#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d1v n ASN 3 N 0.00 0.00 0.00 -1.84 5.03 -1.26 -3.11 115.26 114.07 3d1v n ASN 3 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 3d1v n ASN 3 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 3d1v n ASN 3 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3d1v n GLY 4 N 0.00 1.03 3.52 7.41 0.00 -1.26 -4.86 105.19 111.03 3d1v n GLY 4 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 3d1v n GLY 4 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d1v s TYR 5 N 0.00 2.80 0.49 1.61 2.02 -1.18 -5.12 117.35 117.96 3d1v s TYR 5 Ca 0.00 -0.10 0.06 0.00 -0.37 0.00 0.00 57.07 56.67 3d1v s TYR 5 Cb 0.00 -1.67 0.03 0.00 -0.40 0.00 0.00 41.96 39.93 3d1v s TYR 5 CO 0.00 0.24 0.67 0.95 -1.57 0.00 0.00 175.55 175.84 3d1v s THR 6 N -0.74 2.76 0.32 -0.71 -4.23 -1.26 -4.94 115.64 106.85 3d1v s THR 6 Ca 0.11 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.73 3d1v s THR 6 Cb -0.11 -2.86 0.27 0.00 1.34 0.00 0.00 72.50 71.14 3d1v s THR 6 CO 0.01 0.00 1.97 0.22 -0.54 0.00 0.00 174.62 176.28 3d1v h TYR 7 N 0.38 0.94 -0.56 3.99 3.20 -2.00 -2.41 116.97 120.51 3d1v h TYR 7 Ca -0.39 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.48 3d1v h TYR 7 Cb 1.28 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 39.21 3d1v h TYR 7 CO 0.37 0.57 0.26 0.93 -1.64 0.00 0.00 178.16 178.64 3d1v h GLU 8 N 0.99 0.79 -0.25 1.82 4.39 -1.98 -0.81 114.58 119.53 3d1v h GLU 8 Ca 0.30 -0.10 0.02 0.00 0.34 0.00 0.00 59.36 59.91 3d1v h GLU 8 Cb -0.03 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 3d1v h GLU 8 CO -0.08 0.63 0.11 -0.44 -1.16 0.00 0.00 179.01 178.07 3d1v h ASP 9 N 0.79 0.15 -0.02 1.42 3.32 -1.81 0.83 116.42 121.10 3d1v h ASP 9 Ca 0.20 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 3d1v h ASP 9 Cb 0.10 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 3d1v h ASP 9 CO -0.02 0.12 0.01 1.88 -1.72 0.00 0.00 179.24 179.51 3d1v h TYR 10 N 0.24 0.03 -0.25 4.55 0.05 -1.06 0.37 116.97 120.90 3d1v h TYR 10 Ca 0.11 -0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.93 3d1v h TYR 10 Cb 0.05 -0.01 -0.04 0.00 1.01 0.00 0.00 36.73 37.74 3d1v h TYR 10 CO -0.11 0.12 -0.02 0.87 -1.05 0.00 0.00 178.16 177.97 3d1v h LYS 11 N -0.06 0.05 -0.85 4.88 1.79 -0.50 0.14 116.57 122.02 3d1v h LYS 11 Ca 0.01 -0.00 0.10 0.00 -2.18 0.00 0.00 60.65 58.58 3d1v h LYS 11 Cb 0.09 -0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 30.66 3d1v h LYS 11 CO -0.00 0.04 0.49 -0.91 -1.08 0.00 0.00 179.45 177.99 3d1v h ASN 12 N 0.06 0.70 -0.47 0.86 2.35 0.13 0.46 115.58 119.66 3d1v h ASN 12 Ca 0.12 0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 3d1v h ASN 12 Cb 0.16 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 3d1v h ASN 12 CO -0.21 0.39 -0.03 0.74 -1.65 0.00 0.00 177.43 176.67 3d1v h THR 13 N 0.81 1.27 0.18 2.81 2.02 0.12 0.07 112.91 120.18 3d1v h THR 13 Ca 0.42 -1.11 -0.01 0.00 0.77 0.00 0.00 66.41 66.48 3d1v h THR 13 Cb 0.41 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 3d1v h THR 13 CO -0.26 0.38 -0.09 0.00 0.37 0.00 0.00 175.52 175.93 3d1v h ALA 14 N 0.91 -0.24 -0.52 6.16 0.00 0.22 -2.47 119.26 123.32 3d1v h ALA 14 Ca 0.13 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.98 3d1v h ALA 14 Cb 0.55 0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.32 3d1v h ALA 14 CO 0.03 -0.49 -0.26 0.93 0.00 0.00 0.00 179.25 179.46 3d1v h GLU 15 N -0.53 -0.13 -0.10 0.00 5.08 -0.26 0.34 114.58 118.98 3d1v h GLU 15 Ca -0.02 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 3d1v h GLU 15 Cb 0.40 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 3d1v h GLU 15 CO 0.04 -0.09 0.10 2.35 -1.00 0.00 0.00 179.01 180.41 3d1v h TRP 16 N -0.14 0.00 0.05 4.33 7.01 -0.87 0.38 115.95 126.71 3d1v h TRP 16 Ca 0.23 0.00 -0.32 0.00 2.11 0.00 0.00 58.89 60.91 3d1v h TRP 16 Cb 0.51 0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 27.53 3d1v h TRP 16 CO -0.55 0.00 -1.83 1.28 -2.79 0.00 0.00 178.44 174.56 3d1v n LEU 17 N -4.03 1.58 0.31 0.65 4.77 0.64 -2.10 117.00 118.82 3d1v n LEU 17 Ca -0.00 0.33 -0.12 0.00 -0.03 0.00 0.00 56.01 56.19 3d1v n LEU 17 Cb 0.20 -0.35 -0.06 0.00 -2.33 0.00 0.00 43.42 40.89 3d1v n LEU 17 CO 0.30 0.58 0.46 -0.07 -1.33 0.00 0.00 177.39 177.32 3d1v h LEU 18 N 0.03 -0.68 -0.09 2.23 4.07 0.05 -1.50 115.31 119.42 3d1v h LEU 18 Ca -0.34 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.64 3d1v h LEU 18 Cb 2.02 0.18 0.00 0.00 1.08 0.00 0.00 40.66 43.94 3d1v h LEU 18 CO 0.08 -0.44 0.00 -1.54 -1.08 0.00 0.00 178.44 175.46 3d1v n SER 19 N -4.39 0.04 0.00 -0.43 3.41 0.13 -1.33 113.62 111.04 3d1v n SER 19 Ca -0.10 -0.91 0.00 0.00 -0.26 0.00 0.00 58.87 57.60 3d1v n SER 19 Cb 0.32 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 3d1v n SER 19 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3d1v n HIS 20 N -0.43 0.00 -3.86 7.33 8.25 -0.89 -5.00 115.22 120.61 3d1v n HIS 20 Ca 0.00 -0.31 -0.11 0.00 -0.26 0.00 0.00 57.72 57.04 3d1v n HIS 20 Cb 0.01 -0.03 -0.09 0.00 1.12 0.00 0.00 29.99 31.00 3d1v n HIS 20 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3d1v s THR 21 N -0.63 0.10 0.10 1.59 -1.32 -0.44 -5.00 115.64 110.04 3d1v s THR 21 Ca 0.00 -0.84 -0.16 0.00 -1.21 0.00 0.00 61.69 59.48 3d1v s THR 21 Cb 0.00 -0.75 -0.06 0.00 -1.51 0.00 0.00 72.50 70.18 3d1v s THR 21 CO 0.00 -0.46 1.50 0.11 -2.21 0.00 0.00 174.62 173.55 3d1v h LYS 22 N 3.75 0.63 -6.95 7.08 1.79 -1.88 -3.45 116.57 117.54 3d1v h LYS 22 Ca -0.32 -0.25 -0.54 0.00 -2.18 0.00 0.00 60.65 57.37 3d1v h LYS 22 Cb 1.19 -0.03 0.11 0.00 -1.58 0.00 0.00 32.23 31.92 3d1v h LYS 22 CO 0.46 0.82 0.76 -1.01 -1.08 0.00 0.00 179.45 179.39 3d1v s HIS 23 N -4.74 2.57 -0.25 -1.35 3.76 -1.26 -5.04 115.29 108.98 3d1v s HIS 23 Ca -0.13 1.20 0.02 0.00 -0.15 0.00 0.00 55.06 56.00 3d1v s HIS 23 Cb 0.09 -3.99 0.05 0.00 1.11 0.00 0.00 32.58 29.84 3d1v s HIS 23 CO 0.79 -2.94 -0.11 1.03 -0.85 0.00 0.00 174.74 172.66 3d1v s ARG 24 N -2.17 2.45 0.27 1.40 1.81 -1.26 -4.88 118.95 116.58 3d1v s ARG 24 Ca 0.54 -1.21 -0.15 0.00 -1.72 0.00 0.00 55.73 53.20 3d1v s ARG 24 Cb -0.46 -2.87 -0.08 0.00 -0.45 0.00 0.00 34.95 31.09 3d1v s ARG 24 CO 0.61 -0.49 0.68 -1.25 -0.68 0.00 0.00 175.30 174.17 3d1v s PRO 25 N 1.17 4.00 -0.20 3.54 0.04 -1.26 -4.78 135.00 137.51 3d1v s PRO 25 Ca -0.05 0.61 0.09 0.00 0.04 0.00 0.00 61.00 61.68 3d1v s PRO 25 Cb -0.18 -2.59 -0.19 0.00 0.04 0.00 0.00 34.50 31.58 3d1v s PRO 25 CO -0.06 0.25 -0.07 0.94 0.04 0.00 0.00 177.00 178.11 3d1v n GLN 26 N -0.05 0.83 -4.87 4.56 0.00 0.65 -3.59 117.38 114.91 3d1v n GLN 26 Ca 0.01 0.06 -0.33 0.00 -0.00 0.00 0.00 57.00 56.75 3d1v n GLN 26 Cb 0.53 -1.46 -0.16 0.00 0.00 0.00 0.00 30.24 29.15 3d1v n GLN 26 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3d1v s VAL 27 N -2.45 2.57 -0.09 1.69 1.01 -0.74 -0.56 120.40 121.85 3d1v s VAL 27 Ca -0.20 -0.83 -0.05 0.00 0.00 0.00 0.00 61.98 60.91 3d1v s VAL 27 Cb 0.07 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 3d1v s VAL 27 CO 0.64 0.54 0.13 0.00 0.00 0.00 0.00 175.10 176.40 3d1v s ALA 28 N 0.48 3.80 -0.02 5.51 0.00 0.78 0.11 121.76 132.42 3d1v s ALA 28 Ca -0.12 -0.70 0.07 0.00 0.00 0.00 0.00 51.96 51.21 3d1v s ALA 28 Cb -0.16 -1.87 -0.02 0.00 0.00 0.00 0.00 23.12 21.07 3d1v s ALA 28 CO 0.05 0.65 -0.24 0.42 0.00 0.00 0.00 175.76 176.64 3d1v s ILE 29 N -1.08 1.88 -0.12 0.00 1.01 -0.42 0.12 121.20 122.60 3d1v s ILE 29 Ca 0.18 -1.02 0.01 0.00 0.00 0.00 0.00 60.65 59.82 3d1v s ILE 29 Cb -0.12 -1.57 0.02 0.00 0.01 0.00 0.00 42.46 40.80 3d1v s ILE 29 CO 0.07 0.53 -0.11 -0.63 0.00 0.00 0.00 174.94 174.80 3d1v s ILE 30 N -0.52 1.28 0.25 2.92 1.01 0.07 -0.15 121.20 126.06 3d1v s ILE 30 Ca 0.08 -0.47 -0.05 0.00 0.00 0.00 0.00 60.65 60.21 3d1v s ILE 30 Cb -0.10 -1.22 -0.05 0.00 0.01 0.00 0.00 42.46 41.10 3d1v s ILE 30 CO -0.01 0.40 0.50 0.00 0.00 0.00 0.00 174.94 175.84 3d1v n GLY 32 N -0.64 2.56 3.78 0.00 0.00 -1.22 -4.22 105.19 105.45 3d1v n GLY 32 Ca -0.02 -2.15 -0.36 0.00 0.00 0.00 0.00 46.02 43.48 3d1v n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d1v s SER 33 N -1.04 6.45 -0.68 1.61 0.01 -1.26 -1.58 113.70 117.21 3d1v s SER 33 Ca 0.01 2.13 0.00 0.00 1.31 0.00 0.00 55.95 59.39 3d1v s SER 33 Cb -0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 3d1v s SER 33 CO 0.00 -0.71 0.00 0.61 0.41 0.00 0.00 173.24 173.55 3d1v n GLY 34 N 0.30 0.75 0.24 3.44 0.00 -1.26 -4.69 105.19 103.97 3d1v n GLY 34 Ca 0.07 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.02 3d1v n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d1v n LEU 35 N -0.73 1.98 0.14 0.99 4.77 -0.61 -4.61 117.00 118.93 3d1v n LEU 35 Ca -0.06 -2.83 0.13 0.00 -0.03 0.00 0.00 56.01 53.22 3d1v n LEU 35 Cb 0.41 -0.36 0.36 0.00 -2.33 0.00 0.00 43.42 41.49 3d1v n LEU 35 CO 0.10 0.72 0.87 1.23 -1.33 0.00 0.00 177.39 178.97 3d1v h GLY 36 N 0.15 0.00 2.00 -0.72 0.00 -1.88 -3.09 103.07 99.53 3d1v h GLY 36 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3d1v h GLY 36 CO 0.00 0.00 -0.03 -1.33 0.00 0.00 0.00 176.54 175.18 3d1v h GLY 37 N 4.24 0.00 1.47 4.60 0.00 -1.94 0.19 103.07 111.63 3d1v h GLY 37 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 3d1v h GLY 37 CO 0.00 0.00 0.23 -2.00 0.00 0.00 0.00 176.54 174.77 3d1v h LEU 38 N 0.00 0.00 -1.53 3.11 6.46 -1.91 0.28 115.31 121.72 3d1v h LEU 38 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 3d1v h LEU 38 Cb 0.06 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.99 3d1v h LEU 38 CO 0.00 0.00 0.00 0.71 -0.62 0.00 0.00 178.44 178.53 3d1v h THR 39 N 0.00 0.00 -0.28 1.05 1.35 -0.87 -1.84 112.91 112.32 3d1v h THR 39 Ca 0.06 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 3d1v h THR 39 Cb 0.51 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 67.91 3d1v h THR 39 CO -0.00 0.00 0.18 0.44 -0.25 0.00 0.00 175.52 175.89 3d1v h ASP 40 N 0.00 0.33 0.00 5.36 3.45 -0.63 -2.53 116.42 122.40 3d1v h ASP 40 Ca 0.00 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.44 3d1v h ASP 40 Cb 0.24 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 38.93 3d1v h ASP 40 CO 0.00 0.25 0.19 0.29 -1.57 0.00 0.00 179.24 178.39 3d1v n LYS 41 N -4.88 0.00 -2.17 3.56 5.02 -0.69 -4.62 118.16 114.37 3d1v n LYS 41 Ca -0.02 0.26 -0.33 0.00 -2.02 0.00 0.00 58.31 56.20 3d1v n LYS 41 Cb 0.03 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.36 3d1v n LYS 41 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3d1v s LEU 42 N -2.49 3.60 -0.00 -0.35 1.43 -0.95 -4.68 118.68 115.24 3d1v s LEU 42 Ca 0.00 1.89 0.02 0.00 -1.03 0.00 0.00 54.13 55.02 3d1v s LEU 42 Cb 0.00 -4.55 -0.01 0.00 0.03 0.00 0.00 46.19 41.67 3d1v s LEU 42 CO 0.00 -1.11 -0.07 0.42 0.23 0.00 0.00 176.35 175.82 3d1v s THR 43 N -2.26 0.58 -1.10 5.49 -4.23 -0.69 -4.58 115.64 108.85 3d1v s THR 43 Ca 0.66 -0.37 -0.05 0.00 -1.18 0.00 0.00 61.69 60.75 3d1v s THR 43 Cb -0.17 -0.50 0.01 0.00 1.34 0.00 0.00 72.50 73.18 3d1v s THR 43 CO 0.32 0.12 0.71 0.00 -0.54 0.00 0.00 174.62 175.23 3d1v n GLN 44 N 2.80 -5.02 -1.67 3.99 6.02 -1.26 -2.45 117.38 119.78 3d1v n GLN 44 Ca -0.14 0.66 -0.50 0.00 -0.01 0.00 0.00 57.00 57.01 3d1v n GLN 44 Cb 0.57 -5.08 -0.05 0.00 1.02 0.00 0.00 30.24 26.71 3d1v n GLN 44 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3d1v n ALA 45 N -3.84 0.56 -3.26 -1.58 0.00 -1.25 -4.61 120.51 106.53 3d1v n ALA 45 Ca -0.03 0.38 -0.37 0.00 0.00 0.00 0.00 53.44 53.42 3d1v n ALA 45 Cb 0.57 -2.35 -0.13 0.00 0.00 0.00 0.00 19.45 17.54 3d1v n ALA 45 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3d1v s GLN 46 N 2.62 3.17 0.15 0.00 0.74 -0.35 -4.96 119.66 121.03 3d1v s GLN 46 Ca 0.89 -0.79 -0.18 0.00 0.05 0.00 0.00 55.36 55.33 3d1v s GLN 46 Cb -0.79 -3.28 -0.07 0.00 1.10 0.00 0.00 33.01 29.96 3d1v s GLN 46 CO 0.50 -0.38 0.61 0.42 -0.55 0.00 0.00 175.29 175.89 3d1v s ILE 47 N 1.49 4.72 -0.02 -2.34 1.01 -1.26 -0.80 121.20 124.00 3d1v s ILE 47 Ca 0.03 1.11 0.05 0.00 0.00 0.00 0.00 60.65 61.84 3d1v s ILE 47 Cb -0.16 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.46 3d1v s ILE 47 CO 0.01 0.34 -0.16 -0.36 0.00 0.00 0.00 174.94 174.77 3d1v s PHE 48 N -1.36 1.48 0.28 3.97 0.08 0.23 -4.96 117.98 117.71 3d1v s PHE 48 Ca 0.36 -0.33 -0.28 0.00 0.12 0.00 0.00 56.93 56.80 3d1v s PHE 48 Cb -0.17 -0.98 -0.09 0.00 -0.57 0.00 0.00 43.02 41.21 3d1v s PHE 48 CO 0.20 -0.07 0.96 0.34 -0.10 0.00 0.00 175.22 176.54 3d1v s ASP 49 N -0.20 7.48 0.08 1.36 -1.08 -1.26 -1.15 116.67 121.89 3d1v s ASP 49 Ca 0.02 1.93 -0.30 0.00 -0.52 0.00 0.00 52.55 53.68 3d1v s ASP 49 Cb -0.08 -2.60 -0.18 0.00 -1.46 0.00 0.00 42.92 38.60 3d1v s ASP 49 CO 0.00 0.03 1.66 1.88 0.52 0.00 0.00 175.17 179.27 3d1v h TYR 50 N 3.70 -0.59 0.00 -5.34 0.05 -1.91 -0.91 116.97 111.97 3d1v h TYR 50 Ca -0.46 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.31 3d1v h TYR 50 Cb 1.20 0.20 0.00 0.00 1.01 0.00 0.00 36.73 39.13 3d1v h TYR 50 CO 0.61 -0.37 0.00 0.43 -1.05 0.00 0.00 178.16 177.78 3d1v n SER 51 N -5.36 0.00 0.12 3.88 7.64 -1.26 0.10 113.62 118.74 3d1v n SER 51 Ca -0.12 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.88 3d1v n SER 51 Cb 0.27 0.00 0.48 0.00 -1.01 0.00 0.00 64.21 63.95 3d1v n SER 51 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 3d1v n GLU 52 N 0.00 0.17 -3.25 1.43 0.28 -0.35 -4.70 120.64 114.23 3d1v n GLU 52 Ca 0.00 0.43 -0.40 0.00 -0.16 0.00 0.00 57.16 57.03 3d1v n GLU 52 Cb 0.00 -1.84 -0.08 0.00 1.43 0.00 0.00 31.44 30.95 3d1v n GLU 52 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 3d1v s ILE 53 N -3.31 5.08 0.04 3.84 1.01 0.28 -4.96 121.20 123.19 3d1v s ILE 53 Ca 0.04 0.87 -0.08 0.00 0.00 0.00 0.00 60.65 61.48 3d1v s ILE 53 Cb 0.09 -3.82 -0.02 0.00 0.01 0.00 0.00 42.46 38.72 3d1v s ILE 53 CO 0.36 0.10 0.39 -2.65 0.00 0.00 0.00 174.94 173.14 3d1v n PRO 54 N 5.43 -0.11 -0.09 2.79 -0.02 -1.26 -1.82 135.00 139.92 3d1v n PRO 54 Ca -0.04 0.38 0.05 0.00 -2.02 0.00 0.00 63.50 61.86 3d1v n PRO 54 Cb 0.50 -0.56 0.09 0.00 -0.02 0.00 0.00 33.50 33.51 3d1v n PRO 54 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3d1v n ASN 55 N -4.31 2.43 -4.74 2.55 3.02 -1.26 -4.97 115.26 107.97 3d1v n ASN 55 Ca 0.01 -2.47 -0.41 0.00 -0.03 0.00 0.00 54.58 51.68 3d1v n ASN 55 Cb 0.07 -0.23 -0.03 0.00 -0.61 0.00 0.00 39.78 38.97 3d1v n ASN 55 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3d1v s PHE 56 N -1.82 3.35 0.20 3.10 5.36 -0.75 -4.88 117.98 122.54 3d1v s PHE 56 Ca 0.18 1.40 -0.32 0.00 -0.96 0.00 0.00 56.93 57.23 3d1v s PHE 56 Cb 0.14 -3.50 -0.15 0.00 -0.34 0.00 0.00 43.02 39.18 3d1v s PHE 56 CO 0.04 -1.41 1.19 -2.30 -1.46 0.00 0.00 175.22 171.28 3d1v n PRO 57 N 2.14 1.36 -2.08 10.12 -0.02 -1.26 -4.63 135.00 140.62 3d1v n PRO 57 Ca 0.04 0.48 -0.30 0.00 -2.02 0.00 0.00 63.50 61.70 3d1v n PRO 57 Cb 0.44 -1.99 0.01 0.00 -0.02 0.00 0.00 33.50 31.94 3d1v n PRO 57 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3d1v s ARG 58 N -0.55 3.44 0.47 -0.52 0.52 -1.26 -4.67 118.95 116.37 3d1v s ARG 58 Ca 0.70 0.53 -0.08 0.00 -0.52 0.00 0.00 55.73 56.37 3d1v s ARG 58 Cb -0.79 -2.15 0.11 0.00 0.52 0.00 0.00 34.95 32.63 3d1v s ARG 58 CO 0.53 -0.56 0.62 0.43 0.02 0.00 0.00 175.30 176.35 3d1v n SER 59 N -2.66 -0.00 -0.74 0.23 7.64 -1.26 -5.01 113.62 111.82 3d1v n SER 59 Ca 0.05 -1.21 0.12 0.00 1.01 0.00 0.00 58.87 58.83 3d1v n SER 59 Cb 0.55 -0.48 0.11 0.00 -1.01 0.00 0.00 64.21 63.38 3d1v n SER 59 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3d1v n THR 60 N -2.89 0.00 0.00 0.44 -2.24 -1.26 -4.99 114.28 103.34 3d1v n THR 60 Ca 0.08 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 3d1v n THR 60 Cb 0.27 1.29 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 3d1v n THR 60 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 3d1v n VAL 61 N 0.72 0.00 -3.90 2.28 3.14 -1.26 -5.03 118.33 114.28 3d1v n VAL 61 Ca 0.13 0.00 -0.35 0.00 -2.96 0.00 0.00 64.34 61.16 3d1v n VAL 61 Cb 0.53 0.00 -0.13 0.00 -1.06 0.00 0.00 33.84 33.17 3d1v n VAL 61 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 3d1v s PRO 62 N 0.00 2.21 0.00 1.45 0.04 -1.26 -4.65 135.00 132.79 3d1v s PRO 62 Ca 0.00 -1.47 0.00 0.00 0.04 0.00 0.00 61.00 59.57 3d1v s PRO 62 Cb 0.00 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.28 3d1v s PRO 62 CO 0.00 -0.76 0.00 0.41 0.04 0.00 0.00 177.00 176.69 3d1v n GLY 63 N 4.56 2.88 0.04 0.56 0.00 -1.26 -4.07 105.19 107.90 3d1v n GLY 63 Ca -0.09 -0.77 0.12 0.00 0.00 0.00 0.00 46.02 45.27 3d1v n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3d1v n HIS 64 N 0.00 0.00 1.98 1.61 8.25 -1.26 0.28 115.22 126.08 3d1v n HIS 64 Ca 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.53 3d1v n HIS 64 Cb 0.00 -0.16 0.41 0.00 1.12 0.00 0.00 29.99 31.36 3d1v n HIS 64 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3d1v n ALA 65 N -1.36 2.57 -3.08 -1.41 0.00 -1.26 -4.89 120.51 111.09 3d1v n ALA 65 Ca 0.06 -0.09 -0.40 0.00 0.00 0.00 0.00 53.44 53.01 3d1v n ALA 65 Cb 0.34 -1.23 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 3d1v n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d1v n GLY 66 N 0.71 5.11 3.08 0.00 0.00 0.80 -1.92 105.19 112.97 3d1v n GLY 66 Ca 0.10 -2.69 -0.09 0.00 0.00 0.00 0.00 46.02 43.35 3d1v n GLY 66 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3d1v s ARG 67 N -2.74 0.59 -0.34 1.61 1.04 0.17 -3.59 118.95 115.70 3d1v s ARG 67 Ca 0.32 -1.05 -0.05 0.00 -1.04 0.00 0.00 55.73 53.92 3d1v s ARG 67 Cb 0.06 0.01 0.05 0.00 -2.04 0.00 0.00 34.95 33.03 3d1v s ARG 67 CO 0.09 -0.05 0.10 -1.17 -0.04 0.00 0.00 175.30 174.22 3d1v s LEU 68 N -2.43 4.34 -0.29 -1.89 2.96 -0.30 0.09 118.68 121.16 3d1v s LEU 68 Ca 0.01 -1.25 -0.08 0.00 -0.22 0.00 0.00 54.13 52.59 3d1v s LEU 68 Cb 0.01 -1.84 -0.00 0.00 0.50 0.00 0.00 46.19 44.86 3d1v s LEU 68 CO -0.05 -0.34 0.09 -0.69 -1.32 0.00 0.00 176.35 174.04 3d1v s VAL 69 N 1.35 4.17 0.03 1.68 1.01 -0.49 0.76 120.40 128.90 3d1v s VAL 69 Ca -0.02 -0.53 -0.22 0.00 0.00 0.00 0.00 61.98 61.22 3d1v s VAL 69 Cb -0.20 -3.10 -0.06 0.00 0.00 0.00 0.00 36.38 33.02 3d1v s VAL 69 CO 0.01 0.13 0.66 -0.36 0.00 0.00 0.00 175.10 175.55 3d1v s PHE 70 N 1.55 3.72 0.32 5.22 0.40 0.02 -1.22 117.98 127.98 3d1v s PHE 70 Ca 0.04 1.32 -0.03 0.00 -0.60 0.00 0.00 56.93 57.66 3d1v s PHE 70 Cb -0.17 -2.68 -0.00 0.00 0.51 0.00 0.00 43.02 40.68 3d1v s PHE 70 CO 0.03 0.35 0.44 0.20 0.70 0.00 0.00 175.22 176.94 3d1v s GLY 71 N -0.24 1.40 -0.16 4.36 0.00 0.50 -1.21 107.32 111.97 3d1v s GLY 71 Ca 0.34 -1.47 0.01 0.00 0.00 0.00 0.00 44.72 43.59 3d1v s GLY 71 CO 0.20 -1.00 -0.18 -1.36 0.00 0.00 0.00 173.10 170.76 3d1v s PHE 72 N -3.26 2.48 -0.33 1.90 0.08 -1.03 -1.99 117.98 115.84 3d1v s PHE 72 Ca 0.30 -1.41 0.01 0.00 0.12 0.00 0.00 56.93 55.96 3d1v s PHE 72 Cb 0.00 -1.75 0.08 0.00 -0.57 0.00 0.00 43.02 40.78 3d1v s PHE 72 CO 0.19 -0.71 0.03 -1.17 -0.10 0.00 0.00 175.22 173.45 3d1v s LEU 73 N 1.29 4.34 -1.32 -0.37 2.96 0.34 -1.70 118.68 124.23 3d1v s LEU 73 Ca 0.03 -1.73 -0.04 0.00 -0.22 0.00 0.00 54.13 52.17 3d1v s LEU 73 Cb -0.13 -1.67 0.02 0.00 0.50 0.00 0.00 46.19 44.90 3d1v s LEU 73 CO -0.10 -0.34 0.97 -3.20 -1.32 0.00 0.00 176.35 172.36 3d1v n ASN 74 N 4.46 -3.33 0.00 3.68 5.15 -1.26 -0.64 115.26 123.32 3d1v n ASN 74 Ca -0.06 -0.67 0.00 0.00 -0.60 0.00 0.00 54.58 53.25 3d1v n ASN 74 Cb 0.42 -4.66 0.00 0.00 -0.53 0.00 0.00 39.78 35.01 3d1v n ASN 74 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3d1v n GLY 75 N -1.55 1.37 3.77 8.20 0.00 -1.26 -4.29 105.19 111.43 3d1v n GLY 75 Ca -0.17 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 3d1v n GLY 75 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d1v s ARG 76 N 0.00 4.15 -0.75 1.61 1.81 0.19 -4.94 118.95 121.03 3d1v s ARG 76 Ca 0.00 2.51 -0.25 0.00 -1.72 0.00 0.00 55.73 56.27 3d1v s ARG 76 Cb 0.00 -3.01 -0.14 0.00 -0.45 0.00 0.00 34.95 31.35 3d1v s ARG 76 CO 0.00 -0.51 2.41 0.00 -0.68 0.00 0.00 175.30 176.51 3d1v n ALA 77 N 1.11 0.48 -2.45 2.13 0.00 -1.26 -0.51 120.51 120.01 3d1v n ALA 77 Ca 0.03 -1.24 -0.33 0.00 0.00 0.00 0.00 53.44 51.90 3d1v n ALA 77 Cb 0.39 -3.19 -0.05 0.00 0.00 0.00 0.00 19.45 16.60 3d1v n ALA 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d1v s VAL 79 N -1.66 2.63 0.12 0.00 0.11 0.12 -0.37 120.40 121.35 3d1v s VAL 79 Ca 0.42 -0.77 0.06 0.00 -2.93 0.00 0.00 61.98 58.76 3d1v s VAL 79 Cb -0.13 -2.12 -0.04 0.00 -1.53 0.00 0.00 36.38 32.56 3d1v s VAL 79 CO 0.21 0.51 -0.01 -0.04 -3.33 0.00 0.00 175.10 172.44 3d1v s MET 80 N 0.98 2.47 -0.23 1.54 -1.94 -0.36 -1.30 119.30 120.47 3d1v s MET 80 Ca -0.02 -0.94 -0.01 0.00 -1.71 0.00 0.00 55.69 53.01 3d1v s MET 80 Cb -0.15 -2.47 0.02 0.00 2.01 0.00 0.00 34.83 34.25 3d1v s MET 80 CO -0.03 0.51 -0.10 1.41 -0.01 0.00 0.00 175.02 176.80 3d1v s MET 81 N -2.52 2.89 -0.44 2.03 1.75 0.79 -1.40 119.30 122.41 3d1v s MET 81 Ca 0.26 -0.93 -0.11 0.00 -1.25 0.00 0.00 55.69 53.66 3d1v s MET 81 Cb -0.11 -2.87 0.08 0.00 2.84 0.00 0.00 34.83 34.77 3d1v s MET 81 CO 0.18 -0.34 0.31 -1.14 -0.65 0.00 0.00 175.02 173.38 3d1v s GLN 82 N 1.31 2.70 0.00 4.11 0.74 0.11 -2.14 119.66 126.49 3d1v s GLN 82 Ca 0.01 -1.48 0.00 0.00 0.05 0.00 0.00 55.36 53.94 3d1v s GLN 82 Cb -0.16 -3.90 0.00 0.00 1.10 0.00 0.00 33.01 30.05 3d1v s GLN 82 CO -0.07 -1.01 0.00 0.41 -0.55 0.00 0.00 175.29 174.07 3d1v n GLY 83 N 5.00 0.76 3.81 2.59 0.00 -0.81 0.44 105.19 117.00 3d1v n GLY 83 Ca -0.11 -0.64 -0.32 0.00 0.00 0.00 0.00 46.02 44.96 3d1v n GLY 83 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3d1v s ARG 84 N -0.33 3.18 0.29 1.61 1.70 -1.26 -4.73 118.95 119.41 3d1v s ARG 84 Ca 0.00 1.07 -0.25 0.00 -0.47 0.00 0.00 55.73 56.08 3d1v s ARG 84 Cb 0.00 -2.02 -0.09 0.00 -0.57 0.00 0.00 34.95 32.27 3d1v s ARG 84 CO 0.00 -0.91 0.89 -0.06 -1.08 0.00 0.00 175.30 174.14 3d1v s PHE 85 N -2.74 3.71 0.07 5.89 0.08 -1.26 -5.10 117.98 118.64 3d1v s PHE 85 Ca 0.61 1.70 0.09 0.00 0.12 0.00 0.00 56.93 59.44 3d1v s PHE 85 Cb -0.15 -2.85 -0.03 0.00 -0.57 0.00 0.00 43.02 39.42 3d1v s PHE 85 CO 0.45 0.27 -0.23 -1.01 -0.10 0.00 0.00 175.22 174.60 3d1v s HIS 86 N -1.54 1.99 -0.48 0.36 3.76 -1.26 -4.83 115.29 113.30 3d1v s HIS 86 Ca 0.47 -0.39 0.22 0.00 -0.15 0.00 0.00 55.06 55.21 3d1v s HIS 86 Cb -0.19 -1.14 0.97 0.00 1.11 0.00 0.00 32.58 33.33 3d1v s HIS 86 CO 0.24 0.17 1.68 0.00 -0.85 0.00 0.00 174.74 175.98 3d1v n MET 87 N 1.47 0.17 0.18 1.40 0.00 -1.26 -1.48 117.12 117.59 3d1v n MET 87 Ca -0.18 0.45 0.14 0.00 0.00 0.00 0.00 57.70 58.11 3d1v n MET 87 Cb 0.53 -1.86 0.52 0.00 0.00 0.00 0.00 33.22 32.41 3d1v n MET 87 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 175.97 176.07 3d1v h TYR 88 N 0.00 0.00 -0.00 3.17 -0.00 -1.90 0.23 116.97 118.47 3d1v h TYR 88 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3d1v h TYR 88 Cb 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.03 3d1v h TYR 88 CO 0.00 0.00 -0.25 0.39 -0.00 0.00 0.00 178.16 178.30 3d1v n GLU 89 N -2.55 0.37 0.00 0.10 1.02 -0.55 -4.78 120.64 114.24 3d1v n GLU 89 Ca 0.02 -0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 3d1v n GLU 89 Cb 0.30 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 3d1v n GLU 89 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d1v n GLY 90 N 1.40 1.65 3.75 0.62 0.00 0.80 -5.03 105.19 108.38 3d1v n GLY 90 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 3d1v n GLY 90 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d1v s TYR 91 N -1.88 2.40 0.82 1.61 2.02 -1.26 -5.00 117.35 116.07 3d1v s TYR 91 Ca 0.00 1.58 -0.12 0.00 -0.37 0.00 0.00 57.07 58.17 3d1v s TYR 91 Cb 0.00 -3.24 0.11 0.00 -0.40 0.00 0.00 41.96 38.43 3d1v s TYR 91 CO 0.00 -2.01 1.18 -1.25 -1.57 0.00 0.00 175.55 171.90 3d1v s PRO 92 N -4.21 1.68 0.57 -1.71 0.04 -1.26 -4.55 135.00 125.56 3d1v s PRO 92 Ca 0.68 -0.11 0.10 0.00 0.04 0.00 0.00 61.00 61.71 3d1v s PRO 92 Cb -0.22 -1.98 0.57 0.00 0.04 0.00 0.00 34.50 32.91 3d1v s PRO 92 CO 0.46 -1.72 1.27 -0.07 0.04 0.00 0.00 177.00 176.97 3d1v h LEU 93 N -1.10 0.00 -3.38 -3.56 3.38 -1.94 1.09 115.31 109.80 3d1v h LEU 93 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3d1v h LEU 93 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 3d1v h LEU 93 CO 0.58 0.00 0.00 -2.67 0.09 0.00 0.00 178.44 176.44 3d1v n TRP 94 N -2.45 1.49 -0.09 1.13 4.27 -1.26 -0.54 117.44 119.99 3d1v n TRP 94 Ca -0.01 -0.78 -0.13 0.00 -3.89 0.00 0.00 57.50 52.69 3d1v n TRP 94 Cb 0.70 -0.39 -0.07 0.00 -1.36 0.00 0.00 31.31 30.19 3d1v n TRP 94 CO 0.00 0.00 0.00 1.63 -2.29 0.00 0.00 177.69 177.03 3d1v n LYS 95 N 0.17 0.41 -0.27 -2.67 5.02 0.37 -4.16 118.16 117.02 3d1v n LYS 95 Ca 0.24 0.11 -0.01 0.00 -2.02 0.00 0.00 58.31 56.64 3d1v n LYS 95 Cb 1.02 -1.28 0.06 0.00 -0.02 0.00 0.00 35.03 34.80 3d1v n LYS 95 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3d1v h VAL 96 N -0.16 0.15 -0.30 -0.18 2.07 -1.32 -0.62 116.25 115.89 3d1v h VAL 96 Ca -0.39 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.13 3d1v h VAL 96 Cb 1.53 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 3d1v h VAL 96 CO -0.11 0.00 0.00 0.35 0.02 0.00 0.00 177.57 177.83 3d1v n THR 97 N -5.49 1.00 0.02 2.57 -2.24 0.29 -3.79 114.28 106.65 3d1v n THR 97 Ca 0.09 -0.59 -0.22 0.00 -2.27 0.00 0.00 64.05 61.06 3d1v n THR 97 Cb 0.39 -0.18 -0.14 0.00 -2.10 0.00 0.00 70.33 68.30 3d1v n THR 97 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3d1v h PHE 98 N 1.92 0.50 -0.46 4.78 3.57 -1.27 -2.15 116.94 123.84 3d1v h PHE 98 Ca 0.00 -0.36 0.13 0.00 3.53 0.00 0.00 57.97 61.27 3d1v h PHE 98 Cb 0.94 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 3d1v h PHE 98 CO 0.41 1.66 0.37 -1.35 -2.23 0.00 0.00 178.31 177.18 3d1v h PRO 99 N -0.12 0.00 -0.08 6.41 0.11 -1.77 -2.44 132.00 134.12 3d1v h PRO 99 Ca -0.36 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.68 3d1v h PRO 99 Cb 1.91 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 33.01 3d1v h PRO 99 CO 0.08 0.00 -0.29 0.28 -0.21 0.00 0.00 178.00 177.86 3d1v h VAL 100 N 0.00 1.24 0.00 3.15 2.07 -1.64 1.20 116.25 122.27 3d1v h VAL 100 Ca 0.22 -1.12 -0.07 0.00 0.82 0.00 0.00 66.70 66.54 3d1v h VAL 100 Cb 0.95 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 3d1v h VAL 100 CO -0.00 0.33 -0.33 -0.09 0.02 0.00 0.00 177.57 177.50 3d1v h ARG 101 N 0.12 0.00 0.02 1.57 9.65 -1.32 -2.73 114.38 121.69 3d1v h ARG 101 Ca 0.02 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.90 3d1v h ARG 101 Cb 0.58 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.16 3d1v h ARG 101 CO 0.04 0.33 -0.01 -0.39 2.80 0.00 0.00 179.97 182.75 3d1v h VAL 102 N 0.00 1.49 -0.86 0.20 -1.51 0.14 -3.03 116.25 112.68 3d1v h VAL 102 Ca -0.00 -1.63 0.15 0.00 -1.23 0.00 0.00 66.70 63.99 3d1v h VAL 102 Cb 1.17 2.57 -0.15 0.00 -2.13 0.00 0.00 31.29 32.74 3d1v h VAL 102 CO 0.04 0.41 -0.27 0.49 -1.23 0.00 0.00 177.57 177.02 3d1v n PHE 103 N -4.76 0.19 0.00 5.19 3.72 0.46 -0.56 117.46 121.70 3d1v n PHE 103 Ca -0.09 1.05 0.00 0.00 -0.05 0.00 0.00 57.45 58.36 3d1v n PHE 103 Cb 0.34 -0.92 0.00 0.00 -0.94 0.00 0.00 39.48 37.96 3d1v n PHE 103 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 3d1v n HIS 104 N -5.34 0.00 -0.29 1.38 -0.00 -1.04 -0.52 115.22 109.41 3d1v n HIS 104 Ca 0.12 0.00 0.25 0.00 -0.00 0.00 0.00 57.72 58.08 3d1v n HIS 104 Cb 0.39 0.00 0.38 0.00 -0.00 0.00 0.00 29.99 30.76 3d1v n HIS 104 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3d1v n LEU 105 N -0.63 0.00 0.00 0.27 4.77 0.28 0.41 117.00 122.10 3d1v n LEU 105 Ca 0.00 0.52 0.09 0.00 -0.03 0.00 0.00 56.01 56.59 3d1v n LEU 105 Cb 0.00 -0.23 0.51 0.00 -2.33 0.00 0.00 43.42 41.37 3d1v n LEU 105 CO 0.00 -0.52 0.72 0.18 -1.33 0.00 0.00 177.39 176.44 3d1v n LEU 106 N -2.81 0.00 -0.27 2.23 4.32 0.22 -4.87 117.00 115.82 3d1v n LEU 106 Ca 0.21 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 56.16 3d1v n LEU 106 Cb 1.06 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.85 3d1v n LEU 106 CO 0.21 0.00 -0.03 0.61 -1.22 0.00 0.00 177.39 176.95 3d1v n GLY 107 N 0.23 0.55 3.76 -0.72 0.00 1.38 -4.41 105.19 105.99 3d1v n GLY 107 Ca 0.13 -0.16 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 3d1v n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d1v s VAL 108 N -1.77 2.73 0.00 1.61 1.01 0.32 -4.71 120.40 119.58 3d1v s VAL 108 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 61.98 62.57 3d1v s VAL 108 Cb 0.00 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 33.06 3d1v s VAL 108 CO 0.00 0.03 0.31 -0.90 0.00 0.00 0.00 175.10 174.55 3d1v n ASP 109 N -0.33 0.63 -4.07 3.32 5.68 0.28 -4.27 116.55 117.80 3d1v n ASP 109 Ca 0.06 -0.99 -0.18 0.00 -0.50 0.00 0.00 54.79 53.18 3d1v n ASP 109 Cb 0.46 0.01 -0.14 0.00 -1.14 0.00 0.00 41.12 40.31 3d1v n ASP 109 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3d1v s THR 110 N -0.01 0.81 -0.11 2.12 2.01 -1.10 -0.79 115.64 118.56 3d1v s THR 110 Ca 0.00 -0.68 0.03 0.00 0.31 0.00 0.00 61.69 61.35 3d1v s THR 110 Cb 0.00 -0.72 0.01 0.00 0.01 0.00 0.00 72.50 71.79 3d1v s THR 110 CO 0.00 0.05 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.55 3d1v s LEU 111 N -0.71 2.00 -0.11 4.42 2.96 0.64 -0.15 118.68 127.73 3d1v s LEU 111 Ca 0.01 -0.53 -0.02 0.00 -0.22 0.00 0.00 54.13 53.36 3d1v s LEU 111 Cb -0.06 -1.32 -0.03 0.00 0.50 0.00 0.00 46.19 45.28 3d1v s LEU 111 CO 0.00 0.09 -0.02 0.54 -1.32 0.00 0.00 176.35 175.65 3d1v s VAL 112 N 0.66 4.09 -0.06 1.68 0.11 0.33 -2.89 120.40 124.32 3d1v s VAL 112 Ca -0.12 -0.31 0.04 0.00 -2.93 0.00 0.00 61.98 58.66 3d1v s VAL 112 Cb -0.16 -2.74 -0.02 0.00 -1.53 0.00 0.00 36.38 31.93 3d1v s VAL 112 CO 0.03 0.56 -0.19 0.68 -3.33 0.00 0.00 175.10 172.85 3d1v s VAL 113 N -0.44 2.60 0.33 2.04 -7.23 -0.98 -0.75 120.40 115.97 3d1v s VAL 113 Ca 0.08 -0.87 0.07 0.00 -1.81 0.00 0.00 61.98 59.45 3d1v s VAL 113 Cb -0.12 -2.00 -0.07 0.00 0.56 0.00 0.00 36.38 34.75 3d1v s VAL 113 CO 0.02 0.57 -0.04 0.42 -0.31 0.00 0.00 175.10 175.76 3d1v s THR 114 N -0.33 1.87 0.23 5.32 -4.23 0.02 -2.59 115.64 115.93 3d1v s THR 114 Ca 0.02 -2.11 -0.22 0.00 -1.18 0.00 0.00 61.69 58.20 3d1v s THR 114 Cb -0.13 -2.67 0.06 0.00 1.34 0.00 0.00 72.50 71.10 3d1v s THR 114 CO 0.02 -0.17 0.91 0.54 -0.54 0.00 0.00 174.62 175.38 3d1v s ASN 115 N -3.56 -0.11 -0.13 3.99 6.03 -1.01 -3.46 114.94 116.70 3d1v s ASN 115 Ca 0.32 -0.65 -0.03 0.00 -1.03 0.00 0.00 52.86 51.48 3d1v s ASN 115 Cb 0.05 0.60 -0.03 0.00 -3.03 0.00 0.00 41.25 38.84 3d1v s ASN 115 CO 0.15 -1.15 -0.03 0.00 -2.03 0.00 0.00 177.10 174.04 3d1v s ALA 116 N -2.91 3.08 0.22 3.54 0.00 -1.26 0.24 121.76 124.67 3d1v s ALA 116 Ca 0.15 -0.82 -0.00 0.00 0.00 0.00 0.00 51.96 51.29 3d1v s ALA 116 Cb -0.03 -1.50 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 3d1v s ALA 116 CO 0.06 0.36 0.12 0.00 0.00 0.00 0.00 175.76 176.30 3d1v s ALA 117 N -0.14 1.40 -0.13 0.00 0.00 -0.39 -4.68 121.76 117.83 3d1v s ALA 117 Ca 0.03 -1.77 -0.04 0.00 0.00 0.00 0.00 51.96 50.18 3d1v s ALA 117 Cb -0.13 1.25 -0.03 0.00 0.00 0.00 0.00 23.12 24.21 3d1v s ALA 117 CO 0.02 -0.54 0.01 0.20 0.00 0.00 0.00 175.76 175.45 3d1v s GLY 118 N -3.22 1.83 0.10 0.00 0.00 -0.31 -0.44 107.32 105.28 3d1v s GLY 118 Ca 0.39 -0.79 -0.19 0.00 0.00 0.00 0.00 44.72 44.13 3d1v s GLY 118 CO 0.13 -0.30 0.59 -0.32 0.00 0.00 0.00 173.10 173.19 3d1v s GLY 119 N -0.29 2.64 -0.01 0.20 0.00 0.63 0.35 107.32 110.83 3d1v s GLY 119 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 44.72 44.81 3d1v s GLY 119 CO 0.02 0.42 -0.01 1.04 0.00 0.00 0.00 173.10 174.57 3d1v n LEU 120 N 1.44 2.62 -4.68 0.66 4.77 0.52 -0.55 117.00 121.79 3d1v n LEU 120 Ca -0.08 -0.00 -0.46 0.00 -0.03 0.00 0.00 56.01 55.43 3d1v n LEU 120 Cb 0.51 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.51 3d1v n LEU 120 CO 0.42 0.46 1.47 -3.20 -1.33 0.00 0.00 177.39 175.21 3d1v n ASN 121 N -2.61 3.64 0.20 -1.43 2.85 -0.64 -4.89 115.26 112.39 3d1v n ASN 121 Ca -0.02 0.98 0.04 0.00 -0.11 0.00 0.00 54.58 55.46 3d1v n ASN 121 Cb 0.52 -1.44 0.42 0.00 1.24 0.00 0.00 39.78 40.52 3d1v n ASN 121 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3d1v h PRO 122 N 8.95 0.00 -1.89 1.20 0.11 -1.92 -3.10 132.00 135.35 3d1v h PRO 122 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3d1v h PRO 122 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3d1v h PRO 122 CO 0.94 0.31 0.00 0.36 -0.21 0.00 0.00 178.00 179.39 3d1v n LYS 123 N -4.13 0.52 -3.94 1.05 2.85 -1.26 -4.77 118.16 108.49 3d1v n LYS 123 Ca -0.02 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.14 3d1v n LYS 123 Cb 0.35 -1.24 -0.11 0.00 -0.65 0.00 0.00 35.03 33.39 3d1v n LYS 123 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 3d1v s PHE 124 N 0.86 0.17 -0.04 5.58 0.40 -1.17 -5.11 117.98 118.67 3d1v s PHE 124 Ca 0.00 -0.36 -0.04 0.00 -0.60 0.00 0.00 56.93 55.93 3d1v s PHE 124 Cb 0.00 -0.13 0.01 0.00 0.51 0.00 0.00 43.02 43.41 3d1v s PHE 124 CO 0.00 -0.23 0.11 -2.00 0.70 0.00 0.00 175.22 173.81 3d1v s GLU 125 N -1.41 0.15 0.27 0.44 2.56 -1.26 -4.94 118.70 114.50 3d1v s GLU 125 Ca -0.15 0.12 -0.30 0.00 0.00 0.00 0.00 54.97 54.64 3d1v s GLU 125 Cb -0.09 0.07 -0.13 0.00 2.00 0.00 0.00 34.13 35.98 3d1v s GLU 125 CO 0.00 -0.02 1.34 1.33 -0.56 0.00 0.00 175.26 177.35 3d1v n VAL 126 N 2.93 1.32 0.00 3.70 0.24 -1.26 0.94 118.33 126.21 3d1v n VAL 126 Ca -0.13 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 3d1v n VAL 126 Cb 0.59 -1.45 0.00 0.00 -1.47 0.00 0.00 33.84 31.51 3d1v n VAL 126 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3d1v n GLY 127 N 1.69 2.16 3.70 7.63 0.00 -0.59 -5.03 105.19 114.76 3d1v n GLY 127 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 3d1v n GLY 127 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3d1v n ASP 128 N 0.00 3.55 -4.88 1.61 8.00 0.27 -4.69 116.55 120.41 3d1v n ASP 128 Ca 0.00 1.10 -0.30 0.00 0.71 0.00 0.00 54.79 56.30 3d1v n ASP 128 Cb 0.00 -1.52 -0.03 0.00 -0.02 0.00 0.00 41.12 39.56 3d1v n ASP 128 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3d1v s ILE 129 N 0.67 4.78 -0.04 0.53 1.01 -1.26 0.19 121.20 127.08 3d1v s ILE 129 Ca 0.73 0.61 -0.00 0.00 0.00 0.00 0.00 60.65 61.98 3d1v s ILE 129 Cb -0.57 -3.76 0.03 0.00 0.01 0.00 0.00 42.46 38.17 3d1v s ILE 129 CO 0.40 -0.61 0.02 -0.32 0.00 0.00 0.00 174.94 174.43 3d1v s MET 130 N -4.05 0.21 -0.14 2.79 1.75 0.86 -3.44 119.30 117.28 3d1v s MET 130 Ca 0.51 0.17 -0.11 0.00 -1.25 0.00 0.00 55.69 55.01 3d1v s MET 130 Cb -0.10 -0.52 -0.05 0.00 2.84 0.00 0.00 34.83 37.00 3d1v s MET 130 CO 0.34 -0.21 0.22 -1.17 -0.65 0.00 0.00 175.02 173.55 3d1v s LEU 131 N 1.43 4.30 -0.25 4.11 1.98 -0.28 -1.10 118.68 128.86 3d1v s LEU 131 Ca -0.04 0.47 -0.29 0.00 -2.89 0.00 0.00 54.13 51.38 3d1v s LEU 131 Cb -0.13 -2.23 0.01 0.00 0.66 0.00 0.00 46.19 44.50 3d1v s LEU 131 CO -0.03 0.23 1.03 -0.63 -1.89 0.00 0.00 176.35 175.07 3d1v s ILE 132 N -0.15 4.65 -0.08 6.68 1.01 0.23 -2.89 121.20 130.65 3d1v s ILE 132 Ca 0.14 1.93 0.09 0.00 0.00 0.00 0.00 60.65 62.81 3d1v s ILE 132 Cb -0.13 -4.32 -0.24 0.00 0.01 0.00 0.00 42.46 37.79 3d1v s ILE 132 CO 0.03 -0.24 0.53 -1.14 0.00 0.00 0.00 174.94 174.12 3d1v n ARG 133 N 6.42 0.66 -3.85 2.79 0.63 0.64 -4.64 116.66 119.32 3d1v n ARG 133 Ca 0.12 0.26 -0.08 0.00 -0.92 0.00 0.00 57.85 57.23 3d1v n ARG 133 Cb 0.46 -1.75 -0.01 0.00 0.45 0.00 0.00 32.46 31.62 3d1v n ARG 133 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 3d1v s ASP 134 N -6.25 -0.17 0.08 6.15 -1.08 -1.21 -4.52 116.67 109.68 3d1v s ASP 134 Ca -0.10 -0.79 -0.01 0.00 -0.52 0.00 0.00 52.55 51.13 3d1v s ASP 134 Cb 0.08 0.77 -0.04 0.00 -1.46 0.00 0.00 42.92 42.26 3d1v s ASP 134 CO 0.81 -1.46 0.00 -1.38 0.52 0.00 0.00 175.17 173.66 3d1v s HIS 135 N -3.39 0.67 -0.11 -5.34 -3.43 -1.26 -1.05 115.29 101.38 3d1v s HIS 135 Ca 0.13 -1.13 0.03 0.00 -0.80 0.00 0.00 55.06 53.29 3d1v s HIS 135 Cb -0.06 -0.43 0.00 0.00 -1.43 0.00 0.00 32.58 30.67 3d1v s HIS 135 CO 0.09 -0.43 -0.23 0.42 -2.00 0.00 0.00 174.74 172.59 3d1v s ILE 136 N -3.96 2.00 -1.06 -5.38 1.01 0.13 -4.87 121.20 109.07 3d1v s ILE 136 Ca 0.14 -0.97 -0.06 0.00 0.00 0.00 0.00 60.65 59.76 3d1v s ILE 136 Cb 0.08 -1.75 0.28 0.00 0.01 0.00 0.00 42.46 41.08 3d1v s ILE 136 CO -0.05 0.54 1.15 -3.20 0.00 0.00 0.00 174.94 173.38 3d1v n ASN 137 N 3.71 5.49 -0.27 3.58 5.15 -1.26 -1.32 115.26 130.33 3d1v n ASN 137 Ca -0.19 -3.17 -0.06 0.00 -0.60 0.00 0.00 54.58 50.56 3d1v n ASN 137 Cb 0.52 -1.27 0.06 0.00 -0.53 0.00 0.00 39.78 38.56 3d1v n ASN 137 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3d1v h LEU 138 N 6.14 0.98 -0.59 1.20 5.85 -1.81 0.71 115.31 127.78 3d1v h LEU 138 Ca 0.18 -0.15 -0.15 0.00 0.84 0.00 0.00 57.88 58.61 3d1v h LEU 138 Cb 0.79 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 3d1v h LEU 138 CO 1.07 0.85 -0.45 -0.65 -0.34 0.00 0.00 178.44 178.92 3d1v h PRO 139 N 1.04 0.60 -0.92 5.25 0.11 -1.85 -3.02 132.00 133.22 3d1v h PRO 139 Ca 0.25 -0.33 0.24 0.00 0.11 0.00 0.00 66.00 66.27 3d1v h PRO 139 Cb 0.15 0.02 -0.13 0.00 0.11 0.00 0.00 31.00 31.15 3d1v h PRO 139 CO -0.03 0.93 0.42 0.78 -0.21 0.00 0.00 178.00 179.89 3d1v h GLY 140 N 1.03 1.63 2.00 -0.55 0.00 -0.66 0.44 103.07 106.95 3d1v h GLY 140 Ca 0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 3d1v h GLY 140 CO 0.09 -0.32 -0.08 0.74 0.00 0.00 0.00 176.54 176.97 3d1v h PHE 141 N 0.38 0.00 -0.01 5.60 0.04 -1.11 -2.42 116.94 119.42 3d1v h PHE 141 Ca 0.60 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.37 3d1v h PHE 141 Cb 1.18 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.33 3d1v h PHE 141 CO -0.12 0.08 -0.12 0.43 -0.60 0.00 0.00 178.31 177.97 3d1v n SER 142 N -4.27 0.70 0.00 2.17 7.64 0.12 -4.92 113.62 115.06 3d1v n SER 142 Ca -0.03 -0.79 0.00 0.00 1.01 0.00 0.00 58.87 59.06 3d1v n SER 142 Cb 0.16 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 3d1v n SER 142 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d1v n GLY 143 N 1.26 3.71 2.82 0.23 0.00 -0.91 -5.02 105.19 107.28 3d1v n GLY 143 Ca 0.15 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 3d1v n GLY 143 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3d1v n GLN 144 N 0.00 2.56 -4.73 1.61 1.13 -1.08 -4.70 117.38 112.16 3d1v n GLN 144 Ca 0.00 -2.44 -0.26 0.00 -1.94 0.00 0.00 57.00 52.36 3d1v n GLN 144 Cb 0.00 -3.21 -0.16 0.00 0.11 0.00 0.00 30.24 26.97 3d1v n GLN 144 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 3d1v s ASN 145 N 3.62 2.01 0.00 1.08 3.84 -1.26 -2.64 114.94 121.59 3d1v s ASN 145 Ca 0.49 -0.34 0.07 0.00 0.21 0.00 0.00 52.86 53.30 3d1v s ASN 145 Cb 0.14 -0.76 0.43 0.00 -0.55 0.00 0.00 41.25 40.50 3d1v s ASN 145 CO -0.04 0.09 0.84 -0.81 -2.79 0.00 0.00 177.10 174.39 3d1v n PRO 146 N 3.49 0.38 -0.02 0.43 -0.04 -1.26 0.13 135.00 138.11 3d1v n PRO 146 Ca -0.20 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.26 3d1v n PRO 146 Cb 0.52 -1.29 0.02 0.00 -0.04 0.00 0.00 33.50 32.71 3d1v n PRO 146 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3d1v n LEU 147 N -0.79 2.10 -4.48 1.53 4.32 -1.26 -1.75 117.00 116.66 3d1v n LEU 147 Ca 0.05 -1.99 -0.30 0.00 -0.02 0.00 0.00 56.01 53.75 3d1v n LEU 147 Cb 0.02 -0.03 0.21 0.00 -1.62 0.00 0.00 43.42 42.01 3d1v n LEU 147 CO 0.04 0.52 0.33 -1.14 -1.22 0.00 0.00 177.39 175.92 3d1v n ARG 148 N -0.38 -1.73 -0.01 3.23 0.63 0.12 -4.70 116.66 113.81 3d1v n ARG 148 Ca 0.01 -0.47 0.00 0.00 -0.92 0.00 0.00 57.85 56.48 3d1v n ARG 148 Cb 0.27 -2.12 -0.00 0.00 0.45 0.00 0.00 32.46 31.06 3d1v n ARG 148 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3d1v n GLY 149 N 1.05 -2.17 3.75 5.14 0.00 -1.26 -4.67 105.19 107.02 3d1v n GLY 149 Ca 0.05 -1.48 -0.32 0.00 0.00 0.00 0.00 46.02 44.27 3d1v n GLY 149 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3d1v s PRO 150 N -0.48 2.28 -0.04 1.61 0.02 -1.26 -5.02 135.00 132.12 3d1v s PRO 150 Ca 0.00 1.39 0.01 0.00 0.02 0.00 0.00 61.00 62.42 3d1v s PRO 150 Cb 0.00 -1.88 -0.03 0.00 0.02 0.00 0.00 34.50 32.60 3d1v s PRO 150 CO 0.00 -1.66 -0.02 1.21 -0.33 0.00 0.00 177.00 176.20 3d1v s ASN 151 N -2.78 4.99 -0.37 2.53 2.47 -1.26 -4.79 114.94 115.73 3d1v s ASN 151 Ca 0.66 0.01 -0.07 0.00 0.42 0.00 0.00 52.86 53.88 3d1v s ASN 151 Cb -0.21 -1.31 0.05 0.00 -1.45 0.00 0.00 41.25 38.33 3d1v s ASN 151 CO 0.49 0.32 0.16 -0.62 -3.72 0.00 0.00 177.10 173.73 3d1v s ASP 152 N -1.21 5.43 0.52 -4.21 -1.08 -1.26 -4.89 116.67 109.98 3d1v s ASP 152 Ca 0.16 -1.27 0.32 0.00 -0.52 0.00 0.00 52.55 51.24 3d1v s ASP 152 Cb -0.11 -1.91 1.74 0.00 -1.46 0.00 0.00 42.92 41.18 3d1v s ASP 152 CO 0.06 -0.40 1.97 -0.33 0.52 0.00 0.00 175.17 176.99 3d1v h GLU 153 N 8.28 0.00 -0.28 4.34 4.39 -1.97 0.40 114.58 129.73 3d1v h GLU 153 Ca -0.23 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.47 3d1v h GLU 153 Cb 1.08 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.72 3d1v h GLU 153 CO 0.65 0.00 0.17 0.00 -1.16 0.00 0.00 179.01 178.67 3d1v h ARG 154 N 0.00 0.37 0.06 2.33 3.08 -2.01 -3.18 114.38 115.03 3d1v h ARG 154 Ca 0.00 -0.03 -0.36 0.00 0.07 0.00 0.00 59.98 59.66 3d1v h ARG 154 Cb 0.16 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.09 3d1v h ARG 154 CO 0.00 0.26 -2.16 1.19 -1.07 0.00 0.00 179.97 178.19 3d1v n PHE 155 N -4.48 0.69 -3.59 3.04 3.72 0.14 -5.10 117.46 111.87 3d1v n PHE 155 Ca 0.01 0.17 0.00 0.00 -0.05 0.00 0.00 57.45 57.58 3d1v n PHE 155 Cb 0.08 -1.10 0.00 0.00 -0.94 0.00 0.00 39.48 37.52 3d1v n PHE 155 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d1v n GLY 156 N 2.00 0.93 3.88 1.37 0.00 -0.87 -3.85 105.19 108.65 3d1v n GLY 156 Ca -0.35 -0.84 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 3d1v n GLY 156 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3d1v s ASP 157 N -0.71 6.57 0.37 1.61 1.01 -1.26 -3.90 116.67 120.37 3d1v s ASP 157 Ca 0.00 0.87 0.16 0.00 0.71 0.00 0.00 52.55 54.29 3d1v s ASP 157 Cb 0.00 -2.21 1.06 0.00 1.01 0.00 0.00 42.92 42.78 3d1v s ASP 157 CO 0.00 -0.12 1.73 -0.09 0.21 0.00 0.00 175.17 176.91 3d1v h ARG 158 N 2.28 0.41 -2.08 8.23 1.12 -1.95 -3.26 114.38 119.14 3d1v h ARG 158 Ca -0.47 -0.02 -0.55 0.00 -1.11 0.00 0.00 59.98 57.83 3d1v h ARG 158 Cb 1.17 -0.09 -0.40 0.00 -0.01 0.00 0.00 29.97 30.64 3d1v h ARG 158 CO 0.68 0.27 -0.97 1.19 -3.11 0.00 0.00 179.97 178.03 3d1v n PHE 159 N -4.76 1.18 -1.59 2.20 3.72 -1.26 -5.05 117.46 111.90 3d1v n PHE 159 Ca 0.27 -3.81 -0.42 0.00 -0.05 0.00 0.00 57.45 53.44 3d1v n PHE 159 Cb 0.89 -0.43 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 3d1v n PHE 159 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3d1v n PRO 160 N 0.74 1.29 -2.49 -1.08 -0.04 -1.23 -4.96 135.00 127.23 3d1v n PRO 160 Ca 0.25 0.46 -0.33 0.00 -0.04 0.00 0.00 63.50 63.85 3d1v n PRO 160 Cb 0.53 -1.94 -0.04 0.00 -0.04 0.00 0.00 33.50 32.00 3d1v n PRO 160 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d1v s ALA 161 N -1.24 3.00 0.00 0.55 0.00 -1.26 -4.96 121.76 117.85 3d1v s ALA 161 Ca 0.62 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.89 3d1v s ALA 161 Cb -0.60 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 19.37 3d1v s ALA 161 CO 0.58 -0.21 0.12 -1.33 0.00 0.00 0.00 175.76 174.91 3d1v n MET 162 N -1.31 4.20 -0.34 0.00 2.81 -1.26 -4.64 117.12 116.58 3d1v n MET 162 Ca 0.07 -0.12 0.24 0.00 -1.81 0.00 0.00 57.70 56.08 3d1v n MET 162 Cb 0.54 -0.57 0.51 0.00 -0.71 0.00 0.00 33.22 32.99 3d1v n MET 162 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3d1v h SER 163 N 0.00 0.45 -0.73 7.83 4.64 -2.01 0.20 113.55 123.93 3d1v h SER 163 Ca 0.00 0.10 -0.42 0.00 -0.47 0.00 0.00 61.79 61.00 3d1v h SER 163 Cb 0.02 0.03 -0.24 0.00 -0.31 0.00 0.00 62.40 61.90 3d1v h SER 163 CO 0.00 0.05 0.29 -0.90 -0.87 0.00 0.00 176.83 175.40 3d1v n ASP 164 N -4.68 4.00 -0.23 4.97 3.85 -1.26 -4.73 116.55 118.47 3d1v n ASP 164 Ca 0.27 -3.73 -0.01 0.00 -0.71 0.00 0.00 54.79 50.61 3d1v n ASP 164 Cb 0.92 -0.74 0.06 0.00 -1.35 0.00 0.00 41.12 40.01 3d1v n ASP 164 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3d1v h ALA 165 N 1.26 0.32 -2.05 2.12 0.00 -0.87 -3.38 119.26 116.66 3d1v h ALA 165 Ca 0.45 0.25 -0.71 0.00 0.00 0.00 0.00 54.91 54.90 3d1v h ALA 165 Cb 1.96 0.62 -0.21 0.00 0.00 0.00 0.00 17.79 20.16 3d1v h ALA 165 CO 0.89 -0.49 -0.04 0.71 0.00 0.00 0.00 179.25 180.32 3d1v s TYR 166 N -6.17 3.10 -0.12 0.00 2.02 -1.26 -4.06 117.35 110.86 3d1v s TYR 166 Ca -0.14 -0.91 -0.23 0.00 -0.37 0.00 0.00 57.07 55.42 3d1v s TYR 166 Cb 0.20 -3.71 -0.10 0.00 -0.40 0.00 0.00 41.96 37.94 3d1v s TYR 166 CO 0.73 -1.10 0.68 -0.25 -1.57 0.00 0.00 175.55 174.05 3d1v n ASP 167 N 5.91 0.28 0.06 2.29 10.43 -0.77 -4.85 116.55 129.90 3d1v n ASP 167 Ca -0.10 0.61 -0.13 0.00 2.57 0.00 0.00 54.79 57.75 3d1v n ASP 167 Cb 0.43 -0.47 -0.08 0.00 1.84 0.00 0.00 41.12 42.84 3d1v n ASP 167 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 3d1v h ARG 168 N 2.04 -0.06 -0.63 -1.24 3.08 -1.94 -1.01 114.38 114.62 3d1v h ARG 168 Ca -0.25 0.00 0.13 0.00 0.07 0.00 0.00 59.98 59.93 3d1v h ARG 168 Cb 0.73 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.70 3d1v h ARG 168 CO 0.42 0.04 0.11 1.15 -1.07 0.00 0.00 179.97 180.61 3d1v h THR 169 N -0.15 0.58 0.00 2.04 2.02 -1.99 0.45 112.91 115.86 3d1v h THR 169 Ca -0.01 -0.08 -0.14 0.00 0.77 0.00 0.00 66.41 66.96 3d1v h THR 169 Cb 0.13 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 3d1v h THR 169 CO 0.01 0.04 -0.71 0.24 0.37 0.00 0.00 175.52 175.47 3d1v h MET 170 N 0.23 0.00 -0.47 6.66 2.86 -1.91 0.80 114.93 123.08 3d1v h MET 170 Ca 0.34 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.86 3d1v h MET 170 Cb 0.53 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.17 3d1v h MET 170 CO -0.45 0.62 -0.18 0.00 1.06 0.00 0.00 176.91 177.96 3d1v h ARG 171 N 0.00 0.94 0.00 1.72 3.08 0.54 0.67 114.38 121.33 3d1v h ARG 171 Ca -0.02 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.66 3d1v h ARG 171 Cb 1.51 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.52 3d1v h ARG 171 CO 0.08 1.03 0.00 0.94 -1.07 0.00 0.00 179.97 180.95 3d1v n GLN 172 N -4.12 0.00 -0.33 0.04 0.00 0.13 -0.74 117.38 112.37 3d1v n GLN 172 Ca 0.01 0.50 0.24 0.00 -0.00 0.00 0.00 57.00 57.74 3d1v n GLN 172 Cb 0.43 -1.30 0.47 0.00 0.00 0.00 0.00 30.24 29.84 3d1v n GLN 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3d1v h ARG 173 N 0.00 0.23 0.28 3.69 -0.00 0.75 0.91 114.38 120.23 3d1v h ARG 173 Ca 0.00 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.98 59.45 3d1v h ARG 173 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 29.97 29.92 3d1v h ARG 173 CO 0.00 0.15 -0.13 0.00 0.00 0.00 0.00 179.97 179.99 3d1v h ALA 174 N 1.88 -0.38 -0.87 0.04 0.00 0.76 -0.98 119.26 119.71 3d1v h ALA 174 Ca 0.73 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.51 3d1v h ALA 174 Cb 1.70 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 19.59 3d1v h ALA 174 CO -0.66 -0.63 0.57 1.25 0.00 0.00 0.00 179.25 179.78 3d1v h LEU 175 N -0.54 1.00 0.00 0.00 5.85 0.13 0.31 115.31 122.07 3d1v h LEU 175 Ca -0.04 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.65 3d1v h LEU 175 Cb 0.40 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.18 3d1v h LEU 175 CO 0.06 0.73 0.00 -1.20 -0.34 0.00 0.00 178.44 177.69 3d1v n SER 176 N -4.47 0.00 -0.28 1.25 7.64 -0.43 -2.73 113.62 114.60 3d1v n SER 176 Ca 0.09 0.46 0.09 0.00 1.01 0.00 0.00 58.87 60.52 3d1v n SER 176 Cb 0.02 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 63.40 3d1v n SER 176 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 3d1v n THR 177 N -0.75 -0.34 0.19 0.44 -1.04 -0.39 0.22 114.28 112.61 3d1v n THR 177 Ca 0.00 1.81 0.16 0.00 -2.04 0.00 0.00 64.05 63.98 3d1v n THR 177 Cb 0.00 -2.58 0.78 0.00 -1.82 0.00 0.00 70.33 66.71 3d1v n THR 177 CO 0.00 0.00 0.00 -0.25 -0.64 0.00 0.00 175.07 174.18 3d1v h TRP 178 N 0.00 0.00 0.00 -1.42 2.91 -0.22 -2.27 115.95 114.95 3d1v h TRP 178 Ca 0.45 0.00 -0.07 0.00 1.13 0.00 0.00 58.89 60.40 3d1v h TRP 178 Cb 0.83 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.47 3d1v h TRP 178 CO -0.50 0.00 -0.49 0.87 -1.03 0.00 0.00 178.44 177.29 3d1v h LYS 179 N 0.00 0.00 -0.91 2.65 1.57 0.29 -3.29 116.57 116.88 3d1v h LYS 179 Ca 0.09 0.00 0.26 0.00 -1.87 0.00 0.00 60.65 59.13 3d1v h LYS 179 Cb 0.44 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 3d1v h LYS 179 CO -0.00 0.57 0.76 1.04 -0.57 0.00 0.00 179.45 181.25 3d1v n GLN 180 N -4.59 0.00 -0.17 3.15 1.13 -0.41 0.70 117.38 117.19 3d1v n GLN 180 Ca -0.14 0.60 0.06 0.00 -1.94 0.00 0.00 57.00 55.58 3d1v n GLN 180 Cb 0.39 -1.42 0.15 0.00 0.11 0.00 0.00 30.24 29.48 3d1v n GLN 180 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3d1v n MET 181 N -2.81 2.68 -1.64 -1.09 0.00 -1.02 -5.05 117.12 108.19 3d1v n MET 181 Ca 0.21 -2.01 0.00 0.00 0.00 0.00 0.00 57.70 55.89 3d1v n MET 181 Cb 1.04 -1.28 0.00 0.00 0.00 0.00 0.00 33.22 32.97 3d1v n MET 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3d1v n GLY 182 N 0.59 0.00 3.08 3.17 0.00 3.37 -4.98 105.19 110.41 3d1v n GLY 182 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 3d1v n GLY 182 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d1v s GLU 183 N 0.00 0.68 0.00 1.61 0.41 -1.26 -5.04 118.70 115.10 3d1v s GLU 183 Ca 0.00 -0.66 0.00 0.00 -0.41 0.00 0.00 54.97 53.90 3d1v s GLU 183 Cb 0.00 -0.60 0.00 0.00 -1.78 0.00 0.00 34.13 31.75 3d1v s GLU 183 CO 0.00 0.14 0.00 1.04 -0.49 0.00 0.00 175.26 175.95 3d1v n GLN 184 N 1.92 0.00 -0.91 1.61 1.13 -1.26 -4.67 117.38 115.21 3d1v n GLN 184 Ca -0.19 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.87 3d1v n GLN 184 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.90 3d1v n GLN 184 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3d1v n ARG 185 N 0.00 2.64 -2.88 -1.09 1.74 -1.26 -5.13 116.66 110.67 3d1v n ARG 185 Ca 0.00 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.72 3d1v n ARG 185 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.38 3d1v n ARG 185 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3d1v s GLU 186 N -0.32 4.43 -0.69 5.56 2.56 -1.26 -5.00 118.70 123.98 3d1v s GLU 186 Ca 0.00 1.16 -0.27 0.00 0.00 0.00 0.00 54.97 55.86 3d1v s GLU 186 Cb 0.00 -2.72 0.01 0.00 2.00 0.00 0.00 34.13 33.41 3d1v s GLU 186 CO 0.00 0.26 1.56 -1.17 -0.56 0.00 0.00 175.26 175.35 3d1v s LEU 187 N -2.22 3.22 1.14 2.70 0.20 -1.26 -4.70 118.68 117.76 3d1v s LEU 187 Ca 0.50 -0.11 -0.15 0.00 0.69 0.00 0.00 54.13 55.06 3d1v s LEU 187 Cb -0.16 -2.55 0.20 0.00 -0.43 0.00 0.00 46.19 43.25 3d1v s LEU 187 CO 0.21 -2.09 0.60 0.00 -0.29 0.00 0.00 176.35 174.78 3d1v n GLN 188 N 9.28 -1.98 -3.53 1.98 1.13 -1.22 -4.88 117.38 118.16 3d1v n GLN 188 Ca 0.12 -0.55 -0.15 0.00 -1.94 0.00 0.00 57.00 54.48 3d1v n GLN 188 Cb 0.50 -1.98 -0.05 0.00 0.11 0.00 0.00 30.24 28.82 3d1v n GLN 188 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3d1v s GLU 189 N -4.00 0.93 0.00 -1.09 2.12 -1.26 -1.13 118.70 114.27 3d1v s GLU 189 Ca 0.63 0.15 0.00 0.00 0.36 0.00 0.00 54.97 56.11 3d1v s GLU 189 Cb -0.20 0.44 0.00 0.00 0.26 0.00 0.00 34.13 34.63 3d1v s GLU 189 CO 0.65 -0.31 0.00 0.41 -0.54 0.00 0.00 175.26 175.48 3d1v n GLY 190 N 0.72 2.15 3.72 -1.50 0.00 -1.14 -4.84 105.19 104.29 3d1v n GLY 190 Ca -0.16 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 3d1v n GLY 190 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d1v s THR 191 N -1.67 4.96 -0.25 2.61 2.01 -1.26 -0.26 115.64 121.79 3d1v s THR 191 Ca 0.00 1.60 -0.10 0.00 0.31 0.00 0.00 61.69 63.50 3d1v s THR 191 Cb 0.00 -4.11 -0.05 0.00 0.01 0.00 0.00 72.50 68.35 3d1v s THR 191 CO 0.00 0.25 0.15 -0.47 -0.69 0.00 0.00 174.62 173.86 3d1v s TYR 192 N 0.72 3.24 -0.25 4.92 5.04 -0.21 0.67 117.35 131.49 3d1v s TYR 192 Ca 0.41 0.08 -0.18 0.00 -2.44 0.00 0.00 57.07 54.93 3d1v s TYR 192 Cb -0.19 -2.28 -0.03 0.00 0.35 0.00 0.00 41.96 39.81 3d1v s TYR 192 CO 0.21 -0.06 0.54 0.54 -1.34 0.00 0.00 175.55 175.43 3d1v s VAL 193 N 1.31 5.06 -0.38 3.14 0.11 0.17 0.19 120.40 129.99 3d1v s VAL 193 Ca 0.07 0.94 -0.27 0.00 -2.93 0.00 0.00 61.98 59.79 3d1v s VAL 193 Cb -0.14 -3.85 0.02 0.00 -1.53 0.00 0.00 36.38 30.87 3d1v s VAL 193 CO 0.06 0.09 0.97 -0.32 -3.33 0.00 0.00 175.10 172.57 3d1v s MET 194 N 2.21 3.82 0.02 1.54 1.75 -0.43 -0.87 119.30 127.34 3d1v s MET 194 Ca 0.23 0.60 0.03 0.00 -1.25 0.00 0.00 55.69 55.29 3d1v s MET 194 Cb -0.16 -3.82 -0.04 0.00 2.84 0.00 0.00 34.83 33.66 3d1v s MET 194 CO 0.09 -1.02 -0.02 0.54 -0.65 0.00 0.00 175.02 173.96 3d1v s VAL 195 N 3.64 3.95 0.78 10.11 0.11 -0.46 -2.10 120.40 136.42 3d1v s VAL 195 Ca 0.40 -0.73 -0.12 0.00 -2.93 0.00 0.00 61.98 58.60 3d1v s VAL 195 Cb -0.11 -2.77 0.06 0.00 -1.53 0.00 0.00 36.38 32.03 3d1v s VAL 195 CO 0.21 0.33 1.15 0.00 -3.33 0.00 0.00 175.10 173.46 3d1v s ALA 196 N -1.10 2.67 0.00 1.54 0.00 -1.26 -4.35 121.76 119.26 3d1v s ALA 196 Ca 0.20 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.64 3d1v s ALA 196 Cb -0.11 -2.99 0.00 0.00 0.00 0.00 0.00 23.12 20.01 3d1v s ALA 196 CO 0.11 -1.52 0.00 0.41 0.00 0.00 0.00 175.76 174.75 3d1v n GLY 197 N -3.10 -0.59 0.02 0.00 0.00 -1.26 -4.88 105.19 95.38 3d1v n GLY 197 Ca 0.07 -0.95 0.11 0.00 0.00 0.00 0.00 46.02 45.25 3d1v n GLY 197 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d1v n PRO 198 N 1.84 0.26 -0.60 1.61 -0.04 -1.26 -4.93 135.00 131.88 3d1v n PRO 198 Ca 0.00 -0.03 -0.31 0.00 -0.04 0.00 0.00 63.50 63.12 3d1v n PRO 198 Cb 0.00 -1.56 0.20 0.00 -0.04 0.00 0.00 33.50 32.10 3d1v n PRO 198 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3d1v n SER 199 N -1.88 -2.28 -4.96 3.54 3.41 -1.26 -5.07 113.62 105.12 3d1v n SER 199 Ca 0.02 -0.17 -0.23 0.00 -0.26 0.00 0.00 58.87 58.23 3d1v n SER 199 Cb 0.43 -1.03 0.04 0.00 -0.26 0.00 0.00 64.21 63.39 3d1v n SER 199 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3d1v s PHE 200 N -2.27 2.94 0.76 7.33 0.08 -1.26 -5.07 117.98 120.48 3d1v s PHE 200 Ca 0.59 0.18 -0.11 0.00 0.12 0.00 0.00 56.93 57.71 3d1v s PHE 200 Cb -0.15 -2.83 0.05 0.00 -0.57 0.00 0.00 43.02 39.51 3d1v s PHE 200 CO 0.66 -0.97 1.09 -1.21 -0.10 0.00 0.00 175.22 174.68 3d1v s GLU 201 N -4.89 2.42 0.75 0.44 8.01 -1.26 -5.05 118.70 119.12 3d1v s GLU 201 Ca 0.57 0.68 -0.03 0.00 0.01 0.00 0.00 54.97 56.20 3d1v s GLU 201 Cb -0.10 -1.95 0.13 0.00 -4.31 0.00 0.00 34.13 27.89 3d1v s GLU 201 CO 0.41 -1.39 1.03 0.95 0.01 0.00 0.00 175.26 176.27 3d1v s THR 202 N -3.16 2.16 0.16 3.63 -4.23 -1.26 -4.89 115.64 108.04 3d1v s THR 202 Ca 0.60 -0.48 -0.10 0.00 -1.18 0.00 0.00 61.69 60.52 3d1v s THR 202 Cb -0.14 -2.67 0.01 0.00 1.34 0.00 0.00 72.50 71.04 3d1v s THR 202 CO 0.54 0.00 1.57 0.58 -0.54 0.00 0.00 174.62 176.77 3d1v h VAL 203 N -0.67 1.27 0.00 2.29 2.07 -1.96 0.93 116.25 120.17 3d1v h VAL 203 Ca -0.38 -1.31 -0.06 0.00 0.82 0.00 0.00 66.70 65.77 3d1v h VAL 203 Cb 1.27 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 3d1v h VAL 203 CO 0.42 0.46 -0.27 0.00 0.02 0.00 0.00 177.57 178.19 3d1v h ALA 204 N 0.89 1.44 -0.01 1.67 0.00 -1.94 0.16 119.26 121.47 3d1v h ALA 204 Ca 0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3d1v h ALA 204 Cb 0.72 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3d1v h ALA 204 CO 0.06 0.34 -0.03 0.93 0.00 0.00 0.00 179.25 180.55 3d1v h GLU 205 N 0.00 0.04 -0.61 0.00 5.08 -1.52 -0.90 114.58 116.66 3d1v h GLU 205 Ca -0.00 -0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.46 3d1v h GLU 205 Cb 0.52 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.66 3d1v h GLU 205 CO 0.04 0.64 -0.11 0.00 -1.00 0.00 0.00 179.01 178.58 3d1v h ARG 207 N 0.03 -0.20 -0.93 0.00 3.08 -0.57 0.13 114.38 115.92 3d1v h ARG 207 Ca 0.30 0.01 0.19 0.00 0.07 0.00 0.00 59.98 60.55 3d1v h ARG 207 Cb 0.47 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.49 3d1v h ARG 207 CO -0.60 -0.13 0.60 -0.39 -1.07 0.00 0.00 179.97 178.38 3d1v h VAL 208 N -0.21 0.72 0.00 2.04 -1.51 0.22 -0.77 116.25 116.74 3d1v h VAL 208 Ca 0.14 -0.20 -0.11 0.00 -1.23 0.00 0.00 66.70 65.30 3d1v h VAL 208 Cb 0.42 0.10 -0.02 0.00 -2.13 0.00 0.00 31.29 29.66 3d1v h VAL 208 CO -0.38 0.11 -0.53 -0.07 -1.23 0.00 0.00 177.57 175.47 3d1v h LEU 209 N 0.58 0.00 0.46 4.19 4.07 0.02 0.13 115.31 124.76 3d1v h LEU 209 Ca 0.50 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.43 3d1v h LEU 209 Cb 0.99 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.73 3d1v h LEU 209 CO -0.24 0.53 -0.22 1.56 -1.08 0.00 0.00 178.44 178.99 3d1v h GLN 210 N 0.00 -0.60 -0.16 1.13 4.20 0.31 0.16 115.11 120.15 3d1v h GLN 210 Ca -0.01 0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.79 3d1v h GLN 210 Cb 1.24 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 29.14 3d1v h GLN 210 CO 0.07 -0.40 0.20 1.57 -0.67 0.00 0.00 178.83 179.60 3d1v h LYS 211 N -0.98 0.00 0.00 1.46 2.10 -1.09 3.25 116.57 121.31 3d1v h LYS 211 Ca -0.06 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.59 3d1v h LYS 211 Cb 0.48 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.81 3d1v h LYS 211 CO 0.10 0.00 0.00 1.25 -2.00 0.00 0.00 179.45 178.80 3d1v h LEU 212 N 0.00 0.00 0.00 7.07 5.85 -0.61 -3.46 115.31 124.15 3d1v h LEU 212 Ca 0.08 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.80 3d1v h LEU 212 Cb 0.47 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.50 3d1v h LEU 212 CO -0.00 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.71 3d1v n GLY 213 N 0.09 1.11 3.73 3.75 0.00 1.08 -5.05 105.19 109.91 3d1v n GLY 213 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 3d1v n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d1v s ALA 214 N -2.00 3.39 -0.15 4.61 0.00 0.50 -4.72 121.76 123.39 3d1v s ALA 214 Ca 0.00 -1.27 0.03 0.00 0.00 0.00 0.00 51.96 50.72 3d1v s ALA 214 Cb 0.00 -1.19 -0.11 0.00 0.00 0.00 0.00 23.12 21.81 3d1v s ALA 214 CO 0.00 0.52 -0.11 -0.25 0.00 0.00 0.00 175.76 175.92 3d1v n ASP 215 N -0.15 2.62 -4.18 0.00 8.00 0.21 -4.26 116.55 118.80 3d1v n ASP 215 Ca -0.09 -0.07 -0.28 0.00 0.71 0.00 0.00 54.79 55.06 3d1v n ASP 215 Cb 0.55 -0.06 -0.16 0.00 -0.02 0.00 0.00 41.12 41.42 3d1v n ASP 215 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d1v s ALA 216 N -2.31 1.73 -0.10 2.24 0.00 -0.74 0.20 121.76 122.77 3d1v s ALA 216 Ca -0.19 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 50.98 3d1v s ALA 216 Cb 0.05 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.59 3d1v s ALA 216 CO 0.39 0.32 -0.12 0.54 0.00 0.00 0.00 175.76 176.89 3d1v s VAL 217 N -0.03 3.19 0.00 0.00 0.11 0.16 0.41 120.40 124.23 3d1v s VAL 217 Ca -0.04 -0.64 0.00 0.00 -2.93 0.00 0.00 61.98 58.37 3d1v s VAL 217 Cb -0.12 -2.31 0.00 0.00 -1.53 0.00 0.00 36.38 32.42 3d1v s VAL 217 CO 0.03 0.55 0.00 0.61 -3.33 0.00 0.00 175.10 172.96 3d1v n GLY 218 N 2.93 4.56 0.57 6.54 0.00 -0.05 -1.16 105.19 118.58 3d1v n GLY 218 Ca -0.18 -0.69 -0.01 0.00 0.00 0.00 0.00 46.02 45.14 3d1v n GLY 218 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3d1v n MET 219 N 0.00 0.00 0.00 1.61 2.81 -1.26 -1.36 117.12 118.92 3d1v n MET 219 Ca 0.00 -0.21 0.00 0.00 -1.81 0.00 0.00 57.70 55.68 3d1v n MET 219 Cb 0.00 0.02 0.00 0.00 -0.71 0.00 0.00 33.22 32.53 3d1v n MET 219 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3d1v n SER 220 N 0.01 0.16 0.00 7.83 3.41 -1.26 -4.65 113.62 119.12 3d1v n SER 220 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 3d1v n SER 220 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 3d1v n SER 220 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3d1v n THR 221 N 0.00 0.00 0.03 6.66 -1.04 -1.26 -4.06 114.28 114.61 3d1v n THR 221 Ca 0.00 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 61.94 3d1v n THR 221 Cb 0.00 0.00 0.09 0.00 -1.82 0.00 0.00 70.33 68.60 3d1v n THR 221 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3d1v h VAL 222 N 0.00 1.33 0.60 12.58 2.07 -1.95 3.22 116.25 134.10 3d1v h VAL 222 Ca 0.00 -1.79 -0.03 0.00 0.82 0.00 0.00 66.70 65.71 3d1v h VAL 222 Cb 0.00 1.79 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 3d1v h VAL 222 CO 0.00 0.55 -0.33 -0.65 0.02 0.00 0.00 177.57 177.16 3d1v h PRO 223 N 0.35 -0.83 -0.79 1.57 0.11 -1.98 -1.78 132.00 128.66 3d1v h PRO 223 Ca 0.01 0.06 0.19 0.00 0.11 0.00 0.00 66.00 66.36 3d1v h PRO 223 Cb 1.05 0.19 -0.13 0.00 0.11 0.00 0.00 31.00 32.22 3d1v h PRO 223 CO 0.09 -0.56 0.10 0.93 -0.21 0.00 0.00 178.00 178.36 3d1v h GLU 224 N -0.87 0.16 0.48 1.05 3.07 -0.52 0.93 114.58 118.88 3d1v h GLU 224 Ca -0.08 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.75 3d1v h GLU 224 Cb 0.69 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.57 3d1v h GLU 224 CO 0.10 0.10 -0.23 0.28 -1.40 0.00 0.00 179.01 177.86 3d1v h VAL 225 N 0.16 0.27 -0.94 3.13 2.07 0.55 1.91 116.25 123.41 3d1v h VAL 225 Ca 0.45 -0.51 0.26 0.00 0.82 0.00 0.00 66.70 67.72 3d1v h VAL 225 Cb 0.83 0.41 -0.14 0.00 -1.52 0.00 0.00 31.29 30.86 3d1v h VAL 225 CO -0.64 0.05 0.42 0.40 0.02 0.00 0.00 177.57 177.82 3d1v h ILE 226 N -1.05 0.37 0.00 4.57 2.04 -1.09 2.07 117.51 124.41 3d1v h ILE 226 Ca -0.07 -0.11 -0.22 0.00 1.00 0.00 0.00 64.86 65.46 3d1v h ILE 226 Cb 0.58 0.01 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 3d1v h ILE 226 CO 0.11 0.06 -1.46 -0.37 0.00 0.00 0.00 178.15 176.49 3d1v h VAL 227 N 0.33 0.77 0.58 1.67 -1.51 0.14 0.30 116.25 118.53 3d1v h VAL 227 Ca 0.62 -2.43 -0.03 0.00 -1.23 0.00 0.00 66.70 63.63 3d1v h VAL 227 Cb 1.30 2.29 0.01 0.00 -2.13 0.00 0.00 31.29 32.75 3d1v h VAL 227 CO -0.59 0.44 -0.28 0.00 -1.23 0.00 0.00 177.57 175.90 3d1v h ALA 228 N 1.21 -0.78 -0.06 5.19 0.00 0.48 -1.07 119.26 124.23 3d1v h ALA 228 Ca -0.19 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 3d1v h ALA 228 Cb 1.78 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.86 3d1v h ALA 228 CO 0.07 -0.84 -0.22 0.00 0.00 0.00 0.00 179.25 178.26 3d1v h ARG 229 N -0.98 0.09 0.00 0.00 2.47 0.36 0.16 114.38 116.48 3d1v h ARG 229 Ca -0.08 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.59 3d1v h ARG 229 Cb 0.66 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.96 3d1v h ARG 229 CO 0.13 0.31 -0.12 1.25 0.56 0.00 0.00 179.97 182.11 3d1v h HIS 230 N 0.08 0.00 0.00 3.04 2.76 0.04 0.16 115.15 121.23 3d1v h HIS 230 Ca 0.01 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 3d1v h HIS 230 Cb 0.44 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.40 3d1v h HIS 230 CO 0.00 0.12 -1.30 0.00 -1.30 0.00 0.00 177.93 175.45 3d1v n GLY 232 N 1.26 0.63 3.75 0.00 0.00 0.57 -4.93 105.19 106.48 3d1v n GLY 232 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 3d1v n GLY 232 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d1v s LEU 233 N 0.00 3.49 -0.02 0.99 1.43 -0.31 -4.94 118.68 119.33 3d1v s LEU 233 Ca 0.00 2.23 -0.30 0.00 -1.03 0.00 0.00 54.13 55.03 3d1v s LEU 233 Cb 0.00 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.61 3d1v s LEU 233 CO 0.00 -1.74 0.98 -0.60 0.23 0.00 0.00 176.35 175.23 3d1v s ARG 234 N -3.72 4.54 -0.04 1.70 3.52 0.03 -4.38 118.95 120.59 3d1v s ARG 234 Ca 0.73 1.41 0.06 0.00 -0.13 0.00 0.00 55.73 57.80 3d1v s ARG 234 Cb -0.26 -3.47 -0.01 0.00 -1.56 0.00 0.00 34.95 29.64 3d1v s ARG 234 CO 0.38 -0.09 -0.23 0.08 -0.81 0.00 0.00 175.30 174.63 3d1v s VAL 235 N 1.18 1.84 0.25 7.11 1.01 -1.26 -0.26 120.40 130.26 3d1v s VAL 235 Ca 0.51 -0.97 -0.08 0.00 0.00 0.00 0.00 61.98 61.45 3d1v s VAL 235 Cb -0.21 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 3d1v s VAL 235 CO 0.26 0.52 0.38 0.72 0.00 0.00 0.00 175.10 176.98 3d1v s PHE 236 N -0.31 0.69 -0.03 5.22 -0.12 -1.14 -1.86 117.98 120.43 3d1v s PHE 236 Ca 0.02 -0.99 -0.10 0.00 -0.05 0.00 0.00 56.93 55.81 3d1v s PHE 236 Cb -0.11 -0.06 0.03 0.00 -0.63 0.00 0.00 43.02 42.25 3d1v s PHE 236 CO 0.01 -0.92 0.45 0.41 -0.05 0.00 0.00 175.22 175.13 3d1v n GLY 237 N -0.38 0.31 3.19 1.99 0.00 -1.26 -2.32 105.19 106.72 3d1v n GLY 237 Ca -0.00 -0.87 -0.10 0.00 0.00 0.00 0.00 46.02 45.05 3d1v n GLY 237 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d1v s PHE 238 N -2.09 0.10 -0.05 1.61 0.08 -1.07 0.74 117.98 117.30 3d1v s PHE 238 Ca 0.11 -0.42 0.06 0.00 0.12 0.00 0.00 56.93 56.80 3d1v s PHE 238 Cb -0.00 -0.04 -0.02 0.00 -0.57 0.00 0.00 43.02 42.39 3d1v s PHE 238 CO -0.01 -0.49 -0.22 -1.12 -0.10 0.00 0.00 175.22 173.28 3d1v s SER 239 N -2.46 3.31 -0.23 1.36 0.01 -0.26 -2.39 113.70 113.04 3d1v s SER 239 Ca -0.00 -0.43 -0.24 0.00 1.31 0.00 0.00 55.95 56.59 3d1v s SER 239 Cb 0.02 -0.74 -0.01 0.00 0.21 0.00 0.00 66.02 65.50 3d1v s SER 239 CO -0.07 0.28 0.80 -0.22 0.41 0.00 0.00 173.24 174.44 3d1v s LEU 240 N -0.37 4.10 -0.48 2.44 2.96 0.14 -0.09 118.68 127.37 3d1v s LEU 240 Ca 0.03 1.02 -0.28 0.00 -0.22 0.00 0.00 54.13 54.68 3d1v s LEU 240 Cb -0.12 -3.15 0.01 0.00 0.50 0.00 0.00 46.19 43.42 3d1v s LEU 240 CO 0.02 -0.47 1.48 -0.63 -1.32 0.00 0.00 176.35 175.43 3d1v s ILE 241 N 2.62 3.77 -2.51 6.68 -1.09 0.13 -1.27 121.20 129.54 3d1v s ILE 241 Ca 0.34 0.72 0.23 0.00 -2.23 0.00 0.00 60.65 59.71 3d1v s ILE 241 Cb -0.16 -4.23 0.41 0.00 -1.58 0.00 0.00 42.46 36.90 3d1v s ILE 241 CO 0.09 -0.91 1.48 0.35 -1.23 0.00 0.00 174.94 174.71 3d1v n THR 242 N 7.03 0.24 -3.61 2.92 -2.24 0.41 -1.54 114.28 117.49 3d1v n THR 242 Ca 0.16 -0.49 -0.13 0.00 -2.27 0.00 0.00 64.05 61.32 3d1v n THR 242 Cb 0.49 0.79 -0.07 0.00 -2.10 0.00 0.00 70.33 69.44 3d1v n THR 242 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3d1v s ASN 243 N -1.68 -0.61 -0.27 3.42 -0.87 -1.22 -3.89 114.94 109.82 3d1v s ASN 243 Ca 0.34 1.05 -0.12 0.00 -1.57 0.00 0.00 52.86 52.57 3d1v s ASN 243 Cb 0.20 1.02 -0.05 0.00 -0.02 0.00 0.00 41.25 42.40 3d1v s ASN 243 CO 0.30 -0.29 0.22 -0.75 -2.57 0.00 0.00 177.10 174.00 3d1v s LYS 244 N -0.08 4.00 0.02 -0.60 2.20 -1.26 0.23 119.74 124.24 3d1v s LYS 244 Ca -0.01 -0.23 -0.22 0.00 -0.36 0.00 0.00 55.97 55.15 3d1v s LYS 244 Cb -0.04 -3.63 -0.06 0.00 -1.51 0.00 0.00 37.83 32.60 3d1v s LYS 244 CO 0.00 -0.13 0.64 0.08 -0.36 0.00 0.00 175.35 175.58 3d1v s VAL 245 N 1.62 4.83 -0.12 4.02 1.01 0.29 -4.73 120.40 127.31 3d1v s VAL 245 Ca 0.09 1.35 -0.29 0.00 0.00 0.00 0.00 61.98 63.12 3d1v s VAL 245 Cb -0.15 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 3d1v s VAL 245 CO 0.09 0.42 1.45 -0.63 0.00 0.00 0.00 175.10 176.44 3d1v s ILE 246 N -0.29 3.94 -2.16 2.22 -1.09 -1.26 -4.86 121.20 117.70 3d1v s ILE 246 Ca 0.33 1.13 0.20 0.00 -2.23 0.00 0.00 60.65 60.08 3d1v s ILE 246 Cb -0.19 -3.75 0.50 0.00 -1.58 0.00 0.00 42.46 37.44 3d1v s ILE 246 CO 0.19 -0.12 1.45 0.23 -1.23 0.00 0.00 174.94 175.46 3d1v n MET 247 N 6.92 2.36 -3.64 2.79 2.81 -1.26 -4.71 117.12 122.39 3d1v n MET 247 Ca 0.16 -2.09 -0.10 0.00 -1.81 0.00 0.00 57.70 53.86 3d1v n MET 247 Cb 0.44 -1.48 -0.07 0.00 -0.71 0.00 0.00 33.22 31.40 3d1v n MET 247 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3d1v s ASP 248 N -1.20 -0.64 -0.05 7.83 -1.08 -1.26 -4.77 116.67 115.51 3d1v s ASP 248 Ca 0.39 1.18 -0.30 0.00 -0.52 0.00 0.00 52.55 53.30 3d1v s ASP 248 Cb 0.21 1.21 -0.03 0.00 -1.46 0.00 0.00 42.92 42.85 3d1v s ASP 248 CO 0.29 -0.20 1.19 -0.31 0.52 0.00 0.00 175.17 176.65 3d1v s TYR 249 N 0.59 3.23 0.00 -5.34 2.02 -1.26 -4.98 117.35 111.61 3d1v s TYR 249 Ca -0.01 1.25 0.00 0.00 -0.37 0.00 0.00 57.07 57.94 3d1v s TYR 249 Cb -0.05 -3.40 0.00 0.00 -0.40 0.00 0.00 41.96 38.11 3d1v s TYR 249 CO -0.06 -1.23 0.00 -0.85 -1.57 0.00 0.00 175.55 171.83 3d1v n GLU 250 N 5.06 0.00 0.00 -0.62 -0.00 -1.26 -5.20 120.64 118.62 3d1v n GLU 250 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.27 3d1v n GLU 250 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.90 3d1v n GLU 250 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3d1v n SER 251 N 0.00 0.00 -4.61 -1.84 2.88 -1.26 -4.61 113.62 104.18 3d1v n SER 251 Ca 0.00 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 3d1v n SER 251 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 3d1v n SER 251 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3d1v s LEU 252 N 0.00 3.62 0.00 2.46 1.02 -1.26 -4.88 118.68 119.65 3d1v s LEU 252 Ca 0.00 1.51 0.00 0.00 0.02 0.00 0.00 54.13 55.66 3d1v s LEU 252 Cb 0.00 -3.53 0.00 0.00 0.02 0.00 0.00 46.19 42.68 3d1v s LEU 252 CO 0.00 -1.60 0.00 1.21 0.02 0.00 0.00 176.35 175.98 3d1v n GLU 253 N 8.25 0.00 -3.44 1.70 4.07 -1.26 -5.15 120.64 124.81 3d1v n GLU 253 Ca 0.23 0.00 -0.24 0.00 -0.06 0.00 0.00 57.16 57.08 3d1v n GLU 253 Cb 0.46 0.00 -0.11 0.00 -0.06 0.00 0.00 31.44 31.73 3d1v n GLU 253 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 3d1v s LYS 254 N 1.47 0.50 0.00 5.31 1.02 -1.26 -5.11 119.74 121.66 3d1v s LYS 254 Ca 0.00 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.04 3d1v s LYS 254 Cb 0.00 -1.04 0.00 0.00 -0.52 0.00 0.00 37.83 36.27 3d1v s LYS 254 CO 0.00 -1.16 0.00 0.00 -0.92 0.00 0.00 175.35 173.27 3d1v n ALA 255 N 4.41 0.00 -2.77 5.17 0.00 -1.26 -4.53 120.51 121.53 3d1v n ALA 255 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3d1v n ALA 255 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 3d1v n ALA 255 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3d1v n ASN 256 N 0.00 1.14 0.00 0.00 6.94 -1.26 -5.09 115.26 116.99 3d1v n ASN 256 Ca 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 54.58 54.44 3d1v n ASN 256 Cb 0.00 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.34 3d1v n ASN 256 CO 0.00 0.00 0.00 -0.74 -1.03 0.00 0.00 177.26 175.49 3d1v h HIS 257 N 0.00 0.03 -1.22 -2.53 -0.00 -1.98 -3.31 115.15 106.15 3d1v h HIS 257 Ca 0.00 -0.00 -0.74 0.00 -0.00 0.00 0.00 60.37 59.63 3d1v h HIS 257 Cb 0.00 -0.01 -0.13 0.00 -0.00 0.00 0.00 27.41 27.27 3d1v h HIS 257 CO 0.00 0.28 2.13 -0.85 -0.00 0.00 0.00 177.93 179.49 3d1v n GLU 258 N -4.94 3.37 0.00 5.26 0.00 -1.26 -4.02 120.64 119.05 3d1v n GLU 258 Ca -0.07 -3.38 0.00 0.00 0.00 0.00 0.00 57.16 53.70 3d1v n GLU 258 Cb 0.15 -3.08 0.00 0.00 0.00 0.00 0.00 31.44 28.51 3d1v n GLU 258 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 3d1v n GLU 259 N 5.18 0.00 -4.00 3.44 0.28 -1.24 -5.18 120.64 119.12 3d1v n GLU 259 Ca 0.43 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 57.14 3d1v n GLU 259 Cb 0.39 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 33.21 3d1v n GLU 259 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 3d1v s VAL 260 N 0.00 4.93 0.00 3.84 1.01 -1.26 -4.99 120.40 123.94 3d1v s VAL 260 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.27 3d1v s VAL 260 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.93 3d1v s VAL 260 CO 0.00 0.04 0.17 0.18 0.00 0.00 0.00 175.10 175.48 3d1v n LEU 261 N 0.04 1.85 -0.00 3.92 4.77 -1.26 -3.27 117.00 123.05 3d1v n LEU 261 Ca -0.07 0.17 0.08 0.00 -0.03 0.00 0.00 56.01 56.16 3d1v n LEU 261 Cb 0.53 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.52 3d1v n LEU 261 CO 0.47 0.00 -0.10 0.00 -1.33 0.00 0.00 177.39 176.43 3d1v n ALA 262 N -0.62 4.07 1.53 -1.18 0.00 -1.26 -3.35 120.51 119.70 3d1v n ALA 262 Ca 0.00 -0.47 0.02 0.00 0.00 0.00 0.00 53.44 52.98 3d1v n ALA 262 Cb 0.00 -0.61 0.05 0.00 0.00 0.00 0.00 19.45 18.88 3d1v n ALA 262 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d1v n ALA 263 N -1.47 2.51 -0.00 0.00 0.00 -1.26 0.83 120.51 121.13 3d1v n ALA 263 Ca 0.03 -0.20 -0.00 0.00 0.00 0.00 0.00 53.44 53.26 3d1v n ALA 263 Cb 0.28 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.74 3d1v n ALA 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d1v n GLY 264 N 0.59 -0.18 0.17 0.00 0.00 -1.20 -4.47 105.19 100.09 3d1v n GLY 264 Ca 0.04 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.11 3d1v n GLY 264 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d1v h LYS 265 N -0.04 0.00 -0.03 1.61 1.57 -1.62 0.12 116.57 118.18 3d1v h LYS 265 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 3d1v h LYS 265 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3d1v h LYS 265 CO 0.00 0.28 -0.13 0.37 -0.57 0.00 0.00 179.45 179.40 3d1v h GLN 266 N 0.00 0.14 -0.67 3.15 5.75 0.19 -2.61 115.11 121.06 3d1v h GLN 266 Ca -0.00 -0.11 0.07 0.00 -0.15 0.00 0.00 58.65 58.45 3d1v h GLN 266 Cb 1.22 0.02 -0.06 0.00 1.07 0.00 0.00 27.48 29.73 3d1v h GLN 266 CO 0.04 0.77 0.35 0.00 -2.65 0.00 0.00 178.83 177.34 3d1v h ALA 267 N 0.37 0.89 -0.08 3.38 0.00 -1.31 0.47 119.26 122.98 3d1v h ALA 267 Ca -0.01 0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3d1v h ALA 267 Cb 0.79 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 3d1v h ALA 267 CO 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 179.25 179.05 3d1v h ALA 268 N 1.37 -0.23 -0.48 0.00 0.00 -0.83 0.11 119.26 119.20 3d1v h ALA 268 Ca 0.31 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.19 3d1v h ALA 268 Cb 0.24 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3d1v h ALA 268 CO -0.21 -0.70 0.06 1.96 0.00 0.00 0.00 179.25 180.36 3d1v h GLN 269 N -0.31 0.75 0.12 0.00 4.20 -1.04 0.59 115.11 119.42 3d1v h GLN 269 Ca 0.09 -0.17 0.02 0.00 0.06 0.00 0.00 58.65 58.65 3d1v h GLN 269 Cb 0.44 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 28.07 3d1v h GLN 269 CO -0.26 0.72 -0.43 -0.22 -0.67 0.00 0.00 178.83 177.97 3d1v h LYS 270 N 0.72 -0.64 -0.80 1.46 1.63 0.83 0.37 116.57 120.13 3d1v h LYS 270 Ca 0.15 0.04 0.05 0.00 -0.85 0.00 0.00 60.65 60.04 3d1v h LYS 270 Cb 0.35 0.15 -0.05 0.00 -0.60 0.00 0.00 32.23 32.07 3d1v h LYS 270 CO 0.01 -0.43 0.50 1.25 -3.45 0.00 0.00 179.45 177.33 3d1v h LEU 271 N -0.67 0.80 -0.52 5.20 6.46 -0.53 -1.23 115.31 124.81 3d1v h LEU 271 Ca 0.02 0.01 0.01 0.00 -0.12 0.00 0.00 57.88 57.80 3d1v h LEU 271 Cb 0.69 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 40.43 3d1v h LEU 271 CO -0.24 0.53 0.33 -0.33 -0.62 0.00 0.00 178.44 178.10 3d1v h GLU 272 N 0.94 0.65 -0.47 1.25 5.08 0.13 0.21 114.58 122.36 3d1v h GLU 272 Ca 0.34 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.56 3d1v h GLU 272 Cb 0.11 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3d1v h GLU 272 CO -0.15 0.43 -0.11 -0.56 -1.00 0.00 0.00 179.01 177.62 3d1v h GLN 273 N 0.67 0.91 -0.87 2.33 3.07 -0.14 0.14 115.11 121.21 3d1v h GLN 273 Ca 0.20 -0.34 0.12 0.00 0.09 0.00 0.00 58.65 58.71 3d1v h GLN 273 Cb -0.03 -0.05 -0.08 0.00 0.08 0.00 0.00 27.48 27.39 3d1v h GLN 273 CO -0.07 1.00 0.50 0.35 0.09 0.00 0.00 178.83 180.70 3d1v h PHE 274 N 0.76 0.90 -0.29 0.06 3.57 -0.96 0.85 116.94 121.82 3d1v h PHE 274 Ca 0.12 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.52 3d1v h PHE 274 Cb 0.66 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.12 3d1v h PHE 274 CO 0.05 0.32 -0.32 0.28 -2.23 0.00 0.00 178.31 176.41 3d1v h VAL 275 N 0.79 1.30 -0.13 1.41 2.07 0.36 0.17 116.25 122.22 3d1v h VAL 275 Ca 0.44 -1.50 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 3d1v h VAL 275 Cb 0.48 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 3d1v h VAL 275 CO -0.28 0.48 0.07 -1.28 0.02 0.00 0.00 177.57 176.58 3d1v h SER 276 N 0.48 0.16 0.06 0.57 0.87 0.16 -2.70 113.55 113.15 3d1v h SER 276 Ca 0.04 -0.07 0.03 0.00 -1.23 0.00 0.00 61.79 60.55 3d1v h SER 276 Cb 0.90 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.77 3d1v h SER 276 CO 0.08 0.18 -0.41 0.40 -0.53 0.00 0.00 176.83 176.55 3d1v h ILE 277 N 0.12 0.17 -0.34 2.23 2.04 0.80 -0.41 117.51 122.12 3d1v h ILE 277 Ca 0.04 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.00 3d1v h ILE 277 Cb 0.06 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 3d1v h ILE 277 CO -0.01 0.00 0.79 -0.07 0.00 0.00 0.00 178.15 178.87 3d1v h LEU 278 N -0.60 0.00 -1.96 1.44 3.38 -0.35 0.23 115.31 117.44 3d1v h LEU 278 Ca 0.04 0.00 0.41 0.00 0.09 0.00 0.00 57.88 58.41 3d1v h LEU 278 Cb 0.66 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.35 3d1v h LEU 278 CO -0.27 0.00 1.01 0.24 0.09 0.00 0.00 178.44 179.50 3d1v h MET 279 N 0.00 0.02 -0.27 1.13 2.86 -0.76 0.11 114.93 118.01 3d1v h MET 279 Ca 0.16 -0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.65 3d1v h MET 279 Cb 1.75 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.40 3d1v h MET 279 CO -0.00 0.01 -0.40 0.00 1.06 0.00 0.00 176.91 177.58 3d1v h ALA 280 N 1.31 0.42 0.00 6.32 0.00 -0.72 -0.29 119.26 126.29 3d1v h ALA 280 Ca 0.68 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3d1v h ALA 280 Cb 2.67 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 20.38 3d1v h ALA 280 CO -0.03 0.52 0.00 0.43 0.00 0.00 0.00 179.25 180.17 3d1v n SER 281 N -4.17 0.00 -4.62 0.00 7.64 0.36 -4.72 113.62 108.10 3d1v n SER 281 Ca -0.04 -0.12 -0.43 0.00 1.01 0.00 0.00 58.87 59.29 3d1v n SER 281 Cb 0.54 -0.21 -0.02 0.00 -1.01 0.00 0.00 64.21 63.51 3d1v n SER 281 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3d1v s ILE 282 N -2.41 4.45 -0.36 0.44 1.01 -0.12 -4.88 121.20 119.32 3d1v s ILE 282 Ca 0.19 1.51 -0.33 0.00 0.00 0.00 0.00 60.65 62.02 3d1v s ILE 282 Cb 0.12 -4.45 -0.14 0.00 0.01 0.00 0.00 42.46 37.99 3d1v s ILE 282 CO 0.24 -0.63 1.32 -2.65 0.00 0.00 0.00 174.94 173.23 3d1v n PRO 283 N 7.10 0.00 -0.83 2.79 -0.02 -1.26 -4.88 135.00 137.90 3d1v n PRO 283 Ca 0.11 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.26 3d1v n PRO 283 Cb 0.48 -1.08 0.11 0.00 -0.02 0.00 0.00 33.50 32.98 3d1v n PRO 283 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 3d1v n LEU 284 N 3.96 -1.40 0.04 2.45 -0.00 -1.26 -4.95 117.00 115.83 3d1v n LEU 284 Ca 0.30 0.28 -0.17 0.00 -0.00 0.00 0.00 56.01 56.41 3d1v n LEU 284 Cb -0.04 -1.11 -0.14 0.00 -0.00 0.00 0.00 43.42 42.13 3d1v n LEU 284 CO 0.64 -4.03 -0.49 1.55 -0.00 0.00 0.00 177.39 175.06 3d1v h PRO 285 N -1.49 0.22 -0.22 1.47 0.13 -1.90 -3.42 132.00 126.79 3d1v h PRO 285 Ca -0.44 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.31 3d1v h PRO 285 Cb 1.29 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.56 3d1v h PRO 285 CO 0.32 1.05 0.00 -3.47 -0.23 0.00 0.00 178.00 175.68 3d1v n ASP 286 N -3.40 0.22 0.00 1.44 -0.08 -1.26 -4.65 116.55 108.82 3d1v n ASP 286 Ca -0.21 -0.76 0.00 0.00 -1.51 0.00 0.00 54.79 52.32 3d1v n ASP 286 Cb 1.05 -0.11 0.00 0.00 2.34 0.00 0.00 41.12 44.40 3d1v n ASP 286 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 3d1v n LYS 287 N -0.03 0.00 -4.02 -0.67 -0.00 -1.26 -4.98 118.16 107.20 3d1v n LYS 287 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 57.91 3d1v n LYS 287 Cb 0.05 0.00 0.01 0.00 -0.00 0.00 0.00 35.03 35.09 3d1v n LYS 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3d1v n ALA 288 N 0.00 -2.49 0.23 0.58 0.00 -1.26 -4.97 120.51 112.60 3d1v n ALA 288 Ca 0.00 -0.47 0.03 0.00 0.00 0.00 0.00 53.44 52.99 3d1v n ALA 288 Cb 0.00 -2.65 0.02 0.00 0.00 0.00 0.00 19.45 16.82 3d1v n ALA 288 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37