#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d0g n THR 20 N 0.00 0.00 -0.10 0.44 -2.24 -1.26 -4.78 114.28 106.34 3d0g n THR 20 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 3d0g n THR 20 Cb 0.00 -1.41 0.03 0.00 -2.10 0.00 0.00 70.33 66.86 3d0g n THR 20 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3d0g h THR 21 N -1.08 1.28 -0.12 4.28 2.02 -1.98 -2.69 112.91 114.62 3d0g h THR 21 Ca 0.00 -1.48 -0.13 0.00 0.77 0.00 0.00 66.41 65.57 3d0g h THR 21 Cb 0.00 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 3d0g h THR 21 CO 0.00 0.49 -0.50 -0.08 0.37 0.00 0.00 175.52 175.80 3d0g h GLU 22 N 0.70 0.33 -0.27 6.66 4.81 -1.93 -0.83 114.58 124.05 3d0g h GLU 22 Ca 0.07 -0.19 -0.12 0.00 -0.13 0.00 0.00 59.36 58.99 3d0g h GLU 22 Cb 0.87 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.27 3d0g h GLU 22 CO 0.08 0.76 -0.31 1.49 -0.73 0.00 0.00 179.01 180.29 3d0g h GLU 23 N 0.26 0.69 0.00 1.92 4.57 -1.90 -2.59 114.58 117.52 3d0g h GLU 23 Ca 0.01 -0.38 0.00 0.00 -1.18 0.00 0.00 59.36 57.81 3d0g h GLU 23 Cb 0.98 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.59 3d0g h GLU 23 CO 0.08 0.99 0.00 -0.07 -1.18 0.00 0.00 179.01 178.84 3d0g h LEU 24 N 0.42 0.00 0.14 1.64 3.38 -1.30 -2.92 115.31 116.68 3d0g h LEU 24 Ca 0.04 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.78 3d0g h LEU 24 Cb 0.89 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.65 3d0g h LEU 24 CO 0.08 0.00 -1.05 0.00 0.09 0.00 0.00 178.44 177.56 3d0g h ALA 25 N 2.08 -0.02 -0.42 1.53 0.00 -1.00 -2.91 119.26 118.51 3d0g h ALA 25 Ca 0.00 -0.83 0.01 0.00 0.00 0.00 0.00 54.91 54.09 3d0g h ALA 25 Cb 0.37 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 3d0g h ALA 25 CO 0.00 0.54 0.26 0.87 0.00 0.00 0.00 179.25 180.92 3d0g h LYS 26 N -0.32 0.52 -0.56 0.00 1.57 -1.32 0.26 116.57 116.72 3d0g h LYS 26 Ca -0.20 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.47 3d0g h LYS 26 Cb 1.72 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.89 3d0g h LYS 26 CO 0.13 0.34 0.02 1.15 -0.57 0.00 0.00 179.45 180.53 3d0g h THR 27 N 0.53 1.26 0.21 -0.16 2.02 -1.66 0.15 112.91 115.25 3d0g h THR 27 Ca 0.16 -1.06 -0.01 0.00 0.77 0.00 0.00 66.41 66.27 3d0g h THR 27 Cb -0.02 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 3d0g h THR 27 CO -0.06 0.38 -0.10 0.15 0.37 0.00 0.00 175.52 176.26 3d0g h PHE 28 N 0.88 -0.27 -0.23 3.16 3.04 -1.23 -2.75 116.94 119.54 3d0g h PHE 28 Ca 0.17 -0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.13 3d0g h PHE 28 Cb 0.48 0.09 -0.02 0.00 2.56 0.00 0.00 35.95 39.06 3d0g h PHE 28 CO 0.03 -0.10 0.08 -0.07 -2.02 0.00 0.00 178.31 176.23 3d0g h LEU 29 N -0.37 0.10 -0.49 0.59 -0.00 -0.10 -2.04 115.31 113.00 3d0g h LEU 29 Ca -0.03 0.02 0.10 0.00 -0.00 0.00 0.00 57.88 57.97 3d0g h LEU 29 Cb 0.29 0.01 -0.09 0.00 -0.00 0.00 0.00 40.66 40.87 3d0g h LEU 29 CO 0.05 0.09 -0.04 -0.33 -0.00 0.00 0.00 178.44 178.21 3d0g h GLU 30 N 0.19 0.07 -0.67 1.13 5.08 -0.76 0.22 114.58 119.84 3d0g h GLU 30 Ca 0.10 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.48 3d0g h GLU 30 Cb 0.06 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.26 3d0g h GLU 30 CO -0.10 0.05 0.44 1.15 -1.00 0.00 0.00 179.01 179.56 3d0g h THR 31 N 0.08 1.11 0.76 1.13 2.02 -1.27 -2.69 112.91 114.05 3d0g h THR 31 Ca 0.25 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 3d0g h THR 31 Cb 0.37 0.21 0.01 0.00 -1.74 0.00 0.00 68.15 67.00 3d0g h THR 31 CO -0.44 0.15 -0.37 0.15 0.37 0.00 0.00 175.52 175.38 3d0g h PHE 32 N 0.83 -0.95 -0.87 3.16 3.04 0.06 -2.34 116.94 119.87 3d0g h PHE 32 Ca 0.26 -0.02 0.23 0.00 3.98 0.00 0.00 57.97 62.42 3d0g h PHE 32 Cb 0.04 0.31 -0.14 0.00 2.56 0.00 0.00 35.95 38.72 3d0g h PHE 32 CO -0.00 -0.59 0.20 -0.91 -2.02 0.00 0.00 178.31 174.99 3d0g h ASN 33 N -1.12 -0.06 -0.26 0.41 -0.26 -0.75 0.69 115.58 114.22 3d0g h ASN 33 Ca -0.10 0.20 -0.06 0.00 -0.56 0.00 0.00 56.30 55.77 3d0g h ASN 33 Cb 0.78 0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 38.32 3d0g h ASN 33 CO 0.17 -0.17 -0.08 1.88 -1.06 0.00 0.00 177.43 178.18 3d0g h TYR 34 N 0.19 0.59 -0.33 1.19 -1.99 -1.50 -0.31 116.97 114.80 3d0g h TYR 34 Ca 0.53 -0.13 -0.13 0.00 2.00 0.00 0.00 58.73 61.01 3d0g h TYR 34 Cb 1.06 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 39.64 3d0g h TYR 34 CO -0.29 0.74 -0.31 0.93 -0.00 0.00 0.00 178.16 179.23 3d0g h GLU 35 N 0.26 0.72 -0.62 4.88 4.39 -0.16 -2.90 114.58 121.14 3d0g h GLU 35 Ca 0.06 -0.33 -0.04 0.00 0.34 0.00 0.00 59.36 59.40 3d0g h GLU 35 Cb 0.56 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.17 3d0g h GLU 35 CO 0.03 0.93 0.23 0.00 -1.16 0.00 0.00 179.01 179.05 3d0g h ALA 36 N 1.04 1.25 -0.68 3.43 0.00 0.34 -2.71 119.26 121.93 3d0g h ALA 36 Ca 0.07 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.86 3d0g h ALA 36 Cb 0.83 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3d0g h ALA 36 CO 0.07 0.55 0.45 1.96 0.00 0.00 0.00 179.25 182.28 3d0g h GLN 37 N 0.89 0.74 0.00 0.00 4.20 -0.84 0.32 115.11 120.43 3d0g h GLN 37 Ca 0.21 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 3d0g h GLN 37 Cb 0.19 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.80 3d0g h GLN 37 CO -0.02 0.49 -0.13 0.93 -0.67 0.00 0.00 178.83 179.43 3d0g h GLU 38 N 0.77 0.00 -0.29 1.46 4.39 -1.55 -1.08 114.58 118.28 3d0g h GLU 38 Ca 0.28 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.99 3d0g h GLU 38 Cb 0.15 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 3d0g h GLU 38 CO -0.08 0.80 0.17 -0.07 -1.16 0.00 0.00 179.01 178.66 3d0g h LEU 39 N -1.00 0.27 -0.72 1.33 3.38 -1.46 -0.11 115.31 117.00 3d0g h LEU 39 Ca -0.03 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3d0g h LEU 39 Cb 0.84 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 3d0g h LEU 39 CO -0.02 0.20 0.29 -1.28 0.09 0.00 0.00 178.44 177.71 3d0g h SER 40 N 0.34 1.00 -0.80 -0.43 0.87 -1.05 0.48 113.55 113.97 3d0g h SER 40 Ca 0.11 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 3d0g h SER 40 Cb -0.00 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 61.66 3d0g h SER 40 CO -0.05 0.90 0.48 0.22 -0.53 0.00 0.00 176.83 177.85 3d0g h TYR 41 N 1.04 1.06 -0.40 2.24 3.20 -0.79 -0.18 116.97 123.13 3d0g h TYR 41 Ca 0.24 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.05 3d0g h TYR 41 Cb 0.22 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 3d0g h TYR 41 CO 0.02 0.71 0.03 1.96 -1.64 0.00 0.00 178.16 179.24 3d0g h GLN 42 N 1.10 0.70 -0.14 1.82 4.20 -0.39 -1.30 115.11 121.09 3d0g h GLN 42 Ca 0.29 -0.21 0.05 0.00 0.06 0.00 0.00 58.65 58.83 3d0g h GLN 42 Cb -0.03 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 27.62 3d0g h GLN 42 CO -0.05 0.77 -0.23 1.03 -0.67 0.00 0.00 178.83 179.67 3d0g h SER 43 N 0.53 -0.72 -0.02 1.46 0.87 0.28 -2.22 113.55 113.72 3d0g h SER 43 Ca 0.12 0.12 -0.00 0.00 -1.23 0.00 0.00 61.79 60.80 3d0g h SER 43 Cb 0.44 0.32 -0.00 0.00 -0.44 0.00 0.00 62.40 62.72 3d0g h SER 43 CO 0.02 -0.28 0.01 0.28 -0.53 0.00 0.00 176.83 176.33 3d0g h SER 44 N -0.29 0.03 -0.60 6.23 0.02 -0.83 -0.75 113.55 117.36 3d0g h SER 44 Ca 0.10 -0.07 0.02 0.00 -0.84 0.00 0.00 61.79 60.99 3d0g h SER 44 Cb 0.44 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 3d0g h SER 44 CO -0.30 0.10 0.39 0.58 -1.14 0.00 0.00 176.83 176.45 3d0g h VAL 45 N -0.04 1.12 -0.23 2.27 2.07 -1.20 0.51 116.25 120.76 3d0g h VAL 45 Ca 0.01 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 3d0g h VAL 45 Cb 0.07 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 3d0g h VAL 45 CO -0.00 0.14 0.14 0.00 0.02 0.00 0.00 177.57 177.87 3d0g h ALA 46 N 1.24 0.30 -0.61 1.67 0.00 -1.31 0.17 119.26 120.71 3d0g h ALA 46 Ca 0.23 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 3d0g h ALA 46 Cb -0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3d0g h ALA 46 CO -0.07 -0.19 0.24 1.03 0.00 0.00 0.00 179.25 180.25 3d0g h SER 47 N 0.28 0.81 0.47 0.00 0.87 -0.42 -2.35 113.55 113.22 3d0g h SER 47 Ca 0.08 -0.11 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 3d0g h SER 47 Cb 0.03 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.78 3d0g h SER 47 CO -0.02 0.73 -0.23 -0.25 -0.53 0.00 0.00 176.83 176.54 3d0g h TRP 48 N 0.87 -0.59 -1.04 2.24 2.91 0.39 -2.85 115.95 117.88 3d0g h TRP 48 Ca 0.21 -0.01 0.32 0.00 1.13 0.00 0.00 58.89 60.53 3d0g h TRP 48 Cb 0.18 0.19 -0.14 0.00 -0.51 0.00 0.00 29.16 28.88 3d0g h TRP 48 CO 0.01 -0.27 0.62 -0.91 -1.03 0.00 0.00 178.44 176.86 3d0g h ASN 49 N -0.99 0.50 0.10 2.65 2.35 -0.54 -0.71 115.58 118.93 3d0g h ASN 49 Ca -0.06 0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 3d0g h ASN 49 Cb 0.59 0.11 -0.00 0.00 0.05 0.00 0.00 38.32 39.06 3d0g h ASN 49 CO 0.11 -0.09 -0.07 0.22 -1.65 0.00 0.00 177.43 175.94 3d0g h TYR 50 N 0.33 -0.20 0.00 1.19 3.20 -1.39 0.29 116.97 120.40 3d0g h TYR 50 Ca 0.72 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.59 3d0g h TYR 50 Cb 1.71 0.07 0.00 0.00 1.54 0.00 0.00 36.73 40.06 3d0g h TYR 50 CO -0.01 -0.10 0.43 -0.91 -1.64 0.00 0.00 178.16 175.93 3d0g h ASN 51 N -0.17 0.00 0.00 -2.11 4.21 -0.93 0.93 115.58 117.52 3d0g h ASN 51 Ca -0.01 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.50 3d0g h ASN 51 Cb 0.14 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.34 3d0g h ASN 51 CO 0.01 0.00 -1.21 0.35 -1.29 0.00 0.00 177.43 175.29 3d0g n THR 52 N -2.68 0.00 -3.10 2.81 -2.24 -0.57 -2.05 114.28 106.45 3d0g n THR 52 Ca -0.01 -0.26 -0.17 0.00 -2.27 0.00 0.00 64.05 61.34 3d0g n THR 52 Cb 0.47 0.55 -0.05 0.00 -2.10 0.00 0.00 70.33 69.19 3d0g n THR 52 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3d0g s ASN 53 N -3.06 0.10 -0.99 3.42 2.47 0.10 -4.61 114.94 112.36 3d0g s ASN 53 Ca -0.00 -2.46 -0.24 0.00 0.42 0.00 0.00 52.86 50.57 3d0g s ASN 53 Cb 0.10 0.63 -0.07 0.00 -1.45 0.00 0.00 41.25 40.46 3d0g s ASN 53 CO 0.59 -0.12 1.98 -0.63 -3.72 0.00 0.00 177.10 175.21 3d0g s ILE 54 N 0.43 3.44 0.18 -5.21 1.01 -1.04 -4.43 121.20 115.57 3d0g s ILE 54 Ca 0.32 -0.51 0.10 0.00 0.00 0.00 0.00 60.65 60.56 3d0g s ILE 54 Cb 0.02 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 3d0g s ILE 54 CO -0.13 -0.87 -0.20 -0.89 0.00 0.00 0.00 174.94 172.85 3d0g s THR 55 N 10.93 2.61 0.48 2.92 2.01 -1.26 -4.86 115.64 128.46 3d0g s THR 55 Ca 0.71 -1.87 0.17 0.00 0.31 0.00 0.00 61.69 61.02 3d0g s THR 55 Cb -0.05 -2.25 0.23 0.00 0.01 0.00 0.00 72.50 70.43 3d0g s THR 55 CO 0.05 -0.08 2.06 -0.08 -0.69 0.00 0.00 174.62 175.88 3d0g h GLU 56 N 3.22 0.00 0.00 4.92 4.57 -2.00 -0.49 114.58 124.80 3d0g h GLU 56 Ca -0.47 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 57.66 3d0g h GLU 56 Cb 1.20 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.78 3d0g h GLU 56 CO 0.49 0.11 -0.25 1.05 -1.18 0.00 0.00 179.01 179.24 3d0g h GLU 57 N 0.00 0.00 0.15 1.92 4.11 -1.96 -3.05 114.58 115.75 3d0g h GLU 57 Ca -0.00 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.15 3d0g h GLU 57 Cb 0.21 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.47 3d0g h GLU 57 CO 0.01 0.25 -1.35 -0.91 0.07 0.00 0.00 179.01 177.08 3d0g h ASN 58 N 0.00 0.49 0.08 3.06 4.21 -1.43 -3.01 115.58 118.99 3d0g h ASN 58 Ca -0.00 -0.90 -0.01 0.00 1.21 0.00 0.00 56.30 56.60 3d0g h ASN 58 Cb 0.62 -0.16 -0.00 0.00 -1.12 0.00 0.00 38.32 37.66 3d0g h ASN 58 CO 0.03 1.61 -0.04 1.62 -1.29 0.00 0.00 177.43 179.36 3d0g h VAL 59 N -0.20 0.74 -0.41 2.81 3.04 -1.47 0.12 116.25 120.87 3d0g h VAL 59 Ca -0.27 -0.17 -0.15 0.00 -1.01 0.00 0.00 66.70 65.09 3d0g h VAL 59 Cb 1.84 1.10 -0.01 0.00 -2.01 0.00 0.00 31.29 32.21 3d0g h VAL 59 CO 0.12 0.04 -0.34 -0.61 -1.01 0.00 0.00 177.57 175.77 3d0g h GLN 60 N 0.00 0.96 -0.08 4.17 5.75 -1.61 -2.90 115.11 121.41 3d0g h GLN 60 Ca -0.00 -0.48 -0.17 0.00 -0.15 0.00 0.00 58.65 57.84 3d0g h GLN 60 Cb 0.10 0.01 0.01 0.00 1.07 0.00 0.00 27.48 28.66 3d0g h GLN 60 CO 0.01 1.15 -0.63 -0.91 -2.65 0.00 0.00 178.83 175.79 3d0g h ASN 61 N 0.80 0.69 -0.84 -0.69 2.35 -0.97 -1.83 115.58 115.08 3d0g h ASN 61 Ca 0.07 -0.67 0.02 0.00 -0.55 0.00 0.00 56.30 55.17 3d0g h ASN 61 Cb 0.94 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 39.06 3d0g h ASN 61 CO 0.09 1.26 0.56 -0.03 -1.65 0.00 0.00 177.43 177.66 3d0g h MET 62 N 0.18 1.08 -0.17 0.81 4.05 -0.93 -0.89 114.93 119.06 3d0g h MET 62 Ca -0.06 -0.07 -0.06 0.00 -0.28 0.00 0.00 59.70 59.24 3d0g h MET 62 Cb 1.29 -0.24 -0.00 0.00 -0.80 0.00 0.00 31.60 31.84 3d0g h MET 62 CO 0.13 0.72 -0.12 -0.91 0.23 0.00 0.00 176.91 176.96 3d0g h ASN 63 N 1.12 0.41 -0.30 1.39 4.21 -1.56 -1.82 115.58 119.02 3d0g h ASN 63 Ca 0.32 -0.44 0.06 0.00 1.21 0.00 0.00 56.30 57.44 3d0g h ASN 63 Cb -0.09 -0.11 -0.08 0.00 -1.12 0.00 0.00 38.32 36.92 3d0g h ASN 63 CO -0.08 0.76 -0.42 0.78 -1.29 0.00 0.00 177.43 177.19 3d0g h ASN 64 N 0.05 -1.38 0.85 5.81 -0.26 -0.71 0.12 115.58 120.07 3d0g h ASN 64 Ca 0.03 0.20 -0.16 0.00 -0.56 0.00 0.00 56.30 55.82 3d0g h ASN 64 Cb 0.63 0.59 -0.02 0.00 -1.06 0.00 0.00 38.32 38.45 3d0g h ASN 64 CO 0.03 -0.39 -0.76 0.00 -1.06 0.00 0.00 177.43 175.26 3d0g h ALA 65 N 0.32 0.69 -0.02 -0.83 0.00 -1.27 -3.04 119.26 115.10 3d0g h ALA 65 Ca 0.11 -0.69 -0.14 0.00 0.00 0.00 0.00 54.91 54.19 3d0g h ALA 65 Cb 0.60 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3d0g h ALA 65 CO -0.51 0.95 -0.64 0.78 0.00 0.00 0.00 179.25 179.83 3d0g h GLY 66 N 2.46 0.11 0.49 0.00 0.00 -1.02 -2.65 103.07 102.46 3d0g h GLY 66 Ca -0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 3d0g h GLY 66 CO 0.10 0.13 -0.08 -0.55 0.00 0.00 0.00 176.54 176.15 3d0g h ASP 67 N 0.07 -0.18 -0.26 0.19 5.19 -0.69 -2.28 116.42 118.46 3d0g h ASP 67 Ca -0.01 -0.34 0.06 0.00 -0.62 0.00 0.00 57.03 56.12 3d0g h ASP 67 Cb 1.15 0.05 -0.07 0.00 0.18 0.00 0.00 39.33 40.63 3d0g h ASP 67 CO 0.09 0.30 -0.26 0.11 -3.12 0.00 0.00 179.24 176.36 3d0g h LYS 68 N -0.73 -0.25 -0.81 3.56 1.57 -1.61 0.22 116.57 118.51 3d0g h LYS 68 Ca -0.02 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3d0g h LYS 68 Cb 0.51 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.84 3d0g h LYS 68 CO 0.04 -0.17 0.51 2.35 -0.57 0.00 0.00 179.45 181.60 3d0g h TRP 69 N -0.26 1.04 -0.01 -1.35 -0.00 -1.55 0.82 115.95 114.63 3d0g h TRP 69 Ca 0.14 0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 59.03 3d0g h TRP 69 Cb 0.48 -0.35 0.00 0.00 -0.00 0.00 0.00 29.16 29.30 3d0g h TRP 69 CO -0.42 0.67 -0.03 0.66 -0.00 0.00 0.00 178.44 179.33 3d0g h SER 70 N 1.10 0.04 -0.75 2.65 4.64 -1.06 -2.59 113.55 117.58 3d0g h SER 70 Ca 0.29 -0.62 0.14 0.00 -0.47 0.00 0.00 61.79 61.13 3d0g h SER 70 Cb -0.08 -0.01 -0.09 0.00 -0.31 0.00 0.00 62.40 61.90 3d0g h SER 70 CO -0.06 0.65 0.30 0.00 -0.87 0.00 0.00 176.83 176.85 3d0g h ALA 71 N 0.39 1.05 0.02 5.18 0.00 -0.35 -2.21 119.26 123.35 3d0g h ALA 71 Ca -0.00 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3d0g h ALA 71 Cb 0.64 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3d0g h ALA 71 CO 0.01 -0.20 -0.08 0.35 0.00 0.00 0.00 179.25 179.33 3d0g h PHE 72 N 0.45 -0.20 -0.21 0.00 3.57 -0.86 -1.45 116.94 118.25 3d0g h PHE 72 Ca 0.41 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.97 3d0g h PHE 72 Cb 0.61 0.09 -0.07 0.00 2.79 0.00 0.00 35.95 39.36 3d0g h PHE 72 CO -0.16 -0.12 -0.39 -0.07 -2.23 0.00 0.00 178.31 175.34 3d0g h LEU 73 N -0.15 -1.23 -0.21 0.59 3.38 -1.00 0.18 115.31 116.87 3d0g h LEU 73 Ca 0.02 0.18 0.04 0.00 0.09 0.00 0.00 57.88 58.21 3d0g h LEU 73 Cb 0.18 0.52 -0.07 0.00 0.09 0.00 0.00 40.66 41.37 3d0g h LEU 73 CO -0.06 -0.39 -0.48 0.50 0.09 0.00 0.00 178.44 178.10 3d0g h LYS 74 N -0.42 -0.47 -0.75 1.13 3.11 -1.22 0.34 116.57 118.31 3d0g h LYS 74 Ca 0.10 0.03 0.15 0.00 -2.81 0.00 0.00 60.65 58.13 3d0g h LYS 74 Cb 0.59 0.11 -0.10 0.00 -1.00 0.00 0.00 32.23 31.83 3d0g h LYS 74 CO -0.43 -0.31 0.25 1.49 -2.81 0.00 0.00 179.45 177.64 3d0g h GLU 75 N -0.49 0.36 -0.24 1.90 4.81 -0.65 -1.27 114.58 119.00 3d0g h GLU 75 Ca 0.07 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.20 3d0g h GLU 75 Cb 0.64 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 3d0g h GLU 75 CO -0.46 0.24 -0.17 1.96 -0.73 0.00 0.00 179.01 179.84 3d0g h GLN 76 N 0.37 0.54 0.09 1.92 1.08 0.85 -2.47 115.11 117.49 3d0g h GLN 76 Ca 0.42 -0.26 -0.00 0.00 -1.45 0.00 0.00 58.65 57.36 3d0g h GLN 76 Cb 0.68 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.10 3d0g h GLN 76 CO -0.45 0.83 -0.06 0.66 -0.95 0.00 0.00 178.83 178.87 3d0g h SER 77 N 0.25 -0.14 -0.96 1.46 4.64 0.27 0.45 113.55 119.52 3d0g h SER 77 Ca 0.05 0.01 0.17 0.00 -0.47 0.00 0.00 61.79 61.54 3d0g h SER 77 Cb 0.70 0.04 -0.08 0.00 -0.31 0.00 0.00 62.40 62.75 3d0g h SER 77 CO 0.05 -0.09 0.60 0.71 -0.87 0.00 0.00 176.83 177.23 3d0g h THR 78 N -0.15 0.77 -0.19 2.95 1.35 -1.24 0.27 112.91 116.67 3d0g h THR 78 Ca -0.01 -0.24 -0.19 0.00 -0.55 0.00 0.00 66.41 65.42 3d0g h THR 78 Cb 0.12 -0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.54 3d0g h THR 78 CO 0.01 0.13 -0.65 -0.07 -0.25 0.00 0.00 175.52 174.69 3d0g h LEU 79 N 0.71 0.81 -1.73 3.87 3.38 -0.90 -3.21 115.31 118.24 3d0g h LEU 79 Ca 0.51 -0.48 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3d0g h LEU 79 Cb 0.84 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 3d0g h LEU 79 CO -0.27 1.25 -0.17 0.00 0.09 0.00 0.00 178.44 179.33 3d0g h ALA 80 N 0.76 1.45 0.00 1.53 0.00 0.32 -1.55 119.26 121.76 3d0g h ALA 80 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3d0g h ALA 80 Cb 1.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3d0g h ALA 80 CO 0.13 0.22 0.00 1.04 0.00 0.00 0.00 179.25 180.64 3d0g n GLN 81 N -3.95 0.12 -0.43 0.00 3.00 -0.01 -2.70 117.38 113.40 3d0g n GLN 81 Ca -0.02 0.20 -0.03 0.00 -0.01 0.00 0.00 57.00 57.14 3d0g n GLN 81 Cb 0.26 -1.50 0.13 0.00 0.00 0.00 0.00 30.24 29.13 3d0g n GLN 81 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 3d0g n MET 82 N -1.37 2.14 -3.63 -1.09 2.81 -0.58 -4.67 117.12 110.72 3d0g n MET 82 Ca 0.05 -1.28 -0.18 0.00 -1.81 0.00 0.00 57.70 54.49 3d0g n MET 82 Cb 0.13 -1.68 -0.15 0.00 -0.71 0.00 0.00 33.22 30.81 3d0g n MET 82 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 3d0g s TYR 83 N -1.57 -0.16 -0.12 2.03 1.51 -1.10 -5.14 117.35 112.81 3d0g s TYR 83 Ca 0.23 0.45 -0.27 0.00 -1.01 0.00 0.00 57.07 56.47 3d0g s TYR 83 Cb 0.18 -0.32 -0.02 0.00 -0.11 0.00 0.00 41.96 41.69 3d0g s TYR 83 CO 0.06 -0.35 0.89 -1.25 -1.11 0.00 0.00 175.55 173.79 3d0g s PRO 84 N 2.28 4.39 0.17 -1.71 0.05 -1.26 -4.95 135.00 133.97 3d0g s PRO 84 Ca 0.04 1.18 0.26 0.00 0.05 0.00 0.00 61.00 62.53 3d0g s PRO 84 Cb -0.13 -3.53 0.89 0.00 0.05 0.00 0.00 34.50 31.78 3d0g s PRO 84 CO -0.07 -0.24 1.80 1.47 0.05 0.00 0.00 177.00 180.00 3d0g n LEU 85 N 4.83 0.66 -0.86 -3.56 -0.00 -1.26 -2.23 117.00 114.57 3d0g n LEU 85 Ca 0.05 0.57 0.06 0.00 -0.00 0.00 0.00 56.01 56.69 3d0g n LEU 85 Cb 0.49 -0.36 0.19 0.00 -0.00 0.00 0.00 43.42 43.74 3d0g n LEU 85 CO 0.50 -0.17 0.65 0.00 -0.00 0.00 0.00 177.39 178.37 3d0g n GLN 86 N -2.12 2.19 -0.72 1.47 6.02 -1.26 -3.19 117.38 119.76 3d0g n GLN 86 Ca 0.06 -1.55 0.08 0.00 -0.01 0.00 0.00 57.00 55.58 3d0g n GLN 86 Cb 0.40 -1.44 0.37 0.00 1.02 0.00 0.00 30.24 30.60 3d0g n GLN 86 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 3d0g n GLU 87 N 0.65 4.20 -3.85 -1.09 2.13 -0.95 -4.90 120.64 116.84 3d0g n GLU 87 Ca 0.14 -3.00 -0.27 0.00 0.66 0.00 0.00 57.16 54.69 3d0g n GLU 87 Cb 0.43 -2.05 -0.17 0.00 0.27 0.00 0.00 31.44 29.92 3d0g n GLU 87 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3d0g s ILE 88 N -2.34 0.87 -1.08 6.31 1.01 -1.19 -4.63 121.20 120.14 3d0g s ILE 88 Ca 0.52 -0.43 -0.05 0.00 0.00 0.00 0.00 60.65 60.69 3d0g s ILE 88 Cb 0.37 -1.07 0.30 0.00 0.01 0.00 0.00 42.46 42.07 3d0g s ILE 88 CO 0.19 0.13 1.39 0.00 0.00 0.00 0.00 174.94 176.65 3d0g n GLN 89 N 4.96 4.23 -2.90 2.79 0.00 -1.26 -4.81 117.38 120.39 3d0g n GLN 89 Ca -0.11 -4.54 0.02 0.00 0.00 0.00 0.00 57.00 52.38 3d0g n GLN 89 Cb 0.48 -2.52 0.00 0.00 0.00 0.00 0.00 30.24 28.21 3d0g n GLN 89 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 3d0g s ASN 90 N -1.05 -0.65 0.17 2.61 3.04 -1.26 -5.06 114.94 112.74 3d0g s ASN 90 Ca 0.31 -0.30 -0.28 0.00 0.04 0.00 0.00 52.86 52.63 3d0g s ASN 90 Cb 0.01 0.87 -0.00 0.00 -1.54 0.00 0.00 41.25 40.59 3d0g s ASN 90 CO 0.06 -0.08 1.54 0.25 -3.04 0.00 0.00 177.10 175.84 3d0g h LEU 91 N 5.95 -2.00 -0.56 3.21 5.85 -1.97 0.09 115.31 125.88 3d0g h LEU 91 Ca -0.02 0.32 0.06 0.00 0.84 0.00 0.00 57.88 59.09 3d0g h LEU 91 Cb 1.22 0.91 -0.09 0.00 0.37 0.00 0.00 40.66 43.06 3d0g h LEU 91 CO -0.03 -0.25 -0.55 0.74 -0.34 0.00 0.00 178.44 178.01 3d0g h THR 92 N -0.01 0.01 -0.22 1.05 2.02 -1.97 0.86 112.91 114.65 3d0g h THR 92 Ca 0.20 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.25 3d0g h THR 92 Cb 0.46 0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.88 3d0g h THR 92 CO -0.94 0.00 -0.35 -0.37 0.37 0.00 0.00 175.52 174.22 3d0g h VAL 93 N -0.29 1.32 -0.70 3.16 -1.51 -1.90 -2.63 116.25 113.70 3d0g h VAL 93 Ca 0.11 -1.56 0.14 0.00 -1.23 0.00 0.00 66.70 64.15 3d0g h VAL 93 Cb 0.55 1.78 -0.10 0.00 -2.13 0.00 0.00 31.29 31.40 3d0g h VAL 93 CO -0.69 0.49 0.22 0.50 -1.23 0.00 0.00 177.57 176.86 3d0g h LYS 94 N 0.33 0.34 -0.65 5.19 3.64 0.18 -0.05 116.57 125.54 3d0g h LYS 94 Ca 0.02 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 3d0g h LYS 94 Cb 0.94 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.66 3d0g h LYS 94 CO 0.08 0.22 0.23 -0.07 -2.27 0.00 0.00 179.45 177.64 3d0g h LEU 95 N 0.35 0.90 -0.11 5.20 3.38 0.84 -1.62 115.31 124.24 3d0g h LEU 95 Ca 0.39 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 3d0g h LEU 95 Cb 0.60 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3d0g h LEU 95 CO -0.43 0.82 -0.07 1.56 0.09 0.00 0.00 178.44 180.41 3d0g h GLN 96 N 0.95 0.24 -0.63 1.13 4.20 -0.74 -1.83 115.11 118.43 3d0g h GLN 96 Ca 0.22 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.82 3d0g h GLN 96 Cb 0.23 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 3d0g h GLN 96 CO -0.01 0.61 0.40 1.25 -0.67 0.00 0.00 178.83 180.41 3d0g h LEU 97 N -0.14 0.73 -0.29 1.46 5.85 -0.96 -1.48 115.31 120.48 3d0g h LEU 97 Ca 0.02 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 3d0g h LEU 97 Cb 0.55 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 3d0g h LEU 97 CO 0.02 0.54 -0.24 -0.61 -0.34 0.00 0.00 178.44 177.81 3d0g h GLN 98 N 0.85 0.67 -0.13 1.25 -0.00 -1.21 -2.43 115.11 114.12 3d0g h GLN 98 Ca 0.23 -0.34 0.01 0.00 -0.00 0.00 0.00 58.65 58.55 3d0g h GLN 98 Cb -0.08 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 27.39 3d0g h GLN 98 CO -0.05 0.94 0.03 0.00 0.00 0.00 0.00 178.83 179.75 3d0g h ALA 99 N 0.72 0.13 0.00 3.38 0.00 -0.72 -1.83 119.26 120.93 3d0g h ALA 99 Ca 0.05 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3d0g h ALA 99 Cb 0.80 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3d0g h ALA 99 CO 0.06 -0.42 -0.02 1.25 0.00 0.00 0.00 179.25 180.12 3d0g h LEU 100 N 0.08 0.00 -3.94 0.00 6.46 -1.24 -2.79 115.31 113.88 3d0g h LEU 100 Ca 0.05 0.00 -0.22 0.00 -0.12 0.00 0.00 57.88 57.60 3d0g h LEU 100 Cb 0.04 0.00 -0.08 0.00 -0.73 0.00 0.00 40.66 39.89 3d0g h LEU 100 CO -0.07 0.02 -0.20 0.00 -0.62 0.00 0.00 178.44 177.58 3d0g n GLN 101 N -3.47 1.93 -2.63 1.25 6.02 -0.69 -4.28 117.38 115.51 3d0g n GLN 101 Ca -0.03 -1.09 -0.42 0.00 -0.01 0.00 0.00 57.00 55.45 3d0g n GLN 101 Cb 0.12 -1.88 -0.02 0.00 1.02 0.00 0.00 30.24 29.47 3d0g n GLN 101 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3d0g s GLN 102 N 0.37 3.68 0.04 -1.09 -0.21 -1.06 -4.90 119.66 116.50 3d0g s GLN 102 Ca 0.56 -1.42 -0.13 0.00 0.02 0.00 0.00 55.36 54.39 3d0g s GLN 102 Cb 0.29 -5.32 -0.05 0.00 1.00 0.00 0.00 33.01 28.93 3d0g s GLN 102 CO -0.03 -2.14 1.21 -0.97 -2.12 0.00 0.00 175.29 171.23 3d0g h ASN 103 N 9.16 -0.66 0.00 5.90 -0.00 -1.93 -3.47 115.58 124.59 3d0g h ASN 103 Ca 0.24 0.08 0.00 0.00 -0.00 0.00 0.00 56.30 56.62 3d0g h ASN 103 Cb 0.98 0.25 0.00 0.00 -0.00 0.00 0.00 38.32 39.56 3d0g h ASN 103 CO 1.38 -0.19 0.00 0.61 -0.00 0.00 0.00 177.43 179.24 3d0g n GLY 104 N -1.17 -1.04 0.16 1.57 0.00 -1.26 -4.34 105.19 99.10 3d0g n GLY 104 Ca -0.02 -2.09 0.12 0.00 0.00 0.00 0.00 46.02 44.03 3d0g n GLY 104 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d0g n SER 105 N 0.00 0.47 0.09 1.61 3.41 -1.26 -3.53 113.62 114.42 3d0g n SER 105 Ca 0.00 -1.38 0.10 0.00 -0.26 0.00 0.00 58.87 57.33 3d0g n SER 105 Cb 0.00 -0.02 0.43 0.00 -0.26 0.00 0.00 64.21 64.36 3d0g n SER 105 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3d0g n SER 106 N -0.53 0.45 0.25 4.04 3.41 -1.26 -1.66 113.62 118.33 3d0g n SER 106 Ca 0.17 0.62 0.15 0.00 -0.26 0.00 0.00 58.87 59.56 3d0g n SER 106 Cb 0.16 -0.72 0.50 0.00 -0.26 0.00 0.00 64.21 63.89 3d0g n SER 106 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 3d0g h VAL 107 N 0.00 0.00 -3.31 -3.33 3.04 -1.84 -3.45 116.25 107.36 3d0g h VAL 107 Ca 0.00 -0.68 -0.45 0.00 -1.01 0.00 0.00 66.70 64.56 3d0g h VAL 107 Cb 0.29 1.67 0.08 0.00 -2.01 0.00 0.00 31.29 31.32 3d0g h VAL 107 CO 0.00 0.00 0.17 -0.76 -1.01 0.00 0.00 177.57 175.97 3d0g s LEU 108 N -6.13 2.92 0.72 3.16 1.43 -0.66 -5.07 118.68 115.05 3d0g s LEU 108 Ca 0.03 0.24 -0.11 0.00 -1.03 0.00 0.00 54.13 53.26 3d0g s LEU 108 Cb 0.08 -2.85 0.02 0.00 0.03 0.00 0.00 46.19 43.47 3d0g s LEU 108 CO 0.59 -1.63 1.07 -0.94 0.23 0.00 0.00 176.35 175.67 3d0g s SER 109 N -4.56 5.04 0.22 2.29 1.04 -1.26 -4.86 113.70 111.62 3d0g s SER 109 Ca 0.61 1.73 -0.03 0.00 0.48 0.00 0.00 55.95 58.74 3d0g s SER 109 Cb -0.09 -2.51 0.43 0.00 0.10 0.00 0.00 66.02 63.95 3d0g s SER 109 CO 0.44 -1.67 1.19 1.21 0.98 0.00 0.00 173.24 175.39 3d0g n GLU 110 N -3.19 -0.07 0.01 4.02 4.07 -1.26 -2.01 120.64 122.22 3d0g n GLU 110 Ca 0.08 1.17 -0.10 0.00 -0.06 0.00 0.00 57.16 58.26 3d0g n GLU 110 Cb 0.53 -1.79 -0.14 0.00 -0.06 0.00 0.00 31.44 29.98 3d0g n GLU 110 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 3d0g h ASP 111 N 0.00 0.06 0.14 4.31 5.19 -1.99 -2.52 116.42 121.60 3d0g h ASP 111 Ca 0.40 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.70 3d0g h ASP 111 Cb 0.70 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.19 3d0g h ASP 111 CO -0.76 1.09 0.00 0.29 -3.12 0.00 0.00 179.24 176.74 3d0g n LYS 112 N -3.18 0.64 -0.09 3.56 5.02 -0.93 -1.44 118.16 121.75 3d0g n LYS 112 Ca -0.14 0.02 -0.15 0.00 -2.02 0.00 0.00 58.31 56.01 3d0g n LYS 112 Cb 1.03 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 34.46 3d0g n LYS 112 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3d0g n SER 113 N -1.09 2.19 -0.03 4.39 7.64 -0.85 -3.82 113.62 122.05 3d0g n SER 113 Ca 0.16 0.01 -0.12 0.00 1.01 0.00 0.00 58.87 59.94 3d0g n SER 113 Cb 0.12 -0.38 -0.06 0.00 -1.01 0.00 0.00 64.21 62.87 3d0g n SER 113 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 3d0g h LYS 114 N -0.23 0.20 -0.10 1.43 3.11 -1.46 -1.90 116.57 117.62 3d0g h LYS 114 Ca -0.44 -0.05 -0.00 0.00 -2.81 0.00 0.00 60.65 57.35 3d0g h LYS 114 Cb 1.57 -0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 32.77 3d0g h LYS 114 CO -0.14 0.36 0.06 -0.09 -2.81 0.00 0.00 179.45 176.83 3d0g h ARG 115 N 0.01 0.14 -0.44 1.90 9.65 -1.49 0.30 114.38 124.44 3d0g h ARG 115 Ca 0.04 -0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.96 3d0g h ARG 115 Cb 0.25 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.75 3d0g h ARG 115 CO -0.00 0.14 0.17 1.25 2.80 0.00 0.00 179.97 184.32 3d0g h LEU 116 N 0.10 0.19 -1.69 3.80 5.85 -1.65 0.20 115.31 122.11 3d0g h LEU 116 Ca 0.04 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 3d0g h LEU 116 Cb 0.03 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 3d0g h LEU 116 CO -0.01 0.14 0.09 0.78 -0.34 0.00 0.00 178.44 179.11 3d0g h ASN 117 N 0.34 0.26 0.30 1.25 4.21 -1.16 0.15 115.58 120.94 3d0g h ASN 117 Ca 0.21 -0.02 -0.01 0.00 1.21 0.00 0.00 56.30 57.68 3d0g h ASN 117 Cb 0.19 -0.07 0.00 0.00 -1.12 0.00 0.00 38.32 37.32 3d0g h ASN 117 CO -0.20 0.24 -0.15 0.74 -1.29 0.00 0.00 177.43 176.77 3d0g h THR 118 N 0.30 0.73 -0.07 2.81 2.02 0.14 -1.70 112.91 117.14 3d0g h THR 118 Ca 0.08 -0.34 0.04 0.00 0.77 0.00 0.00 66.41 66.96 3d0g h THR 118 Cb 0.05 0.92 -0.06 0.00 -1.74 0.00 0.00 68.15 67.32 3d0g h THR 118 CO -0.01 0.07 -0.34 0.40 0.37 0.00 0.00 175.52 176.01 3d0g h ILE 119 N -0.59 0.26 -0.94 3.11 1.08 -0.26 -1.39 117.51 118.78 3d0g h ILE 119 Ca -0.04 0.00 0.20 0.00 -0.39 0.00 0.00 64.86 64.63 3d0g h ILE 119 Cb 0.43 0.26 -0.11 0.00 -3.07 0.00 0.00 36.82 34.33 3d0g h ILE 119 CO 0.07 0.00 0.50 -0.07 -0.69 0.00 0.00 178.15 177.96 3d0g h LEU 120 N -0.45 0.57 -0.16 1.44 3.38 -0.65 -0.64 115.31 118.79 3d0g h LEU 120 Ca 0.08 0.12 -0.23 0.00 0.09 0.00 0.00 57.88 57.94 3d0g h LEU 120 Cb 0.57 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.36 3d0g h LEU 120 CO -0.32 0.14 -0.94 -1.13 0.09 0.00 0.00 178.44 176.28 3d0g h ASN 121 N 0.58 0.58 -0.07 -0.43 -0.73 -0.70 -2.98 115.58 111.83 3d0g h ASN 121 Ca 0.56 -0.46 -0.11 0.00 1.87 0.00 0.00 56.30 58.17 3d0g h ASN 121 Cb 0.97 -0.18 0.01 0.00 0.27 0.00 0.00 38.32 39.39 3d0g h ASN 121 CO -0.44 1.26 -0.37 0.74 -0.37 0.00 0.00 177.43 178.24 3d0g h THR 122 N 0.26 1.42 -0.61 -3.57 2.02 -0.17 -0.44 112.91 111.81 3d0g h THR 122 Ca -0.08 -1.77 0.12 0.00 0.77 0.00 0.00 66.41 65.44 3d0g h THR 122 Cb 1.57 2.33 -0.09 0.00 -1.74 0.00 0.00 68.15 70.22 3d0g h THR 122 CO 0.17 0.51 0.12 0.24 0.37 0.00 0.00 175.52 176.93 3d0g h MET 123 N -0.10 0.24 0.36 6.66 2.86 -1.28 0.65 114.93 124.32 3d0g h MET 123 Ca -0.03 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 3d0g h MET 123 Cb 1.03 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 3d0g h MET 123 CO 0.08 0.16 -0.26 1.03 1.06 0.00 0.00 176.91 178.98 3d0g h SER 124 N 0.25 -0.67 0.48 1.22 0.87 -1.34 -2.33 113.55 112.02 3d0g h SER 124 Ca 0.32 0.05 -0.05 0.00 -1.23 0.00 0.00 61.79 60.88 3d0g h SER 124 Cb 0.49 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 3d0g h SER 124 CO -0.42 -0.40 -0.24 0.74 -0.53 0.00 0.00 176.83 175.98 3d0g h THR 125 N -0.61 0.84 -0.14 2.23 2.02 -0.71 -1.53 112.91 115.00 3d0g h THR 125 Ca -0.03 -0.94 -0.09 0.00 0.77 0.00 0.00 66.41 66.11 3d0g h THR 125 Cb 0.53 1.57 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 3d0g h THR 125 CO 0.01 0.24 -0.26 0.40 0.37 0.00 0.00 175.52 176.27 3d0g h ILE 126 N 0.00 1.37 -0.02 3.11 2.04 -0.69 -1.05 117.51 122.27 3d0g h ILE 126 Ca -0.00 -1.52 -0.08 0.00 1.00 0.00 0.00 64.86 64.26 3d0g h ILE 126 Cb 0.55 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 3d0g h ILE 126 CO 0.03 0.45 -0.38 0.22 0.00 0.00 0.00 178.15 178.47 3d0g h TYR 127 N 0.03 0.04 0.00 1.37 5.03 -1.13 0.23 116.97 122.54 3d0g h TYR 127 Ca 0.01 -0.01 -0.19 0.00 2.58 0.00 0.00 58.73 61.12 3d0g h TYR 127 Cb 0.85 -0.01 -0.03 0.00 1.55 0.00 0.00 36.73 39.09 3d0g h TYR 127 CO 0.10 0.41 -0.98 0.66 -1.32 0.00 0.00 178.16 177.04 3d0g h SER 128 N 0.03 0.00 0.00 -2.11 4.64 -1.26 -3.37 113.55 111.49 3d0g h SER 128 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d0g h SER 128 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 3d0g h SER 128 CO 0.05 0.84 -0.68 0.41 -0.87 0.00 0.00 176.83 176.59 3d0g n THR 129 N -3.25 0.00 -1.66 2.95 -1.04 -0.40 -4.97 114.28 105.91 3d0g n THR 129 Ca -0.02 -0.26 -0.45 0.00 -2.04 0.00 0.00 64.05 61.28 3d0g n THR 129 Cb 0.89 0.85 -0.03 0.00 -1.82 0.00 0.00 70.33 70.22 3d0g n THR 129 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3d0g n GLY 130 N 1.38 0.67 3.08 3.41 0.00 0.78 -5.00 105.19 109.50 3d0g n GLY 130 Ca 0.01 0.50 -0.09 0.00 0.00 0.00 0.00 46.02 46.44 3d0g n GLY 130 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d0g s LYS 131 N -0.42 0.53 0.09 1.61 -2.85 -1.26 -4.25 119.74 113.19 3d0g s LYS 131 Ca 0.69 -0.86 0.05 0.00 -1.00 0.00 0.00 55.97 54.85 3d0g s LYS 131 Cb -0.68 0.20 -0.03 0.00 -2.06 0.00 0.00 37.83 35.26 3d0g s LYS 131 CO 0.50 -0.11 -0.14 0.14 0.10 0.00 0.00 175.35 175.84 3d0g s VAL 132 N -2.74 1.16 -0.02 1.79 -7.23 -0.53 -4.94 120.40 107.89 3d0g s VAL 132 Ca -0.04 -1.49 0.07 0.00 -1.81 0.00 0.00 61.98 58.70 3d0g s VAL 132 Cb -0.00 -1.27 -0.02 0.00 0.56 0.00 0.00 36.38 35.65 3d0g s VAL 132 CO -0.05 -0.34 -0.23 0.00 -0.31 0.00 0.00 175.10 174.17 3d0g s ASN 134 N -0.46 5.54 0.57 0.00 3.84 -1.15 -4.87 114.94 118.40 3d0g s ASN 134 Ca 0.07 1.92 0.25 0.00 0.21 0.00 0.00 52.86 55.31 3d0g s ASN 134 Cb -0.09 -2.51 1.58 0.00 -0.55 0.00 0.00 41.25 39.68 3d0g s ASN 134 CO -0.00 -1.89 2.15 -0.65 -2.79 0.00 0.00 177.10 173.92 3d0g h PRO 135 N 14.66 0.00 0.00 0.43 0.11 -1.96 0.87 132.00 146.10 3d0g h PRO 135 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3d0g h PRO 135 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3d0g h PRO 135 CO 0.96 0.00 -0.48 -0.25 -0.21 0.00 0.00 178.00 178.03 3d0g n ASP 136 N -4.07 0.52 -2.93 -2.05 10.43 -1.26 -4.50 116.55 112.69 3d0g n ASP 136 Ca -0.00 0.00 -0.13 0.00 2.57 0.00 0.00 54.79 57.24 3d0g n ASP 136 Cb 0.22 0.10 -0.01 0.00 1.84 0.00 0.00 41.12 43.27 3d0g n ASP 136 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 3d0g n ASN 137 N -1.75 -2.15 0.00 -2.24 4.05 0.07 -5.03 115.26 108.21 3d0g n ASN 137 Ca 0.05 -2.93 0.05 0.00 0.45 0.00 0.00 54.58 52.20 3d0g n ASN 137 Cb 0.38 1.00 0.30 0.00 1.23 0.00 0.00 39.78 42.68 3d0g n ASN 137 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 3d0g n PRO 138 N 2.18 0.23 0.00 1.20 -0.02 0.07 -2.28 135.00 136.38 3d0g n PRO 138 Ca 0.17 0.11 0.13 0.00 -2.02 0.00 0.00 63.50 61.90 3d0g n PRO 138 Cb 0.57 -1.50 0.66 0.00 -0.02 0.00 0.00 33.50 33.21 3d0g n PRO 138 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d0g n GLN 139 N -1.17 0.26 -3.99 -0.52 10.64 -1.26 -4.56 117.38 116.77 3d0g n GLN 139 Ca 0.06 0.03 -0.32 0.00 -1.83 0.00 0.00 57.00 54.94 3d0g n GLN 139 Cb 0.07 -1.50 -0.14 0.00 -0.86 0.00 0.00 30.24 27.80 3d0g n GLN 139 CO 0.00 0.00 0.00 -2.00 -1.83 0.00 0.00 177.06 173.23 3d0g s GLU 140 N -2.72 1.77 -0.20 2.61 2.12 -0.96 -5.09 118.70 116.22 3d0g s GLU 140 Ca 0.22 -1.72 -0.07 0.00 0.36 0.00 0.00 54.97 53.76 3d0g s GLU 140 Cb 0.18 -3.19 -0.04 0.00 0.26 0.00 0.00 34.13 31.35 3d0g s GLU 140 CO 0.45 -0.86 0.05 0.00 -0.54 0.00 0.00 175.26 174.37 3d0g s LEU 142 N 0.82 4.10 0.00 0.00 1.43 0.91 -4.88 118.68 121.06 3d0g s LEU 142 Ca 0.03 0.33 -0.04 0.00 -1.03 0.00 0.00 54.13 53.42 3d0g s LEU 142 Cb -0.14 -2.06 0.10 0.00 0.03 0.00 0.00 46.19 44.12 3d0g s LEU 142 CO 0.02 0.37 0.64 0.18 0.23 0.00 0.00 176.35 177.80 3d0g n LEU 143 N 1.85 0.00 0.11 1.79 4.32 -1.26 -1.45 117.00 122.36 3d0g n LEU 143 Ca -0.18 -1.05 -0.05 0.00 -0.02 0.00 0.00 56.01 54.70 3d0g n LEU 143 Cb 0.54 -0.45 -0.03 0.00 -1.62 0.00 0.00 43.42 41.86 3d0g n LEU 143 CO 0.32 -0.88 0.18 0.25 -1.22 0.00 0.00 177.39 176.04 3d0g h LEU 144 N 0.00 -0.29 -9.30 2.23 5.85 -1.91 0.37 115.31 112.25 3d0g h LEU 144 Ca -0.21 0.01 -0.62 0.00 0.84 0.00 0.00 57.88 57.90 3d0g h LEU 144 Cb 0.69 0.08 -0.12 0.00 0.37 0.00 0.00 40.66 41.67 3d0g h LEU 144 CO 0.19 0.03 -0.51 -0.70 -0.34 0.00 0.00 178.44 177.11 3d0g s GLU 145 N -2.71 3.96 0.00 1.25 2.56 -1.26 -0.77 118.70 121.73 3d0g s GLU 145 Ca -0.05 -0.24 0.20 0.00 0.00 0.00 0.00 54.97 54.88 3d0g s GLU 145 Cb 0.01 -3.31 0.67 0.00 2.00 0.00 0.00 34.13 33.50 3d0g s GLU 145 CO 0.15 0.40 1.50 -0.35 -0.56 0.00 0.00 175.26 176.40 3d0g n PRO 146 N 3.18 1.83 0.00 4.30 -0.05 -1.26 -4.96 135.00 138.04 3d0g n PRO 146 Ca -0.17 -1.25 0.00 0.00 -0.05 0.00 0.00 63.50 62.03 3d0g n PRO 146 Cb 0.53 -1.40 0.00 0.00 -0.05 0.00 0.00 33.50 32.58 3d0g n PRO 146 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 3d0g n GLY 147 N 1.17 -2.86 0.16 0.55 0.00 -1.02 -1.95 105.19 101.24 3d0g n GLY 147 Ca 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.12 3d0g n GLY 147 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3d0g h LEU 148 N 0.00 0.03 -1.03 0.99 4.07 -0.07 -2.88 115.31 116.42 3d0g h LEU 148 Ca 0.00 0.06 0.29 0.00 0.08 0.00 0.00 57.88 58.30 3d0g h LEU 148 Cb 0.00 0.07 -0.13 0.00 1.08 0.00 0.00 40.66 41.68 3d0g h LEU 148 CO 0.00 0.05 0.59 0.78 -1.08 0.00 0.00 178.44 178.79 3d0g h ASN 149 N 0.21 0.58 -0.16 -0.43 -0.26 -1.06 -0.76 115.58 113.69 3d0g h ASN 149 Ca 0.17 0.16 -0.02 0.00 -0.56 0.00 0.00 56.30 56.05 3d0g h ASN 149 Cb 0.19 0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.52 3d0g h ASN 149 CO -0.21 -0.02 0.04 -0.08 -1.06 0.00 0.00 177.43 176.10 3d0g h GLU 150 N 0.44 0.26 -0.06 0.81 4.22 -1.16 -2.36 114.58 116.72 3d0g h GLU 150 Ca 0.69 -0.06 0.04 0.00 0.08 0.00 0.00 59.36 60.11 3d0g h GLU 150 Cb 1.49 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.65 3d0g h GLU 150 CO -0.53 0.40 -0.30 0.82 -2.18 0.00 0.00 179.01 177.22 3d0g h ILE 151 N 0.08 0.32 0.00 2.32 2.04 -1.22 -1.64 117.51 119.42 3d0g h ILE 151 Ca 0.05 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.91 3d0g h ILE 151 Cb 0.26 0.32 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 3d0g h ILE 151 CO 0.00 0.00 -0.02 0.24 0.00 0.00 0.00 178.15 178.37 3d0g h MET 152 N -0.41 0.00 0.05 2.37 2.86 -1.14 0.13 114.93 118.78 3d0g h MET 152 Ca 0.08 0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 57.40 3d0g h MET 152 Cb 0.53 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.16 3d0g h MET 152 CO -0.30 0.02 -1.80 0.00 1.06 0.00 0.00 176.91 175.89 3d0g h ALA 153 N 1.98 0.64 0.00 6.32 0.00 -1.03 -3.15 119.26 124.02 3d0g h ALA 153 Ca -0.00 -1.43 0.00 0.00 0.00 0.00 0.00 54.91 53.48 3d0g h ALA 153 Cb 0.12 0.56 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3d0g h ALA 153 CO 0.00 1.48 -0.97 0.09 0.00 0.00 0.00 179.25 179.85 3d0g n ASN 154 N -3.21 4.87 -4.71 0.00 4.13 -0.65 -4.88 115.26 110.81 3d0g n ASN 154 Ca -0.22 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.61 3d0g n ASN 154 Cb 1.05 0.56 -0.02 0.00 -1.54 0.00 0.00 39.78 39.82 3d0g n ASN 154 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 3d0g n SER 155 N -1.89 3.39 -0.99 6.41 2.88 0.38 -4.90 113.62 118.90 3d0g n SER 155 Ca 0.00 1.13 0.10 0.00 -1.33 0.00 0.00 58.87 58.77 3d0g n SER 155 Cb 0.42 -1.51 0.18 0.00 -0.75 0.00 0.00 64.21 62.54 3d0g n SER 155 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3d0g n LEU 156 N 2.55 3.18 -4.54 2.46 7.99 -1.26 -4.94 117.00 122.44 3d0g n LEU 156 Ca 0.12 -1.44 -0.42 0.00 -0.01 0.00 0.00 56.01 54.25 3d0g n LEU 156 Cb 0.34 -0.19 -0.08 0.00 -0.11 0.00 0.00 43.42 43.37 3d0g n LEU 156 CO 0.63 0.67 0.23 -0.62 -1.51 0.00 0.00 177.39 176.79 3d0g s ASP 157 N -1.41 6.29 0.21 -1.43 2.15 -1.26 -4.96 116.67 116.27 3d0g s ASP 157 Ca 0.33 -0.20 -0.09 0.00 0.43 0.00 0.00 52.55 53.01 3d0g s ASP 157 Cb 0.20 -2.27 0.31 0.00 -0.30 0.00 0.00 42.92 40.86 3d0g s ASP 157 CO 0.27 -0.54 1.70 0.22 -0.17 0.00 0.00 175.17 176.65 3d0g h TYR 158 N 8.58 0.19 -0.15 -5.34 3.20 -1.96 -0.70 116.97 120.79 3d0g h TYR 158 Ca -0.27 0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.55 3d0g h TYR 158 Cb 1.12 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 39.40 3d0g h TYR 158 CO 0.70 -0.04 -0.23 -0.91 -1.64 0.00 0.00 178.16 176.04 3d0g h ASN 159 N 0.25 0.47 -0.23 -2.11 2.35 -1.97 0.54 115.58 114.87 3d0g h ASN 159 Ca 0.32 -0.53 0.05 0.00 -0.55 0.00 0.00 56.30 55.60 3d0g h ASN 159 Cb 0.49 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.68 3d0g h ASN 159 CO -0.42 0.90 -0.11 -0.08 -1.65 0.00 0.00 177.43 176.07 3d0g h GLU 160 N 0.05 -0.08 -0.20 0.81 4.81 -1.94 0.46 114.58 118.49 3d0g h GLU 160 Ca 0.01 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.29 3d0g h GLU 160 Cb 0.80 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.16 3d0g h GLU 160 CO 0.05 -0.05 -0.08 0.00 -0.73 0.00 0.00 179.01 178.20 3d0g h ARG 161 N -0.08 -0.05 -0.68 1.92 3.08 -0.96 -1.67 114.38 115.94 3d0g h ARG 161 Ca 0.13 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.27 3d0g h ARG 161 Cb 0.27 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.26 3d0g h ARG 161 CO -0.29 -0.03 0.33 1.25 -1.07 0.00 0.00 179.97 180.15 3d0g h LEU 162 N -0.05 0.41 0.23 3.04 5.85 0.86 -1.73 115.31 123.92 3d0g h LEU 162 Ca 0.10 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 3d0g h LEU 162 Cb 0.21 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 3d0g h LEU 162 CO -0.23 0.24 -0.20 -0.25 -0.34 0.00 0.00 178.44 177.65 3d0g h TRP 163 N 0.56 -0.56 -0.56 1.25 7.01 0.54 -1.17 115.95 123.03 3d0g h TRP 163 Ca 0.33 0.00 0.06 0.00 2.11 0.00 0.00 58.89 61.39 3d0g h TRP 163 Cb 0.35 0.22 -0.08 0.00 -2.10 0.00 0.00 29.16 27.55 3d0g h TRP 163 CO -0.12 -0.28 -0.49 0.00 -2.79 0.00 0.00 178.44 174.76 3d0g h ALA 164 N -1.45 -0.62 -0.74 2.65 0.00 -1.17 0.22 119.26 118.16 3d0g h ALA 164 Ca -0.03 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.00 3d0g h ALA 164 Cb 0.36 1.17 -0.11 0.00 0.00 0.00 0.00 17.79 19.22 3d0g h ALA 164 CO -0.01 -0.90 -0.54 2.35 0.00 0.00 0.00 179.25 180.14 3d0g h TRP 165 N -0.21 -1.67 -0.25 0.00 7.01 -1.30 -1.68 115.95 117.85 3d0g h TRP 165 Ca 0.09 0.10 -0.01 0.00 2.11 0.00 0.00 58.89 61.18 3d0g h TRP 165 Cb 0.45 0.83 -0.01 0.00 -2.10 0.00 0.00 29.16 28.33 3d0g h TRP 165 CO -0.83 -0.42 0.10 1.49 -2.79 0.00 0.00 178.44 175.99 3d0g h GLU 166 N -0.17 0.38 -0.36 2.65 4.57 -0.73 -3.09 114.58 117.83 3d0g h GLU 166 Ca 0.15 -0.07 0.06 0.00 -1.18 0.00 0.00 59.36 58.32 3d0g h GLU 166 Cb 0.51 -0.06 -0.08 0.00 -0.16 0.00 0.00 28.75 28.96 3d0g h GLU 166 CO -0.79 0.42 -0.50 0.77 -1.18 0.00 0.00 179.01 177.72 3d0g h SER 167 N 0.26 -1.66 -0.49 1.04 0.02 -0.08 0.12 113.55 112.76 3d0g h SER 167 Ca 0.08 0.23 0.09 0.00 -0.84 0.00 0.00 61.79 61.36 3d0g h SER 167 Cb 0.18 0.69 -0.08 0.00 0.14 0.00 0.00 62.40 63.33 3d0g h SER 167 CO -0.01 -0.40 -0.01 -0.25 -1.14 0.00 0.00 176.83 175.02 3d0g h TRP 168 N -0.40 -0.04 0.00 3.45 2.91 -1.31 0.33 115.95 120.89 3d0g h TRP 168 Ca 0.09 0.04 -0.02 0.00 1.13 0.00 0.00 58.89 60.13 3d0g h TRP 168 Cb 0.61 0.09 -0.00 0.00 -0.51 0.00 0.00 29.16 29.35 3d0g h TRP 168 CO -0.66 -0.12 -0.08 0.00 -1.03 0.00 0.00 178.44 176.55 3d0g h ARG 169 N 0.11 0.00 0.01 2.65 3.08 -1.38 -2.42 114.38 116.43 3d0g h ARG 169 Ca 0.25 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 60.00 3d0g h ARG 169 Cb 0.37 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.37 3d0g h ARG 169 CO -0.41 0.08 -1.72 1.03 -1.07 0.00 0.00 179.97 177.88 3d0g h SER 170 N 0.00 0.05 0.00 7.04 0.87 0.92 -2.93 113.55 119.50 3d0g h SER 170 Ca -0.00 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 3d0g h SER 170 Cb 0.86 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 3d0g h SER 170 CO 0.01 1.09 0.00 -0.62 -0.53 0.00 0.00 176.83 176.78 3d0g n GLU 171 N -3.10 0.00 0.13 2.24 -0.58 0.10 -4.20 120.64 115.24 3d0g n GLU 171 Ca -0.18 0.21 -0.01 0.00 -0.42 0.00 0.00 57.16 56.76 3d0g n GLU 171 Cb 1.05 -0.69 0.15 0.00 -0.57 0.00 0.00 31.44 31.38 3d0g n GLU 171 CO 0.00 0.00 0.00 -0.39 -0.48 0.00 0.00 177.13 176.26 3d0g h VAL 172 N 0.00 1.35 0.02 2.62 -1.51 -1.65 -3.10 116.25 113.99 3d0g h VAL 172 Ca 0.00 -2.22 -0.00 0.00 -1.23 0.00 0.00 66.70 63.25 3d0g h VAL 172 Cb 0.00 2.23 -0.00 0.00 -2.13 0.00 0.00 31.29 31.39 3d0g h VAL 172 CO 0.00 0.61 -0.04 1.23 -1.23 0.00 0.00 177.57 178.15 3d0g h GLY 173 N 2.17 -0.94 -0.02 5.19 0.00 -1.29 -2.58 103.07 105.61 3d0g h GLY 173 Ca -0.01 0.41 0.26 0.00 0.00 0.00 0.00 47.33 48.00 3d0g h GLY 173 CO 0.08 -0.35 0.68 0.50 0.00 0.00 0.00 176.54 177.45 3d0g h LYS 174 N -0.06 0.26 -0.47 4.80 1.57 -1.58 0.20 116.57 121.29 3d0g h LYS 174 Ca -0.00 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 3d0g h LYS 174 Cb 0.06 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 3d0g h LYS 174 CO -0.01 0.17 0.07 1.96 -0.57 0.00 0.00 179.45 181.07 3d0g h GLN 175 N 0.27 0.73 0.00 3.15 4.20 -1.45 -3.08 115.11 118.93 3d0g h GLN 175 Ca 0.53 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 59.09 3d0g h GLN 175 Cb 1.58 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 29.26 3d0g h GLN 175 CO -0.18 0.69 -0.53 -0.07 -0.67 0.00 0.00 178.83 178.08 3d0g h LEU 176 N 0.70 0.00 -0.16 1.46 3.38 -0.21 -3.39 115.31 117.09 3d0g h LEU 176 Ca 0.15 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.13 3d0g h LEU 176 Cb 0.33 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 3d0g h LEU 176 CO 0.01 0.01 -0.41 -0.09 0.09 0.00 0.00 178.44 178.04 3d0g h ARG 177 N 0.00 -0.38 -0.03 1.13 9.65 -1.34 0.62 114.38 124.03 3d0g h ARG 177 Ca 0.00 0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.91 3d0g h ARG 177 Cb 0.97 0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.63 3d0g h ARG 177 CO 0.00 -0.25 -0.01 -1.35 2.80 0.00 0.00 179.97 181.16 3d0g h PRO 178 N -0.39 -0.01 -0.65 0.20 0.11 -1.75 -1.81 132.00 127.70 3d0g h PRO 178 Ca 0.03 0.00 0.11 0.00 0.11 0.00 0.00 66.00 66.26 3d0g h PRO 178 Cb 0.49 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 31.52 3d0g h PRO 178 CO -0.36 -0.00 0.22 -0.07 -0.21 0.00 0.00 178.00 177.57 3d0g h LEU 179 N -0.01 0.17 -1.15 2.35 4.07 -1.70 -0.57 115.31 118.48 3d0g h LEU 179 Ca 0.02 0.10 -0.04 0.00 0.08 0.00 0.00 57.88 58.03 3d0g h LEU 179 Cb 0.03 0.10 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 3d0g h LEU 179 CO -0.03 0.08 0.15 0.22 -1.08 0.00 0.00 178.44 177.78 3d0g h TYR 180 N 0.37 0.76 -0.18 1.13 3.20 0.76 -1.02 116.97 121.99 3d0g h TYR 180 Ca 0.34 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 62.16 3d0g h TYR 180 Cb 0.48 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 3d0g h TYR 180 CO -0.19 0.63 0.11 0.93 -1.64 0.00 0.00 178.16 177.99 3d0g h GLU 181 N 0.73 0.25 -0.22 1.82 5.08 -0.27 -1.83 114.58 120.13 3d0g h GLU 181 Ca 0.17 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.38 3d0g h GLU 181 Cb 0.23 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3d0g h GLU 181 CO -0.01 0.21 -0.39 1.49 -1.00 0.00 0.00 179.01 179.32 3d0g h GLU 182 N 0.22 0.51 -0.97 2.33 4.81 -1.28 -2.82 114.58 117.37 3d0g h GLU 182 Ca 0.07 -0.25 0.13 0.00 -0.13 0.00 0.00 59.36 59.18 3d0g h GLU 182 Cb 0.03 -0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.32 3d0g h GLU 182 CO -0.01 0.82 0.59 -0.92 -0.73 0.00 0.00 179.01 178.76 3d0g h TYR 183 N 0.42 1.06 -0.29 0.92 5.03 -0.78 -0.51 116.97 122.81 3d0g h TYR 183 Ca 0.04 0.03 -0.18 0.00 2.58 0.00 0.00 58.73 61.20 3d0g h TYR 183 Cb 0.87 -0.33 -0.00 0.00 1.55 0.00 0.00 36.73 38.82 3d0g h TYR 183 CO 0.03 0.37 -0.52 0.28 -1.32 0.00 0.00 178.16 177.01 3d0g h VAL 184 N 0.89 1.28 0.09 1.81 2.07 -1.09 -0.67 116.25 120.63 3d0g h VAL 184 Ca 0.50 -1.71 -0.00 0.00 0.82 0.00 0.00 66.70 66.31 3d0g h VAL 184 Cb 0.57 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 3d0g h VAL 184 CO -0.30 0.56 -0.04 0.58 0.02 0.00 0.00 177.57 178.39 3d0g h VAL 185 N 0.66 1.15 -0.78 2.57 2.07 -1.35 -2.01 116.25 118.55 3d0g h VAL 185 Ca 0.02 -0.97 -0.02 0.00 0.82 0.00 0.00 66.70 66.55 3d0g h VAL 185 Cb 1.12 1.76 -0.04 0.00 -1.52 0.00 0.00 31.29 32.61 3d0g h VAL 185 CO 0.11 0.23 0.40 -0.07 0.02 0.00 0.00 177.57 178.27 3d0g h LEU 186 N -0.57 1.00 -0.57 2.57 3.38 -1.13 -2.10 115.31 117.89 3d0g h LEU 186 Ca -0.01 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.69 3d0g h LEU 186 Cb 0.47 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3d0g h LEU 186 CO 0.02 0.84 -0.54 0.50 0.09 0.00 0.00 178.44 179.35 3d0g h LYS 187 N 1.09 0.48 -0.22 1.13 1.63 -1.18 -3.12 116.57 116.39 3d0g h LYS 187 Ca 0.27 -0.30 -0.04 0.00 -0.85 0.00 0.00 60.65 59.74 3d0g h LYS 187 Cb 0.08 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.74 3d0g h LYS 187 CO -0.04 0.90 -0.00 -0.91 -3.45 0.00 0.00 179.45 175.95 3d0g h ASN 188 N 0.37 0.38 -0.52 4.20 2.35 -1.03 -2.79 115.58 118.54 3d0g h ASN 188 Ca 0.01 -0.31 0.10 0.00 -0.55 0.00 0.00 56.30 55.55 3d0g h ASN 188 Cb 1.07 -0.10 -0.10 0.00 0.05 0.00 0.00 38.32 39.24 3d0g h ASN 188 CO 0.10 0.60 -0.16 -0.33 -1.65 0.00 0.00 177.43 175.98 3d0g h GLU 189 N 0.15 -0.04 -0.36 0.81 5.08 -1.39 -0.36 114.58 118.47 3d0g h GLU 189 Ca 0.06 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.49 3d0g h GLU 189 Cb 0.40 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.57 3d0g h GLU 189 CO 0.01 -0.02 -0.37 1.98 -1.00 0.00 0.00 179.01 179.61 3d0g h MET 190 N -0.04 -0.30 -0.10 2.33 4.05 -1.48 0.60 114.93 120.00 3d0g h MET 190 Ca 0.25 0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.63 3d0g h MET 190 Cb 0.42 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.27 3d0g h MET 190 CO -0.55 -0.20 -0.18 0.00 0.23 0.00 0.00 176.91 176.21 3d0g h ALA 191 N 0.57 1.50 -0.17 0.39 0.00 -1.05 -2.12 119.26 118.38 3d0g h ALA 191 Ca 0.15 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3d0g h ALA 191 Cb 0.56 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3d0g h ALA 191 CO -0.53 0.36 -0.07 0.00 0.00 0.00 0.00 179.25 179.01 3d0g h ARG 192 N 0.16 0.35 0.00 0.00 3.08 -0.32 -0.28 114.38 117.37 3d0g h ARG 192 Ca 0.03 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.93 3d0g h ARG 192 Cb 0.42 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.46 3d0g h ARG 192 CO 0.03 0.65 0.00 0.00 -1.07 0.00 0.00 179.97 179.58 3d0g n ALA 193 N -2.38 1.40 -0.81 0.04 0.00 0.13 -0.84 120.51 118.06 3d0g n ALA 193 Ca -0.05 0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.48 3d0g n ALA 193 Cb 0.30 -1.20 0.32 0.00 0.00 0.00 0.00 19.45 18.87 3d0g n ALA 193 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3d0g n ASN 194 N -1.69 4.63 -3.04 0.00 3.02 -0.84 -4.96 115.26 112.37 3d0g n ASN 194 Ca 0.02 -2.77 -0.15 0.00 -0.03 0.00 0.00 54.58 51.64 3d0g n ASN 194 Cb 0.11 -0.57 0.07 0.00 -0.61 0.00 0.00 39.78 38.79 3d0g n ASN 194 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3d0g n HIS 195 N 0.33 -1.93 -4.37 3.10 8.25 -0.02 -5.05 115.22 115.52 3d0g n HIS 195 Ca 0.24 0.80 -0.28 0.00 -0.26 0.00 0.00 57.72 58.22 3d0g n HIS 195 Cb 0.96 -4.54 -0.13 0.00 1.12 0.00 0.00 29.99 27.40 3d0g n HIS 195 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3d0g s TYR 196 N -3.29 2.19 0.19 4.41 2.02 -0.13 -5.03 117.35 117.71 3d0g s TYR 196 Ca 0.09 -0.39 -0.12 0.00 -0.37 0.00 0.00 57.07 56.28 3d0g s TYR 196 Cb -0.04 -1.18 0.22 0.00 -0.40 0.00 0.00 41.96 40.56 3d0g s TYR 196 CO 0.61 0.32 1.73 0.93 -1.57 0.00 0.00 175.55 177.57 3d0g h GLU 197 N 3.86 0.29 -2.92 -0.62 5.08 -1.92 -3.31 114.58 115.04 3d0g h GLU 197 Ca -0.49 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 57.86 3d0g h GLU 197 Cb 1.18 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3d0g h GLU 197 CO 0.40 0.19 0.34 0.16 -1.00 0.00 0.00 179.01 179.10 3d0g s ASP 198 N -5.34 0.03 0.34 1.42 -4.77 -1.26 -4.82 116.67 102.27 3d0g s ASP 198 Ca -0.13 -1.11 0.03 0.00 -3.30 0.00 0.00 52.55 48.04 3d0g s ASP 198 Cb 0.16 0.80 0.61 0.00 -1.09 0.00 0.00 42.92 43.40 3d0g s ASP 198 CO 0.73 -1.59 1.95 0.22 0.70 0.00 0.00 175.17 177.18 3d0g h TYR 199 N 2.00 0.70 0.12 2.11 3.20 -1.81 -1.27 116.97 122.03 3d0g h TYR 199 Ca -0.32 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.54 3d0g h TYR 199 Cb 1.24 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 39.25 3d0g h TYR 199 CO 1.47 0.53 -0.31 0.78 -1.64 0.00 0.00 178.16 178.99 3d0g h GLY 200 N 0.83 -0.58 0.61 1.82 0.00 -1.88 -0.69 103.07 103.19 3d0g h GLY 200 Ca 0.18 0.36 0.16 0.00 0.00 0.00 0.00 47.33 48.03 3d0g h GLY 200 CO -0.02 -0.24 0.52 -1.80 0.00 0.00 0.00 176.54 174.99 3d0g h ASP 201 N -0.53 0.36 0.33 0.19 3.58 -1.82 0.16 116.42 118.70 3d0g h ASP 201 Ca 0.03 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.49 3d0g h ASP 201 Cb 0.56 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.56 3d0g h ASP 201 CO -0.18 0.18 -0.16 0.22 -2.88 0.00 0.00 179.24 176.42 3d0g h TYR 202 N 0.38 -0.41 -0.65 0.28 3.20 -0.19 -2.36 116.97 117.22 3d0g h TYR 202 Ca 0.38 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.27 3d0g h TYR 202 Cb 0.94 0.14 -0.04 0.00 1.54 0.00 0.00 36.73 39.31 3d0g h TYR 202 CO -0.00 -0.22 0.40 -1.49 -1.64 0.00 0.00 178.16 175.21 3d0g h TRP 203 N -0.51 0.76 -0.07 -3.82 6.55 0.32 -1.36 115.95 117.81 3d0g h TRP 203 Ca -0.05 0.02 0.02 0.00 0.95 0.00 0.00 58.89 59.84 3d0g h TRP 203 Cb 0.38 -0.25 -0.00 0.00 -0.86 0.00 0.00 29.16 28.43 3d0g h TRP 203 CO -0.04 0.44 0.08 0.00 -1.05 0.00 0.00 178.44 177.87 3d0g h ARG 204 N 0.79 0.00 -0.91 0.49 3.08 -0.68 -2.63 114.38 114.53 3d0g h ARG 204 Ca 0.26 0.00 0.25 0.00 0.07 0.00 0.00 59.98 60.56 3d0g h ARG 204 Cb 0.01 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 29.92 3d0g h ARG 204 CO -0.10 0.00 0.35 0.78 -1.07 0.00 0.00 179.97 179.93 3d0g h GLY 205 N 0.00 1.56 -0.56 0.04 0.00 -0.69 -0.36 103.07 103.07 3d0g h GLY 205 Ca 0.03 -0.11 0.34 0.00 0.00 0.00 0.00 47.33 47.59 3d0g h GLY 205 CO -0.00 -0.37 0.95 -1.80 0.00 0.00 0.00 176.54 175.32 3d0g h ASP 206 N 0.28 0.00 -0.04 0.19 1.82 -1.61 0.23 116.42 117.28 3d0g h ASP 206 Ca 0.60 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.24 3d0g h ASP 206 Cb 1.23 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.24 3d0g h ASP 206 CO -0.62 0.00 0.00 -1.22 -1.61 0.00 0.00 179.24 175.79 3d0g n TYR 207 N -3.87 0.03 -2.81 0.28 4.02 -0.14 -4.85 117.16 109.81 3d0g n TYR 207 Ca 0.25 -0.02 -0.36 0.00 -0.01 0.00 0.00 57.90 57.77 3d0g n TYR 207 Cb 1.33 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 40.58 3d0g n TYR 207 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 3d0g s GLU 208 N -1.97 4.45 -0.05 -0.72 2.12 0.81 -4.79 118.70 118.55 3d0g s GLU 208 Ca 0.34 1.23 -0.01 0.00 0.36 0.00 0.00 54.97 56.89 3d0g s GLU 208 Cb 0.20 -2.61 0.03 0.00 0.26 0.00 0.00 34.13 32.02 3d0g s GLU 208 CO 0.32 0.19 0.02 0.08 -0.54 0.00 0.00 175.26 175.32 3d0g s VAL 209 N -1.79 0.20 -0.24 3.70 1.01 0.85 -4.90 120.40 119.22 3d0g s VAL 209 Ca 0.54 0.19 -0.02 0.00 0.00 0.00 0.00 61.98 62.69 3d0g s VAL 209 Cb -0.15 -0.37 0.02 0.00 0.00 0.00 0.00 36.38 35.88 3d0g s VAL 209 CO 0.20 0.21 -0.06 0.20 0.00 0.00 0.00 175.10 175.65 3d0g s ASN 210 N 1.77 4.29 0.00 3.32 0.01 -1.26 -2.60 114.94 120.47 3d0g s ASN 210 Ca 0.01 -0.79 0.00 0.00 -0.71 0.00 0.00 52.86 51.37 3d0g s ASN 210 Cb -0.13 -1.67 0.00 0.00 0.41 0.00 0.00 41.25 39.86 3d0g s ASN 210 CO -0.04 -0.11 0.00 0.61 -1.51 0.00 0.00 177.10 176.05 3d0g n GLY 211 N 4.69 -2.59 0.00 0.66 0.00 -1.26 -5.05 105.19 101.64 3d0g n GLY 211 Ca -0.17 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.38 3d0g n GLY 211 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3d0g n VAL 212 N 0.14 0.00 -0.71 1.61 0.24 -1.26 -4.97 118.33 113.38 3d0g n VAL 212 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3d0g n VAL 212 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3d0g n VAL 212 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3d0g n ASP 213 N 0.00 -2.35 0.00 -1.34 8.00 -1.26 -4.59 116.55 115.01 3d0g n ASP 213 Ca 0.00 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.57 3d0g n ASP 213 Cb 0.00 -1.20 0.00 0.00 -0.02 0.00 0.00 41.12 39.90 3d0g n ASP 213 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d0g n GLY 214 N 0.09 0.71 0.00 0.44 0.00 -1.26 -4.46 105.19 100.71 3d0g n GLY 214 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3d0g n GLY 214 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3d0g n TYR 215 N 0.00 0.00 -1.72 1.61 0.53 -1.26 -4.83 117.16 111.49 3d0g n TYR 215 Ca 0.00 0.00 -0.34 0.00 -1.02 0.00 0.00 57.90 56.54 3d0g n TYR 215 Cb 0.00 -0.32 0.06 0.00 -1.03 0.00 0.00 39.34 38.05 3d0g n TYR 215 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 3d0g s ASP 216 N -2.63 4.91 -0.23 7.72 1.11 -1.26 -4.71 116.67 121.58 3d0g s ASP 216 Ca 0.17 2.12 -0.10 0.00 0.18 0.00 0.00 52.55 54.91 3d0g s ASP 216 Cb 0.13 -2.56 0.09 0.00 1.07 0.00 0.00 42.92 41.64 3d0g s ASP 216 CO 0.30 -1.77 0.52 -0.47 1.18 0.00 0.00 175.17 174.93 3d0g s TYR 217 N -2.18 -0.91 0.54 4.23 5.04 -1.07 -4.91 117.35 118.08 3d0g s TYR 217 Ca 0.70 1.75 -0.03 0.00 -2.44 0.00 0.00 57.07 57.05 3d0g s TYR 217 Cb -0.23 0.47 0.01 0.00 0.35 0.00 0.00 41.96 42.55 3d0g s TYR 217 CO 0.41 -0.49 0.81 -1.54 -1.34 0.00 0.00 175.55 173.40 3d0g s SER 218 N 2.07 5.67 0.10 4.32 1.04 -1.26 -0.11 113.70 125.54 3d0g s SER 218 Ca -0.07 0.53 -0.19 0.00 0.48 0.00 0.00 55.95 56.70 3d0g s SER 218 Cb -0.09 -1.61 -0.07 0.00 0.10 0.00 0.00 66.02 64.35 3d0g s SER 218 CO -0.16 -0.93 1.64 0.03 0.98 0.00 0.00 173.24 174.80 3d0g h ARG 219 N 0.05 0.37 0.00 4.02 3.08 -1.91 -3.06 114.38 116.93 3d0g h ARG 219 Ca -0.46 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 59.46 3d0g h ARG 219 Cb 1.26 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 3d0g h ARG 219 CO 0.59 0.41 -0.30 0.78 -1.07 0.00 0.00 179.97 180.38 3d0g h GLY 220 N 0.25 0.00 1.48 0.04 0.00 -1.95 -2.79 103.07 100.09 3d0g h GLY 220 Ca 0.08 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.47 3d0g h GLY 220 CO -0.01 0.00 0.20 -1.61 0.00 0.00 0.00 176.54 175.13 3d0g h GLN 221 N 0.00 0.00 0.36 4.80 4.15 -1.93 -1.82 115.11 120.66 3d0g h GLN 221 Ca -0.00 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 3d0g h GLN 221 Cb 0.56 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.25 3d0g h GLN 221 CO 0.04 0.00 -0.17 1.25 -1.93 0.00 0.00 178.83 178.02 3d0g h LEU 222 N 0.00 -0.40 -0.19 -2.39 5.85 -1.58 0.25 115.31 116.84 3d0g h LEU 222 Ca 0.10 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.83 3d0g h LEU 222 Cb 0.50 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.58 3d0g h LEU 222 CO -0.00 -0.22 -0.22 0.40 -0.34 0.00 0.00 178.44 178.06 3d0g h ILE 223 N -0.56 0.44 -0.21 4.05 2.04 -1.51 0.69 117.51 122.45 3d0g h ILE 223 Ca -0.05 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.86 3d0g h ILE 223 Cb 0.42 0.44 -0.07 0.00 -0.74 0.00 0.00 36.82 36.87 3d0g h ILE 223 CO 0.08 0.00 -0.43 -0.08 0.00 0.00 0.00 178.15 177.72 3d0g h GLU 224 N -0.25 -0.43 0.00 2.37 4.81 -1.34 0.51 114.58 120.25 3d0g h GLU 224 Ca 0.12 0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.33 3d0g h GLU 224 Cb 0.43 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 3d0g h GLU 224 CO -0.34 -0.29 -0.25 -0.44 -0.73 0.00 0.00 179.01 176.96 3d0g h ASP 225 N -0.45 0.00 0.05 1.04 3.32 0.05 0.12 116.42 120.55 3d0g h ASP 225 Ca 0.09 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 3d0g h ASP 225 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.17 3d0g h ASP 225 CO -0.45 0.25 -0.02 0.58 -1.72 0.00 0.00 179.24 177.88 3d0g h VAL 226 N 0.00 1.28 -0.51 -1.35 2.07 0.14 -2.85 116.25 115.03 3d0g h VAL 226 Ca -0.00 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.24 3d0g h VAL 226 Cb 0.53 2.09 -0.02 0.00 -1.52 0.00 0.00 31.29 32.37 3d0g h VAL 226 CO 0.03 0.31 0.20 -0.33 0.02 0.00 0.00 177.57 177.80 3d0g h GLU 227 N -0.64 0.77 -0.52 1.57 5.08 0.26 -0.31 114.58 120.80 3d0g h GLU 227 Ca -0.01 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 3d0g h GLU 227 Cb 0.55 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 3d0g h GLU 227 CO 0.01 0.69 0.31 1.25 -1.00 0.00 0.00 179.01 180.27 3d0g h HIS 228 N 0.69 0.70 0.00 4.33 2.76 -0.90 -2.52 115.15 120.21 3d0g h HIS 228 Ca 0.17 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.29 3d0g h HIS 228 Cb 0.21 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 3d0g h HIS 228 CO 0.01 0.50 -0.18 0.00 -1.30 0.00 0.00 177.93 176.95 3d0g h THR 229 N 0.70 0.44 0.09 6.26 1.03 -1.29 -3.14 112.91 117.00 3d0g h THR 229 Ca 0.19 -1.03 -0.25 0.00 -0.01 0.00 0.00 66.41 65.30 3d0g h THR 229 Cb 0.01 1.74 -0.00 0.00 -1.07 0.00 0.00 68.15 68.83 3d0g h THR 229 CO -0.03 0.18 -1.14 0.15 -0.01 0.00 0.00 175.52 174.67 3d0g h PHE 230 N 0.00 0.45 -0.61 0.00 3.57 -0.64 -3.18 116.94 116.52 3d0g h PHE 230 Ca -0.00 -0.31 0.09 0.00 3.53 0.00 0.00 57.97 61.28 3d0g h PHE 230 Cb 0.73 -0.03 -0.07 0.00 2.79 0.00 0.00 35.95 39.37 3d0g h PHE 230 CO 0.00 1.21 0.25 0.93 -2.23 0.00 0.00 178.31 178.47 3d0g h GLU 231 N 0.09 0.44 0.00 1.11 4.39 -1.42 0.14 114.58 119.33 3d0g h GLU 231 Ca -0.11 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.57 3d0g h GLU 231 Cb 1.85 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.40 3d0g h GLU 231 CO 0.18 0.29 0.00 0.39 -1.16 0.00 0.00 179.01 178.71 3d0g n GLU 232 N -4.96 0.36 -0.03 2.33 1.02 -1.20 -2.44 120.64 115.72 3d0g n GLU 232 Ca 0.08 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.19 3d0g n GLU 232 Cb 0.25 -1.05 -0.05 0.00 -0.02 0.00 0.00 31.44 30.58 3d0g n GLU 232 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3d0g n ILE 233 N -0.55 0.41 -0.30 -3.67 5.41 0.02 -4.78 119.36 115.90 3d0g n ILE 233 Ca 0.01 -0.24 -0.04 0.00 1.00 0.00 0.00 62.75 63.48 3d0g n ILE 233 Cb 0.00 -0.84 0.02 0.00 -0.71 0.00 0.00 39.64 38.11 3d0g n ILE 233 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 3d0g h LYS 234 N 0.00 -0.08 -0.31 0.38 1.57 -1.28 -1.61 116.57 115.24 3d0g h LYS 234 Ca -0.16 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.70 3d0g h LYS 234 Cb 1.36 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 33.60 3d0g h LYS 234 CO 0.01 -0.05 -0.29 -1.35 -0.57 0.00 0.00 179.45 177.19 3d0g h PRO 235 N -0.08 -0.25 0.17 3.15 0.11 -1.86 0.39 132.00 133.62 3d0g h PRO 235 Ca 0.28 0.02 0.02 0.00 0.11 0.00 0.00 66.00 66.42 3d0g h PRO 235 Cb 0.57 0.06 -0.04 0.00 0.11 0.00 0.00 31.00 31.70 3d0g h PRO 235 CO -0.84 -0.17 -0.36 1.25 -0.21 0.00 0.00 178.00 177.67 3d0g h LEU 236 N -0.26 -1.03 -1.10 2.35 5.85 -1.77 -1.83 115.31 117.51 3d0g h LEU 236 Ca 0.15 0.11 0.07 0.00 0.84 0.00 0.00 57.88 59.06 3d0g h LEU 236 Cb 0.51 0.38 -0.06 0.00 0.37 0.00 0.00 40.66 41.85 3d0g h LEU 236 CO -0.46 -0.45 0.61 0.22 -0.34 0.00 0.00 178.44 178.02 3d0g h TYR 237 N -0.62 1.09 -0.47 1.25 3.20 -0.44 0.76 116.97 121.73 3d0g h TYR 237 Ca 0.02 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.84 3d0g h TYR 237 Cb 0.63 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 3d0g h TYR 237 CO -0.29 0.56 0.02 0.93 -1.64 0.00 0.00 178.16 177.73 3d0g h GLU 238 N 1.06 0.83 -0.58 1.82 5.08 -0.06 0.49 114.58 123.22 3d0g h GLU 238 Ca 0.41 -0.25 -0.08 0.00 -1.00 0.00 0.00 59.36 58.44 3d0g h GLU 238 Cb 0.22 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3d0g h GLU 238 CO -0.16 0.86 0.06 0.45 -1.00 0.00 0.00 179.01 179.22 3d0g h HIS 239 N 0.68 1.05 0.27 4.33 3.86 -0.46 0.33 115.15 125.22 3d0g h HIS 239 Ca 0.14 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 59.18 3d0g h HIS 239 Cb 0.48 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.66 3d0g h HIS 239 CO 0.04 0.93 -0.18 1.25 0.86 0.00 0.00 177.93 180.82 3d0g h LEU 240 N 0.87 -0.45 -0.40 2.43 6.46 -0.10 -1.36 115.31 122.76 3d0g h LEU 240 Ca 0.17 0.03 0.06 0.00 -0.12 0.00 0.00 57.88 58.02 3d0g h LEU 240 Cb 0.46 0.14 -0.09 0.00 -0.73 0.00 0.00 40.66 40.45 3d0g h LEU 240 CO 0.02 -0.28 -0.49 -0.74 -0.62 0.00 0.00 178.44 176.32 3d0g h HIS 241 N -0.44 -1.47 -0.97 1.25 2.76 0.05 -1.19 115.15 115.14 3d0g h HIS 241 Ca -0.02 0.08 0.08 0.00 -2.20 0.00 0.00 60.37 58.31 3d0g h HIS 241 Cb 0.37 0.70 -0.07 0.00 1.55 0.00 0.00 27.41 29.96 3d0g h HIS 241 CO -0.10 -0.47 0.61 0.00 -1.30 0.00 0.00 177.93 176.67 3d0g h ALA 242 N 0.19 1.38 0.29 5.26 0.00 0.27 0.13 119.26 126.77 3d0g h ALA 242 Ca 0.11 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3d0g h ALA 242 Cb 0.60 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3d0g h ALA 242 CO -0.58 0.32 -0.14 -0.92 0.00 0.00 0.00 179.25 177.93 3d0g h TYR 243 N 1.06 -0.36 -0.69 0.00 3.20 -0.95 -2.37 116.97 116.85 3d0g h TYR 243 Ca 0.44 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.38 3d0g h TYR 243 Cb 0.28 0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.63 3d0g h TYR 243 CO -0.01 -0.01 0.46 -0.39 -1.64 0.00 0.00 178.16 176.56 3d0g h VAL 244 N -0.78 0.97 -0.05 1.81 -1.51 -0.77 -0.32 116.25 115.59 3d0g h VAL 244 Ca -0.04 -0.22 0.01 0.00 -1.23 0.00 0.00 66.70 65.23 3d0g h VAL 244 Cb 0.51 0.27 -0.01 0.00 -2.13 0.00 0.00 31.29 29.93 3d0g h VAL 244 CO 0.06 0.12 -0.03 -0.09 -1.23 0.00 0.00 177.57 176.40 3d0g h ARG 245 N 0.64 -0.03 -0.01 5.19 2.43 -0.66 0.23 114.38 122.17 3d0g h ARG 245 Ca 0.31 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.51 3d0g h ARG 245 Cb 0.38 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 3d0g h ARG 245 CO -0.10 -0.02 -0.21 0.00 -1.51 0.00 0.00 179.97 178.13 3d0g h ALA 246 N 1.02 -0.26 -0.66 2.80 0.00 -0.64 -0.84 119.26 120.68 3d0g h ALA 246 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.05 3d0g h ALA 246 Cb 0.08 0.36 -0.08 0.00 0.00 0.00 0.00 17.79 18.16 3d0g h ALA 246 CO -0.07 -0.70 0.27 0.87 0.00 0.00 0.00 179.25 179.62 3d0g h LYS 247 N -0.33 0.44 -0.38 0.00 1.79 -0.74 -2.25 116.57 115.11 3d0g h LYS 247 Ca 0.06 -0.03 -0.07 0.00 -2.18 0.00 0.00 60.65 58.43 3d0g h LYS 247 Cb 0.41 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.94 3d0g h LYS 247 CO -0.19 0.29 -0.07 -0.07 -1.08 0.00 0.00 179.45 178.33 3d0g h LEU 248 N 0.46 0.61 -1.65 2.94 3.38 0.17 -2.14 115.31 119.08 3d0g h LEU 248 Ca 0.34 -0.15 0.21 0.00 0.09 0.00 0.00 57.88 58.37 3d0g h LEU 248 Cb 0.43 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 3d0g h LEU 248 CO -0.32 0.72 0.58 0.24 0.09 0.00 0.00 178.44 179.75 3d0g h MET 249 N 0.59 0.28 -0.13 1.13 2.86 -0.55 -0.21 114.93 118.90 3d0g h MET 249 Ca 0.11 -0.02 -0.21 0.00 -2.06 0.00 0.00 59.70 57.52 3d0g h MET 249 Cb 0.47 -0.06 0.01 0.00 0.06 0.00 0.00 31.60 32.07 3d0g h MET 249 CO 0.02 0.19 -0.77 -0.91 1.06 0.00 0.00 176.91 176.50 3d0g h ASN 250 N 0.29 0.82 1.38 1.22 2.35 -1.35 -2.46 115.58 117.84 3d0g h ASN 250 Ca 0.44 -0.54 -0.09 0.00 -0.55 0.00 0.00 56.30 55.55 3d0g h ASN 250 Cb 1.24 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.35 3d0g h ASN 250 CO -0.12 1.33 -0.44 0.00 -1.65 0.00 0.00 177.43 176.55 3d0g h ALA 251 N 0.66 0.76 -2.16 -0.83 0.00 -1.10 -3.36 119.26 113.22 3d0g h ALA 251 Ca -0.05 -0.40 -0.58 0.00 0.00 0.00 0.00 54.91 53.89 3d0g h ALA 251 Cb 1.39 -0.07 -0.39 0.00 0.00 0.00 0.00 17.79 18.71 3d0g h ALA 251 CO 0.15 0.54 -0.98 0.66 0.00 0.00 0.00 179.25 179.63 3d0g n TYR 252 N -3.27 0.27 -1.95 0.00 4.01 -0.25 -5.04 117.16 110.93 3d0g n TYR 252 Ca 0.02 -3.63 -0.39 0.00 -0.16 0.00 0.00 57.90 53.74 3d0g n TYR 252 Cb 0.67 -0.26 0.01 0.00 -0.31 0.00 0.00 39.34 39.45 3d0g n TYR 252 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 3d0g s PRO 253 N -1.11 3.67 0.00 -0.72 0.02 -0.93 -2.30 135.00 133.63 3d0g s PRO 253 Ca 0.35 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.56 3d0g s PRO 253 Cb 0.13 -2.57 0.00 0.00 0.02 0.00 0.00 34.50 32.08 3d0g s PRO 253 CO -0.12 -0.75 0.00 -1.13 -0.33 0.00 0.00 177.00 174.67 3d0g n SER 254 N -0.31 0.00 0.12 2.53 3.41 -1.26 -4.81 113.62 113.31 3d0g n SER 254 Ca 0.06 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.77 3d0g n SER 254 Cb 0.44 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.41 3d0g n SER 254 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 3d0g h TYR 255 N 0.00 0.00 -4.21 7.33 -1.99 -1.81 -3.47 116.97 112.81 3d0g h TYR 255 Ca 0.00 0.00 -0.54 0.00 2.00 0.00 0.00 58.73 60.19 3d0g h TYR 255 Cb 0.00 0.00 -0.30 0.00 2.00 0.00 0.00 36.73 38.43 3d0g h TYR 255 CO 0.00 0.08 -0.83 0.42 -0.00 0.00 0.00 178.16 177.83 3d0g s ILE 256 N -3.28 1.32 -0.08 -2.88 1.01 -1.26 -4.90 121.20 111.14 3d0g s ILE 256 Ca 0.01 -0.70 -0.11 0.00 0.00 0.00 0.00 60.65 59.84 3d0g s ILE 256 Cb 0.08 -1.11 -0.05 0.00 0.01 0.00 0.00 42.46 41.40 3d0g s ILE 256 CO 0.77 0.38 0.28 -0.55 0.00 0.00 0.00 174.94 175.81 3d0g s SER 257 N -0.29 6.57 0.00 3.58 0.15 -1.26 -4.96 113.70 117.48 3d0g s SER 257 Ca 0.04 0.68 0.19 0.00 0.70 0.00 0.00 55.95 57.56 3d0g s SER 257 Cb -0.07 -2.16 1.06 0.00 -1.71 0.00 0.00 66.02 63.13 3d0g s SER 257 CO -0.00 0.32 1.53 -0.81 1.20 0.00 0.00 173.24 175.48 3d0g n PRO 258 N 2.19 0.48 -0.00 5.44 -0.04 -1.26 -1.52 135.00 140.29 3d0g n PRO 258 Ca -0.16 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 3d0g n PRO 258 Cb 0.53 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 3d0g n PRO 258 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3d0g n ILE 259 N -1.10 0.24 -2.88 0.52 -5.35 -1.26 -4.51 119.36 105.03 3d0g n ILE 259 Ca 0.12 -0.62 -0.21 0.00 -0.27 0.00 0.00 62.75 61.77 3d0g n ILE 259 Cb 0.09 0.88 0.09 0.00 -1.74 0.00 0.00 39.64 38.96 3d0g n ILE 259 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d0g n GLY 260 N -0.12 1.47 3.75 3.28 0.00 -0.58 -0.88 105.19 112.10 3d0g n GLY 260 Ca 0.00 -2.15 -0.29 0.00 0.00 0.00 0.00 46.02 43.57 3d0g n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d0g s LEU 262 N -6.12 4.14 -0.07 0.00 1.43 0.28 -4.72 118.68 113.62 3d0g s LEU 262 Ca 0.63 0.56 -0.38 0.00 -1.03 0.00 0.00 54.13 53.92 3d0g s LEU 262 Cb -0.16 -2.58 -0.15 0.00 0.03 0.00 0.00 46.19 43.32 3d0g s LEU 262 CO 0.55 -0.13 1.58 -2.65 0.23 0.00 0.00 176.35 175.94 3d0g n PRO 263 N 4.67 1.35 0.13 1.29 -0.02 -1.26 -1.16 135.00 140.00 3d0g n PRO 263 Ca -0.07 0.49 0.17 0.00 -2.02 0.00 0.00 63.50 62.08 3d0g n PRO 263 Cb 0.51 -2.19 0.74 0.00 -0.02 0.00 0.00 33.50 32.55 3d0g n PRO 263 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d0g h ALA 264 N 6.25 2.12 -0.37 3.55 0.00 -0.01 -1.93 119.26 128.87 3d0g h ALA 264 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3d0g h ALA 264 Cb 1.31 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3d0g h ALA 264 CO 0.88 -0.42 0.00 -2.39 0.00 0.00 0.00 179.25 177.32 3d0g n HIS 265 N -4.11 0.61 -1.07 0.00 1.44 -1.26 -4.07 115.22 106.76 3d0g n HIS 265 Ca 0.04 -0.28 0.09 0.00 -2.01 0.00 0.00 57.72 55.57 3d0g n HIS 265 Cb 0.42 -0.05 0.19 0.00 0.12 0.00 0.00 29.99 30.67 3d0g n HIS 265 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3d0g n LEU 266 N 0.58 3.01 -0.98 2.39 4.77 -0.72 -4.75 117.00 121.30 3d0g n LEU 266 Ca 0.13 -3.11 0.10 0.00 -0.03 0.00 0.00 56.01 53.10 3d0g n LEU 266 Cb 0.39 -0.48 0.20 0.00 -2.33 0.00 0.00 43.42 41.19 3d0g n LEU 266 CO 0.10 0.73 0.66 0.18 -1.33 0.00 0.00 177.39 177.73 3d0g n LEU 267 N -1.06 3.23 0.00 2.23 4.77 -1.26 -4.95 117.00 119.96 3d0g n LEU 267 Ca 0.19 -1.64 0.00 0.00 -0.03 0.00 0.00 56.01 54.53 3d0g n LEU 267 Cb 0.75 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3d0g n LEU 267 CO 0.07 0.73 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 3d0g n GLY 268 N 1.18 2.58 1.42 -0.72 0.00 -1.26 -4.18 105.19 104.21 3d0g n GLY 268 Ca 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.14 3d0g n GLY 268 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3d0g n ASP 269 N 0.00 -0.69 0.25 1.61 3.85 -1.19 -3.61 116.55 116.77 3d0g n ASP 269 Ca 0.00 -1.72 0.09 0.00 -0.71 0.00 0.00 54.79 52.45 3d0g n ASP 269 Cb 0.00 1.22 0.64 0.00 -1.35 0.00 0.00 41.12 41.63 3d0g n ASP 269 CO 0.00 0.00 0.00 -0.03 -1.01 0.00 0.00 177.20 176.16 3d0g h MET 270 N 0.00 0.00 0.00 0.11 1.85 -1.91 -3.20 114.93 111.78 3d0g h MET 270 Ca -0.12 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.97 3d0g h MET 270 Cb 0.49 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.52 3d0g h MET 270 CO 0.16 0.11 -0.88 0.91 -0.40 0.00 0.00 176.91 176.81 3d0g n TRP 271 N -4.15 0.00 -1.66 1.39 8.01 -1.26 -4.94 117.44 114.82 3d0g n TRP 271 Ca -0.03 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.16 3d0g n TRP 271 Cb 0.19 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.49 3d0g n TRP 271 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3d0g n GLY 272 N 2.21 0.45 0.24 6.99 0.00 -1.21 -4.94 105.19 108.93 3d0g n GLY 272 Ca 0.00 -0.89 0.07 0.00 0.00 0.00 0.00 46.02 45.20 3d0g n GLY 272 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3d0g h ARG 273 N 0.00 0.00 -3.78 1.61 2.43 -1.91 -3.43 114.38 109.30 3d0g h ARG 273 Ca 0.00 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.93 3d0g h ARG 273 Cb 0.72 0.00 -0.28 0.00 -0.42 0.00 0.00 29.97 29.99 3d0g h ARG 273 CO 0.00 0.11 -0.72 -0.06 -1.51 0.00 0.00 179.97 177.79 3d0g s PHE 274 N -4.77 0.04 -2.02 2.20 0.40 -1.26 -4.01 117.98 108.56 3d0g s PHE 274 Ca -0.04 -0.01 0.12 0.00 -0.60 0.00 0.00 56.93 56.40 3d0g s PHE 274 Cb 0.16 -0.03 0.36 0.00 0.51 0.00 0.00 43.02 44.02 3d0g s PHE 274 CO 0.68 -0.00 1.29 0.91 0.70 0.00 0.00 175.22 178.80 3d0g n TRP 275 N 3.08 0.47 -0.26 0.36 8.01 0.11 -4.32 117.44 124.88 3d0g n TRP 275 Ca -0.12 -0.24 -0.04 0.00 -1.31 0.00 0.00 57.50 55.79 3d0g n TRP 275 Cb 0.60 0.00 0.02 0.00 -2.01 0.00 0.00 31.31 29.92 3d0g n TRP 275 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.69 177.83 3d0g h THR 276 N 2.17 0.11 0.00 -0.99 2.02 -1.82 0.35 112.91 114.76 3d0g h THR 276 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3d0g h THR 276 Cb 0.49 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.02 3d0g h THR 276 CO 0.00 0.00 0.00 0.59 0.37 0.00 0.00 175.52 176.48 3d0g n ASN 277 N -5.45 0.00 0.06 4.18 5.03 -1.26 -1.79 115.26 116.02 3d0g n ASN 277 Ca 0.06 -0.28 0.11 0.00 0.87 0.00 0.00 54.58 55.35 3d0g n ASN 277 Cb 0.37 -0.14 0.46 0.00 -1.02 0.00 0.00 39.78 39.44 3d0g n ASN 277 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3d0g n LEU 278 N -1.14 0.36 -0.25 3.41 4.77 0.12 -4.02 117.00 120.25 3d0g n LEU 278 Ca 0.11 0.56 0.06 0.00 -0.03 0.00 0.00 56.01 56.71 3d0g n LEU 278 Cb 0.10 -0.48 0.19 0.00 -2.33 0.00 0.00 43.42 40.90 3d0g n LEU 278 CO 0.12 -0.25 0.98 0.22 -1.33 0.00 0.00 177.39 177.13 3d0g h TYR 279 N 0.00 0.41 -0.81 -1.77 3.20 -1.49 0.22 116.97 116.72 3d0g h TYR 279 Ca 0.00 0.04 0.14 0.00 3.14 0.00 0.00 58.73 62.05 3d0g h TYR 279 Cb 0.46 -0.07 -0.09 0.00 1.54 0.00 0.00 36.73 38.57 3d0g h TYR 279 CO 0.00 -0.01 0.39 0.66 -1.64 0.00 0.00 178.16 177.56 3d0g h SER 280 N 0.36 0.45 -0.10 -2.11 4.64 -1.85 0.13 113.55 115.07 3d0g h SER 280 Ca 0.42 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 3d0g h SER 280 Cb 0.68 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 3d0g h SER 280 CO -0.45 0.19 0.00 0.00 -0.87 0.00 0.00 176.83 175.70 3d0g n LEU 281 N -4.91 2.88 -0.35 5.97 -0.00 -0.28 -4.22 117.00 116.09 3d0g n LEU 281 Ca 0.16 -1.12 0.04 0.00 -0.00 0.00 0.00 56.01 55.09 3d0g n LEU 281 Cb 0.41 -0.05 0.04 0.00 -0.00 0.00 0.00 43.42 43.82 3d0g n LEU 281 CO 0.21 0.52 0.40 0.35 -0.00 0.00 0.00 177.39 178.87 3d0g n THR 282 N 1.22 0.06 -1.66 1.47 -2.24 0.61 -4.71 114.28 109.03 3d0g n THR 282 Ca 0.13 -0.53 -0.48 0.00 -2.27 0.00 0.00 64.05 60.91 3d0g n THR 282 Cb 0.53 1.14 -0.05 0.00 -2.10 0.00 0.00 70.33 69.86 3d0g n THR 282 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 3d0g n VAL 283 N 0.47 0.14 0.34 2.28 3.14 0.40 -4.91 118.33 120.19 3d0g n VAL 283 Ca 0.05 -0.02 -0.17 0.00 -2.96 0.00 0.00 64.34 61.24 3d0g n VAL 283 Cb 0.23 -1.52 -0.09 0.00 -1.06 0.00 0.00 33.84 31.40 3d0g n VAL 283 CO 0.00 0.00 0.00 -0.65 -6.46 0.00 0.00 176.83 169.72 3d0g h PRO 284 N 6.54 -0.82 -3.21 1.45 0.11 -1.89 -3.38 132.00 130.79 3d0g h PRO 284 Ca -0.46 0.06 -0.65 0.00 0.11 0.00 0.00 66.00 65.06 3d0g h PRO 284 Cb 1.27 0.19 -0.40 0.00 0.11 0.00 0.00 31.00 32.17 3d0g h PRO 284 CO 0.89 -0.52 -0.45 -0.06 -0.21 0.00 0.00 178.00 177.65 3d0g s PHE 285 N -5.74 3.59 0.34 0.65 0.40 -1.26 -4.94 117.98 111.01 3d0g s PHE 285 Ca -0.17 -3.21 0.35 0.00 -0.60 0.00 0.00 56.93 53.30 3d0g s PHE 285 Cb 0.03 -2.88 1.91 0.00 0.51 0.00 0.00 43.02 42.59 3d0g s PHE 285 CO 0.59 -0.64 2.08 0.78 0.70 0.00 0.00 175.22 178.73 3d0g h GLY 286 N 5.79 0.00 0.86 4.36 0.00 -1.99 -2.53 103.07 109.55 3d0g h GLY 286 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.34 3d0g h GLY 286 CO 0.75 0.00 -0.27 1.46 0.00 0.00 0.00 176.54 178.47 3d0g h GLN 287 N 0.00 0.53 -7.04 4.80 1.08 -1.97 -3.46 115.11 109.05 3d0g h GLN 287 Ca 0.00 -0.31 -0.55 0.00 -1.45 0.00 0.00 58.65 56.34 3d0g h GLN 287 Cb 0.05 0.03 0.14 0.00 -0.05 0.00 0.00 27.48 27.64 3d0g h GLN 287 CO 0.00 0.90 0.64 0.15 -0.95 0.00 0.00 178.83 179.58 3d0g s LYS 288 N -4.18 3.25 0.00 1.46 -0.14 -0.96 -5.02 119.74 114.16 3d0g s LYS 288 Ca -0.13 2.32 0.00 0.00 -1.36 0.00 0.00 55.97 56.80 3d0g s LYS 288 Cb 0.07 -2.36 0.00 0.00 -1.68 0.00 0.00 37.83 33.86 3d0g s LYS 288 CO 0.80 -1.13 0.00 -0.35 -0.76 0.00 0.00 175.35 173.91 3d0g n PRO 289 N -0.84 3.02 -2.10 -1.68 -0.04 -1.26 -5.04 135.00 127.06 3d0g n PRO 289 Ca 0.09 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.18 3d0g n PRO 289 Cb 0.44 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.91 3d0g n PRO 289 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3d0g s ASN 290 N -1.00 5.76 0.11 3.54 0.02 -1.26 -4.91 114.94 117.20 3d0g s ASN 290 Ca 0.00 2.42 0.21 0.00 -1.02 0.00 0.00 52.86 54.48 3d0g s ASN 290 Cb 0.00 -2.61 -0.12 0.00 0.02 0.00 0.00 41.25 38.54 3d0g s ASN 290 CO 0.00 -1.21 0.83 -0.38 0.02 0.00 0.00 177.10 176.36 3d0g n ILE 291 N -0.86 0.55 -1.45 0.60 2.08 -1.26 -4.96 119.36 114.06 3d0g n ILE 291 Ca 0.09 -0.56 -0.49 0.00 0.56 0.00 0.00 62.75 62.35 3d0g n ILE 291 Cb 0.48 -0.30 -0.07 0.00 -0.75 0.00 0.00 39.64 38.99 3d0g n ILE 291 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 3d0g n ASP 292 N -2.60 1.99 -1.29 4.38 4.64 -1.26 -4.85 116.55 117.56 3d0g n ASP 292 Ca -0.03 0.32 0.08 0.00 -1.38 0.00 0.00 54.79 53.78 3d0g n ASP 292 Cb 0.61 -1.26 0.29 0.00 -1.04 0.00 0.00 41.12 39.72 3d0g n ASP 292 CO 0.00 0.00 0.00 1.33 -0.82 0.00 0.00 177.20 177.71 3d0g n VAL 293 N 7.28 1.33 -0.25 5.18 0.24 -1.26 -4.56 118.33 126.29 3d0g n VAL 293 Ca 0.43 -0.92 0.05 0.00 -2.04 0.00 0.00 64.34 61.86 3d0g n VAL 293 Cb 0.24 0.12 0.15 0.00 -1.47 0.00 0.00 33.84 32.88 3d0g n VAL 293 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 3d0g h THR 294 N 3.36 0.38 0.00 3.34 2.02 -1.90 0.18 112.91 120.29 3d0g h THR 294 Ca 0.00 -0.04 -0.16 0.00 0.77 0.00 0.00 66.41 66.98 3d0g h THR 294 Cb 1.13 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 3d0g h THR 294 CO 0.15 0.02 -0.77 0.44 0.37 0.00 0.00 175.52 175.73 3d0g h ASP 295 N 0.12 0.00 0.06 4.18 5.19 -1.92 -3.19 116.42 120.86 3d0g h ASP 295 Ca 0.40 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.73 3d0g h ASP 295 Cb 0.70 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.20 3d0g h ASP 295 CO -0.62 0.77 -0.26 0.00 -3.12 0.00 0.00 179.24 176.01 3d0g h ALA 296 N 1.23 1.22 -0.33 3.45 0.00 -1.33 -2.96 119.26 120.53 3d0g h ALA 296 Ca -0.01 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.45 3d0g h ALA 296 Cb 1.47 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 3d0g h ALA 296 CO 0.10 0.51 -0.30 0.52 0.00 0.00 0.00 179.25 180.08 3d0g h MET 297 N 0.30 0.80 -0.63 0.00 2.86 -1.14 -3.25 114.93 113.86 3d0g h MET 297 Ca 0.05 -0.41 -0.06 0.00 -2.06 0.00 0.00 59.70 57.22 3d0g h MET 297 Cb 0.63 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 3d0g h MET 297 CO 0.04 1.04 0.17 0.28 1.06 0.00 0.00 176.91 179.51 3d0g h VAL 298 N 0.57 1.25 -0.10 -2.22 2.07 -1.57 -2.97 116.25 113.29 3d0g h VAL 298 Ca 0.06 -0.90 0.03 0.00 0.82 0.00 0.00 66.70 66.71 3d0g h VAL 298 Cb 0.88 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 3d0g h VAL 298 CO 0.08 0.34 0.68 0.44 0.02 0.00 0.00 177.57 179.12 3d0g h ASP 299 N 0.93 0.00 -0.11 0.57 3.32 -1.55 0.34 116.42 119.91 3d0g h ASP 299 Ca 0.20 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 3d0g h ASP 299 Cb 0.33 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 3d0g h ASP 299 CO -0.00 0.00 -0.11 0.00 -1.72 0.00 0.00 179.24 177.41 3d0g n GLN 300 N -2.81 1.79 -4.26 3.56 6.02 -1.12 -4.99 117.38 115.56 3d0g n GLN 300 Ca 0.01 -2.87 -0.37 0.00 -0.01 0.00 0.00 57.00 53.75 3d0g n GLN 300 Cb 0.73 -1.65 -0.05 0.00 1.02 0.00 0.00 30.24 30.30 3d0g n GLN 300 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3d0g n ALA 301 N -1.13 -1.21 -2.03 -1.58 0.00 0.12 -4.87 120.51 109.81 3d0g n ALA 301 Ca 0.20 -0.08 -0.42 0.00 0.00 0.00 0.00 53.44 53.14 3d0g n ALA 301 Cb 0.77 -3.00 -0.03 0.00 0.00 0.00 0.00 19.45 17.19 3d0g n ALA 301 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3d0g s TRP 302 N -3.21 2.86 0.38 0.00 0.52 -1.24 -5.03 118.94 113.23 3d0g s TRP 302 Ca 0.75 0.62 0.08 0.00 0.02 0.00 0.00 56.10 57.57 3d0g s TRP 302 Cb -0.42 -3.85 -0.02 0.00 -1.15 0.00 0.00 33.47 28.03 3d0g s TRP 302 CO 0.92 -3.20 0.35 0.16 0.02 0.00 0.00 176.95 175.20 3d0g s ASP 303 N 1.66 5.22 0.31 2.95 1.47 -1.26 -4.94 116.67 122.07 3d0g s ASP 303 Ca 0.69 -0.60 0.08 0.00 1.18 0.00 0.00 52.55 53.90 3d0g s ASP 303 Cb -0.39 -0.77 0.87 0.00 -0.34 0.00 0.00 42.92 42.29 3d0g s ASP 303 CO 0.31 -0.52 1.67 0.00 0.68 0.00 0.00 175.17 177.30 3d0g h ALA 304 N 1.10 1.60 -0.87 2.11 0.00 -1.95 0.34 119.26 121.58 3d0g h ALA 304 Ca -0.43 0.19 0.23 0.00 0.00 0.00 0.00 54.91 54.90 3d0g h ALA 304 Cb 1.26 0.20 -0.14 0.00 0.00 0.00 0.00 17.79 19.11 3d0g h ALA 304 CO 0.57 -0.46 0.19 1.96 0.00 0.00 0.00 179.25 181.51 3d0g h GLN 305 N 0.32 0.17 -0.13 0.00 1.08 -1.96 -0.07 115.11 114.52 3d0g h GLN 305 Ca 0.63 -0.01 -0.20 0.00 -1.45 0.00 0.00 58.65 57.62 3d0g h GLN 305 Cb 1.32 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.71 3d0g h GLN 305 CO -0.60 0.11 -0.72 -0.09 -0.95 0.00 0.00 178.83 176.58 3d0g h ARG 306 N 0.17 0.62 -0.33 1.46 9.65 -1.32 -1.57 114.38 123.05 3d0g h ARG 306 Ca 0.54 -0.48 0.04 0.00 -1.10 0.00 0.00 59.98 58.97 3d0g h ARG 306 Cb 1.09 0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 29.73 3d0g h ARG 306 CO -0.68 1.11 0.12 0.82 2.80 0.00 0.00 179.97 184.14 3d0g h ILE 307 N 0.43 0.92 0.23 1.20 1.08 -0.86 -0.52 117.51 119.98 3d0g h ILE 307 Ca -0.03 -0.09 -0.34 0.00 -0.39 0.00 0.00 64.86 64.00 3d0g h ILE 307 Cb 1.32 0.62 0.03 0.00 -3.07 0.00 0.00 36.82 35.72 3d0g h ILE 307 CO 0.14 0.05 -1.59 -0.26 -0.69 0.00 0.00 178.15 175.80 3d0g h PHE 308 N 0.27 0.87 -0.90 1.37 0.04 -1.47 -1.50 116.94 115.62 3d0g h PHE 308 Ca 0.15 -0.64 0.14 0.00 2.80 0.00 0.00 57.97 60.42 3d0g h PHE 308 Cb 0.11 -0.03 -0.09 0.00 2.20 0.00 0.00 35.95 38.14 3d0g h PHE 308 CO -0.13 1.61 0.51 -0.22 -0.60 0.00 0.00 178.31 179.47 3d0g h LYS 309 N 0.13 0.74 0.20 1.51 1.63 -1.23 1.10 116.57 120.65 3d0g h LYS 309 Ca -0.29 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.45 3d0g h LYS 309 Cb 2.14 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 33.61 3d0g h LYS 309 CO 0.24 0.49 -0.10 1.49 -3.45 0.00 0.00 179.45 178.12 3d0g h GLU 310 N 0.76 -0.26 -0.16 1.90 4.57 -1.06 0.58 114.58 120.91 3d0g h GLU 310 Ca 0.47 0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.72 3d0g h GLU 310 Cb 0.60 0.06 -0.07 0.00 -0.16 0.00 0.00 28.75 29.18 3d0g h GLU 310 CO -0.32 -0.06 -0.35 0.00 -1.18 0.00 0.00 179.01 177.09 3d0g h ALA 311 N 0.35 -0.42 -0.72 2.92 0.00 -0.11 0.50 119.26 121.78 3d0g h ALA 311 Ca -0.03 0.02 0.16 0.00 0.00 0.00 0.00 54.91 55.06 3d0g h ALA 311 Cb 0.32 0.67 -0.11 0.00 0.00 0.00 0.00 17.79 18.68 3d0g h ALA 311 CO 0.05 -0.83 0.14 1.49 0.00 0.00 0.00 179.25 180.10 3d0g h GLU 312 N -0.41 0.23 -0.76 0.00 4.81 0.14 0.19 114.58 118.79 3d0g h GLU 312 Ca 0.10 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 3d0g h GLU 312 Cb 0.57 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 3d0g h GLU 312 CO -0.39 0.15 0.41 -0.22 -0.73 0.00 0.00 179.01 178.24 3d0g h LYS 313 N 0.24 1.05 0.12 1.92 3.64 0.17 -0.08 116.57 123.63 3d0g h LYS 313 Ca 0.40 -0.12 0.02 0.00 -1.27 0.00 0.00 60.65 59.68 3d0g h LYS 313 Cb 0.68 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.26 3d0g h LYS 313 CO -0.52 0.77 -0.27 0.35 -2.27 0.00 0.00 179.45 177.51 3d0g h PHE 314 N 1.06 -0.73 -0.49 1.91 3.57 0.30 -1.15 116.94 121.41 3d0g h PHE 314 Ca 0.27 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.70 3d0g h PHE 314 Cb 0.03 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 3d0g h PHE 314 CO 0.01 -0.38 -0.04 0.74 -2.23 0.00 0.00 178.31 176.41 3d0g h PHE 315 N -0.49 0.92 0.00 0.41 0.04 -0.99 -1.88 116.94 114.96 3d0g h PHE 315 Ca 0.03 -0.15 -0.03 0.00 2.80 0.00 0.00 57.97 60.61 3d0g h PHE 315 Cb 0.51 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 38.41 3d0g h PHE 315 CO -0.24 0.86 -0.17 0.28 -0.60 0.00 0.00 178.31 178.44 3d0g h VAL 316 N 0.78 0.80 -0.08 -0.55 2.07 -0.86 -2.67 116.25 115.74 3d0g h VAL 316 Ca 0.14 -0.65 -0.06 0.00 0.82 0.00 0.00 66.70 66.95 3d0g h VAL 316 Cb 0.53 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 3d0g h VAL 316 CO 0.03 0.16 -0.24 0.77 0.02 0.00 0.00 177.57 178.31 3d0g h SER 317 N 0.00 0.13 -0.37 0.57 4.64 -0.34 -1.07 113.55 117.10 3d0g h SER 317 Ca -0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3d0g h SER 317 Cb 0.37 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3d0g h SER 317 CO 0.02 0.37 0.00 1.33 -0.87 0.00 0.00 176.83 177.68 3d0g n VAL 318 N -4.21 1.14 -0.67 0.95 0.24 -1.03 -3.84 118.33 110.91 3d0g n VAL 318 Ca -0.01 -0.70 0.00 0.00 -2.04 0.00 0.00 64.34 61.59 3d0g n VAL 318 Cb 0.32 -0.09 0.00 0.00 -1.47 0.00 0.00 33.84 32.61 3d0g n VAL 318 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3d0g n GLY 319 N 0.71 0.73 3.93 7.63 0.00 -0.41 -3.80 105.19 113.99 3d0g n GLY 319 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 3d0g n GLY 319 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d0g s LEU 320 N 0.00 3.09 0.46 0.99 1.43 -1.05 -5.01 118.68 118.59 3d0g s LEU 320 Ca 0.00 0.44 -0.16 0.00 -1.03 0.00 0.00 54.13 53.39 3d0g s LEU 320 Cb 0.00 -3.21 -0.08 0.00 0.03 0.00 0.00 46.19 42.93 3d0g s LEU 320 CO 0.00 -1.28 0.92 -2.16 0.23 0.00 0.00 176.35 174.06 3d0g s PRO 321 N -5.03 3.96 0.82 1.29 0.04 -1.26 -3.88 135.00 130.94 3d0g s PRO 321 Ca 0.57 0.86 -0.16 0.00 0.04 0.00 0.00 61.00 62.31 3d0g s PRO 321 Cb -0.11 -2.22 -0.06 0.00 0.04 0.00 0.00 34.50 32.16 3d0g s PRO 321 CO 0.43 -0.15 0.13 0.09 0.04 0.00 0.00 177.00 177.53 3d0g n ASN 322 N -1.28 -2.79 -4.75 6.66 3.02 -1.26 -4.68 115.26 110.18 3d0g n ASN 322 Ca 0.06 0.44 -0.32 0.00 -0.03 0.00 0.00 54.58 54.72 3d0g n ASN 322 Cb 0.54 -1.07 0.08 0.00 -0.61 0.00 0.00 39.78 38.72 3d0g n ASN 322 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3d0g s MET 323 N -2.62 2.31 0.32 3.52 -1.94 -1.26 -5.00 119.30 114.63 3d0g s MET 323 Ca 0.57 1.38 -0.27 0.00 -1.71 0.00 0.00 55.69 55.66 3d0g s MET 323 Cb -0.29 -1.89 -0.10 0.00 2.01 0.00 0.00 34.83 34.56 3d0g s MET 323 CO 0.67 -1.63 0.96 0.95 -0.01 0.00 0.00 175.02 175.97 3d0g s THR 324 N -2.53 4.09 0.36 2.05 -4.23 -1.26 -4.92 115.64 109.19 3d0g s THR 324 Ca 0.66 1.79 0.18 0.00 -1.18 0.00 0.00 61.69 63.14 3d0g s THR 324 Cb -0.21 -4.02 0.35 0.00 1.34 0.00 0.00 72.50 69.96 3d0g s THR 324 CO 0.49 0.20 1.60 -0.61 -0.54 0.00 0.00 174.62 175.76 3d0g h GLN 325 N 3.29 0.09 0.00 3.99 4.15 -1.99 0.48 115.11 125.12 3d0g h GLN 325 Ca -0.47 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 58.91 3d0g h GLN 325 Cb 1.20 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.86 3d0g h GLN 325 CO 0.65 0.06 -0.16 0.78 -1.93 0.00 0.00 178.83 178.23 3d0g h GLY 326 N 0.10 0.00 0.83 2.39 0.00 -1.92 -1.50 103.07 102.97 3d0g h GLY 326 Ca 0.80 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 48.11 3d0g h GLY 326 CO -0.73 0.00 0.03 -2.75 0.00 0.00 0.00 176.54 173.09 3d0g h PHE 327 N 0.00 0.26 -0.32 5.60 3.04 -0.16 0.29 116.94 125.65 3d0g h PHE 327 Ca -0.00 -0.03 -0.08 0.00 3.98 0.00 0.00 57.97 61.84 3d0g h PHE 327 Cb 0.29 -0.07 -0.02 0.00 2.56 0.00 0.00 35.95 38.71 3d0g h PHE 327 CO 0.00 0.40 -0.14 -1.49 -2.02 0.00 0.00 178.31 175.05 3d0g h TRP 328 N 0.05 0.60 0.10 0.41 4.06 -1.39 -1.64 115.95 118.14 3d0g h TRP 328 Ca 0.05 -0.10 -0.25 0.00 2.06 0.00 0.00 58.89 60.64 3d0g h TRP 328 Cb 0.27 -0.16 0.03 0.00 -1.00 0.00 0.00 29.16 28.30 3d0g h TRP 328 CO 0.01 0.68 -1.04 0.93 -3.56 0.00 0.00 178.44 175.45 3d0g h GLU 329 N 0.51 0.53 0.00 0.49 5.08 -1.13 -3.40 114.58 116.67 3d0g h GLU 329 Ca 0.09 -0.70 0.00 0.00 -1.00 0.00 0.00 59.36 57.74 3d0g h GLU 329 Cb 0.55 0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.03 3d0g h GLU 329 CO 0.03 1.30 -1.03 0.09 -1.00 0.00 0.00 179.01 178.41 3d0g n ASN 330 N -3.94 0.83 -4.77 1.42 3.02 0.10 -4.99 115.26 106.94 3d0g n ASN 330 Ca -0.13 -0.74 -0.34 0.00 -0.03 0.00 0.00 54.58 53.34 3d0g n ASN 330 Cb 0.90 1.16 0.03 0.00 -0.61 0.00 0.00 39.78 41.25 3d0g n ASN 330 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3d0g s SER 331 N -2.95 5.38 -0.40 6.41 0.01 -0.62 -4.96 113.70 116.57 3d0g s SER 331 Ca 0.04 2.15 -0.09 0.00 1.31 0.00 0.00 55.95 59.36 3d0g s SER 331 Cb 0.13 -2.57 0.06 0.00 0.21 0.00 0.00 66.02 63.85 3d0g s SER 331 CO 0.73 -1.45 0.22 -0.32 0.41 0.00 0.00 173.24 172.83 3d0g s MET 332 N -3.60 2.67 0.08 12.44 1.75 -1.03 -4.96 119.30 126.66 3d0g s MET 332 Ca 0.71 -1.31 0.23 0.00 -1.25 0.00 0.00 55.69 54.07 3d0g s MET 332 Cb -0.24 -3.73 -0.05 0.00 2.84 0.00 0.00 34.83 33.65 3d0g s MET 332 CO 0.33 -0.84 0.91 1.28 -0.65 0.00 0.00 175.02 176.05 3d0g n LEU 333 N 4.93 0.55 -3.78 4.11 7.99 -1.26 -2.55 117.00 126.98 3d0g n LEU 333 Ca -0.11 0.09 -0.13 0.00 -0.01 0.00 0.00 56.01 55.86 3d0g n LEU 333 Cb 0.44 -0.06 -0.13 0.00 -0.11 0.00 0.00 43.42 43.56 3d0g n LEU 333 CO 0.37 -0.04 -0.15 0.42 -1.51 0.00 0.00 177.39 176.48 3d0g s THR 334 N -3.32 -0.01 0.20 -5.08 -4.23 -1.26 -3.10 115.64 98.84 3d0g s THR 334 Ca -0.00 0.05 -0.32 0.00 -1.18 0.00 0.00 61.69 60.23 3d0g s THR 334 Cb 0.13 -0.29 -0.12 0.00 1.34 0.00 0.00 72.50 73.56 3d0g s THR 334 CO 0.82 0.02 1.74 -0.67 -0.54 0.00 0.00 174.62 175.99 3d0g n ASP 335 N 3.33 4.03 0.00 3.99 4.64 -1.26 -4.90 116.55 126.37 3d0g n ASP 335 Ca -0.16 1.05 0.11 0.00 -1.38 0.00 0.00 54.79 54.41 3d0g n ASP 335 Cb 0.57 -1.58 0.53 0.00 -1.04 0.00 0.00 41.12 39.60 3d0g n ASP 335 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 3d0g n PRO 336 N 4.13 0.21 0.00 -0.67 -0.02 -1.26 -5.02 135.00 132.37 3d0g n PRO 336 Ca 0.16 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 3d0g n PRO 336 Cb 0.35 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 3d0g n PRO 336 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d0g n GLY 337 N 0.65 0.26 3.79 -1.23 0.00 -1.26 -4.77 105.19 102.63 3d0g n GLY 337 Ca 0.09 -0.95 -0.30 0.00 0.00 0.00 0.00 46.02 44.85 3d0g n GLY 337 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d0g s ASN 338 N -4.00 4.65 -0.20 1.61 4.22 -1.26 -4.00 114.94 115.96 3d0g s ASN 338 Ca 0.00 1.51 -0.07 0.00 -2.14 0.00 0.00 52.86 52.16 3d0g s ASN 338 Cb 0.00 -2.28 0.03 0.00 1.28 0.00 0.00 41.25 40.27 3d0g s ASN 338 CO 0.00 -1.89 0.13 0.52 -2.04 0.00 0.00 177.10 173.82 3d0g n VAL 339 N -3.41-11.16 -2.14 3.54 0.31 -1.26 -4.82 118.33 99.40 3d0g n VAL 339 Ca 0.07 2.08 -0.03 0.00 -0.01 0.00 0.00 64.34 66.46 3d0g n VAL 339 Cb 0.55 -6.28 0.00 0.00 -0.91 0.00 0.00 33.84 27.20 3d0g n VAL 339 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 3d0g n GLN 340 N 1.12 -1.37 -3.72 5.55 7.27 -1.26 -4.94 117.38 120.03 3d0g n GLN 340 Ca -0.22 1.42 -0.28 0.00 0.07 0.00 0.00 57.00 57.98 3d0g n GLN 340 Cb 0.35 -3.41 -0.03 0.00 2.41 0.00 0.00 30.24 29.55 3d0g n GLN 340 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 3d0g s LYS 341 N -1.43 3.52 0.06 3.69 1.02 -1.26 -4.37 119.74 120.98 3d0g s LYS 341 Ca 0.08 -0.33 -0.00 0.00 0.02 0.00 0.00 55.97 55.74 3d0g s LYS 341 Cb -0.02 -2.86 -0.04 0.00 -0.52 0.00 0.00 37.83 34.39 3d0g s LYS 341 CO 0.38 0.43 -0.04 0.00 -0.92 0.00 0.00 175.35 175.20 3d0g s ALA 342 N -1.81 0.63 0.31 5.17 0.00 -1.26 -2.62 121.76 122.17 3d0g s ALA 342 Ca 0.38 -1.21 -0.28 0.00 0.00 0.00 0.00 51.96 50.85 3d0g s ALA 342 Cb -0.11 0.23 -0.09 0.00 0.00 0.00 0.00 23.12 23.14 3d0g s ALA 342 CO 0.28 -0.31 1.11 0.14 0.00 0.00 0.00 175.76 176.98 3d0g s VAL 343 N -3.66 3.43 -0.76 0.00 -7.23 -0.87 -4.97 120.40 106.34 3d0g s VAL 343 Ca 0.07 1.38 0.07 0.00 -1.81 0.00 0.00 61.98 61.69 3d0g s VAL 343 Cb 0.06 -3.85 0.15 0.00 0.56 0.00 0.00 36.38 33.30 3d0g s VAL 343 CO -0.08 0.28 1.01 0.00 -0.31 0.00 0.00 175.10 176.00 3d0g s HIS 345 N -0.86 3.20 0.13 0.00 3.76 -1.26 -3.90 115.29 116.35 3d0g s HIS 345 Ca 0.13 0.92 -0.31 0.00 -0.15 0.00 0.00 55.06 55.65 3d0g s HIS 345 Cb 0.08 -3.69 -0.09 0.00 1.11 0.00 0.00 32.58 29.99 3d0g s HIS 345 CO 0.10 -2.45 1.45 -2.14 -0.85 0.00 0.00 174.74 170.85 3d0g s PRO 346 N 1.22 4.28 0.03 8.40 0.02 -1.26 -4.72 135.00 142.96 3d0g s PRO 346 Ca 0.65 2.16 -0.06 0.00 0.02 0.00 0.00 61.00 63.77 3d0g s PRO 346 Cb -0.37 -3.24 -0.01 0.00 0.02 0.00 0.00 34.50 30.91 3d0g s PRO 346 CO 0.30 -0.50 0.12 0.95 -0.33 0.00 0.00 177.00 177.54 3d0g s THR 347 N 1.19 0.11 -0.22 0.99 -4.23 -0.64 -5.03 115.64 107.81 3d0g s THR 347 Ca 0.66 -0.93 -0.06 0.00 -1.18 0.00 0.00 61.69 60.18 3d0g s THR 347 Cb -0.39 -0.73 -0.03 0.00 1.34 0.00 0.00 72.50 72.69 3d0g s THR 347 CO 0.30 -0.52 0.04 0.00 -0.54 0.00 0.00 174.62 173.90 3d0g s ALA 348 N -2.18 3.13 -0.20 3.99 0.00 -1.26 -2.47 121.76 122.77 3d0g s ALA 348 Ca -0.08 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 50.77 3d0g s ALA 348 Cb -0.03 -1.91 -0.04 0.00 0.00 0.00 0.00 23.12 21.13 3d0g s ALA 348 CO -0.02 -0.24 0.10 -1.58 0.00 0.00 0.00 175.76 174.01 3d0g s TRP 349 N 1.17 3.29 -0.57 0.00 0.52 0.18 -5.00 118.94 118.53 3d0g s TRP 349 Ca 0.04 0.14 0.04 0.00 0.02 0.00 0.00 56.10 56.33 3d0g s TRP 349 Cb -0.14 -2.14 0.14 0.00 -1.15 0.00 0.00 33.47 30.18 3d0g s TRP 349 CO 0.02 0.15 0.33 0.34 0.02 0.00 0.00 176.95 177.81 3d0g s ASP 350 N 0.54 4.51 0.27 2.95 3.68 -1.26 -1.70 116.67 125.66 3d0g s ASP 350 Ca 0.05 -3.21 0.14 0.00 2.13 0.00 0.00 52.55 51.66 3d0g s ASP 350 Cb -0.12 -1.66 0.16 0.00 -1.45 0.00 0.00 42.92 39.85 3d0g s ASP 350 CO 0.00 -0.20 1.48 -0.07 0.13 0.00 0.00 175.17 176.52 3d0g h LEU 351 N 6.26 0.00 0.00 -1.34 4.07 -1.78 -3.50 115.31 119.03 3d0g h LEU 351 Ca -0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.94 3d0g h LEU 351 Cb 0.86 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.60 3d0g h LEU 351 CO 0.70 0.56 0.00 0.61 -1.08 0.00 0.00 178.44 179.23 3d0g n GLY 352 N 1.01 -0.69 4.24 0.83 0.00 -1.24 -4.31 105.19 105.02 3d0g n GLY 352 Ca 0.01 -2.24 -0.33 0.00 0.00 0.00 0.00 46.02 43.46 3d0g n GLY 352 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d0g n LYS 353 N -0.32 -0.87 -1.71 1.61 5.02 -1.26 0.48 118.16 121.10 3d0g n LYS 353 Ca 0.00 0.10 -0.14 0.00 -2.02 0.00 0.00 58.31 56.25 3d0g n LYS 353 Cb 0.00 -3.69 -0.04 0.00 -0.02 0.00 0.00 35.03 31.27 3d0g n LYS 353 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d0g n GLY 354 N -1.96 0.80 3.40 0.72 0.00 -1.26 -4.92 105.19 101.96 3d0g n GLY 354 Ca -0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.42 3d0g n GLY 354 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3d0g s ASP 355 N -2.15 6.16 0.02 1.61 -1.08 0.18 -5.01 116.67 116.40 3d0g s ASP 355 Ca 0.00 -1.22 0.05 0.00 -0.52 0.00 0.00 52.55 50.87 3d0g s ASP 355 Cb 0.00 -2.21 -0.03 0.00 -1.46 0.00 0.00 42.92 39.22 3d0g s ASP 355 CO 0.00 -0.70 -0.14 -0.36 0.52 0.00 0.00 175.17 174.49 3d0g s PHE 356 N 1.87 2.67 -0.02 -5.34 0.40 -1.26 -1.89 117.98 114.40 3d0g s PHE 356 Ca 0.07 -0.19 -0.29 0.00 -0.60 0.00 0.00 56.93 55.92 3d0g s PHE 356 Cb -0.23 -1.53 0.10 0.00 0.51 0.00 0.00 43.02 41.87 3d0g s PHE 356 CO 0.08 0.27 0.89 -0.98 0.70 0.00 0.00 175.22 176.18 3d0g s ARG 357 N -1.31 0.81 -0.07 0.44 1.70 -0.69 -4.00 118.95 115.83 3d0g s ARG 357 Ca 0.15 -0.25 0.04 0.00 -0.47 0.00 0.00 55.73 55.20 3d0g s ARG 357 Cb -0.11 0.37 -0.02 0.00 -0.57 0.00 0.00 34.95 34.63 3d0g s ARG 357 CO 0.05 -0.34 -0.20 0.42 -1.08 0.00 0.00 175.30 174.15 3d0g s ILE 358 N -2.90 2.50 -0.27 4.99 1.01 -1.26 0.52 121.20 125.78 3d0g s ILE 358 Ca 0.04 -0.90 -0.06 0.00 0.00 0.00 0.00 60.65 59.73 3d0g s ILE 358 Cb -0.01 -1.96 0.00 0.00 0.01 0.00 0.00 42.46 40.51 3d0g s ILE 358 CO -0.08 0.57 0.04 -0.22 0.00 0.00 0.00 174.94 175.25 3d0g s LEU 359 N -0.21 3.57 -0.28 2.97 2.96 -1.03 -2.46 118.68 124.21 3d0g s LEU 359 Ca -0.01 -0.62 -0.10 0.00 -0.22 0.00 0.00 54.13 53.18 3d0g s LEU 359 Cb -0.13 -1.84 0.12 0.00 0.50 0.00 0.00 46.19 44.84 3d0g s LEU 359 CO 0.03 -0.14 0.61 -0.32 -1.32 0.00 0.00 176.35 175.21 3d0g s MET 360 N 1.49 0.54 -1.48 1.98 1.75 -1.06 -1.63 119.30 120.89 3d0g s MET 360 Ca 0.03 1.38 -0.13 0.00 -1.25 0.00 0.00 55.69 55.71 3d0g s MET 360 Cb -0.16 0.76 0.01 0.00 2.84 0.00 0.00 34.83 38.27 3d0g s MET 360 CO 0.01 -0.21 2.38 0.00 -0.65 0.00 0.00 175.02 176.55 3d0g n THR 362 N 4.80 0.25 -2.83 0.00 -1.04 -1.18 -4.79 114.28 109.49 3d0g n THR 362 Ca 0.57 -0.09 -0.21 0.00 -2.04 0.00 0.00 64.05 62.28 3d0g n THR 362 Cb 0.36 -1.25 0.07 0.00 -1.82 0.00 0.00 70.33 67.69 3d0g n THR 362 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3d0g s LYS 363 N 4.36 2.16 0.00 -2.82 3.01 -1.26 -4.77 119.74 120.42 3d0g s LYS 363 Ca 1.03 -1.32 0.19 0.00 -1.01 0.00 0.00 55.97 54.87 3d0g s LYS 363 Cb -1.07 -2.53 0.53 0.00 -1.01 0.00 0.00 37.83 33.76 3d0g s LYS 363 CO 0.63 -0.99 1.44 0.28 0.51 0.00 0.00 175.35 177.21 3d0g n VAL 364 N -2.42 0.50 -0.76 3.17 0.31 -1.26 -4.76 118.33 113.11 3d0g n VAL 364 Ca 0.14 -0.61 -0.29 0.00 -0.01 0.00 0.00 64.34 63.57 3d0g n VAL 364 Cb 0.61 0.53 0.22 0.00 -0.91 0.00 0.00 33.84 34.29 3d0g n VAL 364 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3d0g s THR 365 N -1.50 2.06 0.09 2.52 -4.23 -1.26 -4.79 115.64 108.53 3d0g s THR 365 Ca 0.35 0.02 -0.17 0.00 -1.18 0.00 0.00 61.69 60.71 3d0g s THR 365 Cb 0.19 -2.22 -0.08 0.00 1.34 0.00 0.00 72.50 71.73 3d0g s THR 365 CO 0.27 -0.03 1.47 -0.03 -0.54 0.00 0.00 174.62 175.76 3d0g h MET 366 N -2.36 0.54 -0.76 3.99 1.85 -1.87 -2.80 114.93 113.53 3d0g h MET 366 Ca -0.59 -0.22 0.20 0.00 -0.61 0.00 0.00 59.70 58.49 3d0g h MET 366 Cb 1.33 -0.03 -0.04 0.00 0.43 0.00 0.00 31.60 33.29 3d0g h MET 366 CO 0.52 0.76 0.53 -0.44 -0.40 0.00 0.00 176.91 177.88 3d0g h ASP 367 N 0.29 0.14 0.22 1.39 3.32 -1.98 -0.18 116.42 119.62 3d0g h ASP 367 Ca 0.07 0.01 -0.33 0.00 0.02 0.00 0.00 57.03 56.80 3d0g h ASP 367 Cb 0.57 -0.02 0.03 0.00 0.22 0.00 0.00 39.33 40.14 3d0g h ASP 367 CO 0.03 0.06 -1.50 0.44 -1.72 0.00 0.00 179.24 176.56 3d0g h ASP 368 N 0.15 0.73 -0.65 6.45 5.19 -1.87 -0.70 116.42 125.71 3d0g h ASP 368 Ca 0.37 -0.93 0.11 0.00 -0.62 0.00 0.00 57.03 55.97 3d0g h ASP 368 Cb 1.25 -0.24 -0.08 0.00 0.18 0.00 0.00 39.33 40.44 3d0g h ASP 368 CO -0.06 1.70 0.23 0.15 -3.12 0.00 0.00 179.24 178.15 3d0g h PHE 369 N 0.06 0.39 -0.27 4.55 3.04 -0.97 0.13 116.94 123.88 3d0g h PHE 369 Ca -0.28 0.03 -0.17 0.00 3.98 0.00 0.00 57.97 61.54 3d0g h PHE 369 Cb 2.08 -0.08 -0.00 0.00 2.56 0.00 0.00 35.95 40.51 3d0g h PHE 369 CO 0.13 0.06 -0.50 -0.07 -2.02 0.00 0.00 178.31 175.91 3d0g h LEU 370 N 0.39 0.83 -1.04 0.59 3.38 -1.15 -3.07 115.31 115.24 3d0g h LEU 370 Ca 0.34 -0.42 0.05 0.00 0.09 0.00 0.00 57.88 57.94 3d0g h LEU 370 Cb 0.47 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 3d0g h LEU 370 CO -0.35 1.18 0.64 0.74 0.09 0.00 0.00 178.44 180.74 3d0g h THR 371 N 0.59 1.12 -0.81 0.22 2.02 -0.23 -1.17 112.91 114.64 3d0g h THR 371 Ca 0.02 -0.41 0.04 0.00 0.77 0.00 0.00 66.41 66.84 3d0g h THR 371 Cb 1.08 -0.17 -0.05 0.00 -1.74 0.00 0.00 68.15 67.26 3d0g h THR 371 CO 0.11 0.22 0.51 0.00 0.37 0.00 0.00 175.52 176.72 3d0g h ALA 372 N 1.45 1.07 -0.66 6.16 0.00 -0.67 -0.51 119.26 126.10 3d0g h ALA 372 Ca 0.41 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.25 3d0g h ALA 372 Cb 0.11 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3d0g h ALA 372 CO -0.15 0.31 0.21 0.45 0.00 0.00 0.00 179.25 180.07 3d0g h HIS 373 N 0.98 1.02 0.48 0.00 -0.00 -1.19 0.15 115.15 116.59 3d0g h HIS 373 Ca 0.33 -0.09 -0.02 0.00 -0.00 0.00 0.00 60.37 60.59 3d0g h HIS 373 Cb 0.05 -0.30 0.00 0.00 -0.00 0.00 0.00 27.41 27.16 3d0g h HIS 373 CO -0.03 0.81 -0.23 1.25 -0.00 0.00 0.00 177.93 179.73 3d0g h HIS 374 N 0.96 -0.59 -0.64 2.45 6.17 -1.02 -2.32 115.15 120.16 3d0g h HIS 374 Ca 0.22 -0.01 0.13 0.00 0.71 0.00 0.00 60.37 61.41 3d0g h HIS 374 Cb 0.26 0.20 -0.12 0.00 2.52 0.00 0.00 27.41 30.27 3d0g h HIS 374 CO 0.02 -0.37 -0.08 0.93 0.71 0.00 0.00 177.93 179.13 3d0g h GLU 375 N -0.68 0.05 0.00 5.26 3.07 -0.95 0.11 114.58 121.44 3d0g h GLU 375 Ca -0.07 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.78 3d0g h GLU 375 Cb 0.49 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.39 3d0g h GLU 375 CO 0.11 0.03 -0.03 1.98 -1.40 0.00 0.00 179.01 179.70 3d0g h MET 376 N 0.05 0.00 -0.23 2.33 4.05 -1.03 -1.02 114.93 119.08 3d0g h MET 376 Ca 0.32 0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.79 3d0g h MET 376 Cb 0.52 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.28 3d0g h MET 376 CO -0.61 0.03 -0.02 0.78 0.23 0.00 0.00 176.91 177.32 3d0g h GLY 377 N 1.29 0.20 0.38 1.39 0.00 -0.18 -1.19 103.07 104.96 3d0g h GLY 377 Ca -0.00 0.05 0.03 0.00 0.00 0.00 0.00 47.33 47.40 3d0g h GLY 377 CO 0.00 -0.06 -0.30 0.45 0.00 0.00 0.00 176.54 176.63 3d0g h HIS 378 N 0.04 -0.81 -0.87 5.60 -0.00 -1.08 0.42 115.15 118.45 3d0g h HIS 378 Ca 0.11 0.02 0.14 0.00 -0.00 0.00 0.00 60.37 60.64 3d0g h HIS 378 Cb 0.15 0.35 -0.09 0.00 -0.00 0.00 0.00 27.41 27.82 3d0g h HIS 378 CO -0.21 -0.39 0.47 0.82 -0.00 0.00 0.00 177.93 178.62 3d0g h ILE 379 N -0.46 0.78 -0.68 2.45 1.08 -1.46 0.45 117.51 119.65 3d0g h ILE 379 Ca 0.05 -0.24 -0.04 0.00 -0.39 0.00 0.00 64.86 64.25 3d0g h ILE 379 Cb 0.53 0.02 -0.03 0.00 -3.07 0.00 0.00 36.82 34.28 3d0g h ILE 379 CO -0.23 0.13 0.28 -0.61 -0.69 0.00 0.00 178.15 177.02 3d0g h GLN 380 N 0.69 1.02 0.25 2.37 5.75 0.09 0.13 115.11 125.41 3d0g h GLN 380 Ca 0.46 -0.18 -0.01 0.00 -0.15 0.00 0.00 58.65 58.76 3d0g h GLN 380 Cb 0.60 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 28.99 3d0g h GLN 380 CO -0.33 0.85 -0.12 -0.92 -2.65 0.00 0.00 178.83 175.65 3d0g h TYR 381 N 0.97 -0.31 -0.93 3.99 -0.00 0.10 -1.49 116.97 119.31 3d0g h TYR 381 Ca 0.23 -0.01 0.12 0.00 -0.00 0.00 0.00 58.73 59.07 3d0g h TYR 381 Cb 0.20 0.10 -0.08 0.00 -0.00 0.00 0.00 36.73 36.95 3d0g h TYR 381 CO 0.01 -0.10 0.56 -0.44 -0.00 0.00 0.00 178.16 178.20 3d0g h ASP 382 N -0.47 0.80 -0.19 -2.11 3.32 0.08 -1.57 116.42 116.27 3d0g h ASP 382 Ca -0.03 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 3d0g h ASP 382 Cb 0.35 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 3d0g h ASP 382 CO 0.06 0.42 0.01 0.24 -1.72 0.00 0.00 179.24 178.25 3d0g h MET 383 N 0.88 0.34 -0.76 3.56 2.86 -0.61 -2.86 114.93 118.34 3d0g h MET 383 Ca 0.46 -0.10 0.10 0.00 -2.06 0.00 0.00 59.70 58.10 3d0g h MET 383 Cb 0.47 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 32.03 3d0g h MET 383 CO -0.27 0.52 0.40 0.00 1.06 0.00 0.00 176.91 178.61 3d0g h ALA 384 N 0.80 1.07 -0.54 6.32 0.00 -0.31 -2.64 119.26 123.96 3d0g h ALA 384 Ca 0.06 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3d0g h ALA 384 Cb 0.36 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3d0g h ALA 384 CO 0.01 -0.01 0.00 2.48 0.00 0.00 0.00 179.25 181.73 3d0g n TYR 385 N -4.83 1.18 -0.19 0.00 -0.00 -0.82 -4.45 117.16 108.05 3d0g n TYR 385 Ca 0.12 -0.48 -0.03 0.00 -0.00 0.00 0.00 57.90 57.52 3d0g n TYR 385 Cb 0.29 -0.19 0.07 0.00 -0.00 0.00 0.00 39.34 39.52 3d0g n TYR 385 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 3d0g h ALA 386 N 3.90 0.74 0.00 -3.48 0.00 -1.23 -2.84 119.26 116.35 3d0g h ALA 386 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3d0g h ALA 386 Cb 1.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3d0g h ALA 386 CO 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.36 3d0g n ALA 387 N -2.35 1.76 -1.51 0.00 0.00 -1.26 -4.75 120.51 112.39 3d0g n ALA 387 Ca 0.06 -0.06 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 3d0g n ALA 387 Cb 0.16 -1.23 0.05 0.00 0.00 0.00 0.00 19.45 18.43 3d0g n ALA 387 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3d0g s GLN 388 N -2.69 2.86 0.34 0.00 -1.52 -1.07 -4.98 119.66 112.60 3d0g s GLN 388 Ca 0.12 1.23 -0.25 0.00 -1.95 0.00 0.00 55.36 54.50 3d0g s GLN 388 Cb 0.09 -1.97 -0.13 0.00 -0.22 0.00 0.00 33.01 30.78 3d0g s GLN 388 CO 0.23 -1.18 0.79 -2.30 -0.25 0.00 0.00 175.29 172.57 3d0g n PRO 389 N -2.63 0.91 -0.22 2.91 -0.02 -1.26 -4.79 135.00 129.91 3d0g n PRO 389 Ca 0.09 0.32 -0.09 0.00 -2.02 0.00 0.00 63.50 61.81 3d0g n PRO 389 Cb 0.53 -1.65 -0.04 0.00 -0.02 0.00 0.00 33.50 32.32 3d0g n PRO 389 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3d0g h PHE 390 N 1.38 -1.33 0.00 6.00 3.57 -1.93 0.21 116.94 124.84 3d0g h PHE 390 Ca -0.39 0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.19 3d0g h PHE 390 Cb 1.37 0.66 0.00 0.00 2.79 0.00 0.00 35.95 40.78 3d0g h PHE 390 CO 0.42 -0.42 0.03 1.28 -2.23 0.00 0.00 178.31 177.39 3d0g n LEU 391 N -5.40 0.00 -0.35 0.59 4.77 -1.26 -2.31 117.00 113.05 3d0g n LEU 391 Ca 0.02 0.38 0.03 0.00 -0.03 0.00 0.00 56.01 56.41 3d0g n LEU 391 Cb 0.35 -0.38 0.08 0.00 -2.33 0.00 0.00 43.42 41.13 3d0g n LEU 391 CO -0.02 -0.38 0.53 0.18 -1.33 0.00 0.00 177.39 176.37 3d0g n LEU 392 N -1.37 2.34 -4.45 2.23 4.32 0.73 -4.90 117.00 115.89 3d0g n LEU 392 Ca 0.00 -1.81 -0.43 0.00 -0.02 0.00 0.00 56.01 53.75 3d0g n LEU 392 Cb 0.03 -0.11 -0.04 0.00 -1.62 0.00 0.00 43.42 41.69 3d0g n LEU 392 CO 0.00 0.57 0.79 -0.13 -1.22 0.00 0.00 177.39 177.40 3d0g s ARG 393 N -0.91 3.20 -0.18 3.23 0.52 -0.98 -1.47 118.95 122.36 3d0g s ARG 393 Ca 0.12 -1.01 -0.35 0.00 -0.52 0.00 0.00 55.73 53.97 3d0g s ARG 393 Cb 0.07 -4.37 0.15 0.00 0.52 0.00 0.00 34.95 31.32 3d0g s ARG 393 CO 0.09 -1.81 1.37 1.21 0.02 0.00 0.00 175.30 176.18 3d0g s ASN 394 N 3.70 -0.03 0.84 0.23 3.84 -1.26 -4.93 114.94 117.33 3d0g s ASN 394 Ca 0.24 -0.02 -0.13 0.00 0.21 0.00 0.00 52.86 53.16 3d0g s ASN 394 Cb -0.15 0.05 0.07 0.00 -0.55 0.00 0.00 41.25 40.67 3d0g s ASN 394 CO 0.06 -0.08 0.99 0.61 -2.79 0.00 0.00 177.10 175.88 3d0g n GLY 395 N -0.25 -0.58 0.20 1.21 0.00 -1.26 -1.13 105.19 103.38 3d0g n GLY 395 Ca -0.02 -0.56 -0.06 0.00 0.00 0.00 0.00 46.02 45.38 3d0g n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d0g h ALA 396 N -1.13 0.60 -4.43 4.61 0.00 -1.94 -3.38 119.26 113.59 3d0g h ALA 396 Ca -0.45 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.09 3d0g h ALA 396 Cb 1.30 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.88 3d0g h ALA 396 CO 0.43 -0.05 -0.34 0.27 0.00 0.00 0.00 179.25 179.55 3d0g n ASN 397 N -4.84 0.02 0.29 0.00 0.23 -1.26 -4.62 115.26 105.07 3d0g n ASN 397 Ca 0.03 -2.60 0.19 0.00 -0.53 0.00 0.00 54.58 51.67 3d0g n ASN 397 Cb 0.09 1.07 0.97 0.00 -2.08 0.00 0.00 39.78 39.83 3d0g n ASN 397 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3d0g h GLU 398 N 0.00 0.00 -0.06 -3.83 4.11 -1.88 -0.50 114.58 112.42 3d0g h GLU 398 Ca -0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.24 3d0g h GLU 398 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 3d0g h GLU 398 CO 0.29 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.78 3d0g n GLY 399 N -1.24 0.18 0.08 1.06 0.00 -1.26 -4.49 105.19 99.52 3d0g n GLY 399 Ca -0.01 -0.47 -0.12 0.00 0.00 0.00 0.00 46.02 45.42 3d0g n GLY 399 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3d0g h PHE 400 N 2.57 0.00 -0.06 1.61 -1.00 -1.45 -3.33 116.94 115.29 3d0g h PHE 400 Ca 0.00 0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.81 3d0g h PHE 400 Cb 0.55 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 40.05 3d0g h PHE 400 CO 0.03 0.73 -0.52 0.45 -1.61 0.00 0.00 178.31 177.39 3d0g h HIS 401 N -1.00 -1.52 -0.75 -0.55 3.86 -1.79 -0.26 115.15 113.13 3d0g h HIS 401 Ca -0.14 0.05 0.12 0.00 -1.16 0.00 0.00 60.37 59.24 3d0g h HIS 401 Cb 0.83 0.67 -0.05 0.00 1.06 0.00 0.00 27.41 29.92 3d0g h HIS 401 CO -0.00 -0.55 0.50 0.93 0.86 0.00 0.00 177.93 179.66 3d0g h GLU 402 N -0.62 0.55 -0.56 2.45 4.39 -1.86 -1.47 114.58 117.46 3d0g h GLU 402 Ca 0.03 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3d0g h GLU 402 Cb 0.70 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.20 3d0g h GLU 402 CO -0.39 0.36 0.36 0.00 -1.16 0.00 0.00 179.01 178.19 3d0g h ALA 403 N 1.63 0.72 -0.68 3.43 0.00 -1.18 0.38 119.26 123.56 3d0g h ALA 403 Ca 0.36 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 3d0g h ALA 403 Cb 0.62 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3d0g h ALA 403 CO -0.13 0.17 0.33 0.28 0.00 0.00 0.00 179.25 179.90 3d0g h VAL 404 N 0.76 1.21 0.46 0.00 2.07 -0.56 -2.44 116.25 117.76 3d0g h VAL 404 Ca 0.21 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 3d0g h VAL 404 Cb -0.07 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 3d0g h VAL 404 CO -0.04 0.25 -0.22 1.23 0.02 0.00 0.00 177.57 178.81 3d0g h GLY 405 N 1.02 -0.64 1.02 2.17 0.00 -0.09 -3.20 103.07 103.35 3d0g h GLY 405 Ca 0.24 0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.78 3d0g h GLY 405 CO -0.03 -0.23 0.39 0.83 0.00 0.00 0.00 176.54 177.50 3d0g h GLU 406 N -0.63 1.08 -1.00 4.80 4.39 -0.17 -2.61 114.58 120.44 3d0g h GLU 406 Ca -0.06 -0.14 0.15 0.00 0.34 0.00 0.00 59.36 59.64 3d0g h GLU 406 Cb 0.48 -0.20 -0.16 0.00 -0.10 0.00 0.00 28.75 28.77 3d0g h GLU 406 CO 0.10 0.82 -0.42 -0.89 -1.16 0.00 0.00 179.01 177.46 3d0g n ILE 407 N -4.42 -0.55 -0.28 3.13 2.08 -0.93 -0.92 119.36 117.47 3d0g n ILE 407 Ca 0.07 2.35 -0.05 0.00 0.56 0.00 0.00 62.75 65.67 3d0g n ILE 407 Cb 0.11 -3.07 0.06 0.00 -0.75 0.00 0.00 39.64 35.99 3d0g n ILE 407 CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 3d0g h MET 408 N 0.00 1.08 -0.92 0.38 2.86 -1.46 -1.66 114.93 115.20 3d0g h MET 408 Ca 0.32 -0.14 0.01 0.00 -2.06 0.00 0.00 59.70 57.83 3d0g h MET 408 Cb 0.57 -0.20 -0.05 0.00 0.06 0.00 0.00 31.60 31.98 3d0g h MET 408 CO -0.98 0.82 0.61 1.03 1.06 0.00 0.00 176.91 179.45 3d0g h SER 409 N 1.06 1.06 -0.14 1.22 0.87 -1.03 -2.59 113.55 114.01 3d0g h SER 409 Ca 0.27 -0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.79 3d0g h SER 409 Cb 0.07 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 3d0g h SER 409 CO -0.04 0.77 0.05 -0.07 -0.53 0.00 0.00 176.83 177.00 3d0g h LEU 410 N 1.25 0.20 -0.65 2.23 4.07 -0.10 -2.80 115.31 119.51 3d0g h LEU 410 Ca 0.34 -0.19 -0.15 0.00 0.08 0.00 0.00 57.88 57.96 3d0g h LEU 410 Cb -0.15 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.53 3d0g h LEU 410 CO -0.07 0.33 -0.56 0.28 -1.08 0.00 0.00 178.44 177.34 3d0g h SER 411 N 0.05 0.38 -0.04 -0.43 0.02 -1.39 -3.19 113.55 108.94 3d0g h SER 411 Ca 0.04 -0.20 -0.10 0.00 -0.84 0.00 0.00 61.79 60.69 3d0g h SER 411 Cb 0.20 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 3d0g h SER 411 CO -0.00 0.86 -0.29 0.00 -1.14 0.00 0.00 176.83 176.26 3d0g h ALA 412 N 1.14 1.04 0.00 3.77 0.00 -1.45 -3.13 119.26 120.64 3d0g h ALA 412 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3d0g h ALA 412 Cb 1.07 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3d0g h ALA 412 CO 0.09 0.58 -0.19 0.00 0.00 0.00 0.00 179.25 179.74 3d0g n ALA 413 N -2.49 2.77 -1.77 0.00 0.00 -1.06 -4.14 120.51 113.82 3d0g n ALA 413 Ca -0.01 -0.19 -0.41 0.00 0.00 0.00 0.00 53.44 52.83 3d0g n ALA 413 Cb 0.43 -1.34 -0.00 0.00 0.00 0.00 0.00 19.45 18.54 3d0g n ALA 413 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3d0g n THR 414 N -1.53 1.72 0.23 0.00 -2.24 -1.18 -4.81 114.28 106.46 3d0g n THR 414 Ca 0.06 -0.43 0.15 0.00 -2.27 0.00 0.00 64.05 61.56 3d0g n THR 414 Cb 0.34 -1.98 0.80 0.00 -2.10 0.00 0.00 70.33 67.39 3d0g n THR 414 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3d0g h PRO 415 N 3.49 0.00 -0.47 -0.78 0.11 -1.90 0.17 132.00 132.61 3d0g h PRO 415 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3d0g h PRO 415 Cb 1.24 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 3d0g h PRO 415 CO 0.68 0.00 0.31 -0.22 -0.21 0.00 0.00 178.00 178.57 3d0g h LYS 416 N 0.00 0.63 -0.07 1.05 3.64 -1.88 -2.66 116.57 117.27 3d0g h LYS 416 Ca 0.05 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.33 3d0g h LYS 416 Cb 0.26 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3d0g h LYS 416 CO -0.00 0.42 -0.22 1.25 -2.27 0.00 0.00 179.45 178.63 3d0g h HIS 417 N 0.64 0.35 -0.71 1.91 2.76 -0.96 -2.20 115.15 116.94 3d0g h HIS 417 Ca 0.17 -0.14 0.10 0.00 -2.20 0.00 0.00 60.37 58.30 3d0g h HIS 417 Cb -0.07 -0.06 -0.05 0.00 1.55 0.00 0.00 27.41 28.79 3d0g h HIS 417 CO -0.04 0.84 0.47 -0.07 -1.30 0.00 0.00 177.93 177.83 3d0g h LEU 418 N -0.24 0.52 0.37 0.26 -0.00 -1.47 -0.88 115.31 113.87 3d0g h LEU 418 Ca -0.01 0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.87 3d0g h LEU 418 Cb 0.85 -0.09 -0.00 0.00 -0.00 0.00 0.00 40.66 41.41 3d0g h LEU 418 CO 0.05 0.31 -0.24 0.11 -0.00 0.00 0.00 178.44 178.67 3d0g h LYS 419 N 0.58 -0.55 -0.94 1.13 1.57 -1.33 0.13 116.57 117.15 3d0g h LYS 419 Ca 0.33 0.04 0.23 0.00 -1.87 0.00 0.00 60.65 59.38 3d0g h LYS 419 Cb 0.51 0.12 -0.18 0.00 0.08 0.00 0.00 32.23 32.77 3d0g h LYS 419 CO -0.11 -0.37 -0.08 0.45 -0.57 0.00 0.00 179.45 178.78 3d0g n SER 420 N -3.77 -0.20 0.26 0.86 2.88 -0.84 -0.04 113.62 112.77 3d0g n SER 420 Ca -0.07 1.61 0.12 0.00 -1.33 0.00 0.00 58.87 59.20 3d0g n SER 420 Cb 0.24 -0.55 0.69 0.00 -0.75 0.00 0.00 64.21 63.84 3d0g n SER 420 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 3d0g h ILE 421 N 0.00 0.62 -1.06 2.46 2.04 -1.12 -3.46 117.51 116.99 3d0g h ILE 421 Ca 0.53 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.82 3d0g h ILE 421 Cb 1.00 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 3d0g h ILE 421 CO -0.92 0.13 0.00 0.61 0.00 0.00 0.00 178.15 177.97 3d0g n GLY 422 N -0.69 0.71 0.00 5.37 0.00 0.94 -5.02 105.19 106.50 3d0g n GLY 422 Ca -0.02 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.60 3d0g n GLY 422 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d0g n LEU 423 N -0.53 2.11 -4.78 0.99 4.77 0.31 -5.02 117.00 114.85 3d0g n LEU 423 Ca 0.00 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.60 3d0g n LEU 423 Cb 0.35 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.38 3d0g n LEU 423 CO 0.00 0.35 0.22 -0.22 -1.33 0.00 0.00 177.39 176.41 3d0g s LEU 424 N -4.54 4.42 -0.07 2.23 2.96 -0.35 -4.90 118.68 118.43 3d0g s LEU 424 Ca 0.00 1.05 -0.35 0.00 -0.22 0.00 0.00 54.13 54.61 3d0g s LEU 424 Cb 0.00 -2.79 -0.13 0.00 0.50 0.00 0.00 46.19 43.77 3d0g s LEU 424 CO 0.00 0.16 1.77 -0.24 -1.32 0.00 0.00 176.35 176.71 3d0g n SER 425 N 2.58 3.07 0.00 3.68 2.88 -1.26 -4.47 113.62 120.10 3d0g n SER 425 Ca -0.09 1.02 0.06 0.00 -1.33 0.00 0.00 58.87 58.53 3d0g n SER 425 Cb 0.51 -1.33 0.33 0.00 -0.75 0.00 0.00 64.21 62.97 3d0g n SER 425 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3d0g n PRO 426 N 5.56 0.30 0.03 -1.46 -0.04 -1.26 -2.44 135.00 135.70 3d0g n PRO 426 Ca 0.22 0.06 0.10 0.00 -0.04 0.00 0.00 63.50 63.84 3d0g n PRO 426 Cb 0.26 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.11 3d0g n PRO 426 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3d0g n ASP 427 N -1.09 0.36 -4.64 3.54 8.00 -1.26 -4.93 116.55 116.52 3d0g n ASP 427 Ca 0.08 0.14 -0.42 0.00 0.71 0.00 0.00 54.79 55.29 3d0g n ASP 427 Cb 0.06 1.30 -0.03 0.00 -0.02 0.00 0.00 41.12 42.43 3d0g n ASP 427 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3d0g s PHE 428 N -3.41 1.41 0.20 1.24 2.19 -1.02 -5.00 117.98 113.58 3d0g s PHE 428 Ca -0.05 0.03 0.05 0.00 0.33 0.00 0.00 56.93 57.29 3d0g s PHE 428 Cb 0.12 -4.09 -0.04 0.00 -1.31 0.00 0.00 43.02 37.70 3d0g s PHE 428 CO 0.86 -4.63 0.21 1.14 1.83 0.00 0.00 175.22 174.63 3d0g s GLN 429 N 5.04 3.08 -1.18 10.12 0.00 -1.26 -5.04 119.66 130.42 3d0g s GLN 429 Ca 0.89 -0.86 -0.10 0.00 -0.00 0.00 0.00 55.36 55.28 3d0g s GLN 429 Cb -0.36 -2.71 0.22 0.00 0.00 0.00 0.00 33.01 30.15 3d0g s GLN 429 CO 0.37 0.46 1.45 0.39 0.00 0.00 0.00 175.29 177.96 3d0g n GLU 430 N -0.77 3.63 -2.13 9.60 1.02 -1.26 -5.00 120.64 125.72 3d0g n GLU 430 Ca -0.08 -4.05 -0.33 0.00 -0.02 0.00 0.00 57.16 52.68 3d0g n GLU 430 Cb 0.56 -2.81 0.00 0.00 -0.02 0.00 0.00 31.44 29.17 3d0g n GLU 430 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 3d0g s ASP 431 N 1.36 5.83 0.53 1.62 1.47 -1.26 -4.92 116.67 121.30 3d0g s ASP 431 Ca 0.37 1.88 0.15 0.00 1.18 0.00 0.00 52.55 56.14 3d0g s ASP 431 Cb -0.01 -2.54 0.84 0.00 -0.34 0.00 0.00 42.92 40.86 3d0g s ASP 431 CO -0.00 -1.14 1.41 -0.55 0.68 0.00 0.00 175.17 175.57 3d0g h ASN 432 N 0.67 0.00 0.02 2.11 7.08 -2.01 -3.00 115.58 120.44 3d0g h ASN 432 Ca -0.48 0.00 -0.30 0.00 -3.08 0.00 0.00 56.30 52.45 3d0g h ASN 432 Cb 1.23 0.00 -0.04 0.00 -2.08 0.00 0.00 38.32 37.43 3d0g h ASN 432 CO 0.57 0.00 -1.63 -0.62 -2.08 0.00 0.00 177.43 173.67 3d0g n GLU 433 N -2.44 0.60 0.07 4.14 1.02 -1.26 -3.32 120.64 119.45 3d0g n GLU 433 Ca -0.01 0.47 0.18 0.00 -0.02 0.00 0.00 57.16 57.77 3d0g n GLU 433 Cb 0.54 -1.69 0.70 0.00 -0.02 0.00 0.00 31.44 30.97 3d0g n GLU 433 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3d0g h THR 434 N -0.84 0.73 0.13 2.62 1.35 -1.92 -1.12 112.91 113.87 3d0g h THR 434 Ca -0.43 0.00 -0.29 0.00 -0.55 0.00 0.00 66.41 65.14 3d0g h THR 434 Cb 1.47 0.79 0.02 0.00 -1.73 0.00 0.00 68.15 68.70 3d0g h THR 434 CO -0.21 0.00 -1.24 -0.33 -0.25 0.00 0.00 175.52 173.49 3d0g h GLU 435 N 0.00 0.50 -0.19 4.72 5.08 -1.69 -2.32 114.58 120.68 3d0g h GLU 435 Ca 0.18 -0.71 -0.10 0.00 -1.00 0.00 0.00 59.36 57.74 3d0g h GLU 435 Cb 0.77 0.24 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 3d0g h GLU 435 CO -0.00 1.31 -0.27 0.82 -1.00 0.00 0.00 179.01 179.87 3d0g h ILE 436 N 0.20 1.34 -0.22 3.13 1.08 -1.50 -1.36 117.51 120.18 3d0g h ILE 436 Ca -0.17 -1.47 0.02 0.00 -0.39 0.00 0.00 64.86 62.85 3d0g h ILE 436 Cb 1.93 1.83 -0.04 0.00 -3.07 0.00 0.00 36.82 37.47 3d0g h ILE 436 CO 0.23 0.45 -0.25 0.78 -0.69 0.00 0.00 178.15 178.67 3d0g h ASN 437 N 0.19 -0.85 -0.22 1.72 2.35 -1.24 0.63 115.58 118.16 3d0g h ASN 437 Ca 0.02 0.11 0.06 0.00 -0.55 0.00 0.00 56.30 55.94 3d0g h ASN 437 Cb 0.84 0.35 -0.06 0.00 0.05 0.00 0.00 38.32 39.50 3d0g h ASN 437 CO 0.06 -0.17 -0.21 0.15 -1.65 0.00 0.00 177.43 175.61 3d0g h PHE 438 N -0.15 -0.55 -0.85 1.19 3.57 -1.50 -1.94 116.94 116.71 3d0g h PHE 438 Ca 0.04 0.03 0.16 0.00 3.53 0.00 0.00 57.97 61.73 3d0g h PHE 438 Cb 0.25 0.28 -0.06 0.00 2.79 0.00 0.00 35.95 39.20 3d0g h PHE 438 CO -0.71 -0.29 0.55 -0.07 -2.23 0.00 0.00 178.31 175.57 3d0g h LEU 439 N -0.22 0.52 -0.17 0.59 4.07 -0.88 0.10 115.31 119.32 3d0g h LEU 439 Ca 0.13 0.04 -0.03 0.00 0.08 0.00 0.00 57.88 58.09 3d0g h LEU 439 Cb 0.42 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 3d0g h LEU 439 CO -0.35 0.26 -0.02 0.25 -1.08 0.00 0.00 178.44 177.50 3d0g h LEU 440 N 0.55 0.31 -1.03 1.67 7.12 -0.38 -0.90 115.31 122.66 3d0g h LEU 440 Ca 0.43 -0.34 0.12 0.00 0.13 0.00 0.00 57.88 58.21 3d0g h LEU 440 Cb 0.84 -0.08 -0.08 0.00 -0.53 0.00 0.00 40.66 40.81 3d0g h LEU 440 CO -0.17 0.58 0.63 0.50 -0.13 0.00 0.00 178.44 179.85 3d0g h LYS 441 N 0.04 0.96 -0.36 1.25 3.64 -0.33 0.44 116.57 122.21 3d0g h LYS 441 Ca 0.05 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 3d0g h LYS 441 Cb 0.43 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 3d0g h LYS 441 CO 0.01 0.64 0.02 1.96 -2.27 0.00 0.00 179.45 179.81 3d0g h GLN 442 N 0.99 0.55 0.12 1.90 1.08 -0.51 -3.11 115.11 116.13 3d0g h GLN 442 Ca 0.49 -0.11 -0.27 0.00 -1.45 0.00 0.00 58.65 57.31 3d0g h GLN 442 Cb 0.49 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 3d0g h GLN 442 CO -0.26 0.57 -1.21 0.00 -0.95 0.00 0.00 178.83 176.97 3d0g h ALA 443 N 1.49 0.12 -0.33 3.87 0.00 0.11 0.70 119.26 125.23 3d0g h ALA 443 Ca 0.12 -0.87 0.10 0.00 0.00 0.00 0.00 54.91 54.25 3d0g h ALA 443 Cb 0.32 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3d0g h ALA 443 CO 0.01 0.96 0.32 -0.07 0.00 0.00 0.00 179.25 180.46 3d0g h LEU 444 N 0.09 0.00 0.00 0.00 4.07 -0.67 0.15 115.31 118.94 3d0g h LEU 444 Ca -0.13 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.60 3d0g h LEU 444 Cb 1.94 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 43.64 3d0g h LEU 444 CO 0.20 0.00 -1.67 0.41 -1.08 0.00 0.00 178.44 176.30 3d0g n THR 445 N -3.93 1.10 -0.00 0.22 -1.04 -1.14 0.04 114.28 109.51 3d0g n THR 445 Ca 0.05 -0.13 -0.11 0.00 -2.04 0.00 0.00 64.05 61.82 3d0g n THR 445 Cb 0.48 -1.83 -0.09 0.00 -1.82 0.00 0.00 70.33 67.07 3d0g n THR 445 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3d0g h ILE 446 N -0.65 1.18 -0.06 12.58 2.04 -0.82 -3.11 117.51 128.68 3d0g h ILE 446 Ca -0.35 -1.47 -0.10 0.00 1.00 0.00 0.00 64.86 63.94 3d0g h ILE 446 Cb 1.21 2.06 0.01 0.00 -0.74 0.00 0.00 36.82 39.36 3d0g h ILE 446 CO -0.21 0.33 -0.37 0.58 0.00 0.00 0.00 178.15 178.48 3d0g h VAL 447 N -0.83 1.43 -1.01 1.67 2.07 -1.29 -3.31 116.25 114.98 3d0g h VAL 447 Ca -0.01 -1.80 0.23 0.00 0.82 0.00 0.00 66.70 65.95 3d0g h VAL 447 Cb 0.62 2.37 -0.12 0.00 -1.52 0.00 0.00 31.29 32.65 3d0g h VAL 447 CO 0.02 0.52 0.61 1.23 0.02 0.00 0.00 177.57 179.96 3d0g h GLY 448 N -0.14 1.78 1.72 2.17 0.00 -0.91 -1.90 103.07 105.78 3d0g h GLY 448 Ca -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.99 3d0g h GLY 448 CO 0.08 -0.18 0.00 -0.37 0.00 0.00 0.00 176.54 176.06 3d0g n THR 449 N -4.82 0.00 0.01 4.70 5.66 -1.17 -4.25 114.28 114.41 3d0g n THR 449 Ca 0.26 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 61.08 3d0g n THR 449 Cb 0.72 -0.50 -0.14 0.00 -1.55 0.00 0.00 70.33 68.86 3d0g n THR 449 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 3d0g h LEU 450 N 0.00 0.32 -1.31 1.09 3.38 -1.49 -0.33 115.31 116.96 3d0g h LEU 450 Ca 0.00 -0.94 -0.07 0.00 0.09 0.00 0.00 57.88 56.96 3d0g h LEU 450 Cb 0.36 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3d0g h LEU 450 CO 0.00 1.23 -0.30 -0.65 0.09 0.00 0.00 178.44 178.82 3d0g h PRO 451 N -0.55 0.08 -0.32 1.13 0.11 -1.75 -0.00 132.00 130.69 3d0g h PRO 451 Ca -0.09 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.94 3d0g h PRO 451 Cb 1.38 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.48 3d0g h PRO 451 CO 0.10 0.37 -0.01 0.35 -0.21 0.00 0.00 178.00 178.60 3d0g h PHE 452 N 0.07 0.62 -0.07 0.65 3.04 -1.74 0.22 116.94 119.73 3d0g h PHE 452 Ca 0.01 -0.11 -0.02 0.00 3.98 0.00 0.00 57.97 61.83 3d0g h PHE 452 Cb 0.56 -0.16 -0.00 0.00 2.56 0.00 0.00 35.95 38.91 3d0g h PHE 452 CO 0.00 0.70 -0.02 1.15 -2.02 0.00 0.00 178.31 178.13 3d0g h THR 453 N 0.37 1.30 -0.01 4.41 2.02 -0.83 -1.44 112.91 118.73 3d0g h THR 453 Ca 0.09 -0.95 0.03 0.00 0.77 0.00 0.00 66.41 66.34 3d0g h THR 453 Cb 0.46 1.78 -0.03 0.00 -1.74 0.00 0.00 68.15 68.62 3d0g h THR 453 CO 0.02 0.26 -0.17 0.22 0.37 0.00 0.00 175.52 176.22 3d0g h TYR 454 N -0.20 -0.45 -0.08 3.16 -0.00 -0.95 -2.70 116.97 115.75 3d0g h TYR 454 Ca 0.02 0.02 0.04 0.00 -0.00 0.00 0.00 58.73 58.80 3d0g h TYR 454 Cb 0.43 0.20 -0.06 0.00 -0.00 0.00 0.00 36.73 37.30 3d0g h TYR 454 CO 0.06 -0.25 -0.37 1.98 -0.00 0.00 0.00 178.16 179.57 3d0g h MET 455 N -0.28 -0.47 -0.73 1.82 4.05 -0.90 0.14 114.93 118.57 3d0g h MET 455 Ca 0.06 0.03 0.14 0.00 -0.28 0.00 0.00 59.70 59.65 3d0g h MET 455 Cb 0.35 0.11 -0.14 0.00 -0.80 0.00 0.00 31.60 31.12 3d0g h MET 455 CO -0.17 -0.31 -0.24 1.25 0.23 0.00 0.00 176.91 177.67 3d0g h LEU 456 N -0.48 -0.86 -0.49 3.39 7.12 -1.08 0.59 115.31 123.50 3d0g h LEU 456 Ca 0.07 0.23 -0.17 0.00 0.13 0.00 0.00 57.88 58.14 3d0g h LEU 456 Cb 0.60 0.51 -0.01 0.00 -0.53 0.00 0.00 40.66 41.23 3d0g h LEU 456 CO -0.34 -0.27 -0.70 -0.33 -0.13 0.00 0.00 178.44 176.67 3d0g h GLU 457 N -0.04 0.28 -0.15 1.25 4.39 -1.11 -1.76 114.58 117.45 3d0g h GLU 457 Ca 0.33 -0.22 0.04 0.00 0.34 0.00 0.00 59.36 59.84 3d0g h GLU 457 Cb 0.55 0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 29.21 3d0g h GLU 457 CO -0.76 0.87 -0.11 -0.22 -1.16 0.00 0.00 179.01 177.63 3d0g h LYS 458 N 0.19 -0.12 0.55 2.33 1.63 0.13 0.80 116.57 122.08 3d0g h LYS 458 Ca -0.02 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.77 3d0g h LYS 458 Cb 1.26 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.90 3d0g h LYS 458 CO 0.11 -0.08 -0.46 2.35 -3.45 0.00 0.00 179.45 177.93 3d0g h TRP 459 N -0.12 -1.25 -0.51 1.91 7.01 -0.95 -2.01 115.95 120.04 3d0g h TRP 459 Ca 0.09 0.00 0.10 0.00 2.11 0.00 0.00 58.89 61.19 3d0g h TRP 459 Cb 0.26 0.48 -0.10 0.00 -2.10 0.00 0.00 29.16 27.69 3d0g h TRP 459 CO -0.24 -0.64 -0.30 -0.09 -2.79 0.00 0.00 178.44 174.37 3d0g h ARG 460 N -0.99 -0.17 -0.26 2.65 9.65 -0.78 0.14 114.38 124.61 3d0g h ARG 460 Ca -0.06 0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.88 3d0g h ARG 460 Cb 0.84 0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 29.41 3d0g h ARG 460 CO -0.02 -0.11 -0.08 -1.49 2.80 0.00 0.00 179.97 181.07 3d0g h TRP 461 N -0.18 -0.19 -0.46 2.20 6.55 0.68 -1.92 115.95 122.63 3d0g h TRP 461 Ca 0.22 0.03 -0.06 0.00 0.95 0.00 0.00 58.89 60.02 3d0g h TRP 461 Cb 0.53 0.12 -0.02 0.00 -0.86 0.00 0.00 29.16 28.93 3d0g h TRP 461 CO -0.57 -0.14 0.05 0.52 -1.05 0.00 0.00 178.44 177.25 3d0g h MET 462 N -0.03 0.73 -0.84 0.49 2.86 -0.51 -2.02 114.93 115.61 3d0g h MET 462 Ca 0.13 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 3d0g h MET 462 Cb 0.23 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.75 3d0g h MET 462 CO -0.29 0.71 0.46 0.28 1.06 0.00 0.00 176.91 179.12 3d0g h VAL 463 N 0.69 1.24 0.00 -2.22 2.07 -0.26 -2.08 116.25 115.70 3d0g h VAL 463 Ca 0.15 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 67.05 3d0g h VAL 463 Cb 0.35 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 3d0g h VAL 463 CO 0.01 0.28 0.00 -0.26 0.02 0.00 0.00 177.57 177.61 3d0g h PHE 464 N 1.17 0.00 0.00 1.57 0.04 -0.67 -2.97 116.94 116.09 3d0g h PHE 464 Ca 0.30 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.07 3d0g h PHE 464 Cb 0.03 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.18 3d0g h PHE 464 CO 0.01 0.00 -0.41 1.63 -0.60 0.00 0.00 178.31 178.94 3d0g n LYS 465 N -2.94 0.27 -0.23 1.51 5.02 -0.90 -4.56 118.16 116.33 3d0g n LYS 465 Ca 0.03 0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 3d0g n LYS 465 Cb 0.42 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 3d0g n LYS 465 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d0g n GLY 466 N 1.33 1.00 0.27 0.72 0.00 -1.04 -4.94 105.19 102.53 3d0g n GLY 466 Ca 0.04 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.24 3d0g n GLY 466 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3d0g h GLU 467 N 3.65 0.00 -4.15 1.61 5.08 -1.65 -3.34 114.58 115.79 3d0g h GLU 467 Ca 0.00 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.74 3d0g h GLU 467 Cb 0.00 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.85 3d0g h GLU 467 CO 0.00 0.00 -0.74 0.42 -1.00 0.00 0.00 179.01 177.69 3d0g s ILE 468 N -3.85 1.62 0.57 3.13 1.01 -1.21 -5.00 121.20 117.47 3d0g s ILE 468 Ca -0.02 -1.91 -0.20 0.00 0.00 0.00 0.00 60.65 58.51 3d0g s ILE 468 Cb 0.10 -2.21 -0.05 0.00 0.01 0.00 0.00 42.46 40.31 3d0g s ILE 468 CO 0.39 -0.64 1.13 -2.65 0.00 0.00 0.00 174.94 173.17 3d0g n PRO 469 N 4.52 1.20 -0.33 2.79 -0.02 -1.26 -4.75 135.00 137.16 3d0g n PRO 469 Ca 0.01 0.45 0.08 0.00 -2.02 0.00 0.00 63.50 62.03 3d0g n PRO 469 Cb 0.42 -2.32 0.18 0.00 -0.02 0.00 0.00 33.50 31.76 3d0g n PRO 469 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3d0g n LYS 470 N -1.00 -0.08 0.00 -0.52 5.02 -1.26 -0.75 118.16 119.57 3d0g n LYS 470 Ca 0.13 1.43 0.06 0.00 -2.02 0.00 0.00 58.31 57.90 3d0g n LYS 470 Cb 0.46 -2.17 0.30 0.00 -0.02 0.00 0.00 35.03 33.60 3d0g n LYS 470 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3d0g n ASP 471 N -5.46 0.00 -0.96 4.39 5.68 -1.26 -2.70 116.55 116.24 3d0g n ASP 471 Ca 0.17 0.21 0.05 0.00 -0.50 0.00 0.00 54.79 54.72 3d0g n ASP 471 Cb 0.55 -0.34 0.12 0.00 -1.14 0.00 0.00 41.12 40.30 3d0g n ASP 471 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3d0g n GLN 472 N -1.34 0.82 0.23 0.11 6.02 0.07 -4.86 117.38 118.42 3d0g n GLN 472 Ca 0.05 -2.60 -0.14 0.00 -0.01 0.00 0.00 57.00 54.30 3d0g n GLN 472 Cb 0.11 -0.87 -0.08 0.00 1.02 0.00 0.00 30.24 30.43 3d0g n GLN 472 CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 3d0g h TRP 473 N 0.90 -0.55 -0.12 1.08 4.06 -1.39 -1.39 115.95 118.55 3d0g h TRP 473 Ca -0.10 -0.01 -0.23 0.00 2.06 0.00 0.00 58.89 60.61 3d0g h TRP 473 Cb 1.41 0.18 0.01 0.00 -1.00 0.00 0.00 29.16 29.76 3d0g h TRP 473 CO 0.44 -0.23 -0.81 0.52 -3.56 0.00 0.00 178.44 174.80 3d0g h MET 474 N -0.87 0.74 -1.00 0.49 2.86 -1.88 -1.96 114.93 113.31 3d0g h MET 474 Ca -0.06 -0.63 0.16 0.00 -2.06 0.00 0.00 59.70 57.12 3d0g h MET 474 Cb 0.56 0.14 -0.10 0.00 0.06 0.00 0.00 31.60 32.26 3d0g h MET 474 CO 0.10 1.23 0.61 -0.22 1.06 0.00 0.00 176.91 179.69 3d0g h LYS 475 N 0.49 0.81 0.03 1.72 3.64 -1.82 -1.84 116.57 119.61 3d0g h LYS 475 Ca -0.06 -0.05 -0.26 0.00 -1.27 0.00 0.00 60.65 59.01 3d0g h LYS 475 Cb 1.44 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 3d0g h LYS 475 CO 0.16 0.54 -1.40 -0.22 -2.27 0.00 0.00 179.45 176.26 3d0g h LYS 476 N 0.84 0.06 0.43 1.90 3.11 -1.18 -2.71 116.57 119.03 3d0g h LYS 476 Ca 0.55 -0.10 -0.02 0.00 -2.81 0.00 0.00 60.65 58.27 3d0g h LYS 476 Cb 0.75 0.04 -0.00 0.00 -1.00 0.00 0.00 32.23 32.01 3d0g h LYS 476 CO -0.34 0.83 -0.28 2.35 -2.81 0.00 0.00 179.45 179.20 3d0g h TRP 477 N 0.02 -0.74 -0.50 1.91 2.91 -0.87 -1.42 115.95 117.26 3d0g h TRP 477 Ca -0.17 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.85 3d0g h TRP 477 Cb 1.92 0.27 -0.02 0.00 -0.51 0.00 0.00 29.16 30.81 3d0g h TRP 477 CO 0.02 -0.41 0.33 -1.49 -1.03 0.00 0.00 178.44 175.86 3d0g h TRP 478 N -0.67 0.63 -0.52 2.65 4.06 -1.48 0.25 115.95 120.87 3d0g h TRP 478 Ca -0.06 0.01 0.07 0.00 2.06 0.00 0.00 58.89 60.98 3d0g h TRP 478 Cb 0.54 -0.21 -0.06 0.00 -1.00 0.00 0.00 29.16 28.43 3d0g h TRP 478 CO -0.02 0.40 0.19 1.49 -3.56 0.00 0.00 178.44 176.94 3d0g h GLU 479 N 0.68 0.36 -0.14 0.49 4.81 -1.46 -0.34 114.58 118.99 3d0g h GLU 479 Ca 0.18 -0.02 -0.19 0.00 -0.13 0.00 0.00 59.36 59.20 3d0g h GLU 479 Cb -0.08 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.22 3d0g h GLU 479 CO -0.04 0.24 -0.69 0.52 -0.73 0.00 0.00 179.01 178.31 3d0g h MET 480 N 0.37 0.59 -0.69 1.92 2.86 0.08 -0.34 114.93 119.73 3d0g h MET 480 Ca 0.25 -0.44 -0.00 0.00 -2.06 0.00 0.00 59.70 57.44 3d0g h MET 480 Cb 0.26 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 3d0g h MET 480 CO -0.25 1.07 0.42 0.87 1.06 0.00 0.00 176.91 180.08 3d0g h LYS 481 N 0.42 0.93 0.32 1.72 1.79 -0.33 0.47 116.57 121.89 3d0g h LYS 481 Ca -0.02 -0.07 -0.02 0.00 -2.18 0.00 0.00 60.65 58.35 3d0g h LYS 481 Cb 1.27 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.73 3d0g h LYS 481 CO 0.13 0.65 -0.15 0.00 -1.08 0.00 0.00 179.45 178.99 3d0g h ARG 482 N 0.95 -0.41 0.94 3.15 3.08 -0.79 -1.47 114.38 119.83 3d0g h ARG 482 Ca 0.25 0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.28 3d0g h ARG 482 Cb -0.05 0.09 0.01 0.00 0.08 0.00 0.00 29.97 30.10 3d0g h ARG 482 CO -0.05 -0.08 -0.45 1.49 -1.07 0.00 0.00 179.97 179.80 3d0g h GLU 483 N -0.91 -1.22 -0.05 0.04 4.81 -0.93 -2.89 114.58 113.42 3d0g h GLU 483 Ca -0.04 0.08 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 3d0g h GLU 483 Cb 0.52 0.28 0.00 0.00 0.63 0.00 0.00 28.75 30.18 3d0g h GLU 483 CO 0.07 -0.81 -0.24 0.82 -0.73 0.00 0.00 179.01 178.11 3d0g h ILE 484 N -1.33 1.46 0.00 2.32 1.08 -0.23 -3.40 117.51 117.41 3d0g h ILE 484 Ca -0.13 -1.70 -0.22 0.00 -0.39 0.00 0.00 64.86 62.43 3d0g h ILE 484 Cb 0.97 2.41 -0.04 0.00 -3.07 0.00 0.00 36.82 37.09 3d0g h ILE 484 CO 0.21 0.48 -1.99 0.52 -0.69 0.00 0.00 178.15 176.68 3d0g n VAL 485 N -4.51 0.99 -1.06 1.67 0.31 -0.66 -4.97 118.33 110.10 3d0g n VAL 485 Ca -0.09 -0.72 0.00 0.00 -0.01 0.00 0.00 64.34 63.53 3d0g n VAL 485 Cb 0.46 -0.44 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 3d0g n VAL 485 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3d0g n GLY 486 N 1.52 0.84 3.15 2.92 0.00 -0.65 -4.99 105.19 107.99 3d0g n GLY 486 Ca -0.18 -0.61 -0.21 0.00 0.00 0.00 0.00 46.02 45.01 3d0g n GLY 486 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d0g s VAL 487 N -2.00 1.19 0.06 1.61 1.01 -0.73 -0.56 120.40 120.97 3d0g s VAL 487 Ca 0.00 -0.97 0.05 0.00 0.00 0.00 0.00 61.98 61.06 3d0g s VAL 487 Cb 0.00 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 3d0g s VAL 487 CO 0.00 0.08 -0.14 0.68 0.00 0.00 0.00 175.10 175.71 3d0g s VAL 488 N -0.77 1.13 0.12 2.92 -7.23 -0.31 -2.58 120.40 113.68 3d0g s VAL 488 Ca 0.03 -1.16 -0.31 0.00 -1.81 0.00 0.00 61.98 58.73 3d0g s VAL 488 Cb -0.08 -1.05 -0.09 0.00 0.56 0.00 0.00 36.38 35.72 3d0g s VAL 488 CO 0.01 -0.10 1.57 -1.83 -0.31 0.00 0.00 175.10 174.43 3d0g s GLU 489 N -1.44 4.23 0.43 4.82 1.03 -1.26 0.74 118.70 127.25 3d0g s GLU 489 Ca 0.00 2.30 0.24 0.00 0.03 0.00 0.00 54.97 57.54 3d0g s GLU 489 Cb -0.09 -3.33 0.65 0.00 -0.80 0.00 0.00 34.13 30.56 3d0g s GLU 489 CO 0.02 -0.63 1.71 -1.00 -1.33 0.00 0.00 175.26 174.03 3d0g h PRO 490 N 7.34 0.00 -5.38 -4.83 0.13 -1.95 -3.41 132.00 123.90 3d0g h PRO 490 Ca -0.42 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.22 3d0g h PRO 490 Cb 1.20 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.06 3d0g h PRO 490 CO 0.91 0.17 -0.81 0.08 -0.23 0.00 0.00 178.00 178.13 3d0g s VAL 491 N -3.38 1.17 0.45 1.56 1.01 -1.26 -4.03 120.40 115.93 3d0g s VAL 491 Ca 0.03 -0.76 -0.22 0.00 0.00 0.00 0.00 61.98 61.03 3d0g s VAL 491 Cb 0.08 -1.00 -0.08 0.00 0.00 0.00 0.00 36.38 35.38 3d0g s VAL 491 CO 0.65 0.23 1.09 -2.16 0.00 0.00 0.00 175.10 174.92 3d0g s PRO 492 N -0.61 3.87 -0.16 2.72 0.04 -1.26 -5.06 135.00 134.54 3d0g s PRO 492 Ca 0.05 1.58 0.00 0.00 0.04 0.00 0.00 61.00 62.67 3d0g s PRO 492 Cb -0.06 -2.35 0.03 0.00 0.04 0.00 0.00 34.50 32.16 3d0g s PRO 492 CO 0.00 -0.41 -0.09 -1.01 0.04 0.00 0.00 177.00 175.53 3d0g s HIS 493 N -1.70 1.93 0.70 0.56 3.76 -1.26 -5.14 115.29 114.15 3d0g s HIS 493 Ca 0.63 -1.17 -0.12 0.00 -0.15 0.00 0.00 55.06 54.25 3d0g s HIS 493 Cb -0.23 -1.44 0.16 0.00 1.11 0.00 0.00 32.58 32.18 3d0g s HIS 493 CO 0.28 -0.64 0.88 -0.40 -0.85 0.00 0.00 174.74 174.02 3d0g n ASP 494 N 4.82 -0.23 0.00 1.40 3.85 -1.26 -4.63 116.55 120.50 3d0g n ASP 494 Ca -0.14 -1.27 0.03 0.00 -0.71 0.00 0.00 54.79 52.71 3d0g n ASP 494 Cb 0.48 -0.70 0.19 0.00 -1.35 0.00 0.00 41.12 39.75 3d0g n ASP 494 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3d0g n GLU 495 N -3.07 0.71 0.27 0.11 -0.58 -1.26 -2.30 120.64 114.51 3d0g n GLU 495 Ca 0.11 0.00 0.16 0.00 -0.42 0.00 0.00 57.16 57.02 3d0g n GLU 495 Cb 0.40 -1.14 0.60 0.00 -0.57 0.00 0.00 31.44 30.72 3d0g n GLU 495 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3d0g h THR 496 N 0.00 0.00 -2.52 2.62 1.03 -1.99 -3.46 112.91 108.60 3d0g h THR 496 Ca 0.00 -0.60 -0.45 0.00 -0.01 0.00 0.00 66.41 65.35 3d0g h THR 496 Cb 0.00 1.60 0.06 0.00 -1.07 0.00 0.00 68.15 68.74 3d0g h THR 496 CO 0.00 0.00 0.03 -0.31 -0.01 0.00 0.00 175.52 175.23 3d0g s TYR 497 N -3.59 2.50 -0.43 0.00 2.02 -0.97 -4.24 117.35 112.64 3d0g s TYR 497 Ca 0.02 -0.05 0.08 0.00 -0.37 0.00 0.00 57.07 56.75 3d0g s TYR 497 Cb 0.08 -2.86 0.32 0.00 -0.40 0.00 0.00 41.96 39.11 3d0g s TYR 497 CO 0.57 -1.16 0.96 0.00 -1.57 0.00 0.00 175.55 174.34 3d0g h ASP 499 N 3.08 0.24 -0.75 0.00 3.45 -1.91 -0.92 116.42 119.61 3d0g h ASP 499 Ca -0.03 0.15 0.07 0.00 0.43 0.00 0.00 57.03 57.66 3d0g h ASP 499 Cb 1.04 0.15 -0.06 0.00 -0.56 0.00 0.00 39.33 39.91 3d0g h ASP 499 CO 0.28 -0.01 0.43 1.55 -1.57 0.00 0.00 179.24 179.91 3d0g h PRO 500 N 0.37 0.75 0.00 3.56 0.13 -1.98 -1.19 132.00 133.63 3d0g h PRO 500 Ca 0.53 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.61 3d0g h PRO 500 Cb 0.98 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3d0g h PRO 500 CO -0.53 0.49 0.00 0.00 -0.23 0.00 0.00 178.00 177.73 3d0g n ALA 501 N -2.36 1.81 1.57 -0.56 0.00 -0.35 -2.04 120.51 118.57 3d0g n ALA 501 Ca 0.11 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.49 3d0g n ALA 501 Cb 0.21 -1.22 0.03 0.00 0.00 0.00 0.00 19.45 18.46 3d0g n ALA 501 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3d0g n SER 502 N -1.26 0.58 -4.26 0.00 3.41 -0.45 -3.91 113.62 107.74 3d0g n SER 502 Ca 0.07 -2.02 -0.31 0.00 -0.26 0.00 0.00 58.87 56.35 3d0g n SER 502 Cb 0.10 -0.16 -0.16 0.00 -0.26 0.00 0.00 64.21 63.73 3d0g n SER 502 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3d0g s LEU 503 N -0.79 2.06 0.17 1.04 1.98 -0.87 -5.04 118.68 117.23 3d0g s LEU 503 Ca 0.04 -0.50 -0.19 0.00 -2.89 0.00 0.00 54.13 50.59 3d0g s LEU 503 Cb 0.02 -1.34 0.09 0.00 0.66 0.00 0.00 46.19 45.63 3d0g s LEU 503 CO 0.02 0.24 1.29 0.33 -1.89 0.00 0.00 176.35 176.34 3d0g n PHE 504 N 2.94 -0.14 0.16 5.38 7.35 -1.26 -1.38 117.46 130.51 3d0g n PHE 504 Ca -0.17 1.03 0.03 0.00 -0.76 0.00 0.00 57.45 57.57 3d0g n PHE 504 Cb 0.52 -0.71 0.39 0.00 0.35 0.00 0.00 39.48 40.03 3d0g n PHE 504 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 3d0g h HIS 505 N 0.00 0.12 0.40 -5.13 -0.00 -1.91 -0.09 115.15 108.54 3d0g h HIS 505 Ca 0.22 -0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.56 3d0g h HIS 505 Cb 0.43 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 27.82 3d0g h HIS 505 CO -0.78 0.36 -0.19 0.28 -0.00 0.00 0.00 177.93 177.59 3d0g h VAL 506 N 0.10 0.24 0.00 2.45 2.07 -1.48 -0.08 116.25 119.55 3d0g h VAL 506 Ca 0.02 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3d0g h VAL 506 Cb 0.50 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3d0g h VAL 506 CO 0.04 0.05 0.00 -1.54 0.02 0.00 0.00 177.57 176.14 3d0g n SER 507 N -5.15 0.00 -0.59 0.57 3.41 -1.16 -2.35 113.62 108.35 3d0g n SER 507 Ca -0.08 -0.75 0.06 0.00 -0.26 0.00 0.00 58.87 57.84 3d0g n SER 507 Cb 0.26 -0.06 0.20 0.00 -0.26 0.00 0.00 64.21 64.34 3d0g n SER 507 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3d0g n ASN 508 N -1.06 2.64 -3.62 4.04 3.02 -0.05 -3.91 115.26 116.32 3d0g n ASN 508 Ca 0.20 -3.36 -0.26 0.00 -0.03 0.00 0.00 54.58 51.13 3d0g n ASN 508 Cb 0.13 -0.52 0.04 0.00 -0.61 0.00 0.00 39.78 38.82 3d0g n ASN 508 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3d0g n ASP 509 N -1.08 -5.45 -4.45 6.41 2.03 -0.82 -4.93 116.55 108.25 3d0g n ASP 509 Ca 0.21 -0.59 -0.33 0.00 0.52 0.00 0.00 54.79 54.60 3d0g n ASP 509 Cb 0.79 -4.35 -0.13 0.00 -0.72 0.00 0.00 41.12 36.72 3d0g n ASP 509 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 3d0g s TYR 510 N -3.25 2.91 0.47 -0.67 2.02 -0.11 -5.06 117.35 113.67 3d0g s TYR 510 Ca 0.56 -0.40 -0.22 0.00 -0.37 0.00 0.00 57.07 56.64 3d0g s TYR 510 Cb -0.27 -1.87 -0.10 0.00 -0.40 0.00 0.00 41.96 39.32 3d0g s TYR 510 CO 0.69 -0.06 0.80 -1.13 -1.57 0.00 0.00 175.55 174.28 3d0g n SER 511 N 3.33 0.23 -0.00 2.29 3.41 -1.26 -4.62 113.62 116.99 3d0g n SER 511 Ca -0.18 0.92 0.01 0.00 -0.26 0.00 0.00 58.87 59.36 3d0g n SER 511 Cb 0.53 -1.26 -0.02 0.00 -0.26 0.00 0.00 64.21 63.20 3d0g n SER 511 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3d0g n PHE 512 N -0.97 0.00 0.22 7.33 -0.00 -1.26 -4.64 117.46 118.14 3d0g n PHE 512 Ca 0.11 0.00 0.07 0.00 -0.00 0.00 0.00 57.45 57.63 3d0g n PHE 512 Cb 0.42 -0.02 0.50 0.00 -0.00 0.00 0.00 39.48 40.38 3d0g n PHE 512 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.76 177.73 3d0g h ILE 513 N 0.00 0.98 -1.07 -2.13 6.09 -1.91 -2.92 117.51 116.54 3d0g h ILE 513 Ca 0.00 -0.93 0.35 0.00 -1.37 0.00 0.00 64.86 62.91 3d0g h ILE 513 Cb 0.08 1.53 -0.14 0.00 0.47 0.00 0.00 36.82 38.76 3d0g h ILE 513 CO 0.00 0.25 0.63 0.08 -3.07 0.00 0.00 178.15 176.04 3d0g h ARG 514 N 0.00 0.23 0.00 2.19 -0.00 -1.92 0.39 114.38 115.27 3d0g h ARG 514 Ca -0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 59.98 59.96 3d0g h ARG 514 Cb 0.51 -0.05 -0.00 0.00 -0.00 0.00 0.00 29.97 30.43 3d0g h ARG 514 CO 0.03 0.15 -0.01 1.88 -0.00 0.00 0.00 179.97 182.02 3d0g h TYR 515 N 0.24 0.00 0.00 4.08 0.05 -1.87 -0.59 116.97 118.88 3d0g h TYR 515 Ca 0.76 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 59.51 3d0g h TYR 515 Cb 1.92 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 39.66 3d0g h TYR 515 CO -0.01 0.01 -0.34 -0.92 -1.05 0.00 0.00 178.16 175.86 3d0g h TYR 516 N 0.00 0.00 -0.42 4.88 3.20 -0.44 -3.04 116.97 121.14 3d0g h TYR 516 Ca -0.00 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.89 3d0g h TYR 516 Cb 0.04 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 3d0g h TYR 516 CO 0.00 0.25 0.26 1.79 -1.64 0.00 0.00 178.16 178.82 3d0g h THR 517 N -1.00 1.06 -0.17 1.81 1.35 -1.30 0.30 112.91 114.96 3d0g h THR 517 Ca -0.04 -0.18 0.05 0.00 -0.55 0.00 0.00 66.41 65.69 3d0g h THR 517 Cb 0.44 0.50 -0.07 0.00 -1.73 0.00 0.00 68.15 67.28 3d0g h THR 517 CO -0.02 0.09 -0.41 -0.09 -0.25 0.00 0.00 175.52 174.84 3d0g h ARG 518 N 0.52 -0.44 -0.83 4.72 2.43 -1.25 0.96 114.38 120.49 3d0g h ARG 518 Ca 0.17 0.03 0.19 0.00 -0.81 0.00 0.00 59.98 59.55 3d0g h ARG 518 Cb -0.01 0.10 -0.12 0.00 -0.42 0.00 0.00 29.97 29.53 3d0g h ARG 518 CO -0.07 -0.30 0.30 1.15 -1.51 0.00 0.00 179.97 179.55 3d0g h THR 519 N -0.46 0.51 -0.02 0.20 2.02 -0.85 0.34 112.91 114.65 3d0g h THR 519 Ca 0.09 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 3d0g h THR 519 Cb 0.61 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 67.14 3d0g h THR 519 CO -0.42 0.07 -0.01 -0.07 0.37 0.00 0.00 175.52 175.45 3d0g h LEU 520 N 0.36 0.04 -0.80 2.58 4.07 -1.10 -3.21 115.31 117.26 3d0g h LEU 520 Ca 0.49 -0.45 0.17 0.00 0.08 0.00 0.00 57.88 58.17 3d0g h LEU 520 Cb 0.88 -0.01 -0.15 0.00 1.08 0.00 0.00 40.66 42.46 3d0g h LEU 520 CO -0.51 0.48 -0.15 1.88 -1.08 0.00 0.00 178.44 179.06 3d0g h TYR 521 N -0.39 -0.34 -0.12 1.13 0.05 0.21 -0.17 116.97 117.33 3d0g h TYR 521 Ca 0.00 0.07 -0.04 0.00 0.05 0.00 0.00 58.73 58.82 3d0g h TYR 521 Cb 0.47 0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.47 3d0g h TYR 521 CO 0.08 -0.33 -0.09 -0.56 -1.05 0.00 0.00 178.16 176.21 3d0g h GLN 522 N 0.02 0.19 0.01 4.88 3.07 -0.59 0.26 115.11 122.93 3d0g h GLN 522 Ca 0.40 -0.03 -0.20 0.00 0.09 0.00 0.00 58.65 58.91 3d0g h GLN 522 Cb 0.64 -0.03 -0.03 0.00 0.08 0.00 0.00 27.48 28.14 3d0g h GLN 522 CO -0.80 0.29 -0.92 0.74 0.09 0.00 0.00 178.83 178.23 3d0g h PHE 523 N 0.18 0.04 -0.08 0.06 0.04 -1.08 -1.84 116.94 114.26 3d0g h PHE 523 Ca 0.04 -0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.78 3d0g h PHE 523 Cb 0.28 -0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.42 3d0g h PHE 523 CO 0.00 0.93 0.04 1.96 -0.60 0.00 0.00 178.31 180.64 3d0g h GLN 524 N 0.01 0.11 0.20 1.51 4.20 0.20 -1.47 115.11 119.86 3d0g h GLN 524 Ca -0.02 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 3d0g h GLN 524 Cb 1.62 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.36 3d0g h GLN 524 CO 0.12 0.19 -0.31 0.74 -0.67 0.00 0.00 178.83 178.90 3d0g h PHE 525 N 0.00 -0.89 -0.62 2.96 0.04 -0.62 -2.42 116.94 115.39 3d0g h PHE 525 Ca 0.03 0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.87 3d0g h PHE 525 Cb 0.12 0.36 -0.08 0.00 2.20 0.00 0.00 35.95 38.56 3d0g h PHE 525 CO -0.03 -0.39 -0.38 1.96 -0.60 0.00 0.00 178.31 178.87 3d0g h GLN 526 N -0.54 -0.02 -0.52 1.51 1.08 -1.25 0.27 115.11 115.64 3d0g h GLN 526 Ca -0.02 0.00 0.10 0.00 -1.45 0.00 0.00 58.65 57.28 3d0g h GLN 526 Cb 0.50 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 27.85 3d0g h GLN 526 CO -0.10 -0.01 0.03 1.49 -0.95 0.00 0.00 178.83 179.29 3d0g h GLU 527 N -0.02 0.15 -0.13 1.46 4.81 -1.27 0.37 114.58 119.95 3d0g h GLU 527 Ca 0.10 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.22 3d0g h GLU 527 Cb 0.27 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 3d0g h GLU 527 CO -0.59 0.10 -0.36 0.00 -0.73 0.00 0.00 179.01 177.43 3d0g h ALA 528 N 1.45 1.17 -0.04 2.92 0.00 -0.79 -0.06 119.26 123.91 3d0g h ALA 528 Ca 0.27 -0.38 -0.21 0.00 0.00 0.00 0.00 54.91 54.59 3d0g h ALA 528 Cb 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3d0g h ALA 528 CO -0.41 0.55 -0.86 -0.07 0.00 0.00 0.00 179.25 178.46 3d0g h LEU 529 N 0.22 0.58 -0.56 0.00 4.07 0.82 -1.91 115.31 118.54 3d0g h LEU 529 Ca 0.03 -0.43 -0.16 0.00 0.08 0.00 0.00 57.88 57.40 3d0g h LEU 529 Cb 0.74 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.29 3d0g h LEU 529 CO 0.06 1.21 -0.66 0.00 -1.08 0.00 0.00 178.44 177.97 3d0g h GLN 531 N 0.20 -0.05 0.00 0.00 4.15 -1.01 -1.77 115.11 116.62 3d0g h GLN 531 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 3d0g h GLN 531 Cb 1.19 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.89 3d0g h GLN 531 CO 0.10 0.08 0.22 0.00 -1.93 0.00 0.00 178.83 177.30 3d0g h ALA 532 N 0.79 1.21 -0.27 3.38 0.00 -1.24 -2.14 119.26 120.99 3d0g h ALA 532 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3d0g h ALA 532 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3d0g h ALA 532 CO 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.05 3d0g n ALA 533 N -1.91 2.27 -1.51 0.00 0.00 -0.72 -4.61 120.51 114.03 3d0g n ALA 533 Ca -0.02 -1.33 -0.18 0.00 0.00 0.00 0.00 53.44 51.91 3d0g n ALA 533 Cb 0.27 -0.40 -0.08 0.00 0.00 0.00 0.00 19.45 19.24 3d0g n ALA 533 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3d0g n LYS 534 N 0.15 -1.30 -1.92 0.00 4.76 -0.80 -4.94 118.16 114.11 3d0g n LYS 534 Ca 0.11 1.12 -0.42 0.00 -2.87 0.00 0.00 58.31 56.25 3d0g n LYS 534 Cb 0.47 -5.40 -0.03 0.00 -1.84 0.00 0.00 35.03 28.23 3d0g n LYS 534 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 3d0g s HIS 535 N -2.61 3.05 -0.18 2.13 5.65 -0.95 -4.97 115.29 117.40 3d0g s HIS 535 Ca 0.00 0.61 -0.23 0.00 0.25 0.00 0.00 55.06 55.69 3d0g s HIS 535 Cb 0.00 -3.94 -0.21 0.00 -1.18 0.00 0.00 32.58 27.24 3d0g s HIS 535 CO 0.00 -3.48 0.38 0.93 -0.65 0.00 0.00 174.74 171.92 3d0g h GLU 536 N 6.76 0.01 0.00 2.88 5.08 -1.92 -3.46 114.58 123.93 3d0g h GLU 536 Ca -0.43 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 3d0g h GLU 536 Cb 1.20 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3d0g h GLU 536 CO 0.92 1.01 0.00 0.41 -1.00 0.00 0.00 179.01 180.34 3d0g n GLY 537 N 1.50 -0.92 3.77 -3.84 0.00 -1.26 -4.97 105.19 99.46 3d0g n GLY 537 Ca -0.26 -1.45 -0.40 0.00 0.00 0.00 0.00 46.02 43.92 3d0g n GLY 537 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3d0g s PRO 538 N 0.00 3.71 0.55 1.61 0.02 -1.26 -4.86 135.00 134.77 3d0g s PRO 538 Ca 0.00 2.34 0.21 0.00 0.02 0.00 0.00 61.00 63.57 3d0g s PRO 538 Cb 0.00 -2.65 1.14 0.00 0.02 0.00 0.00 34.50 33.02 3d0g s PRO 538 CO 0.00 -0.77 1.60 1.25 -0.33 0.00 0.00 177.00 178.75 3d0g h LEU 539 N 2.33 0.00 0.00 -5.54 5.85 -1.89 -1.75 115.31 114.31 3d0g h LEU 539 Ca -0.51 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.21 3d0g h LEU 539 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.29 3d0g h LEU 539 CO 0.61 0.00 -0.42 0.00 -0.34 0.00 0.00 178.44 178.29 3d0g n HIS 540 N -2.55 0.29 0.72 1.25 1.44 -1.26 -3.28 115.22 111.83 3d0g n HIS 540 Ca -0.01 0.08 0.12 0.00 -2.01 0.00 0.00 57.72 55.90 3d0g n HIS 540 Cb 0.43 -0.50 0.20 0.00 0.12 0.00 0.00 29.99 30.24 3d0g n HIS 540 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3d0g n LYS 541 N -1.79 2.33 -1.52 -1.40 5.02 -0.66 -4.91 118.16 115.23 3d0g n LYS 541 Ca 0.05 -1.98 -0.36 0.00 -2.02 0.00 0.00 58.31 54.00 3d0g n LYS 541 Cb 0.38 -1.48 0.09 0.00 -0.02 0.00 0.00 35.03 34.00 3d0g n LYS 541 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3d0g s ASP 543 N -1.66 0.02 0.00 0.00 -1.08 -1.26 -4.55 116.67 108.14 3d0g s ASP 543 Ca 0.79 0.57 0.29 0.00 -0.52 0.00 0.00 52.55 53.69 3d0g s ASP 543 Cb -0.34 1.20 1.35 0.00 -1.46 0.00 0.00 42.92 43.67 3d0g s ASP 543 CO 0.44 -0.27 1.95 2.30 0.52 0.00 0.00 175.17 180.11 3d0g n ILE 544 N 5.38 0.00 -1.59 4.11 -5.35 -1.26 -4.88 119.36 115.76 3d0g n ILE 544 Ca -0.06 -0.02 -0.47 0.00 -0.27 0.00 0.00 62.75 61.94 3d0g n ILE 544 Cb 0.50 -0.34 -0.03 0.00 -1.74 0.00 0.00 39.64 38.03 3d0g n ILE 544 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 3d0g n SER 545 N -1.23 1.44 0.00 7.28 2.88 -1.26 -1.40 113.62 121.34 3d0g n SER 545 Ca 0.13 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.82 3d0g n SER 545 Cb 0.27 -1.26 0.00 0.00 -0.75 0.00 0.00 64.21 62.47 3d0g n SER 545 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3d0g n ASN 546 N 1.75 0.00 -4.33 -3.46 5.03 -1.25 -4.98 115.26 108.02 3d0g n ASN 546 Ca 0.13 0.00 -0.47 0.00 0.87 0.00 0.00 54.58 55.11 3d0g n ASN 546 Cb 0.28 -0.73 -0.02 0.00 -1.02 0.00 0.00 39.78 38.29 3d0g n ASN 546 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3d0g s SER 547 N -2.83 6.83 0.22 6.41 0.15 -0.49 -4.84 113.70 119.16 3d0g s SER 547 Ca 0.00 -2.80 -0.09 0.00 0.70 0.00 0.00 55.95 53.77 3d0g s SER 547 Cb 0.00 -2.21 0.20 0.00 -1.71 0.00 0.00 66.02 62.30 3d0g s SER 547 CO 0.00 -0.54 1.89 0.71 1.20 0.00 0.00 173.24 176.50 3d0g h THR 548 N 4.65 1.19 -0.18 6.45 1.35 -1.76 -1.28 112.91 123.33 3d0g h THR 548 Ca 0.12 -0.37 0.05 0.00 -0.55 0.00 0.00 66.41 65.66 3d0g h THR 548 Cb 1.02 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 67.44 3d0g h THR 548 CO 0.78 0.20 0.27 1.05 -0.25 0.00 0.00 175.52 177.57 3d0g h GLU 549 N 1.09 0.00 0.18 4.72 4.11 -1.90 0.80 114.58 123.57 3d0g h GLU 549 Ca 0.31 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.73 3d0g h GLU 549 Cb -0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 3d0g h GLU 549 CO -0.08 0.00 -0.09 0.00 0.07 0.00 0.00 179.01 178.92 3d0g h ALA 550 N 1.63 -0.24 -0.68 1.06 0.00 -1.49 -2.21 119.26 117.34 3d0g h ALA 550 Ca 0.09 -0.22 0.15 0.00 0.00 0.00 0.00 54.91 54.93 3d0g h ALA 550 Cb 0.63 0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.40 3d0g h ALA 550 CO -0.00 -0.38 0.04 0.78 0.00 0.00 0.00 179.25 179.68 3d0g h GLY 551 N -0.75 0.78 0.95 0.00 0.00 -0.83 0.33 103.07 103.54 3d0g h GLY 551 Ca -0.02 0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.39 3d0g h GLY 551 CO 0.04 -0.22 0.33 -1.61 0.00 0.00 0.00 176.54 175.08 3d0g h GLN 552 N 0.14 0.66 -0.45 4.80 5.75 -1.16 1.32 115.11 126.17 3d0g h GLN 552 Ca 0.36 -0.04 -0.07 0.00 -0.15 0.00 0.00 58.65 58.76 3d0g h GLN 552 Cb 0.61 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.99 3d0g h GLN 552 CO -0.56 0.43 -0.01 -0.22 -2.65 0.00 0.00 178.83 175.82 3d0g h LYS 553 N 0.67 0.74 -0.06 1.69 3.64 -0.33 -1.55 116.57 121.38 3d0g h LYS 553 Ca 0.20 -0.20 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 3d0g h LYS 553 Cb -0.04 -0.09 0.01 0.00 -0.41 0.00 0.00 32.23 31.70 3d0g h LYS 553 CO -0.07 0.76 -0.46 1.25 -2.27 0.00 0.00 179.45 178.66 3d0g h LEU 554 N 0.70 0.51 -1.77 5.20 5.85 0.15 -3.30 115.31 122.65 3d0g h LEU 554 Ca 0.14 -0.68 -0.02 0.00 0.84 0.00 0.00 57.88 58.15 3d0g h LEU 554 Cb 0.44 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 3d0g h LEU 554 CO 0.02 1.12 -0.11 0.15 -0.34 0.00 0.00 178.44 179.27 3d0g h PHE 555 N -0.06 0.01 -0.90 1.25 3.04 0.19 0.13 116.94 120.60 3d0g h PHE 555 Ca -0.04 -0.00 0.13 0.00 3.98 0.00 0.00 57.97 62.04 3d0g h PHE 555 Cb 1.14 -0.00 -0.07 0.00 2.56 0.00 0.00 35.95 39.57 3d0g h PHE 555 CO 0.13 0.12 0.58 -0.91 -2.02 0.00 0.00 178.31 176.21 3d0g h ASN 556 N 0.01 0.72 0.27 0.41 4.21 -1.36 -0.36 115.58 119.48 3d0g h ASN 556 Ca 0.00 0.04 -0.11 0.00 1.21 0.00 0.00 56.30 57.44 3d0g h ASN 556 Cb 0.20 -0.10 -0.02 0.00 -1.12 0.00 0.00 38.32 37.28 3d0g h ASN 556 CO 0.01 0.37 -1.83 1.15 -1.29 0.00 0.00 177.43 175.85 3d0g n MET 557 N -4.57 0.65 -0.30 0.81 0.00 -0.64 -4.35 117.12 108.73 3d0g n MET 557 Ca 0.17 -0.04 -0.05 0.00 0.00 0.00 0.00 57.70 57.78 3d0g n MET 557 Cb 0.43 -1.62 0.07 0.00 0.00 0.00 0.00 33.22 32.10 3d0g n MET 557 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 3d0g h LEU 558 N 0.00 1.04 0.00 3.17 5.85 -0.04 -2.42 115.31 122.91 3d0g h LEU 558 Ca -0.14 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.45 3d0g h LEU 558 Cb 1.36 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.13 3d0g h LEU 558 CO 0.01 0.87 0.00 -2.11 -0.34 0.00 0.00 178.44 176.88 3d0g n ARG 559 N -4.36 0.18 0.09 1.25 1.85 -0.21 -3.54 116.66 111.91 3d0g n ARG 559 Ca 0.08 0.12 -0.11 0.00 -1.00 0.00 0.00 57.85 56.93 3d0g n ARG 559 Cb 0.12 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 29.95 3d0g n ARG 559 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 3d0g h LEU 560 N 0.00 0.29 0.00 2.89 3.38 -1.63 -3.41 115.31 116.83 3d0g h LEU 560 Ca 0.00 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3d0g h LEU 560 Cb 0.25 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3d0g h LEU 560 CO 0.00 1.16 0.00 0.61 0.09 0.00 0.00 178.44 180.30 3d0g n GLY 561 N 1.23 1.43 0.00 0.83 0.00 -1.23 -1.57 105.19 105.87 3d0g n GLY 561 Ca -0.05 -0.51 0.03 0.00 0.00 0.00 0.00 46.02 45.49 3d0g n GLY 561 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d0g n LYS 562 N 4.70 0.88 0.36 1.61 4.76 -0.28 -4.07 118.16 126.12 3d0g n LYS 562 Ca 0.00 0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.26 3d0g n LYS 562 Cb 0.00 -1.09 -0.09 0.00 -1.84 0.00 0.00 35.03 32.01 3d0g n LYS 562 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3d0g h SER 563 N 0.00 -1.11 -3.02 4.39 0.87 -1.43 -3.44 113.55 109.81 3d0g h SER 563 Ca 0.00 0.07 -0.62 0.00 -1.23 0.00 0.00 61.79 60.01 3d0g h SER 563 Cb 0.00 0.33 -0.13 0.00 -0.44 0.00 0.00 62.40 62.16 3d0g h SER 563 CO 0.00 -0.65 -0.71 -1.61 -0.53 0.00 0.00 176.83 173.33 3d0g s GLU 564 N -5.97 2.16 0.23 2.24 0.41 -1.26 -4.87 118.70 111.64 3d0g s GLU 564 Ca -0.18 -1.20 -0.31 0.00 -0.41 0.00 0.00 54.97 52.87 3d0g s GLU 564 Cb 0.04 -2.23 -0.15 0.00 -1.78 0.00 0.00 34.13 30.01 3d0g s GLU 564 CO 0.61 0.45 1.12 -2.30 -0.49 0.00 0.00 175.26 174.65 3d0g n PRO 565 N 0.06 1.31 -0.12 0.39 -0.02 -1.26 -4.64 135.00 130.72 3d0g n PRO 565 Ca -0.11 0.46 0.26 0.00 -2.02 0.00 0.00 63.50 62.10 3d0g n PRO 565 Cb 0.55 -1.92 0.72 0.00 -0.02 0.00 0.00 33.50 32.83 3d0g n PRO 565 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 3d0g h TRP 566 N 2.89 0.00 -0.09 6.00 5.08 -1.92 0.89 115.95 128.79 3d0g h TRP 566 Ca -0.42 0.00 0.02 0.00 1.08 0.00 0.00 58.89 59.57 3d0g h TRP 566 Cb 1.34 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.48 3d0g h TRP 566 CO 0.52 0.00 -0.04 1.79 -1.28 0.00 0.00 178.44 179.42 3d0g h THR 567 N 0.00 0.86 -0.43 0.12 1.35 -1.84 0.34 112.91 113.31 3d0g h THR 567 Ca 0.37 0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 66.12 3d0g h THR 567 Cb 1.52 0.86 -0.01 0.00 -1.73 0.00 0.00 68.15 68.79 3d0g h THR 567 CO -0.00 0.00 -0.16 0.25 -0.25 0.00 0.00 175.52 175.35 3d0g h LEU 568 N -0.03 0.88 -0.92 3.87 5.85 -1.19 -1.25 115.31 122.52 3d0g h LEU 568 Ca 0.05 -0.39 0.14 0.00 0.84 0.00 0.00 57.88 58.52 3d0g h LEU 568 Cb 0.11 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 40.81 3d0g h LEU 568 CO -0.11 1.07 0.54 0.00 -0.34 0.00 0.00 178.44 179.60 3d0g h ALA 569 N 0.84 1.41 -0.06 1.25 0.00 -0.99 0.23 119.26 121.94 3d0g h ALA 569 Ca 0.10 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3d0g h ALA 569 Cb 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3d0g h ALA 569 CO 0.05 0.06 -0.14 1.25 0.00 0.00 0.00 179.25 180.47 3d0g h LEU 570 N 0.80 0.22 -2.10 0.00 5.85 -0.10 -3.14 115.31 116.85 3d0g h LEU 570 Ca 0.48 -0.59 0.08 0.00 0.84 0.00 0.00 57.88 58.70 3d0g h LEU 570 Cb 0.59 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 3d0g h LEU 570 CO -0.31 0.77 0.24 -0.08 -0.34 0.00 0.00 178.44 178.71 3d0g h GLU 571 N -0.31 0.00 -0.23 1.25 4.81 -0.77 0.23 114.58 119.55 3d0g h GLU 571 Ca -0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 3d0g h GLU 571 Cb 0.74 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 3d0g h GLU 571 CO 0.03 0.00 0.05 -0.91 -0.73 0.00 0.00 179.01 177.45 3d0g h ASN 572 N 0.00 0.30 0.00 1.04 4.21 -0.91 -1.13 115.58 119.09 3d0g h ASN 572 Ca 0.13 -0.03 -0.32 0.00 1.21 0.00 0.00 56.30 57.29 3d0g h ASN 572 Cb 0.60 -0.08 -0.05 0.00 -1.12 0.00 0.00 38.32 37.67 3d0g h ASN 572 CO -0.00 0.32 -2.16 1.33 -1.29 0.00 0.00 177.43 175.63 3d0g n VAL 573 N -4.39 1.15 -0.03 2.81 0.24 -0.02 -4.72 118.33 113.37 3d0g n VAL 573 Ca 0.00 -0.39 -0.16 0.00 -2.04 0.00 0.00 64.34 61.76 3d0g n VAL 573 Cb 0.16 -1.42 -0.14 0.00 -1.47 0.00 0.00 33.84 30.97 3d0g n VAL 573 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 3d0g n VAL 574 N -3.41 1.67 -0.41 3.34 0.24 0.62 -4.75 118.33 115.63 3d0g n VAL 574 Ca -0.38 -0.71 0.00 0.00 -2.04 0.00 0.00 64.34 61.21 3d0g n VAL 574 Cb 0.85 -1.38 0.00 0.00 -1.47 0.00 0.00 33.84 31.84 3d0g n VAL 574 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3d0g n GLY 575 N 1.86 0.75 2.99 7.63 0.00 -0.43 -4.97 105.19 113.02 3d0g n GLY 575 Ca -0.28 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.19 3d0g n GLY 575 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d0g s ALA 576 N -2.00 -0.03 -2.09 4.61 0.00 -1.26 -4.96 121.76 116.02 3d0g s ALA 576 Ca 0.00 -0.32 0.26 0.00 0.00 0.00 0.00 51.96 51.90 3d0g s ALA 576 Cb 0.00 0.09 1.40 0.00 0.00 0.00 0.00 23.12 24.61 3d0g s ALA 576 CO 0.00 -0.14 1.92 1.63 0.00 0.00 0.00 175.76 179.17 3d0g n LYS 577 N 1.91 1.16 -4.18 0.00 5.02 -1.26 -2.75 118.16 118.07 3d0g n LYS 577 Ca -0.21 -0.24 -0.11 0.00 -2.02 0.00 0.00 58.31 55.74 3d0g n LYS 577 Cb 0.56 -1.41 -0.10 0.00 -0.02 0.00 0.00 35.03 34.06 3d0g n LYS 577 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3d0g s ASN 578 N -1.81 0.54 -0.10 4.39 3.84 -1.26 -4.72 114.94 115.82 3d0g s ASN 578 Ca 0.38 -1.21 -0.29 0.00 0.21 0.00 0.00 52.86 51.94 3d0g s ASN 578 Cb 0.18 0.25 -0.05 0.00 -0.55 0.00 0.00 41.25 41.08 3d0g s ASN 578 CO 0.30 -0.70 1.73 -0.32 -2.79 0.00 0.00 177.10 175.32 3d0g s MET 579 N -4.02 4.00 -0.11 0.43 -2.45 -1.26 -5.01 119.30 110.88 3d0g s MET 579 Ca 0.25 2.10 0.03 0.00 -1.25 0.00 0.00 55.69 56.82 3d0g s MET 579 Cb 0.07 -4.05 -0.00 0.00 1.25 0.00 0.00 34.83 32.10 3d0g s MET 579 CO 0.03 -1.07 -0.23 1.21 1.05 0.00 0.00 175.02 176.01 3d0g s ASN 580 N 4.10 3.19 0.00 1.11 3.04 -1.26 -5.01 114.94 120.11 3d0g s ASN 580 Ca 0.77 -0.54 0.29 0.00 0.04 0.00 0.00 52.86 53.42 3d0g s ASN 580 Cb -0.32 -1.44 1.31 0.00 -1.54 0.00 0.00 41.25 39.26 3d0g s ASN 580 CO 0.31 0.15 1.95 0.55 -3.04 0.00 0.00 177.10 177.03 3d0g n VAL 581 N 3.56 0.00 -0.08 -5.21 3.14 -1.26 -4.20 118.33 114.28 3d0g n VAL 581 Ca -0.19 -0.00 -0.10 0.00 -2.96 0.00 0.00 64.34 61.09 3d0g n VAL 581 Cb 0.53 -0.47 -0.03 0.00 -1.06 0.00 0.00 33.84 32.81 3d0g n VAL 581 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 3d0g h ARG 582 N 0.01 0.40 -0.80 1.45 2.43 -1.96 -2.07 114.38 113.84 3d0g h ARG 582 Ca 0.00 -0.07 0.09 0.00 -0.81 0.00 0.00 59.98 59.19 3d0g h ARG 582 Cb 0.43 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 3d0g h ARG 582 CO 0.00 0.41 0.52 -1.35 -1.51 0.00 0.00 179.97 178.05 3d0g h PRO 583 N 0.30 0.74 -0.20 0.20 0.11 -1.89 -1.81 132.00 129.45 3d0g h PRO 583 Ca 0.09 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.18 3d0g h PRO 583 Cb 0.15 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 3d0g h PRO 583 CO -0.01 0.49 0.05 1.25 -0.21 0.00 0.00 178.00 179.58 3d0g h LEU 584 N 0.76 0.05 -0.08 2.35 5.85 -1.64 -2.15 115.31 120.44 3d0g h LEU 584 Ca 0.37 0.02 0.02 0.00 0.84 0.00 0.00 57.88 59.13 3d0g h LEU 584 Cb 0.41 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 3d0g h LEU 584 CO -0.14 0.06 -0.02 -0.07 -0.34 0.00 0.00 178.44 177.92 3d0g h LEU 585 N 0.14 -0.08 -0.84 2.25 -0.00 -1.16 -2.98 115.31 112.64 3d0g h LEU 585 Ca 0.09 0.03 0.21 0.00 -0.00 0.00 0.00 57.88 58.20 3d0g h LEU 585 Cb 0.07 0.06 -0.13 0.00 -0.00 0.00 0.00 40.66 40.65 3d0g h LEU 585 CO -0.10 -0.03 0.25 0.78 -0.00 0.00 0.00 178.44 179.34 3d0g h ASN 586 N -0.00 0.08 -0.28 -0.43 -0.26 -0.97 0.98 115.58 114.70 3d0g h ASN 586 Ca 0.04 0.17 0.03 0.00 -0.56 0.00 0.00 56.30 55.99 3d0g h ASN 586 Cb 0.07 0.21 -0.03 0.00 -1.06 0.00 0.00 38.32 37.51 3d0g h ASN 586 CO -0.09 -0.08 0.09 0.22 -1.06 0.00 0.00 177.43 176.51 3d0g h TYR 587 N 0.27 0.15 -0.40 1.19 3.20 -1.24 -2.72 116.97 117.43 3d0g h TYR 587 Ca 0.51 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.40 3d0g h TYR 587 Cb 0.97 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.22 3d0g h TYR 587 CO -0.24 0.06 0.00 1.19 -1.64 0.00 0.00 178.16 177.54 3d0g n PHE 588 N -5.04 0.94 -0.33 -3.82 3.01 0.14 -4.52 117.46 107.84 3d0g n PHE 588 Ca -0.01 -0.37 -0.03 0.00 1.01 0.00 0.00 57.45 58.05 3d0g n PHE 588 Cb 0.10 -0.18 0.09 0.00 -0.01 0.00 0.00 39.48 39.48 3d0g n PHE 588 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 3d0g h GLU 589 N 2.54 1.20 0.00 -1.08 4.39 -0.69 -0.47 114.58 120.48 3d0g h GLU 589 Ca 0.00 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.58 3d0g h GLU 589 Cb 1.01 -0.26 -0.00 0.00 -0.10 0.00 0.00 28.75 29.40 3d0g h GLU 589 CO 0.15 0.83 -0.09 -1.35 -1.16 0.00 0.00 179.01 177.40 3d0g h PRO 590 N 1.22 0.00 0.10 2.33 0.11 -1.82 -2.94 132.00 131.00 3d0g h PRO 590 Ca 0.32 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 66.14 3d0g h PRO 590 Cb -0.07 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.06 3d0g h PRO 590 CO -0.06 0.09 -1.20 1.25 -0.21 0.00 0.00 178.00 177.86 3d0g h LEU 591 N 0.00 0.89 -1.61 2.35 5.85 -1.82 -3.23 115.31 117.74 3d0g h LEU 591 Ca -0.00 -0.81 0.08 0.00 0.84 0.00 0.00 57.88 57.99 3d0g h LEU 591 Cb 0.82 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 3d0g h LEU 591 CO 0.01 1.60 0.38 0.15 -0.34 0.00 0.00 178.44 180.25 3d0g h PHE 592 N 0.29 0.47 0.09 1.25 3.57 -0.94 -0.04 116.94 121.64 3d0g h PHE 592 Ca -0.18 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.33 3d0g h PHE 592 Cb 1.87 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.46 3d0g h PHE 592 CO 0.11 0.24 -0.04 1.79 -2.23 0.00 0.00 178.31 178.18 3d0g h THR 593 N 0.46 1.08 -0.56 4.41 1.35 -1.62 -2.40 112.91 115.63 3d0g h THR 593 Ca 0.26 -1.37 0.10 0.00 -0.55 0.00 0.00 66.41 64.85 3d0g h THR 593 Cb 0.42 1.86 -0.11 0.00 -1.73 0.00 0.00 68.15 68.59 3d0g h THR 593 CO -0.07 0.30 -0.32 -0.25 -0.25 0.00 0.00 175.52 174.93 3d0g h TRP 594 N -0.83 -0.86 -0.44 4.73 7.01 -1.50 -1.81 115.95 122.24 3d0g h TRP 594 Ca -0.01 0.07 0.08 0.00 2.11 0.00 0.00 58.89 61.14 3d0g h TRP 594 Cb 0.58 0.46 -0.10 0.00 -2.10 0.00 0.00 29.16 28.01 3d0g h TRP 594 CO 0.12 -0.37 -0.35 -0.07 -2.79 0.00 0.00 178.44 174.97 3d0g h LEU 595 N -0.16 -1.19 -1.65 0.65 4.07 -1.05 0.62 115.31 116.60 3d0g h LEU 595 Ca 0.23 0.21 0.09 0.00 0.08 0.00 0.00 57.88 58.48 3d0g h LEU 595 Cb 0.54 0.55 -0.03 0.00 1.08 0.00 0.00 40.66 42.80 3d0g h LEU 595 CO -0.65 -0.33 0.38 0.11 -1.08 0.00 0.00 178.44 176.87 3d0g h LYS 596 N -0.25 0.39 0.13 1.13 1.57 -0.81 0.76 116.57 119.48 3d0g h LYS 596 Ca 0.17 -0.02 -0.25 0.00 -1.87 0.00 0.00 60.65 58.68 3d0g h LYS 596 Cb 0.55 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.78 3d0g h LYS 596 CO -0.58 0.26 -1.25 0.22 -0.57 0.00 0.00 179.45 177.53 3d0g h ASP 597 N 0.40 0.42 -0.20 0.86 1.82 -0.74 -3.18 116.42 115.80 3d0g h ASP 597 Ca 0.26 -0.88 0.06 0.00 -0.39 0.00 0.00 57.03 56.07 3d0g h ASP 597 Cb 0.49 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.35 3d0g h ASP 597 CO -0.07 1.56 0.16 1.56 -1.61 0.00 0.00 179.24 180.84 3d0g h GLN 598 N -0.32 0.00 -0.45 0.28 1.08 0.77 -0.78 115.11 115.69 3d0g h GLN 598 Ca -0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.94 3d0g h GLN 598 Cb 1.74 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.17 3d0g h GLN 598 CO 0.09 0.00 0.00 0.09 -0.95 0.00 0.00 178.83 178.06 3d0g n ASN 599 N -4.20 2.69 -0.26 1.46 5.03 0.21 -4.56 115.26 115.62 3d0g n ASN 599 Ca 0.02 -1.95 0.06 0.00 0.87 0.00 0.00 54.58 53.58 3d0g n ASN 599 Cb 0.30 -0.30 0.14 0.00 -1.02 0.00 0.00 39.78 38.90 3d0g n ASN 599 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 3d0g n LYS 600 N 0.97 -0.06 -0.19 3.52 3.00 -0.30 -0.75 118.16 124.35 3d0g n LYS 600 Ca 0.17 1.15 0.09 0.00 -0.00 0.00 0.00 58.31 59.72 3d0g n LYS 600 Cb 0.44 -1.74 0.17 0.00 0.00 0.00 0.00 35.03 33.90 3d0g n LYS 600 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3d0g n ASN 601 N -5.16 2.73 -4.87 3.14 3.02 -1.26 -5.01 115.26 107.84 3d0g n ASN 601 Ca 0.13 -3.11 -0.30 0.00 -0.03 0.00 0.00 54.58 51.28 3d0g n ASN 601 Cb 0.43 -0.47 -0.05 0.00 -0.61 0.00 0.00 39.78 39.08 3d0g n ASN 601 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3d0g s SER 602 N -2.64 6.03 0.26 6.41 0.01 0.07 -5.09 113.70 118.74 3d0g s SER 602 Ca 0.35 0.13 -0.30 0.00 1.31 0.00 0.00 55.95 57.45 3d0g s SER 602 Cb 0.30 -1.76 -0.09 0.00 0.21 0.00 0.00 66.02 64.68 3d0g s SER 602 CO 0.04 0.14 1.18 0.12 0.41 0.00 0.00 173.24 175.13 3d0g s PHE 603 N -1.53 3.42 -0.22 2.43 2.19 -1.26 -4.95 117.98 118.05 3d0g s PHE 603 Ca 0.33 1.54 0.02 0.00 0.33 0.00 0.00 56.93 59.15 3d0g s PHE 603 Cb -0.12 -3.41 0.05 0.00 -1.31 0.00 0.00 43.02 38.22 3d0g s PHE 603 CO 0.26 -1.04 -0.12 0.08 1.83 0.00 0.00 175.22 176.22 3d0g s VAL 604 N -0.76 1.93 -0.61 3.12 1.01 -1.26 -4.76 120.40 119.07 3d0g s VAL 604 Ca 0.48 -1.27 0.00 0.00 0.00 0.00 0.00 61.98 61.19 3d0g s VAL 604 Cb -0.34 -1.98 0.00 0.00 0.00 0.00 0.00 36.38 34.06 3d0g s VAL 604 CO 0.42 0.13 0.00 0.61 0.00 0.00 0.00 175.10 176.26 3d0g n GLY 605 N 4.57 0.74 3.17 4.51 0.00 -1.26 -5.06 105.19 111.86 3d0g n GLY 605 Ca -0.15 -2.28 -0.09 0.00 0.00 0.00 0.00 46.02 43.50 3d0g n GLY 605 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3d0g s TRP 606 N -0.80 0.22 -0.13 1.61 -2.14 -1.26 -4.75 118.94 111.69 3d0g s TRP 606 Ca 0.00 -0.66 -0.19 0.00 2.66 0.00 0.00 56.10 57.92 3d0g s TRP 606 Cb 0.00 -0.13 -0.04 0.00 -3.10 0.00 0.00 33.47 30.20 3d0g s TRP 606 CO 0.00 -0.49 0.50 0.45 -2.66 0.00 0.00 176.95 174.75 3d0g s SER 607 N -2.79 6.68 0.00 -2.66 0.15 -0.06 -4.95 113.70 110.07 3d0g s SER 607 Ca 0.04 0.82 0.22 0.00 0.70 0.00 0.00 55.95 57.72 3d0g s SER 607 Cb 0.05 -2.30 1.06 0.00 -1.71 0.00 0.00 66.02 63.12 3d0g s SER 607 CO -0.10 -0.04 1.69 0.35 1.20 0.00 0.00 173.24 176.34 3d0g n THR 608 N 3.84 0.37 -0.03 6.45 -2.24 -1.26 -3.91 114.28 117.49 3d0g n THR 608 Ca -0.06 0.09 -0.17 0.00 -2.27 0.00 0.00 64.05 61.64 3d0g n THR 608 Cb 0.51 -0.73 -0.14 0.00 -2.10 0.00 0.00 70.33 67.87 3d0g n THR 608 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3d0g n ASP 609 N -1.33 1.64 -4.73 3.42 10.43 -1.26 -4.92 116.55 119.81 3d0g n ASP 609 Ca 0.09 0.17 -0.42 0.00 2.57 0.00 0.00 54.79 57.21 3d0g n ASP 609 Cb 0.19 -0.45 -0.03 0.00 1.84 0.00 0.00 41.12 42.67 3d0g n ASP 609 CO 0.00 0.00 0.00 0.86 -1.07 0.00 0.00 177.20 176.99 3d0g s TRP 610 N -2.55 3.25 0.17 1.24 -0.00 -1.26 -5.05 118.94 114.74 3d0g s TRP 610 Ca -0.20 1.13 0.05 0.00 -0.00 0.00 0.00 56.10 57.08 3d0g s TRP 610 Cb 0.07 -3.63 -0.05 0.00 -0.00 0.00 0.00 33.47 29.86 3d0g s TRP 610 CO 0.76 -2.07 -0.11 -1.54 -0.00 0.00 0.00 176.95 173.99 3d0g s SER 611 N 0.61 2.04 0.31 5.86 1.04 -1.26 -4.60 113.70 117.69 3d0g s SER 611 Ca 0.59 -1.03 0.15 0.00 0.48 0.00 0.00 55.95 56.15 3d0g s SER 611 Cb -0.37 -0.05 0.40 0.00 0.10 0.00 0.00 66.02 66.11 3d0g s SER 611 CO 0.36 -0.30 1.60 1.55 0.98 0.00 0.00 173.24 177.43 3d0g h PRO 612 N 2.69 0.00 0.00 4.02 0.13 -1.86 -2.88 132.00 134.10 3d0g h PRO 612 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3d0g h PRO 612 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3d0g h PRO 612 CO 0.63 0.51 -0.37 0.10 -0.23 0.00 0.00 178.00 178.63 3d0g h TYR 613 N 0.00 0.00 0.00 1.56 -0.00 -1.86 -3.49 116.97 113.18 3d0g h TYR 613 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.72 3d0g h TYR 613 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.86 3d0g h TYR 613 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 178.16 178.16 3d0g n ALA 614 N -2.00 0.00 -0.74 0.10 0.00 -1.09 -5.13 120.51 111.65 3d0g n ALA 614 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3d0g n ALA 614 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 3d0g n ALA 614 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25