#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gwp s LEU 2 N 0.00 2.44 0.31 0.99 1.43 -1.26 -5.17 118.68 117.42 3gwp s LEU 2 Ca 0.00 -0.87 0.02 0.00 -1.03 0.00 0.00 54.13 52.25 3gwp s LEU 2 Cb 0.00 -1.16 0.52 0.00 0.03 0.00 0.00 46.19 45.58 3gwp s LEU 2 CO 0.00 0.11 1.84 1.05 0.23 0.00 0.00 176.35 179.59 3gwp h GLU 3 N 3.19 0.61 0.00 1.70 -0.00 -2.05 -2.53 114.58 115.50 3gwp h GLU 3 Ca -0.46 -0.14 -0.05 0.00 -0.00 0.00 0.00 59.36 58.71 3gwp h GLU 3 Cb 1.21 -0.08 -0.01 0.00 -0.00 0.00 0.00 28.75 29.87 3gwp h GLU 3 CO 0.48 0.63 -0.25 0.66 -0.00 0.00 0.00 179.01 180.53 3gwp h SER 4 N 0.58 0.00 0.14 3.06 4.64 -2.03 -2.71 113.55 117.23 3gwp h SER 4 Ca 0.12 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 3gwp h SER 4 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 3gwp h SER 4 CO 0.01 0.25 -0.07 0.74 -0.87 0.00 0.00 176.83 176.89 3gwp h THR 5 N 0.00 0.91 0.00 2.95 2.02 -1.89 -2.48 112.91 114.42 3gwp h THR 5 Ca -0.00 -1.18 -0.01 0.00 0.77 0.00 0.00 66.41 65.98 3gwp h THR 5 Cb 0.78 1.53 -0.00 0.00 -1.74 0.00 0.00 68.15 68.72 3gwp h THR 5 CO 0.03 0.24 -0.06 0.07 0.37 0.00 0.00 175.52 176.17 3gwp h LYS 6 N -0.85 0.00 -0.10 6.66 2.10 -1.58 0.55 116.57 123.36 3gwp h LYS 6 Ca -0.02 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.40 3gwp h LYS 6 Cb 0.54 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.88 3gwp h LYS 6 CO 0.03 0.06 -0.85 0.37 -2.00 0.00 0.00 179.45 177.07 3gwp h GLN 7 N 0.00 0.71 -0.27 0.07 5.75 -1.54 -2.92 115.11 116.91 3gwp h GLN 7 Ca -0.00 -0.63 -0.04 0.00 -0.15 0.00 0.00 58.65 57.84 3gwp h GLN 7 Cb 0.37 0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.05 3gwp h GLN 7 CO 0.01 1.23 0.02 0.35 -2.65 0.00 0.00 178.83 177.79 3gwp h PHE 8 N 0.46 0.49 -0.11 3.99 3.04 -0.84 -3.04 116.94 120.92 3gwp h PHE 8 Ca -0.07 -0.08 0.03 0.00 3.98 0.00 0.00 57.97 61.84 3gwp h PHE 8 Cb 1.48 -0.13 -0.00 0.00 2.56 0.00 0.00 35.95 39.85 3gwp h PHE 8 CO 0.08 0.58 0.10 -0.07 -2.02 0.00 0.00 178.31 176.99 3gwp h LEU 9 N 0.25 0.00 -2.36 0.59 3.38 -0.94 -1.09 115.31 115.14 3gwp h LEU 9 Ca 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3gwp h LEU 9 Cb 0.37 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3gwp h LEU 9 CO 0.01 0.00 -0.02 0.11 0.09 0.00 0.00 178.44 178.63 3gwp h LYS 10 N 0.00 0.00 0.00 1.13 6.56 -1.39 -0.47 116.57 122.40 3gwp h LYS 10 Ca 0.05 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.63 3gwp h LYS 10 Cb 0.25 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.90 3gwp h LYS 10 CO -0.00 0.02 -0.05 0.87 -2.06 0.00 0.00 179.45 178.23 3gwp h LYS 11 N 0.00 0.00 -0.69 3.15 6.56 -1.33 -1.31 116.57 122.96 3gwp h LYS 11 Ca -0.00 0.00 -0.09 0.00 -1.06 0.00 0.00 60.65 59.50 3gwp h LYS 11 Cb 0.04 0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 31.65 3gwp h LYS 11 CO 0.00 0.05 0.12 0.66 -2.06 0.00 0.00 179.45 178.22 3gwp n TYR 12 N -3.55 2.13 -2.84 -1.35 4.02 -0.19 -4.93 117.16 110.45 3gwp n TYR 12 Ca -0.02 -0.89 -0.22 0.00 -0.01 0.00 0.00 57.90 56.76 3gwp n TYR 12 Cb 0.16 -0.57 0.02 0.00 -0.02 0.00 0.00 39.34 38.93 3gwp n TYR 12 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3gwp n ASN 13 N 0.27 -5.87 -4.63 7.72 3.02 -0.49 -4.89 115.26 110.39 3gwp n ASN 13 Ca 0.32 -0.20 -0.42 0.00 -0.03 0.00 0.00 54.58 54.25 3gwp n ASN 13 Cb 1.23 -4.80 -0.04 0.00 -0.61 0.00 0.00 39.78 35.56 3gwp n ASN 13 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3gwp s ILE 14 N -3.11 4.78 0.43 2.41 1.01 -1.17 -4.77 121.20 120.78 3gwp s ILE 14 Ca 0.21 1.42 0.01 0.00 0.00 0.00 0.00 60.65 62.29 3gwp s ILE 14 Cb -0.09 -4.16 -0.00 0.00 0.01 0.00 0.00 42.46 38.21 3gwp s ILE 14 CO 0.26 -0.19 0.63 0.54 0.00 0.00 0.00 174.94 176.18 3gwp s ASN 15 N 1.49 5.86 0.41 3.58 2.20 -1.26 -4.37 114.94 122.85 3gwp s ASN 15 Ca 0.35 0.20 0.12 0.00 -0.94 0.00 0.00 52.86 52.59 3gwp s ASN 15 Cb -0.14 -1.48 0.87 0.00 -2.00 0.00 0.00 41.25 38.50 3gwp s ASN 15 CO 0.10 -0.65 1.94 0.44 -2.94 0.00 0.00 177.10 176.00 3gwp h ASP 16 N 0.49 0.11 -0.28 3.54 3.32 -1.96 -0.82 116.42 120.81 3gwp h ASP 16 Ca -0.46 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 3gwp h ASP 16 Cb 1.25 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 3gwp h ASP 16 CO 0.57 0.29 0.16 0.03 -1.72 0.00 0.00 179.24 178.57 3gwp h ARG 17 N 0.11 0.40 -0.18 3.56 -0.00 -1.94 0.22 114.38 116.54 3gwp h ARG 17 Ca 0.02 -0.05 -0.16 0.00 -0.50 0.00 0.00 59.98 59.29 3gwp h ARG 17 Cb 0.37 -0.08 -0.01 0.00 0.00 0.00 0.00 29.97 30.26 3gwp h ARG 17 CO 0.02 0.34 -0.56 0.28 0.00 0.00 0.00 179.97 180.06 3gwp h VAL 18 N 0.35 1.32 -0.33 2.04 2.07 -1.80 -2.44 116.25 117.45 3gwp h VAL 18 Ca 0.10 -1.81 -0.12 0.00 0.82 0.00 0.00 66.70 65.69 3gwp h VAL 18 Cb 0.06 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 3gwp h VAL 18 CO -0.02 0.56 -0.27 0.25 0.02 0.00 0.00 177.57 178.11 3gwp h LEU 19 N 0.43 0.71 -0.15 2.57 5.85 -0.81 0.61 115.31 124.52 3gwp h LEU 19 Ca 0.01 -0.27 -0.22 0.00 0.84 0.00 0.00 57.88 58.23 3gwp h LEU 19 Cb 1.11 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.94 3gwp h LEU 19 CO 0.11 0.95 -0.98 0.07 -0.34 0.00 0.00 178.44 178.24 3gwp h LYS 20 N 0.59 0.29 -0.19 1.25 2.10 -0.61 -2.53 116.57 117.47 3gwp h LYS 20 Ca 0.08 -0.35 -0.04 0.00 -2.00 0.00 0.00 60.65 58.33 3gwp h LYS 20 Cb 0.77 0.11 -0.01 0.00 -0.90 0.00 0.00 32.23 32.20 3gwp h LYS 20 CO 0.06 1.07 -0.08 1.25 -2.00 0.00 0.00 179.45 179.75 3gwp h LEU 21 N 0.15 0.27 -0.26 7.07 5.85 -1.20 -2.45 115.31 124.73 3gwp h LEU 21 Ca -0.07 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.53 3gwp h LEU 21 Cb 1.63 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 3gwp h LEU 21 CO 0.16 0.39 -0.10 0.22 -0.34 0.00 0.00 178.44 178.77 3gwp h TYR 22 N 0.27 0.60 -0.03 1.25 3.20 -0.74 -2.91 116.97 118.61 3gwp h TYR 22 Ca 0.06 -0.14 -0.03 0.00 3.14 0.00 0.00 58.73 61.76 3gwp h TYR 22 Cb 0.32 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 3gwp h TYR 22 CO 0.01 0.76 -0.11 0.93 -1.64 0.00 0.00 178.16 178.11 3gwp h GLU 23 N 0.27 0.05 -0.05 1.82 4.39 -1.02 -2.80 114.58 117.24 3gwp h GLU 23 Ca 0.06 -0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.59 3gwp h GLU 23 Cb 0.59 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.24 3gwp h GLU 23 CO 0.03 0.17 -0.61 1.15 -1.16 0.00 0.00 179.01 178.59 3gwp h THR 24 N 0.05 1.38 0.00 1.13 2.02 -1.48 -2.94 112.91 113.06 3gwp h THR 24 Ca 0.01 -1.99 0.00 0.00 0.77 0.00 0.00 66.41 65.20 3gwp h THR 24 Cb 0.24 2.39 0.00 0.00 -1.74 0.00 0.00 68.15 69.03 3gwp h THR 24 CO 0.02 0.59 0.00 0.00 0.37 0.00 0.00 175.52 176.50 3gwp n ALA 25 N -2.58 1.78 0.00 6.16 0.00 -1.06 -2.32 120.51 122.50 3gwp n ALA 25 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3gwp n ALA 25 Cb 0.67 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.12 3gwp n ALA 25 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3gwp n ASN 27 N 0.79 0.00 0.06 0.00 5.15 -1.11 -2.39 115.26 117.76 3gwp n ASN 27 Ca 0.00 0.00 0.03 0.00 -0.60 0.00 0.00 54.58 54.01 3gwp n ASN 27 Cb 0.15 0.00 0.41 0.00 -0.53 0.00 0.00 39.78 39.81 3gwp n ASN 27 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 3gwp h ASP 28 N 0.00 0.35 -0.28 1.20 3.32 -1.76 -2.98 116.42 116.27 3gwp h ASP 28 Ca 0.00 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.01 3gwp h ASP 28 Cb 0.00 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.46 3gwp h ASP 28 CO 0.00 0.36 0.00 2.30 -1.72 0.00 0.00 179.24 180.18 3gwp n ILE 29 N -4.38 0.36 -0.18 0.35 -5.35 -1.01 -4.39 119.36 104.76 3gwp n ILE 29 Ca 0.01 -0.47 -0.05 0.00 -0.27 0.00 0.00 62.75 61.96 3gwp n ILE 29 Cb 0.16 0.44 0.04 0.00 -1.74 0.00 0.00 39.64 38.54 3gwp n ILE 29 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 3gwp h GLN 30 N 2.64 0.63 -0.79 6.28 1.08 -1.82 -1.52 115.11 121.61 3gwp h GLN 30 Ca 0.00 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 3gwp h GLN 30 Cb 0.59 -0.14 -0.04 0.00 -0.05 0.00 0.00 27.48 27.84 3gwp h GLN 30 CO 0.00 0.42 0.34 -0.91 -0.95 0.00 0.00 178.83 177.73 3gwp h ASN 31 N 0.65 1.06 0.02 1.46 2.35 -1.83 -2.44 115.58 116.86 3gwp h ASN 31 Ca 0.21 -0.16 -0.13 0.00 -0.55 0.00 0.00 56.30 55.67 3gwp h ASN 31 Cb 0.01 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.09 3gwp h ASN 31 CO -0.09 0.93 -0.43 -0.61 -1.65 0.00 0.00 177.43 175.57 3gwp h GLN 32 N 1.13 0.51 -0.29 0.81 5.75 -1.77 -2.71 115.11 118.53 3gwp h GLN 32 Ca 0.27 -0.27 -0.04 0.00 -0.15 0.00 0.00 58.65 58.46 3gwp h GLN 32 Cb 0.18 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 3gwp h GLN 32 CO -0.03 0.85 0.01 0.74 -2.65 0.00 0.00 178.83 177.76 3gwp h PHE 33 N 0.42 0.45 -0.36 3.99 -1.00 -1.05 -2.48 116.94 116.90 3gwp h PHE 33 Ca 0.03 -0.03 -0.09 0.00 2.81 0.00 0.00 57.97 60.69 3gwp h PHE 33 Cb 0.93 -0.13 -0.02 0.00 3.61 0.00 0.00 35.95 40.34 3gwp h PHE 33 CO 0.03 0.44 -0.15 0.87 -1.61 0.00 0.00 178.31 177.89 3gwp h LYS 34 N 0.43 0.66 -0.53 1.51 6.56 -1.13 -2.30 116.57 121.76 3gwp h LYS 34 Ca 0.10 -0.22 -0.12 0.00 -1.06 0.00 0.00 60.65 59.34 3gwp h LYS 34 Cb 0.26 -0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 31.86 3gwp h LYS 34 CO 0.01 0.78 -0.13 0.82 -2.06 0.00 0.00 179.45 178.87 3gwp h ILE 35 N 0.60 1.27 -0.54 1.86 2.04 -1.25 -3.05 117.51 118.43 3gwp h ILE 35 Ca 0.10 -1.29 -0.06 0.00 1.00 0.00 0.00 64.86 64.60 3gwp h ILE 35 Cb 0.60 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 3gwp h ILE 35 CO 0.04 0.46 0.09 -0.07 0.00 0.00 0.00 178.15 178.66 3gwp h LEU 36 N 0.90 0.86 -0.46 1.44 4.07 -1.37 -3.04 115.31 117.72 3gwp h LEU 36 Ca 0.13 -0.26 0.06 0.00 0.08 0.00 0.00 57.88 57.89 3gwp h LEU 36 Cb 0.70 -0.23 -0.05 0.00 1.08 0.00 0.00 40.66 42.17 3gwp h LEU 36 CO 0.05 0.90 0.17 0.44 -1.08 0.00 0.00 178.44 178.92 3gwp h ASP 37 N 0.78 0.19 1.54 -0.43 3.32 -1.32 0.20 116.42 120.70 3gwp h ASP 37 Ca 0.16 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.26 3gwp h ASP 37 Cb 0.41 0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.99 3gwp h ASP 37 CO 0.01 0.14 0.00 -2.24 -1.72 0.00 0.00 179.24 175.43 3gwp h ASP 38 N 0.35 0.00 0.08 6.45 3.04 -1.59 0.05 116.42 124.80 3gwp h ASP 38 Ca 0.21 0.00 -0.25 0.00 -3.24 0.00 0.00 57.03 53.76 3gwp h ASP 38 Cb 0.20 0.00 0.02 0.00 -1.04 0.00 0.00 39.33 38.52 3gwp h ASP 38 CO -0.21 0.00 -1.01 0.40 -2.04 0.00 0.00 179.24 176.38 3gwp h ILE 39 N 0.00 1.35 -0.67 4.15 2.04 -1.27 -3.10 117.51 120.01 3gwp h ILE 39 Ca 0.00 -2.36 -0.00 0.00 1.00 0.00 0.00 64.86 63.50 3gwp h ILE 39 Cb 0.77 2.72 -0.03 0.00 -0.74 0.00 0.00 36.82 39.54 3gwp h ILE 39 CO 0.00 0.70 0.42 -0.09 0.00 0.00 0.00 178.15 179.19 3gwp h ARG 40 N 0.10 0.91 -0.82 2.37 2.43 -0.48 -2.24 114.38 116.64 3gwp h ARG 40 Ca -0.15 -0.07 0.13 0.00 -0.81 0.00 0.00 59.98 59.07 3gwp h ARG 40 Cb 1.71 -0.19 -0.09 0.00 -0.42 0.00 0.00 29.97 30.98 3gwp h ARG 40 CO 0.19 0.63 0.42 1.49 -1.51 0.00 0.00 179.97 181.20 3gwp h GLU 41 N 0.92 0.63 0.00 0.20 4.81 -1.02 0.35 114.58 120.47 3gwp h GLU 41 Ca 0.24 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.44 3gwp h GLU 41 Cb -0.05 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.18 3gwp h GLU 41 CO -0.05 0.42 -0.00 0.35 -0.73 0.00 0.00 179.01 179.00 3gwp h PHE 42 N 0.65 -0.01 -0.14 0.92 3.57 -1.42 -2.96 116.94 117.55 3gwp h PHE 42 Ca 0.43 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.94 3gwp h PHE 42 Cb 0.54 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 3gwp h PHE 42 CO -0.09 0.46 0.09 -0.91 -2.23 0.00 0.00 178.31 175.63 3gwp h ASN 43 N -0.47 0.13 -0.21 0.41 2.35 -0.91 0.32 115.58 117.19 3gwp h ASN 43 Ca -0.00 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.70 3gwp h ASN 43 Cb 0.47 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 3gwp h ASN 43 CO 0.00 0.09 -0.07 -0.61 -1.65 0.00 0.00 177.43 175.19 3gwp h GLN 44 N 0.15 0.42 0.00 0.81 5.75 -0.97 -1.69 115.11 119.58 3gwp h GLN 44 Ca 0.05 -0.17 -0.08 0.00 -0.15 0.00 0.00 58.65 58.30 3gwp h GLN 44 Cb 0.04 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 3gwp h GLN 44 CO -0.01 0.68 -0.40 1.25 -2.65 0.00 0.00 178.83 177.70 3gwp h LEU 45 N 0.14 0.00 -0.48 -2.39 5.85 -1.12 0.16 115.31 117.47 3gwp h LEU 45 Ca 0.05 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.63 3gwp h LEU 45 Cb 0.53 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 3gwp h LEU 45 CO 0.02 0.40 -0.26 0.50 -0.34 0.00 0.00 178.44 178.76 3gwp h LYS 46 N 0.00 0.97 -0.03 1.25 3.64 -0.30 -2.11 116.57 119.99 3gwp h LYS 46 Ca -0.00 -0.44 -0.12 0.00 -1.27 0.00 0.00 60.65 58.81 3gwp h LYS 46 Cb 0.74 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.54 3gwp h LYS 46 CO 0.05 1.11 -0.46 0.28 -2.27 0.00 0.00 179.45 178.16 3gwp h VAL 47 N 0.83 1.44 -0.54 2.00 2.07 -1.05 -3.03 116.25 117.96 3gwp h VAL 47 Ca 0.10 -1.95 0.08 0.00 0.82 0.00 0.00 66.70 65.75 3gwp h VAL 47 Cb 0.84 2.52 -0.06 0.00 -1.52 0.00 0.00 31.29 33.07 3gwp h VAL 47 CO 0.07 0.56 0.20 0.25 0.02 0.00 0.00 177.57 178.67 3gwp h LEU 48 N -0.17 0.20 -1.31 2.57 5.85 -1.00 -1.33 115.31 120.11 3gwp h LEU 48 Ca -0.05 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 3gwp h LEU 48 Cb 1.16 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.21 3gwp h LEU 48 CO 0.09 0.13 0.37 -1.13 -0.34 0.00 0.00 178.44 177.56 3gwp h ASN 49 N 0.38 0.74 -0.68 1.25 -0.00 -1.46 -1.84 115.58 113.96 3gwp h ASN 49 Ca 0.27 -0.04 -0.01 0.00 -0.00 0.00 0.00 56.30 56.52 3gwp h ASN 49 Cb 0.30 -0.19 -0.03 0.00 -0.00 0.00 0.00 38.32 38.40 3gwp h ASN 49 CO -0.27 0.57 0.38 0.00 -0.00 0.00 0.00 177.43 178.11 3gwp h ALA 50 N 1.56 0.87 -0.10 1.57 0.00 -1.13 -0.49 119.26 121.53 3gwp h ALA 50 Ca 0.22 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3gwp h ALA 50 Cb -0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 3gwp h ALA 50 CO -0.04 0.38 0.02 0.74 0.00 0.00 0.00 179.25 180.35 3gwp h PHE 51 N 0.93 0.18 -0.50 0.00 -1.00 -1.03 -3.10 116.94 112.41 3gwp h PHE 51 Ca 0.24 -0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.98 3gwp h PHE 51 Cb 0.03 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.51 3gwp h PHE 51 CO -0.01 0.35 0.23 1.96 -1.61 0.00 0.00 178.31 179.24 3gwp h GLN 52 N -0.05 0.73 -0.05 1.51 4.20 -1.17 -2.49 115.11 117.80 3gwp h GLN 52 Ca 0.03 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.60 3gwp h GLN 52 Cb 0.27 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 3gwp h GLN 52 CO 0.00 0.62 -0.11 0.93 -0.67 0.00 0.00 178.83 179.60 3gwp h GLU 53 N 0.67 0.08 -0.23 1.46 4.39 -1.16 -1.75 114.58 118.03 3gwp h GLU 53 Ca 0.17 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.86 3gwp h GLU 53 Cb 0.13 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 3gwp h GLU 53 CO -0.02 0.19 0.00 0.39 -1.16 0.00 0.00 179.01 178.41 3gwp n GLU 54 N -4.37 1.83 -3.96 2.33 -0.58 -1.02 -4.96 120.64 109.90 3gwp n GLU 54 Ca -0.02 -1.26 -0.26 0.00 -0.42 0.00 0.00 57.16 55.20 3gwp n GLU 54 Cb 0.20 -1.38 -0.02 0.00 -0.57 0.00 0.00 31.44 29.67 3gwp n GLU 54 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3gwp n ARG 55 N 0.49 -3.32 -2.07 3.49 1.74 -0.66 -4.90 116.66 111.44 3gwp n ARG 55 Ca 0.16 0.41 -0.41 0.00 -0.77 0.00 0.00 57.85 57.23 3gwp n ARG 55 Cb 0.35 -4.56 -0.02 0.00 -1.02 0.00 0.00 32.46 27.21 3gwp n ARG 55 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gwp s ILE 56 N -3.93 2.74 0.32 0.55 -1.09 -1.05 -5.01 121.20 113.73 3gwp s ILE 56 Ca 0.03 0.67 0.05 0.00 -2.23 0.00 0.00 60.65 59.17 3gwp s ILE 56 Cb -0.02 -3.42 -0.03 0.00 -1.58 0.00 0.00 42.46 37.41 3gwp s ILE 56 CO 0.89 0.13 0.29 -0.94 -1.23 0.00 0.00 174.94 174.07 3gwp s SER 57 N 0.03 1.40 0.59 3.58 1.04 -1.26 -4.98 113.70 114.09 3gwp s SER 57 Ca 0.55 -1.68 0.35 0.00 0.48 0.00 0.00 55.95 55.65 3gwp s SER 57 Cb -0.40 0.55 1.86 0.00 0.10 0.00 0.00 66.02 68.13 3gwp s SER 57 CO 0.47 -1.07 2.20 1.05 0.98 0.00 0.00 173.24 176.87 3gwp h GLU 58 N 2.19 0.00 0.00 4.02 4.11 -1.97 -0.95 114.58 121.98 3gwp h GLU 58 Ca -0.27 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.11 3gwp h GLU 58 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 3gwp h GLU 58 CO 0.39 0.04 -0.24 0.00 0.07 0.00 0.00 179.01 179.26 3gwp h ALA 59 N 1.96 1.47 0.00 1.06 0.00 -1.98 -2.66 119.26 119.12 3gwp h ALA 59 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3gwp h ALA 59 Cb 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3gwp h ALA 59 CO 0.00 0.30 0.00 0.72 0.00 0.00 0.00 179.25 180.28 3gwp n HIS 60 N -4.07 0.31 -2.71 0.00 8.25 -0.36 -4.27 115.22 112.37 3gwp n HIS 60 Ca -0.02 0.10 -0.43 0.00 -0.26 0.00 0.00 57.72 57.10 3gwp n HIS 60 Cb 0.31 -0.66 0.00 0.00 1.12 0.00 0.00 29.99 30.76 3gwp n HIS 60 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3gwp n PHE 61 N -1.76 4.77 -2.09 4.41 3.72 -1.00 -3.73 117.46 121.78 3gwp n PHE 61 Ca 0.06 -3.04 -0.27 0.00 -0.05 0.00 0.00 57.45 54.15 3gwp n PHE 61 Cb 0.32 -2.47 0.09 0.00 -0.94 0.00 0.00 39.48 36.48 3gwp n PHE 61 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3gwp s THR 62 N 3.19 2.15 -0.39 4.37 -4.23 -1.26 -4.96 115.64 114.52 3gwp s THR 62 Ca 0.50 -0.17 0.10 0.00 -1.18 0.00 0.00 61.69 60.94 3gwp s THR 62 Cb 0.02 -2.99 0.32 0.00 1.34 0.00 0.00 72.50 71.19 3gwp s THR 62 CO 0.05 0.00 0.73 -3.20 -0.54 0.00 0.00 174.62 171.66 3gwp n ASN 63 N -3.12 0.16 -4.72 3.99 5.15 -1.26 -4.33 115.26 111.13 3gwp n ASN 63 Ca 0.09 -3.03 -0.31 0.00 -0.60 0.00 0.00 54.58 50.73 3gwp n ASN 63 Cb 0.61 -0.23 0.13 0.00 -0.53 0.00 0.00 39.78 39.76 3gwp n ASN 63 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3gwp s SER 64 N -1.98 3.67 0.23 1.20 1.04 -1.26 -4.80 113.70 111.80 3gwp s SER 64 Ca 0.36 1.81 -0.03 0.00 0.48 0.00 0.00 55.95 58.58 3gwp s SER 64 Cb 0.30 -2.43 -0.03 0.00 0.10 0.00 0.00 66.02 63.95 3gwp s SER 64 CO -0.09 -2.57 0.23 -0.94 0.98 0.00 0.00 173.24 170.85 3gwp s SER 65 N -3.18 0.29 1.29 7.02 1.04 -1.26 -4.17 113.70 114.73 3gwp s SER 65 Ca 0.63 -1.34 0.00 0.00 0.48 0.00 0.00 55.95 55.72 3gwp s SER 65 Cb -0.19 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.38 3gwp s SER 65 CO 0.57 -0.94 0.00 0.61 0.98 0.00 0.00 173.24 174.46 3gwp n GLY 66 N -0.34 2.64 0.11 7.32 0.00 -1.26 -1.79 105.19 111.87 3gwp n GLY 66 Ca 0.02 0.34 -0.12 0.00 0.00 0.00 0.00 46.02 46.26 3gwp n GLY 66 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3gwp h TYR 67 N 0.00 -0.14 -0.12 1.61 0.05 -1.98 -3.37 116.97 113.02 3gwp h TYR 67 Ca 0.00 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3gwp h TYR 67 Cb 0.00 0.05 0.00 0.00 1.01 0.00 0.00 36.73 37.79 3gwp h TYR 67 CO 0.00 0.34 0.00 0.41 -1.05 0.00 0.00 178.16 177.86 3gwp n GLY 68 N 0.44 1.26 3.71 3.88 0.00 -0.74 0.71 105.19 114.46 3gwp n GLY 68 Ca -0.08 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 3gwp n GLY 68 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gwp s TYR 69 N -2.12 2.84 -0.72 1.61 2.02 -1.26 -2.79 117.35 116.92 3gwp s TYR 69 Ca 0.00 0.47 -0.01 0.00 -0.37 0.00 0.00 57.07 57.16 3gwp s TYR 69 Cb 0.00 -3.99 0.00 0.00 -0.40 0.00 0.00 41.96 37.58 3gwp s TYR 69 CO 0.00 -3.75 0.10 0.41 -1.57 0.00 0.00 175.55 170.74 3gwp n GLY 70 N 3.87 0.07 3.56 0.71 0.00 -1.26 -4.94 105.19 107.20 3gwp n GLY 70 Ca 0.15 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 3gwp n GLY 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gwp s ASP 71 N -2.71 5.58 0.41 1.61 -1.08 -1.12 -4.83 116.67 114.54 3gwp s ASP 71 Ca 0.05 -0.62 0.10 0.00 -0.52 0.00 0.00 52.55 51.57 3gwp s ASP 71 Cb -0.02 -2.56 0.92 0.00 -1.46 0.00 0.00 42.92 39.80 3gwp s ASP 71 CO 0.06 -2.29 1.99 0.16 0.52 0.00 0.00 175.17 175.61 3gwp h ILE 72 N 6.95 0.97 0.11 4.11 3.07 -1.92 -1.35 117.51 129.45 3gwp h ILE 72 Ca 0.01 -0.18 -0.01 0.00 1.55 0.00 0.00 64.86 66.23 3gwp h ILE 72 Cb 1.04 0.39 0.00 0.00 -0.27 0.00 0.00 36.82 37.99 3gwp h ILE 72 CO 1.27 0.10 -0.05 1.23 -1.05 0.00 0.00 178.15 179.64 3gwp h GLY 73 N 0.53 -0.15 0.83 0.16 0.00 -1.86 0.56 103.07 103.14 3gwp h GLY 73 Ca 0.26 0.06 0.01 0.00 0.00 0.00 0.00 47.33 47.65 3gwp h GLY 73 CO -0.08 -0.05 -0.12 -0.09 0.00 0.00 0.00 176.54 176.20 3gwp h ARG 74 N -0.31 -0.25 -0.49 4.80 2.43 -1.76 -0.69 114.38 118.12 3gwp h ARG 74 Ca -0.01 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 3gwp h ARG 74 Cb 0.25 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 3gwp h ARG 74 CO 0.02 -0.17 0.15 -0.44 -1.51 0.00 0.00 179.97 178.03 3gwp h ASP 75 N -0.26 0.71 0.73 -3.80 3.32 -1.23 -2.05 116.42 113.83 3gwp h ASP 75 Ca 0.01 -0.20 -0.11 0.00 0.02 0.00 0.00 57.03 56.75 3gwp h ASP 75 Cb 0.25 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 3gwp h ASP 75 CO -0.04 0.72 -0.51 0.28 -1.72 0.00 0.00 179.24 177.97 3gwp h SER 76 N 0.65 0.00 -0.38 6.45 0.02 -0.87 -2.17 113.55 117.26 3gwp h SER 76 Ca 0.16 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.99 3gwp h SER 76 Cb 0.27 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 3gwp h SER 76 CO -0.01 0.51 -0.18 0.25 -1.14 0.00 0.00 176.83 176.26 3gwp h LEU 77 N 0.00 0.87 -0.48 5.07 5.85 -0.89 0.80 115.31 126.54 3gwp h LEU 77 Ca -0.01 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 3gwp h LEU 77 Cb 1.01 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 3gwp h LEU 77 CO 0.07 1.04 0.24 0.44 -0.34 0.00 0.00 178.44 179.89 3gwp h ASP 78 N 0.76 0.62 -0.84 1.25 3.32 -1.19 -1.63 116.42 118.71 3gwp h ASP 78 Ca 0.11 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 3gwp h ASP 78 Cb 0.71 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 40.06 3gwp h ASP 78 CO 0.05 0.56 0.52 0.00 -1.72 0.00 0.00 179.24 178.66 3gwp h ALA 79 N 1.08 1.07 -0.35 3.45 0.00 -1.09 -0.91 119.26 122.51 3gwp h ALA 79 Ca 0.17 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3gwp h ALA 79 Cb 0.10 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3gwp h ALA 79 CO -0.02 0.52 0.07 0.28 0.00 0.00 0.00 179.25 180.09 3gwp h VAL 80 N 1.15 1.23 -0.87 0.00 2.07 -0.63 -1.92 116.25 117.28 3gwp h VAL 80 Ca 0.30 -0.81 0.03 0.00 0.82 0.00 0.00 66.70 67.05 3gwp h VAL 80 Cb -0.07 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.73 3gwp h VAL 80 CO -0.06 0.27 0.56 1.88 0.02 0.00 0.00 177.57 180.25 3gwp h TYR 81 N 0.42 1.05 -0.77 1.57 -1.99 -1.08 0.15 116.97 116.33 3gwp h TYR 81 Ca 0.11 0.03 0.03 0.00 2.00 0.00 0.00 58.73 60.89 3gwp h TYR 81 Cb 0.33 -0.35 -0.05 0.00 2.00 0.00 0.00 36.73 38.67 3gwp h TYR 81 CO 0.02 0.60 0.49 0.00 -0.00 0.00 0.00 178.16 179.28 3gwp h ALA 82 N 1.36 1.00 -0.07 3.88 0.00 -0.95 -0.98 119.26 123.50 3gwp h ALA 82 Ca 0.35 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 3gwp h ALA 82 Cb 0.01 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3gwp h ALA 82 CO -0.12 0.31 -0.03 0.00 0.00 0.00 0.00 179.25 179.41 3gwp h ARG 83 N 0.96 0.14 -0.21 0.00 3.08 -0.84 0.99 114.38 118.49 3gwp h ARG 83 Ca 0.30 -0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.35 3gwp h ARG 83 Cb -0.01 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 29.98 3gwp h ARG 83 CO -0.10 0.50 -0.15 0.28 -1.07 0.00 0.00 179.97 179.43 3gwp h VAL 84 N -0.22 0.57 -0.06 2.04 2.07 -0.73 -1.75 116.25 118.18 3gwp h VAL 84 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 3gwp h VAL 84 Cb 0.45 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 3gwp h VAL 84 CO 0.01 0.00 0.00 0.49 0.02 0.00 0.00 177.57 178.09 3gwp n PHE 85 N -5.31 0.07 -3.86 1.57 3.72 -0.40 -4.95 117.46 108.31 3gwp n PHE 85 Ca -0.01 -0.03 -0.26 0.00 -0.05 0.00 0.00 57.45 57.09 3gwp n PHE 85 Cb 0.22 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.78 3gwp n PHE 85 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3gwp n ASN 86 N -0.29 -2.22 -4.66 4.37 3.02 0.03 -4.44 115.26 111.07 3gwp n ASN 86 Ca 0.18 -0.86 -0.24 0.00 -0.03 0.00 0.00 54.58 53.62 3gwp n ASN 86 Cb 0.21 -3.69 -0.08 0.00 -0.61 0.00 0.00 39.78 35.61 3gwp n ASN 86 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3gwp s THR 87 N -3.59 2.63 0.04 3.41 -4.23 0.13 -4.87 115.64 109.14 3gwp s THR 87 Ca 0.26 -1.90 -0.25 0.00 -1.18 0.00 0.00 61.69 58.62 3gwp s THR 87 Cb -0.13 -2.86 -0.17 0.00 1.34 0.00 0.00 72.50 70.68 3gwp s THR 87 CO 0.84 -0.17 1.48 -0.33 -0.54 0.00 0.00 174.62 175.91 3gwp h GLU 88 N 1.72 -0.11 -4.92 3.99 5.08 -1.80 -3.42 114.58 115.12 3gwp h GLU 88 Ca -0.43 0.01 -0.44 0.00 -1.00 0.00 0.00 59.36 57.49 3gwp h GLU 88 Cb 1.25 0.02 -0.14 0.00 0.50 0.00 0.00 28.75 30.39 3gwp h GLU 88 CO 0.67 0.14 -0.55 0.45 -1.00 0.00 0.00 179.01 178.72 3gwp s SER 89 N -5.32 1.78 0.09 1.42 0.15 -0.11 -4.85 113.70 106.86 3gwp s SER 89 Ca -0.14 -1.58 -0.20 0.00 0.70 0.00 0.00 55.95 54.73 3gwp s SER 89 Cb 0.04 0.39 0.05 0.00 -1.71 0.00 0.00 66.02 64.79 3gwp s SER 89 CO 0.65 -0.89 0.49 0.00 1.20 0.00 0.00 173.24 174.68 3gwp s ALA 90 N -3.52 -1.22 -0.37 5.45 0.00 -1.26 -2.04 121.76 118.80 3gwp s ALA 90 Ca 0.34 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.67 3gwp s ALA 90 Cb 0.05 0.55 0.14 0.00 0.00 0.00 0.00 23.12 23.86 3gwp s ALA 90 CO 0.18 -0.58 0.22 -1.17 0.00 0.00 0.00 175.76 174.40 3gwp s LEU 91 N -2.34 1.23 -0.31 0.00 2.96 0.34 -4.84 118.68 115.72 3gwp s LEU 91 Ca -0.02 -2.28 -0.08 0.00 -0.22 0.00 0.00 54.13 51.53 3gwp s LEU 91 Cb 0.00 -0.48 0.01 0.00 0.50 0.00 0.00 46.19 46.21 3gwp s LEU 91 CO -0.07 -0.30 0.11 -0.69 -1.32 0.00 0.00 176.35 174.09 3gwp s VAL 92 N 0.94 4.22 0.03 1.68 1.01 -1.26 -1.77 120.40 125.25 3gwp s VAL 92 Ca 0.18 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.56 3gwp s VAL 92 Cb -0.22 -3.19 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 3gwp s VAL 92 CO 0.00 0.05 -0.07 -0.13 0.00 0.00 0.00 175.10 174.95 3gwp s ARG 93 N 1.54 0.50 0.00 2.72 1.81 -0.96 -4.84 118.95 119.71 3gwp s ARG 93 Ca 0.03 -0.62 0.30 0.00 -1.72 0.00 0.00 55.73 53.72 3gwp s ARG 93 Cb -0.17 -0.31 1.59 0.00 -0.45 0.00 0.00 34.95 35.61 3gwp s ARG 93 CO 0.04 0.06 2.07 -0.35 -0.68 0.00 0.00 175.30 176.44 3gwp n PRO 94 N 1.82 0.56 0.22 3.54 -0.04 -1.26 -1.81 135.00 138.03 3gwp n PRO 94 Ca -0.20 0.01 0.13 0.00 -0.04 0.00 0.00 63.50 63.39 3gwp n PRO 94 Cb 0.55 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.84 3gwp n PRO 94 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3gwp h HIS 95 N 0.00 0.00 -2.73 0.54 3.86 -1.93 -3.31 115.15 111.57 3gwp h HIS 95 Ca 0.00 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.65 3gwp h HIS 95 Cb 0.21 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.64 3gwp h HIS 95 CO 0.00 0.00 1.22 -0.06 0.86 0.00 0.00 177.93 179.95 3gwp s PHE 96 N -3.31 1.97 0.45 2.45 0.08 -1.24 -4.88 117.98 113.51 3gwp s PHE 96 Ca 0.06 0.65 0.19 0.00 0.12 0.00 0.00 56.93 57.95 3gwp s PHE 96 Cb 0.07 -4.19 1.15 0.00 -0.57 0.00 0.00 43.02 39.48 3gwp s PHE 96 CO 0.62 -2.54 1.92 -0.39 -0.10 0.00 0.00 175.22 174.74 3gwp h VAL 97 N 6.70 0.74 -2.54 -0.44 -1.51 -1.91 -3.07 116.25 114.22 3gwp h VAL 97 Ca -0.30 -0.11 0.04 0.00 -1.23 0.00 0.00 66.70 65.10 3gwp h VAL 97 Cb 1.15 0.40 -0.00 0.00 -2.13 0.00 0.00 31.29 30.70 3gwp h VAL 97 CO 1.08 0.06 0.31 -0.46 -1.23 0.00 0.00 177.57 177.33 3gwp n ASN 98 N -4.45 -1.51 0.03 4.19 6.94 -1.26 -4.71 115.26 114.49 3gwp n ASN 98 Ca 0.15 -1.95 0.04 0.00 -0.02 0.00 0.00 54.58 52.79 3gwp n ASN 98 Cb 0.61 2.49 0.42 0.00 -2.36 0.00 0.00 39.78 40.95 3gwp n ASN 98 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 3gwp h GLY 99 N 1.45 0.50 1.03 4.83 0.00 -1.85 -2.68 103.07 106.34 3gwp h GLY 99 Ca -0.23 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 3gwp h GLY 99 CO 0.29 0.20 0.39 -0.84 0.00 0.00 0.00 176.54 176.58 3gwp h THR 100 N 0.47 1.25 -0.14 4.70 2.02 -1.95 -1.56 112.91 117.71 3gwp h THR 100 Ca 0.12 -0.71 0.03 0.00 0.77 0.00 0.00 66.41 66.61 3gwp h THR 100 Cb 0.03 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 66.65 3gwp h THR 100 CO -0.02 0.30 -0.02 -0.74 0.37 0.00 0.00 175.52 175.41 3gwp h HIS 101 N 1.15 -0.05 -0.23 3.16 2.76 -1.88 0.45 115.15 120.50 3gwp h HIS 101 Ca 0.28 0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.49 3gwp h HIS 101 Cb 0.12 0.04 -0.03 0.00 1.55 0.00 0.00 27.41 29.10 3gwp h HIS 101 CO 0.01 -0.05 0.04 0.00 -1.30 0.00 0.00 177.93 176.63 3gwp h ALA 102 N 1.14 0.23 -0.69 5.26 0.00 -1.41 0.13 119.26 123.92 3gwp h ALA 102 Ca 0.07 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3gwp h ALA 102 Cb 0.10 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3gwp h ALA 102 CO -0.14 -0.39 0.16 -0.07 0.00 0.00 0.00 179.25 178.81 3gwp h LEU 103 N 0.12 1.05 -0.11 0.00 3.38 -1.06 -2.75 115.31 115.94 3gwp h LEU 103 Ca 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3gwp h LEU 103 Cb 0.11 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3gwp h LEU 103 CO -0.15 1.02 0.01 1.23 0.09 0.00 0.00 178.44 180.64 3gwp h GLY 104 N 1.07 0.20 -0.14 0.83 0.00 -0.57 -2.69 103.07 101.77 3gwp h GLY 104 Ca 0.22 -0.14 0.23 0.00 0.00 0.00 0.00 47.33 47.64 3gwp h GLY 104 CO 0.00 0.13 0.54 0.00 0.00 0.00 0.00 176.54 177.21 3gwp h ALA 105 N 0.77 1.68 -0.26 3.60 0.00 -0.61 0.38 119.26 124.82 3gwp h ALA 105 Ca 0.03 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 3gwp h ALA 105 Cb 0.32 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3gwp h ALA 105 CO 0.00 -0.28 -0.20 0.00 0.00 0.00 0.00 179.25 178.77 3gwp h ALA 106 N 1.72 0.37 0.46 0.00 0.00 -1.40 -1.89 119.26 118.52 3gwp h ALA 106 Ca 0.62 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 3gwp h ALA 106 Cb 1.16 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3gwp h ALA 106 CO -0.48 0.31 -0.22 -0.07 0.00 0.00 0.00 179.25 178.79 3gwp h LEU 107 N 0.31 -0.53 -1.02 0.00 3.38 -0.67 -1.11 115.31 115.68 3gwp h LEU 107 Ca 0.05 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3gwp h LEU 107 Cb 0.75 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.60 3gwp h LEU 107 CO 0.05 -0.22 0.40 -0.26 0.09 0.00 0.00 178.44 178.51 3gwp h PHE 108 N -0.85 1.08 -0.02 1.13 0.04 -1.18 -1.24 116.94 115.90 3gwp h PHE 108 Ca -0.06 -0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.61 3gwp h PHE 108 Cb 0.57 -0.34 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 3gwp h PHE 108 CO 0.00 0.77 -0.28 0.78 -0.60 0.00 0.00 178.31 178.98 3gwp h GLY 109 N 1.13 0.05 -1.28 -1.45 0.00 -1.31 -3.24 103.07 96.97 3gwp h GLY 109 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.57 3gwp h GLY 109 CO -0.04 0.03 0.00 0.70 0.00 0.00 0.00 176.54 177.23 3gwp n ASN 110 N -4.19 2.95 -4.03 0.19 3.02 -0.42 -4.48 115.26 108.29 3gwp n ASN 110 Ca -0.02 -2.02 -0.25 0.00 -0.03 0.00 0.00 54.58 52.25 3gwp n ASN 110 Cb 0.34 -0.24 -0.17 0.00 -0.61 0.00 0.00 39.78 39.10 3gwp n ASN 110 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3gwp s LEU 111 N -1.04 1.65 0.28 3.41 1.43 -0.50 -4.92 118.68 118.99 3gwp s LEU 111 Ca 0.24 -0.32 0.10 0.00 -1.03 0.00 0.00 54.13 53.12 3gwp s LEU 111 Cb 0.13 -0.88 -0.05 0.00 0.03 0.00 0.00 46.19 45.42 3gwp s LEU 111 CO 0.16 0.03 -0.08 -0.13 0.23 0.00 0.00 176.35 176.56 3gwp s ARG 112 N 0.71 2.04 0.06 1.70 1.81 -1.26 -4.82 118.95 119.20 3gwp s ARG 112 Ca -0.13 -1.59 -0.36 0.00 -1.72 0.00 0.00 55.73 51.92 3gwp s ARG 112 Cb -0.16 -1.99 -0.16 0.00 -0.45 0.00 0.00 34.95 32.20 3gwp s ARG 112 CO 0.03 0.32 1.44 -2.30 -0.68 0.00 0.00 175.30 174.11 3gwp n PRO 113 N -0.80 1.37 0.00 3.54 -0.02 -1.25 -1.42 135.00 136.42 3gwp n PRO 113 Ca -0.06 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 3gwp n PRO 113 Cb 0.60 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 3gwp n PRO 113 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gwp n GLY 114 N 2.90 3.04 3.76 -1.23 0.00 0.18 -4.96 105.19 108.87 3gwp n GLY 114 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3gwp n GLY 114 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gwp s ASN 115 N -0.07 7.29 0.00 1.61 0.01 -0.51 -4.81 114.94 118.46 3gwp s ASN 115 Ca 0.00 2.24 0.00 0.00 -0.71 0.00 0.00 52.86 54.39 3gwp s ASN 115 Cb 0.00 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 39.03 3gwp s ASN 115 CO 0.00 -0.12 0.00 0.41 -1.51 0.00 0.00 177.10 175.88 3gwp n THR 116 N 1.19 0.00 0.00 1.60 -1.04 -0.86 -1.67 114.28 113.50 3gwp n THR 116 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 3gwp n THR 116 Cb 0.45 -0.82 0.00 0.00 -1.82 0.00 0.00 70.33 68.14 3gwp n THR 116 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3gwp n LEU 118 N 0.00 0.00 -4.61 -4.42 7.94 -0.92 -2.77 117.00 112.22 3gwp n LEU 118 Ca 0.00 0.00 -0.42 0.00 -1.11 0.00 0.00 56.01 54.48 3gwp n LEU 118 Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 3gwp n LEU 118 CO 0.00 0.00 0.69 -0.44 -1.11 0.00 0.00 177.39 176.53 3gwp s SER 119 N 0.00 6.67 0.00 1.96 0.01 -1.11 0.08 113.70 121.31 3gwp s SER 119 Ca 0.00 0.59 0.27 0.00 1.31 0.00 0.00 55.95 58.12 3gwp s SER 119 Cb 0.00 -2.44 0.81 0.00 0.21 0.00 0.00 66.02 64.60 3gwp s SER 119 CO 0.00 -0.76 1.60 1.33 0.41 0.00 0.00 173.24 175.81 3gwp n VAL 120 N 5.80 0.00 -1.51 3.43 0.24 -0.58 -1.19 118.33 124.53 3gwp n VAL 120 Ca 0.06 -0.18 -0.14 0.00 -2.04 0.00 0.00 64.34 62.04 3gwp n VAL 120 Cb 0.48 0.48 0.15 0.00 -1.47 0.00 0.00 33.84 33.49 3gwp n VAL 120 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3gwp n GLY 122 N -1.04 -0.19 3.68 0.00 0.00 -0.96 -4.66 105.19 102.01 3gwp n GLY 122 Ca 0.42 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 3gwp n GLY 122 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3gwp s GLU 123 N 0.00 4.25 0.91 1.61 2.12 -1.26 -4.80 118.70 121.53 3gwp s GLU 123 Ca 0.00 1.96 -0.12 0.00 0.36 0.00 0.00 54.97 57.18 3gwp s GLU 123 Cb 0.00 -3.71 0.14 0.00 0.26 0.00 0.00 34.13 30.82 3gwp s GLU 123 CO 0.00 -0.67 1.10 -1.25 -0.54 0.00 0.00 175.26 173.90 3gwp s PRO 124 N 3.00 1.14 0.55 4.30 0.04 -1.26 -4.96 135.00 137.81 3gwp s PRO 124 Ca 0.64 0.66 -0.21 0.00 0.04 0.00 0.00 61.00 62.13 3gwp s PRO 124 Cb -0.30 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 3gwp s PRO 124 CO 0.25 -2.28 1.29 2.48 0.04 0.00 0.00 177.00 178.78 3gwp n TYR 125 N -3.88 2.06 -0.33 0.56 4.11 -1.26 -4.87 117.16 113.54 3gwp n TYR 125 Ca 0.06 0.44 0.04 0.00 -0.00 0.00 0.00 57.90 58.44 3gwp n TYR 125 Cb 0.56 -2.33 0.11 0.00 -0.00 0.00 0.00 39.34 37.69 3gwp n TYR 125 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.86 176.61 3gwp n ASP 126 N -0.96 -0.38 -0.02 9.48 8.00 -1.26 -1.91 116.55 129.50 3gwp n ASP 126 Ca 0.11 1.56 0.00 0.00 0.71 0.00 0.00 54.79 57.17 3gwp n ASP 126 Cb 0.45 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3gwp n ASP 126 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3gwp n THR 127 N -5.45 0.00 0.61 -3.53 -2.24 -1.26 -2.43 114.28 99.97 3gwp n THR 127 Ca 0.13 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.98 3gwp n THR 127 Cb 0.43 -0.12 -0.07 0.00 -2.10 0.00 0.00 70.33 68.47 3gwp n THR 127 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3gwp n LEU 128 N -0.47 0.61 -0.15 3.22 7.94 -0.80 -4.63 117.00 122.71 3gwp n LEU 128 Ca 0.00 -0.49 -0.09 0.00 -1.11 0.00 0.00 56.01 54.32 3gwp n LEU 128 Cb 0.01 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.96 3gwp n LEU 128 CO 0.00 0.15 0.95 0.45 -1.11 0.00 0.00 177.39 177.83 3gwp h HIS 129 N 0.00 0.65 -0.29 1.96 3.86 -1.63 -2.57 115.15 117.13 3gwp h HIS 129 Ca 0.00 -0.04 -0.07 0.00 -1.16 0.00 0.00 60.37 59.10 3gwp h HIS 129 Cb 0.31 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 3gwp h HIS 129 CO 0.00 0.55 -0.11 -0.44 0.86 0.00 0.00 177.93 178.80 3gwp h ASP 130 N 0.57 0.46 -0.61 2.45 3.32 -1.82 0.63 116.42 121.42 3gwp h ASP 130 Ca 0.15 -0.11 -0.06 0.00 0.02 0.00 0.00 57.03 57.02 3gwp h ASP 130 Cb 0.16 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 3gwp h ASP 130 CO -0.01 0.61 0.13 0.58 -1.72 0.00 0.00 179.24 178.82 3gwp h VAL 131 N 0.45 1.26 0.25 -1.35 2.07 -1.78 -3.15 116.25 113.99 3gwp h VAL 131 Ca 0.09 -0.95 -0.34 0.00 0.82 0.00 0.00 66.70 66.32 3gwp h VAL 131 Cb 0.46 0.69 0.04 0.00 -1.52 0.00 0.00 31.29 30.96 3gwp h VAL 131 CO 0.03 0.35 -1.50 0.40 0.02 0.00 0.00 177.57 176.87 3gwp h ILE 132 N 0.90 1.26 -0.79 4.57 2.04 -1.23 -1.69 117.51 122.56 3gwp h ILE 132 Ca 0.19 -2.68 0.00 0.00 1.00 0.00 0.00 64.86 63.37 3gwp h ILE 132 Cb 0.38 3.03 0.00 0.00 -0.74 0.00 0.00 36.82 39.49 3gwp h ILE 132 CO 0.01 0.81 0.00 0.61 0.00 0.00 0.00 178.15 179.58 3gwp n GLY 133 N 1.73 0.51 0.12 5.37 0.00 0.21 -1.81 105.19 111.33 3gwp n GLY 133 Ca -0.18 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.43 3gwp n GLY 133 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3gwp h ILE 134 N 0.00 0.85 0.00 -0.61 2.04 -1.68 -3.44 117.51 114.66 3gwp h ILE 134 Ca 0.00 -2.27 0.00 0.00 1.00 0.00 0.00 64.86 63.59 3gwp h ILE 134 Cb 0.41 2.42 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 3gwp h ILE 134 CO 0.00 0.58 0.00 0.41 0.00 0.00 0.00 178.15 179.14 3gwp n THR 135 N -4.03 0.00 -0.09 -0.27 -1.04 -1.26 -4.93 114.28 102.66 3gwp n THR 135 Ca -0.31 0.00 -0.16 0.00 -2.04 0.00 0.00 64.05 61.54 3gwp n THR 135 Cb 0.84 -0.41 -0.09 0.00 -1.82 0.00 0.00 70.33 68.85 3gwp n THR 135 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 3gwp h GLU 136 N 0.00 0.00 -5.92 -2.82 4.11 -1.91 -3.50 114.58 104.55 3gwp h GLU 136 Ca 0.00 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.22 3gwp h GLU 136 Cb 0.00 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.27 3gwp h GLU 136 CO 0.00 0.72 -0.49 0.09 0.07 0.00 0.00 179.01 179.40 3gwp n ASN 137 N -4.51 -6.54 -3.16 3.06 3.02 -1.26 -4.93 115.26 100.94 3gwp n ASN 137 Ca -0.23 -0.49 -0.39 0.00 -0.03 0.00 0.00 54.58 53.45 3gwp n ASN 137 Cb 0.54 -3.91 0.03 0.00 -0.61 0.00 0.00 39.78 35.82 3gwp n ASN 137 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3gwp n SER 138 N -2.20 7.12 -2.72 6.41 2.88 -1.26 -5.07 113.62 118.79 3gwp n SER 138 Ca -0.12 -3.77 -0.02 0.00 -1.33 0.00 0.00 58.87 53.63 3gwp n SER 138 Cb 0.58 -1.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.00 3gwp n SER 138 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 3gwp n ASN 139 N -0.34 -7.86 -2.67 -3.46 5.15 -1.26 -5.13 115.26 99.69 3gwp n ASN 139 Ca 0.49 1.14 -0.09 0.00 -0.60 0.00 0.00 54.58 55.52 3gwp n ASN 139 Cb 0.28 -5.25 0.05 0.00 -0.53 0.00 0.00 39.78 34.33 3gwp n ASN 139 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3gwp n GLY 141 N 0.39 1.48 3.90 8.20 0.00 -1.26 -5.22 105.19 112.68 3gwp n GLY 141 Ca 0.04 -1.04 -0.29 0.00 0.00 0.00 0.00 46.02 44.73 3gwp n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gwp s SER 142 N -2.70 4.54 0.30 1.61 1.04 -1.26 -4.92 113.70 112.31 3gwp s SER 142 Ca 0.26 0.77 -0.01 0.00 0.48 0.00 0.00 55.95 57.45 3gwp s SER 142 Cb 0.45 -1.28 0.47 0.00 0.10 0.00 0.00 66.02 65.76 3gwp s SER 142 CO 0.01 -1.88 1.94 -0.07 0.98 0.00 0.00 173.24 174.22 3gwp h LEU 143 N -1.03 0.94 -1.22 2.42 3.38 -1.09 -1.80 115.31 116.92 3gwp h LEU 143 Ca -0.46 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.45 3gwp h LEU 143 Cb 1.33 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 3gwp h LEU 143 CO 0.66 0.65 -0.05 0.50 0.09 0.00 0.00 178.44 180.28 3gwp h LYS 144 N 1.09 0.47 0.00 1.13 3.64 -1.23 0.77 116.57 122.44 3gwp h LYS 144 Ca 0.35 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.62 3gwp h LYS 144 Cb 0.03 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 3gwp h LYS 144 CO -0.10 0.54 0.00 0.39 -2.27 0.00 0.00 179.45 178.01 3gwp n GLU 145 N -4.26 0.19 -0.70 1.90 1.02 -0.70 -2.79 120.64 115.30 3gwp n GLU 145 Ca 0.01 0.28 0.03 0.00 -0.02 0.00 0.00 57.16 57.46 3gwp n GLU 145 Cb 0.27 -1.78 0.29 0.00 -0.02 0.00 0.00 31.44 30.19 3gwp n GLU 145 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3gwp n PHE 146 N -2.13 1.51 -1.36 -0.32 3.72 -0.92 -4.93 117.46 113.03 3gwp n PHE 146 Ca 0.04 -1.03 -0.09 0.00 -0.05 0.00 0.00 57.45 56.32 3gwp n PHE 146 Cb 0.32 -0.46 -0.03 0.00 -0.94 0.00 0.00 39.48 38.37 3gwp n PHE 146 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gwp n GLY 147 N -0.33 0.94 3.44 1.37 0.00 -1.12 -3.97 105.19 105.52 3gwp n GLY 147 Ca 0.29 -0.62 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 3gwp n GLY 147 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gwp s ILE 148 N -2.34 4.43 0.51 -0.61 1.01 0.22 0.48 121.20 124.89 3gwp s ILE 148 Ca 0.00 -0.33 -0.06 0.00 0.00 0.00 0.00 60.65 60.26 3gwp s ILE 148 Cb 0.00 -3.18 -0.03 0.00 0.01 0.00 0.00 42.46 39.26 3gwp s ILE 148 CO 0.00 0.19 0.82 0.20 0.00 0.00 0.00 174.94 176.15 3gwp s ASN 149 N 1.61 6.21 -0.04 3.58 0.01 -0.67 -2.92 114.94 122.72 3gwp s ASN 149 Ca 0.05 0.97 0.05 0.00 -0.71 0.00 0.00 52.86 53.22 3gwp s ASN 149 Cb -0.16 -2.24 -0.01 0.00 0.41 0.00 0.00 41.25 39.25 3gwp s ASN 149 CO 0.05 -0.65 -0.19 -0.47 -1.51 0.00 0.00 177.10 174.33 3gwp s TYR 150 N -2.81 1.85 0.35 2.20 5.04 -1.26 -4.33 117.35 118.38 3gwp s TYR 150 Ca 0.49 -0.50 0.04 0.00 -2.44 0.00 0.00 57.07 54.65 3gwp s TYR 150 Cb -0.10 -1.23 -0.06 0.00 0.35 0.00 0.00 41.96 40.92 3gwp s TYR 150 CO 0.46 -0.15 0.06 0.21 -1.34 0.00 0.00 175.55 174.79 3gwp s LYS 151 N -0.09 1.73 -0.16 4.97 2.47 -1.26 -5.01 119.74 122.40 3gwp s LYS 151 Ca -0.02 -1.98 -0.26 0.00 -1.56 0.00 0.00 55.97 52.15 3gwp s LYS 151 Cb -0.11 -0.92 0.06 0.00 -1.46 0.00 0.00 37.83 35.41 3gwp s LYS 151 CO 0.02 -0.22 0.66 -1.14 0.16 0.00 0.00 175.35 174.82 3gwp s GLN 152 N -3.86 0.89 -0.15 4.03 0.74 -1.26 -2.77 119.66 117.28 3gwp s GLN 152 Ca 0.34 0.61 -0.03 0.00 0.05 0.00 0.00 55.36 56.32 3gwp s GLN 152 Cb 0.08 0.42 0.05 0.00 1.10 0.00 0.00 33.01 34.66 3gwp s GLN 152 CO 0.15 -0.19 0.05 0.08 -0.55 0.00 0.00 175.29 174.83 3gwp s VAL 153 N -0.35 0.26 0.83 1.34 1.01 -0.33 -4.95 120.40 118.20 3gwp s VAL 153 Ca -0.05 -0.23 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 3gwp s VAL 153 Cb -0.03 -0.72 0.09 0.00 0.00 0.00 0.00 36.38 35.72 3gwp s VAL 153 CO 0.05 -0.11 1.09 -1.81 0.00 0.00 0.00 175.10 174.32 3gwp s ASP 154 N 1.99 4.06 0.65 3.32 1.11 -1.26 -2.25 116.67 124.28 3gwp s ASP 154 Ca 0.02 1.66 -0.11 0.00 0.18 0.00 0.00 52.55 54.29 3gwp s ASP 154 Cb -0.15 -2.35 -0.02 0.00 1.07 0.00 0.00 42.92 41.46 3gwp s ASP 154 CO -0.07 -2.30 1.04 -0.76 1.18 0.00 0.00 175.17 174.26 3gwp s LEU 155 N -6.05 3.22 1.02 1.23 1.43 -1.26 -4.33 118.68 113.94 3gwp s LEU 155 Ca 0.62 1.53 -0.15 0.00 -1.03 0.00 0.00 54.13 55.11 3gwp s LEU 155 Cb -0.17 -4.49 0.20 0.00 0.03 0.00 0.00 46.19 41.76 3gwp s LEU 155 CO 0.56 -1.12 1.15 -0.54 0.23 0.00 0.00 176.35 176.63 3gwp s LYS 156 N -5.01 0.20 0.24 1.70 1.02 -0.88 -4.90 119.74 112.12 3gwp s LYS 156 Ca 0.57 0.12 -0.05 0.00 0.02 0.00 0.00 55.97 56.63 3gwp s LYS 156 Cb -0.13 -1.75 0.36 0.00 -0.52 0.00 0.00 37.83 35.80 3gwp s LYS 156 CO 0.52 -2.80 1.84 1.05 -0.92 0.00 0.00 175.35 175.04 3gwp h GLU 157 N -1.93 0.88 0.00 1.68 4.11 -1.97 -2.19 114.58 115.16 3gwp h GLU 157 Ca -0.49 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 58.89 3gwp h GLU 157 Cb 1.31 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3gwp h GLU 157 CO 0.49 0.58 0.00 0.38 0.07 0.00 0.00 179.01 180.54 3gwp h ASP 158 N 0.91 0.00 0.00 3.06 3.04 -2.02 -3.47 116.42 117.93 3gwp h ASP 158 Ca 0.39 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.18 3gwp h ASP 158 Cb 0.24 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.53 3gwp h ASP 158 CO -0.20 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.61 3gwp n GLY 159 N -0.07 2.02 3.80 7.15 0.00 -0.82 -4.50 105.19 112.76 3gwp n GLY 159 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 3gwp n GLY 159 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gwp s LYS 160 N -0.12 3.08 0.45 1.61 1.02 -1.26 -4.65 119.74 119.87 3gwp s LYS 160 Ca 0.00 1.19 -0.24 0.00 0.02 0.00 0.00 55.97 56.94 3gwp s LYS 160 Cb 0.00 -2.00 -0.08 0.00 -0.52 0.00 0.00 37.83 35.23 3gwp s LYS 160 CO 0.00 -1.00 1.28 -1.25 -0.92 0.00 0.00 175.35 173.46 3gwp s PRO 161 N -4.30 3.73 -1.29 -1.68 0.04 -1.26 -2.07 135.00 128.17 3gwp s PRO 161 Ca 0.63 2.09 -0.15 0.00 0.04 0.00 0.00 61.00 63.61 3gwp s PRO 161 Cb -0.17 -2.56 0.12 0.00 0.04 0.00 0.00 34.50 31.93 3gwp s PRO 161 CO 0.42 -0.67 1.73 -1.71 0.04 0.00 0.00 177.00 176.81 3gwp n ASN 162 N -0.28 4.90 0.02 6.66 2.85 -1.26 -4.79 115.26 123.36 3gwp n ASN 162 Ca 0.06 -2.96 0.11 0.00 -0.11 0.00 0.00 54.58 51.68 3gwp n ASN 162 Cb 0.45 -1.63 0.54 0.00 1.24 0.00 0.00 39.78 40.38 3gwp n ASN 162 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 3gwp h LEU 163 N 10.47 0.26 0.05 1.20 3.38 -1.96 -1.91 115.31 126.81 3gwp h LEU 163 Ca 0.41 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.38 3gwp h LEU 163 Cb 0.80 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.50 3gwp h LEU 163 CO 1.47 0.17 -0.02 -0.33 0.09 0.00 0.00 178.44 179.82 3gwp h GLU 164 N 0.30 -0.06 -0.04 1.13 3.07 -2.01 -2.48 114.58 114.47 3gwp h GLU 164 Ca 0.19 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.96 3gwp h GLU 164 Cb 0.38 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 3gwp h GLU 164 CO -0.04 -0.02 -0.40 1.49 -1.40 0.00 0.00 179.01 178.64 3gwp h GLU 165 N -0.09 0.09 -0.54 2.33 4.57 -1.81 -2.72 114.58 116.42 3gwp h GLU 165 Ca -0.01 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.10 3gwp h GLU 165 Cb 0.07 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 3gwp h GLU 165 CO 0.01 0.48 0.21 0.82 -1.18 0.00 0.00 179.01 179.35 3gwp h ILE 166 N 0.08 1.22 -0.14 2.32 2.04 -1.22 -1.67 117.51 120.14 3gwp h ILE 166 Ca 0.01 -0.68 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 3gwp h ILE 166 Cb 0.74 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 3gwp h ILE 166 CO 0.06 0.26 0.07 -0.33 0.00 0.00 0.00 178.15 178.21 3gwp h GLU 167 N 0.73 0.19 -0.94 2.37 5.08 -1.22 -1.73 114.58 119.06 3gwp h GLU 167 Ca 0.18 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.53 3gwp h GLU 167 Cb 0.20 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.36 3gwp h GLU 167 CO -0.01 0.21 0.63 -0.22 -1.00 0.00 0.00 179.01 178.62 3gwp h LYS 168 N 0.12 1.23 -0.41 2.33 3.64 -1.37 0.10 116.57 122.22 3gwp h LYS 168 Ca 0.05 -0.07 -0.15 0.00 -1.27 0.00 0.00 60.65 59.20 3gwp h LYS 168 Cb 0.08 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 3gwp h LYS 168 CO -0.01 0.82 -0.35 0.28 -2.27 0.00 0.00 179.45 177.92 3gwp h VAL 169 N 1.27 1.27 -0.23 2.00 2.07 -1.19 -1.43 116.25 120.02 3gwp h VAL 169 Ca 0.35 -1.52 -0.14 0.00 0.82 0.00 0.00 66.70 66.21 3gwp h VAL 169 Cb -0.13 1.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 3gwp h VAL 169 CO -0.08 0.51 -0.39 -0.07 0.02 0.00 0.00 177.57 177.57 3gwp h LEU 170 N 0.78 0.73 -0.62 2.57 3.38 -0.89 -2.75 115.31 118.52 3gwp h LEU 170 Ca 0.07 -0.53 -0.05 0.00 0.09 0.00 0.00 57.88 57.47 3gwp h LEU 170 Cb 0.94 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 3gwp h LEU 170 CO 0.09 1.12 0.21 0.11 0.09 0.00 0.00 178.44 180.06 3gwp h LYS 171 N 0.37 0.95 0.00 1.13 1.57 -0.82 -3.02 116.57 116.76 3gwp h LYS 171 Ca 0.02 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3gwp h LYS 171 Cb 0.98 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.15 3gwp h LYS 171 CO 0.09 0.84 0.00 0.93 -0.57 0.00 0.00 179.45 180.73 3gwp h GLU 172 N 0.88 0.00 -2.97 3.15 5.08 -1.29 -3.41 114.58 116.03 3gwp h GLU 172 Ca 0.20 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 58.03 3gwp h GLU 172 Cb 0.27 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.12 3gwp h GLU 172 CO -0.01 0.00 -0.77 0.34 -1.00 0.00 0.00 179.01 177.57 3gwp s ASP 173 N -4.75 3.56 0.13 1.42 2.15 -1.04 -5.01 116.67 113.13 3gwp s ASP 173 Ca 0.06 -1.31 0.24 0.00 0.43 0.00 0.00 52.55 51.97 3gwp s ASP 173 Cb 0.10 -0.45 0.92 0.00 -0.30 0.00 0.00 42.92 43.19 3gwp s ASP 173 CO 0.51 -0.43 1.73 -0.62 -0.17 0.00 0.00 175.17 176.19 3gwp n GLU 174 N 5.17 0.12 0.28 4.34 1.02 -1.26 -3.23 120.64 127.09 3gwp n GLU 174 Ca -0.05 0.23 0.17 0.00 -0.02 0.00 0.00 57.16 57.48 3gwp n GLU 174 Cb 0.42 -1.68 0.69 0.00 -0.02 0.00 0.00 31.44 30.85 3gwp n GLU 174 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3gwp h SER 175 N 0.00 0.00 -2.45 1.62 4.64 -1.91 -3.43 113.55 112.02 3gwp h SER 175 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 3gwp h SER 175 Cb 0.47 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 3gwp h SER 175 CO 0.00 0.02 1.34 -0.63 -0.87 0.00 0.00 176.83 176.69 3gwp s ILE 176 N -3.69 3.33 -0.32 0.95 1.01 -1.20 -2.03 121.20 119.25 3gwp s ILE 176 Ca 0.01 0.34 0.13 0.00 0.00 0.00 0.00 60.65 61.13 3gwp s ILE 176 Cb 0.09 -3.43 -0.17 0.00 0.01 0.00 0.00 42.46 38.96 3gwp s ILE 176 CO 0.55 -0.27 0.43 0.35 0.00 0.00 0.00 174.94 176.00 3gwp n THR 177 N 7.46 0.00 -3.86 2.92 -2.24 -1.11 -4.89 114.28 112.56 3gwp n THR 177 Ca 0.25 -0.25 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 3gwp n THR 177 Cb 0.46 0.60 -0.14 0.00 -2.10 0.00 0.00 70.33 69.15 3gwp n THR 177 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3gwp s LEU 178 N -3.27 1.80 -0.13 3.22 0.20 -1.24 -0.79 118.68 118.47 3gwp s LEU 178 Ca 0.00 0.01 0.01 0.00 0.69 0.00 0.00 54.13 54.84 3gwp s LEU 178 Cb 0.09 -0.03 -0.00 0.00 -0.43 0.00 0.00 46.19 45.82 3gwp s LEU 178 CO 0.55 -0.03 -0.18 -0.69 -0.29 0.00 0.00 176.35 175.72 3gwp s VAL 179 N 0.23 2.57 -0.15 1.68 1.01 0.07 -2.18 120.40 123.64 3gwp s VAL 179 Ca -0.02 -0.82 -0.12 0.00 0.00 0.00 0.00 61.98 61.02 3gwp s VAL 179 Cb -0.03 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.25 3gwp s VAL 179 CO -0.01 0.53 0.24 -2.28 0.00 0.00 0.00 175.10 173.58 3gwp s HIS 180 N 0.53 3.50 -0.17 5.22 2.46 0.11 -0.99 115.29 125.94 3gwp s HIS 180 Ca -0.11 0.56 -0.01 0.00 0.47 0.00 0.00 55.06 55.96 3gwp s HIS 180 Cb -0.16 -2.22 0.05 0.00 -0.13 0.00 0.00 32.58 30.11 3gwp s HIS 180 CO 0.04 0.38 -0.03 0.42 -2.47 0.00 0.00 174.74 173.08 3gwp s ILE 181 N 0.03 0.96 -0.34 0.89 1.01 -0.18 -1.52 121.20 122.05 3gwp s ILE 181 Ca 0.15 -0.63 -0.17 0.00 0.00 0.00 0.00 60.65 60.00 3gwp s ILE 181 Cb -0.13 -1.23 -0.01 0.00 0.01 0.00 0.00 42.46 41.11 3gwp s ILE 181 CO 0.03 0.03 0.48 -1.58 0.00 0.00 0.00 174.94 173.90 3gwp s GLN 182 N 1.69 3.63 0.03 2.79 0.74 -1.26 -0.32 119.66 126.94 3gwp s GLN 182 Ca -0.00 -0.20 -0.18 0.00 0.05 0.00 0.00 55.36 55.03 3gwp s GLN 182 Cb -0.16 -3.80 -0.22 0.00 1.10 0.00 0.00 33.01 29.94 3gwp s GLN 182 CO -0.07 -0.60 1.15 -0.09 -0.55 0.00 0.00 175.29 175.13 3gwp h ARG 183 N 8.44 0.48 -6.98 1.67 2.43 -1.83 -3.46 114.38 115.13 3gwp h ARG 183 Ca -0.28 -0.47 -0.51 0.00 -0.81 0.00 0.00 59.98 57.90 3gwp h ARG 183 Cb 1.13 0.12 0.07 0.00 -0.42 0.00 0.00 29.97 30.87 3gwp h ARG 183 CO 0.75 1.12 0.52 0.45 -1.51 0.00 0.00 179.97 181.30 3gwp s SER 184 N -6.79 6.21 -0.02 -3.80 0.15 -1.26 -4.11 113.70 104.08 3gwp s SER 184 Ca -0.13 2.42 -0.25 0.00 0.70 0.00 0.00 55.95 58.69 3gwp s SER 184 Cb 0.05 -2.61 -0.19 0.00 -1.71 0.00 0.00 66.02 61.56 3gwp s SER 184 CO 0.84 -0.90 1.21 0.74 1.20 0.00 0.00 173.24 176.33 3gwp h THR 185 N 2.06 1.14 0.00 6.45 2.02 -1.95 -3.49 112.91 119.14 3gwp h THR 185 Ca -0.49 -0.99 0.00 0.00 0.77 0.00 0.00 66.41 65.70 3gwp h THR 185 Cb 1.25 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 69.41 3gwp h THR 185 CO 0.61 0.24 0.00 0.61 0.37 0.00 0.00 175.52 177.35 3gwp n GLY 186 N 0.13 0.99 2.50 2.16 0.00 -1.26 -3.97 105.19 105.74 3gwp n GLY 186 Ca -0.09 -0.64 -0.40 0.00 0.00 0.00 0.00 46.02 44.89 3gwp n GLY 186 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3gwp n TYR 187 N 12.44 2.61 -3.91 1.61 4.02 -1.26 -4.90 117.16 127.78 3gwp n TYR 187 Ca 0.00 -2.84 -0.10 0.00 -0.01 0.00 0.00 57.90 54.95 3gwp n TYR 187 Cb 0.00 -1.88 -0.10 0.00 -0.02 0.00 0.00 39.34 37.34 3gwp n TYR 187 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 3gwp s GLY 188 N 0.51 0.11 -0.90 2.72 0.00 -1.25 -5.09 107.32 103.42 3gwp s GLY 188 Ca 0.54 -0.29 -0.00 0.00 0.00 0.00 0.00 44.72 44.97 3gwp s GLY 188 CO -0.09 -0.40 1.09 1.87 0.00 0.00 0.00 173.10 175.57 3gwp n TRP 189 N 1.46 3.24 -4.14 1.90 -0.00 -1.26 -5.01 117.44 113.63 3gwp n TRP 189 Ca -0.23 -3.47 -0.11 0.00 -0.00 0.00 0.00 57.50 53.69 3gwp n TRP 189 Cb 0.55 -1.02 -0.09 0.00 -0.00 0.00 0.00 31.31 30.76 3gwp n TRP 189 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 177.69 178.72 3gwp s ARG 190 N -2.35 1.19 0.48 5.87 1.81 -1.26 -5.09 118.95 119.59 3gwp s ARG 190 Ca 0.33 -1.49 -0.22 0.00 -1.72 0.00 0.00 55.73 52.63 3gwp s ARG 190 Cb 0.05 0.30 -0.07 0.00 -0.45 0.00 0.00 34.95 34.78 3gwp s ARG 190 CO 0.01 -0.40 1.17 -0.98 -0.68 0.00 0.00 175.30 174.42 3gwp s ARG 191 N -4.10 3.68 0.54 3.54 3.03 -1.26 -4.87 118.95 119.51 3gwp s ARG 191 Ca 0.31 1.76 -0.21 0.00 2.03 0.00 0.00 55.73 59.63 3gwp s ARG 191 Cb 0.06 -2.34 -0.05 0.00 -1.03 0.00 0.00 34.95 31.59 3gwp s ARG 191 CO 0.08 -0.62 1.24 0.00 -1.13 0.00 0.00 175.30 174.88 3gwp s ALA 192 N -1.57 2.74 -0.57 7.88 0.00 -1.26 -4.88 121.76 124.10 3gwp s ALA 192 Ca 0.65 1.09 -0.21 0.00 0.00 0.00 0.00 51.96 53.50 3gwp s ALA 192 Cb -0.28 -3.47 0.06 0.00 0.00 0.00 0.00 23.12 19.43 3gwp s ALA 192 CO 0.34 -1.10 0.79 -1.17 0.00 0.00 0.00 175.76 174.62 3gwp s LEU 193 N -3.63 4.70 0.81 0.00 2.96 -1.26 -4.90 118.68 117.37 3gwp s LEU 193 Ca 0.72 -0.89 -0.11 0.00 -0.22 0.00 0.00 54.13 53.63 3gwp s LEU 193 Cb -0.33 -2.51 0.10 0.00 0.50 0.00 0.00 46.19 43.95 3gwp s LEU 193 CO 0.38 -1.14 1.16 -0.76 -1.32 0.00 0.00 176.35 174.67 3gwp s LEU 194 N 3.28 2.65 0.20 -0.68 1.43 -1.26 -4.69 118.68 119.61 3gwp s LEU 194 Ca 0.20 0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 53.72 3gwp s LEU 194 Cb -0.18 -2.97 0.15 0.00 0.03 0.00 0.00 46.19 43.22 3gwp s LEU 194 CO 0.12 -2.00 1.86 0.40 0.23 0.00 0.00 176.35 176.96 3gwp h ILE 195 N -1.04 1.14 -0.79 -0.59 1.08 -1.95 -1.26 117.51 114.10 3gwp h ILE 195 Ca -0.45 -0.31 0.15 0.00 -0.39 0.00 0.00 64.86 63.87 3gwp h ILE 195 Cb 1.30 0.17 -0.10 0.00 -3.07 0.00 0.00 36.82 35.13 3gwp h ILE 195 CO 0.57 0.16 0.34 -0.08 -0.69 0.00 0.00 178.15 178.46 3gwp h GLU 196 N 0.89 0.47 -0.26 2.37 4.81 -2.00 0.70 114.58 121.57 3gwp h GLU 196 Ca 0.26 -0.03 -0.17 0.00 -0.13 0.00 0.00 59.36 59.29 3gwp h GLU 196 Cb -0.05 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.22 3gwp h GLU 196 CO -0.08 0.31 -0.54 -0.44 -0.73 0.00 0.00 179.01 177.54 3gwp h ASP 197 N 0.49 0.85 -0.77 1.04 3.32 -1.77 -3.08 116.42 116.50 3gwp h ASP 197 Ca 0.44 -0.45 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 3gwp h ASP 197 Cb 0.67 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 3gwp h ASP 197 CO -0.40 1.22 0.30 0.40 -1.72 0.00 0.00 179.24 179.03 3gwp h ILE 198 N 0.59 1.26 -0.75 0.35 2.04 -0.14 -2.55 117.51 118.31 3gwp h ILE 198 Ca 0.02 -0.82 0.03 0.00 1.00 0.00 0.00 64.86 65.08 3gwp h ILE 198 Cb 1.12 0.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 3gwp h ILE 198 CO 0.11 0.33 0.50 0.50 0.00 0.00 0.00 178.15 179.59 3gwp h LYS 199 N 1.13 0.91 -0.39 2.37 3.64 -0.87 -1.38 116.57 121.99 3gwp h LYS 199 Ca 0.26 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.56 3gwp h LYS 199 Cb 0.22 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 3gwp h LYS 199 CO -0.02 0.60 0.16 0.77 -2.27 0.00 0.00 179.45 178.70 3gwp h SER 200 N 0.94 0.53 -0.47 4.20 0.02 -1.38 -1.06 113.55 116.33 3gwp h SER 200 Ca 0.29 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 3gwp h SER 200 Cb 0.01 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 3gwp h SER 200 CO -0.08 0.54 0.27 0.40 -1.14 0.00 0.00 176.83 176.82 3gwp h ILE 201 N 0.48 1.16 0.57 3.27 2.04 -1.05 -0.94 117.51 123.04 3gwp h ILE 201 Ca 0.13 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 3gwp h ILE 201 Cb 0.17 0.56 0.01 0.00 -0.74 0.00 0.00 36.82 36.82 3gwp h ILE 201 CO -0.01 0.16 -0.28 0.58 0.00 0.00 0.00 178.15 178.61 3gwp h VAL 202 N 0.62 0.00 -0.93 1.67 2.07 -1.22 -1.91 116.25 116.54 3gwp h VAL 202 Ca 0.17 -0.21 0.27 0.00 0.82 0.00 0.00 66.70 67.75 3gwp h VAL 202 Cb 0.03 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.65 3gwp h VAL 202 CO -0.03 0.00 0.36 0.44 0.02 0.00 0.00 177.57 178.36 3gwp h ASP 203 N -0.98 0.18 0.22 0.57 3.32 -1.21 0.28 116.42 118.81 3gwp h ASP 203 Ca -0.08 0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 3gwp h ASP 203 Cb 0.59 0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.37 3gwp h ASP 203 CO 0.13 -0.16 -0.11 0.00 -1.72 0.00 0.00 179.24 177.38 3gwp h VAL 205 N -0.49 1.43 0.00 0.00 -1.51 -0.43 -3.10 116.25 112.15 3gwp h VAL 205 Ca -0.03 -2.21 -0.08 0.00 -1.23 0.00 0.00 66.70 63.14 3gwp h VAL 205 Cb 0.37 2.17 -0.01 0.00 -2.13 0.00 0.00 31.29 31.69 3gwp h VAL 205 CO 0.05 0.65 -0.40 0.50 -1.23 0.00 0.00 177.57 177.14 3gwp h LYS 206 N 0.15 0.00 -0.29 5.19 1.63 -0.52 -2.54 116.57 120.18 3gwp h LYS 206 Ca -0.02 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.63 3gwp h LYS 206 Cb 1.25 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.87 3gwp h LYS 206 CO 0.11 0.40 -0.44 -0.97 -3.45 0.00 0.00 179.45 175.10 3gwp h ASN 207 N 0.00 0.78 -0.11 4.20 -1.24 -1.22 -2.89 115.58 115.11 3gwp h ASN 207 Ca -0.00 -0.37 -0.10 0.00 0.71 0.00 0.00 56.30 56.53 3gwp h ASN 207 Cb 0.99 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 39.82 3gwp h ASN 207 CO 0.05 1.11 -0.34 0.40 -1.29 0.00 0.00 177.43 177.36 3gwp h ILE 208 N 0.58 1.39 -1.31 2.57 2.04 -1.49 -3.45 117.51 117.85 3gwp h ILE 208 Ca 0.04 -1.66 -0.00 0.00 1.00 0.00 0.00 64.86 64.24 3gwp h ILE 208 Cb 0.99 2.16 -0.24 0.00 -0.74 0.00 0.00 36.82 38.99 3gwp h ILE 208 CO 0.09 0.49 -0.35 -0.60 0.00 0.00 0.00 178.15 177.78 3gwp s ARG 209 N -3.82 0.49 0.50 2.37 3.52 -0.97 -5.05 118.95 115.99 3gwp s ARG 209 Ca -0.14 0.79 0.16 0.00 -0.13 0.00 0.00 55.73 56.42 3gwp s ARG 209 Cb 0.05 0.18 1.21 0.00 -1.56 0.00 0.00 34.95 34.83 3gwp s ARG 209 CO 0.79 -0.68 2.10 -0.22 -0.81 0.00 0.00 175.30 176.49 3gwp h LYS 210 N 8.06 0.00 0.00 5.12 3.11 -1.75 -2.84 116.57 128.27 3gwp h LYS 210 Ca -0.20 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.64 3gwp h LYS 210 Cb 1.16 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.39 3gwp h LYS 210 CO 0.26 0.06 0.00 -0.25 -2.81 0.00 0.00 179.45 176.71 3gwp n ASP 211 N -4.43 0.00 -4.75 4.20 8.00 -1.26 -4.79 116.55 113.52 3gwp n ASP 211 Ca -0.03 0.20 -0.41 0.00 0.71 0.00 0.00 54.79 55.26 3gwp n ASP 211 Cb 0.14 -0.36 -0.03 0.00 -0.02 0.00 0.00 41.12 40.85 3gwp n ASP 211 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3gwp s ILE 212 N -2.71 3.41 -0.22 0.53 1.01 -1.07 -4.96 121.20 117.18 3gwp s ILE 212 Ca 0.13 1.24 -0.19 0.00 0.00 0.00 0.00 60.65 61.83 3gwp s ILE 212 Cb 0.11 -3.79 -0.03 0.00 0.01 0.00 0.00 42.46 38.76 3gwp s ILE 212 CO 0.26 0.23 0.57 -0.63 0.00 0.00 0.00 174.94 175.37 3gwp s ILE 213 N -0.37 5.05 -0.89 2.92 1.01 0.03 -4.95 121.20 124.01 3gwp s ILE 213 Ca 0.51 1.03 -0.17 0.00 0.00 0.00 0.00 60.65 62.03 3gwp s ILE 213 Cb -0.34 -3.88 0.17 0.00 0.01 0.00 0.00 42.46 38.42 3gwp s ILE 213 CO 0.40 0.11 0.97 0.00 0.00 0.00 0.00 174.94 176.42 3gwp s PHE 215 N 1.62 3.67 -0.17 0.00 5.36 -0.17 -2.57 117.98 125.74 3gwp s PHE 215 Ca 0.26 1.45 0.00 0.00 -0.96 0.00 0.00 56.93 57.69 3gwp s PHE 215 Cb -0.07 -2.87 0.03 0.00 -0.34 0.00 0.00 43.02 39.77 3gwp s PHE 215 CO -0.09 0.16 -0.12 0.08 -1.46 0.00 0.00 175.22 173.79 3gwp s VAL 216 N 0.41 1.52 -0.42 3.12 1.01 -0.39 -1.01 120.40 124.64 3gwp s VAL 216 Ca 0.41 -0.74 -0.28 0.00 0.00 0.00 0.00 61.98 61.37 3gwp s VAL 216 Cb -0.20 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.66 3gwp s VAL 216 CO 0.22 0.32 1.69 -0.62 0.00 0.00 0.00 175.10 176.72 3gwp s ASP 217 N 1.48 5.90 -0.10 3.32 -1.08 0.56 -2.71 116.67 124.04 3gwp s ASP 217 Ca 0.02 0.92 0.15 0.00 -0.52 0.00 0.00 52.55 53.13 3gwp s ASP 217 Cb -0.14 -2.53 0.61 0.00 -1.46 0.00 0.00 42.92 39.40 3gwp s ASP 217 CO -0.09 -1.77 1.50 -3.20 0.52 0.00 0.00 175.17 172.12 3gwp n ASN 218 N 10.35 4.10 -4.78 -0.34 5.15 -0.27 -2.54 115.26 126.94 3gwp n ASN 218 Ca 0.20 -2.37 -0.41 0.00 -0.60 0.00 0.00 54.58 51.40 3gwp n ASN 218 Cb 0.48 -0.53 -0.00 0.00 -0.53 0.00 0.00 39.78 39.20 3gwp n ASN 218 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gwp n TYR 220 N 0.45 0.00 0.18 0.00 4.01 -1.26 -4.32 117.16 116.22 3gwp n TYR 220 Ca 0.01 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.82 3gwp n TYR 220 Cb 0.40 -0.83 0.13 0.00 -0.31 0.00 0.00 39.34 38.73 3gwp n TYR 220 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3gwp n GLY 221 N -2.00 1.36 3.70 2.72 0.00 -1.07 -3.05 105.19 106.85 3gwp n GLY 221 Ca 0.00 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 3gwp n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gwp s GLU 222 N -1.09 4.30 -0.34 1.61 8.01 -1.25 -4.62 118.70 125.30 3gwp s GLU 222 Ca 0.23 2.07 -0.05 0.00 0.01 0.00 0.00 54.97 57.23 3gwp s GLU 222 Cb 0.14 -3.38 0.01 0.00 -4.31 0.00 0.00 34.13 26.59 3gwp s GLU 222 CO 0.19 -0.51 0.18 1.19 0.01 0.00 0.00 175.26 176.33 3gwp n PHE 223 N 4.52 -3.83 -0.64 1.61 3.72 -1.26 -4.82 117.46 116.76 3gwp n PHE 223 Ca 0.12 1.66 -0.23 0.00 -0.05 0.00 0.00 57.45 58.95 3gwp n PHE 223 Cb 0.43 -4.03 0.02 0.00 -0.94 0.00 0.00 39.48 34.96 3gwp n PHE 223 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3gwp n ASP 225 N 0.39 -3.67 0.04 4.37 2.03 -1.26 -4.90 116.55 113.55 3gwp n ASP 225 Ca 0.04 0.10 0.03 0.00 0.52 0.00 0.00 54.79 55.48 3gwp n ASP 225 Cb 0.14 -0.47 0.40 0.00 -0.72 0.00 0.00 41.12 40.47 3gwp n ASP 225 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 3gwp h THR 226 N -0.64 1.14 -2.58 5.18 1.35 -1.99 -3.43 112.91 111.94 3gwp h THR 226 Ca -0.28 -0.45 -0.47 0.00 -0.55 0.00 0.00 66.41 64.66 3gwp h THR 226 Cb 0.84 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 3gwp h THR 226 CO 0.15 0.17 -0.29 -0.54 -0.25 0.00 0.00 175.52 174.75 3gwp s LYS 227 N -5.18 3.47 0.37 4.72 1.02 -1.26 -4.92 119.74 117.96 3gwp s LYS 227 Ca -0.07 -0.49 0.07 0.00 0.02 0.00 0.00 55.97 55.49 3gwp s LYS 227 Cb 0.16 -2.76 -0.07 0.00 -0.52 0.00 0.00 37.83 34.64 3gwp s LYS 227 CO 0.74 0.27 -0.00 -1.21 -0.92 0.00 0.00 175.35 174.23 3gwp s GLU 228 N -4.12 1.83 0.43 1.68 0.41 -1.26 -4.91 118.70 112.77 3gwp s GLU 228 Ca 0.38 -2.01 0.13 0.00 -0.41 0.00 0.00 54.97 53.06 3gwp s GLU 228 Cb -0.09 -1.43 1.02 0.00 -1.78 0.00 0.00 34.13 31.85 3gwp s GLU 228 CO 0.33 -0.05 1.99 -1.35 -0.49 0.00 0.00 175.26 175.69 3gwp h PRO 229 N 1.93 0.40 0.00 0.39 0.11 -1.96 -1.13 132.00 131.73 3gwp h PRO 229 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3gwp h PRO 229 Cb 1.24 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3gwp h PRO 229 CO 0.76 0.26 0.00 1.79 -0.21 0.00 0.00 178.00 180.60 3gwp h THR 230 N 0.41 0.00 0.00 -1.15 1.35 -1.83 -1.70 112.91 109.99 3gwp h THR 230 Ca 0.26 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.88 3gwp h THR 230 Cb 0.50 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.02 3gwp h THR 230 CO -0.07 0.00 -0.28 0.47 -0.25 0.00 0.00 175.52 175.39 3gwp n ASP 231 N -2.76 0.39 -1.10 5.36 8.00 -0.43 -3.86 116.55 122.16 3gwp n ASP 231 Ca -0.00 0.18 -0.04 0.00 0.71 0.00 0.00 54.79 55.64 3gwp n ASP 231 Cb 0.19 -0.16 0.19 0.00 -0.02 0.00 0.00 41.12 41.32 3gwp n ASP 231 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3gwp n VAL 232 N -1.69 2.49 -0.43 2.53 0.24 -0.67 -4.97 118.33 115.83 3gwp n VAL 232 Ca 0.06 -3.00 0.00 0.00 -2.04 0.00 0.00 64.34 59.35 3gwp n VAL 232 Cb 0.36 -0.37 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3gwp n VAL 232 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3gwp n GLY 233 N -1.10 0.76 3.69 7.63 0.00 -1.22 -4.62 105.19 110.33 3gwp n GLY 233 Ca 0.31 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.91 3gwp n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gwp s ALA 234 N -2.32 3.66 0.16 4.61 0.00 -1.01 -4.90 121.76 121.97 3gwp s ALA 234 Ca 0.00 1.13 0.23 0.00 0.00 0.00 0.00 51.96 53.31 3gwp s ALA 234 Cb 0.00 -3.65 0.90 0.00 0.00 0.00 0.00 23.12 20.37 3gwp s ALA 234 CO 0.00 -0.97 1.82 -0.44 0.00 0.00 0.00 175.76 176.17 3gwp h ASP 235 N 7.89 0.00 -3.67 0.00 3.32 -1.85 -3.42 116.42 118.69 3gwp h ASP 235 Ca -0.41 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.65 3gwp h ASP 235 Cb 1.20 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.51 3gwp h ASP 235 CO 0.91 0.25 0.29 -0.22 -1.72 0.00 0.00 179.24 178.76 3gwp s LEU 236 N -6.90 -0.60 0.11 1.55 2.96 -1.22 -2.19 118.68 112.39 3gwp s LEU 236 Ca 0.00 1.14 0.03 0.00 -0.22 0.00 0.00 54.13 55.08 3gwp s LEU 236 Cb 0.11 2.19 -0.04 0.00 0.50 0.00 0.00 46.19 48.95 3gwp s LEU 236 CO 0.65 -0.22 -0.08 0.27 -1.32 0.00 0.00 176.35 175.65 3gwp s ILE 237 N 0.23 0.86 -0.03 6.68 -4.36 0.17 -1.26 121.20 123.50 3gwp s ILE 237 Ca 0.01 -1.89 -0.15 0.00 -0.26 0.00 0.00 60.65 58.37 3gwp s ILE 237 Cb -0.05 -1.63 0.02 0.00 1.25 0.00 0.00 42.46 42.05 3gwp s ILE 237 CO -0.02 -0.77 0.32 0.00 0.24 0.00 0.00 174.94 174.71 3gwp s ALA 238 N -3.26 -0.80 0.37 2.27 0.00 -1.10 -1.92 121.76 117.32 3gwp s ALA 238 Ca 0.11 0.39 -0.16 0.00 0.00 0.00 0.00 51.96 52.31 3gwp s ALA 238 Cb 0.03 0.01 0.06 0.00 0.00 0.00 0.00 23.12 23.22 3gwp s ALA 238 CO -0.02 -0.25 0.83 0.20 0.00 0.00 0.00 175.76 176.51 3gwp s GLY 239 N -1.18 0.38 -0.03 0.00 0.00 -0.80 -1.11 107.32 104.57 3gwp s GLY 239 Ca -0.12 -0.74 -0.01 0.00 0.00 0.00 0.00 44.72 43.85 3gwp s GLY 239 CO 0.04 0.03 0.06 -0.45 0.00 0.00 0.00 173.10 172.78 3gwp s SER 240 N -3.13 5.56 0.11 1.64 0.15 -1.26 -1.36 113.70 115.42 3gwp s SER 240 Ca 0.17 0.15 0.26 0.00 0.70 0.00 0.00 55.95 57.23 3gwp s SER 240 Cb -0.05 -1.59 0.82 0.00 -1.71 0.00 0.00 66.02 63.50 3gwp s SER 240 CO 0.11 0.31 1.70 0.18 1.20 0.00 0.00 173.24 176.74 3gwp n LEU 241 N 1.47 0.54 -2.05 3.45 4.77 0.04 -4.56 117.00 120.66 3gwp n LEU 241 Ca -0.15 0.44 -0.18 0.00 -0.03 0.00 0.00 56.01 56.09 3gwp n LEU 241 Cb 0.53 -0.34 -0.01 0.00 -2.33 0.00 0.00 43.42 41.28 3gwp n LEU 241 CO 0.35 -0.08 1.34 2.30 -1.33 0.00 0.00 177.39 179.97 3gwp n ILE 242 N -1.95 2.90 -0.05 -0.08 -5.35 -1.26 -3.14 119.36 110.43 3gwp n ILE 242 Ca 0.06 -1.96 -0.01 0.00 -0.27 0.00 0.00 62.75 60.56 3gwp n ILE 242 Cb 0.40 -1.46 -0.01 0.00 -1.74 0.00 0.00 39.64 36.82 3gwp n ILE 242 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3gwp n ASN 244 N 0.71 -0.13 0.30 7.28 4.13 -1.26 -2.46 115.26 123.83 3gwp n ASN 244 Ca 0.34 0.41 0.19 0.00 1.68 0.00 0.00 54.58 57.20 3gwp n ASN 244 Cb 0.59 -0.12 0.93 0.00 -1.54 0.00 0.00 39.78 39.64 3gwp n ASN 244 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 3gwp h ILE 245 N 0.00 0.13 0.00 2.41 2.10 -1.87 -1.53 117.51 118.75 3gwp h ILE 245 Ca 0.02 -0.29 0.00 0.00 1.08 0.00 0.00 64.86 65.67 3gwp h ILE 245 Cb 0.05 1.25 0.00 0.00 -1.09 0.00 0.00 36.82 37.03 3gwp h ILE 245 CO -0.12 0.02 0.00 0.61 -1.08 0.00 0.00 178.15 177.59 3gwp n GLY 246 N -0.62 -1.51 2.46 8.18 0.00 -1.19 -3.45 105.19 109.07 3gwp n GLY 246 Ca -0.02 -0.05 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 3gwp n GLY 246 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gwp n GLY 247 N 1.13 0.45 3.21 -0.02 0.00 -0.58 -2.03 105.19 107.35 3gwp n GLY 247 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3gwp n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gwp n GLY 248 N -0.76 2.48 0.13 -0.02 0.00 -1.26 -4.79 105.19 100.98 3gwp n GLY 248 Ca -0.23 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.58 3gwp n GLY 248 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3gwp n ILE 249 N -2.00 1.55 -1.72 -0.61 5.41 -0.91 -4.84 119.36 116.23 3gwp n ILE 249 Ca 0.00 -0.51 -0.61 0.00 1.00 0.00 0.00 62.75 62.63 3gwp n ILE 249 Cb 0.00 -1.62 -0.08 0.00 -0.71 0.00 0.00 39.64 37.23 3gwp n ILE 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3gwp n ALA 250 N -3.46 -0.66 -0.02 -1.39 0.00 -0.86 -4.88 120.51 109.25 3gwp n ALA 250 Ca -0.45 0.43 -0.08 0.00 0.00 0.00 0.00 53.44 53.34 3gwp n ALA 250 Cb 0.96 -2.11 0.08 0.00 0.00 0.00 0.00 19.45 18.38 3gwp n ALA 250 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3gwp h PRO 251 N 6.34 0.60 0.00 0.00 0.13 -1.90 -3.43 132.00 133.76 3gwp h PRO 251 Ca -0.46 -0.32 0.00 0.00 -0.87 0.00 0.00 66.00 64.35 3gwp h PRO 251 Cb 1.34 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.48 3gwp h PRO 251 CO 0.96 0.92 0.00 -2.37 -0.23 0.00 0.00 178.00 177.28 3gwp n THR 252 N -4.02 0.00 0.00 1.56 5.66 -1.26 -4.85 114.28 111.36 3gwp n THR 252 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 3gwp n THR 252 Cb 0.53 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 3gwp n THR 252 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3gwp n GLY 253 N 0.00 0.30 3.52 1.09 0.00 -1.16 -4.68 105.19 104.26 3gwp n GLY 253 Ca 0.00 -1.99 -0.12 0.00 0.00 0.00 0.00 46.02 43.91 3gwp n GLY 253 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gwp s GLY 254 N -0.47 1.06 0.14 -0.02 0.00 -0.75 -0.78 107.32 106.48 3gwp s GLY 254 Ca 0.00 -1.24 -0.00 0.00 0.00 0.00 0.00 44.72 43.47 3gwp s GLY 254 CO 0.00 -0.85 0.04 -2.52 0.00 0.00 0.00 173.10 169.77 3gwp s TYR 255 N -3.47 0.92 -0.05 1.90 1.13 -0.46 -2.27 117.35 115.05 3gwp s TYR 255 Ca 0.27 -1.18 -0.12 0.00 -1.41 0.00 0.00 57.07 54.64 3gwp s TYR 255 Cb -0.00 -0.52 0.02 0.00 -1.10 0.00 0.00 41.96 40.36 3gwp s TYR 255 CO 0.15 -0.44 0.27 -0.51 -2.51 0.00 0.00 175.55 172.51 3gwp s LEU 256 N -3.07 0.99 -0.14 -3.49 1.43 -0.73 -1.91 118.68 111.76 3gwp s LEU 256 Ca 0.23 0.22 -0.09 0.00 -1.03 0.00 0.00 54.13 53.46 3gwp s LEU 256 Cb 0.07 1.07 0.05 0.00 0.03 0.00 0.00 46.19 47.41 3gwp s LEU 256 CO 0.02 -0.31 0.35 0.00 0.23 0.00 0.00 176.35 176.64 3gwp s ALA 257 N -0.80 -0.86 0.00 4.21 0.00 -0.81 -0.50 121.76 123.00 3gwp s ALA 257 Ca -0.09 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.13 3gwp s ALA 257 Cb -0.04 -0.77 0.00 0.00 0.00 0.00 0.00 23.12 22.31 3gwp s ALA 257 CO 0.02 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.97 3gwp n GLY 258 N 3.96 -0.68 3.78 0.00 0.00 -0.86 -0.65 105.19 110.73 3gwp n GLY 258 Ca -0.22 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 44.98 3gwp n GLY 258 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gwp s THR 259 N -3.78 3.36 0.40 2.61 -4.23 -0.93 -0.93 115.64 112.14 3gwp s THR 259 Ca 0.00 0.76 0.11 0.00 -1.18 0.00 0.00 61.69 61.38 3gwp s THR 259 Cb 0.00 -3.28 0.32 0.00 1.34 0.00 0.00 72.50 70.88 3gwp s THR 259 CO 0.00 -0.27 1.95 0.50 -0.54 0.00 0.00 174.62 176.26 3gwp h LYS 260 N 0.85 0.54 -0.02 3.99 1.63 -1.89 -1.57 116.57 120.10 3gwp h LYS 260 Ca -0.49 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.28 3gwp h LYS 260 Cb 1.25 -0.12 -0.00 0.00 -0.60 0.00 0.00 32.23 32.75 3gwp h LYS 260 CO 0.57 0.36 0.00 0.22 -3.45 0.00 0.00 179.45 177.15 3gwp h ASP 261 N 0.56 0.03 -0.35 4.20 3.58 -1.98 -0.65 116.42 121.81 3gwp h ASP 261 Ca 0.33 -0.24 -0.03 0.00 0.42 0.00 0.00 57.03 57.50 3gwp h ASP 261 Cb 0.53 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.55 3gwp h ASP 261 CO -0.11 0.27 0.10 0.00 -2.88 0.00 0.00 179.24 176.61 3gwp h ILE 263 N 0.42 1.15 -0.38 0.00 1.08 -1.28 0.11 117.51 118.61 3gwp h ILE 263 Ca 0.11 -0.38 -0.03 0.00 -0.39 0.00 0.00 64.86 64.17 3gwp h ILE 263 Cb 0.28 0.72 -0.02 0.00 -3.07 0.00 0.00 36.82 34.74 3gwp h ILE 263 CO -0.00 0.15 0.13 -0.33 -0.69 0.00 0.00 178.15 177.41 3gwp h GLU 264 N 0.47 0.58 -0.56 2.37 5.08 -1.10 -0.13 114.58 121.28 3gwp h GLU 264 Ca 0.13 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 3gwp h GLU 264 Cb 0.06 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 3gwp h GLU 264 CO -0.02 0.58 0.31 0.87 -1.00 0.00 0.00 179.01 179.75 3gwp h LYS 265 N 0.46 0.77 -0.19 2.33 1.57 -1.12 -2.30 116.57 118.09 3gwp h LYS 265 Ca 0.12 -0.08 -0.17 0.00 -1.87 0.00 0.00 60.65 58.66 3gwp h LYS 265 Cb 0.23 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 3gwp h LYS 265 CO -0.01 0.57 -0.57 1.15 -0.57 0.00 0.00 179.45 180.01 3gwp h THR 266 N 0.78 1.32 0.00 -0.16 2.02 -0.48 -3.19 112.91 113.20 3gwp h THR 266 Ca 0.20 -1.82 -0.07 0.00 0.77 0.00 0.00 66.41 65.49 3gwp h THR 266 Cb 0.02 1.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 3gwp h THR 266 CO -0.03 0.57 -0.31 0.77 0.37 0.00 0.00 175.52 176.89 3gwp h SER 267 N 0.46 0.00 0.95 4.18 4.64 -0.49 -1.98 113.55 121.31 3gwp h SER 267 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 3gwp h SER 267 Cb 1.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3gwp h SER 267 CO 0.11 0.31 -0.07 1.88 -0.87 0.00 0.00 176.83 178.19 3gwp h TYR 268 N 0.00 0.00 0.20 4.77 0.05 -1.42 -1.21 116.97 119.35 3gwp h TYR 268 Ca -0.00 0.00 -0.33 0.00 0.05 0.00 0.00 58.73 58.45 3gwp h TYR 268 Cb 0.56 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.32 3gwp h TYR 268 CO 0.00 0.07 -1.57 -0.09 -1.05 0.00 0.00 178.16 175.52 3gwp h ARG 269 N 0.00 0.42 -0.50 4.88 9.65 -1.48 -2.72 114.38 124.63 3gwp h ARG 269 Ca -0.00 -0.71 0.08 0.00 -1.10 0.00 0.00 59.98 58.25 3gwp h ARG 269 Cb 0.57 0.27 -0.07 0.00 -1.39 0.00 0.00 29.97 29.35 3gwp h ARG 269 CO 0.01 1.34 0.12 1.25 2.80 0.00 0.00 179.97 185.49 3gwp h LEU 270 N 0.04 0.04 0.00 3.80 5.85 -1.09 -3.43 115.31 120.52 3gwp h LEU 270 Ca -0.30 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.50 3gwp h LEU 270 Cb 2.05 0.10 0.00 0.00 0.37 0.00 0.00 40.66 43.18 3gwp h LEU 270 CO 0.19 0.05 0.00 0.41 -0.34 0.00 0.00 178.44 178.75 3gwp n THR 271 N -5.09 0.00 -3.78 1.05 -1.04 -0.48 -5.11 114.28 99.83 3gwp n THR 271 Ca 0.05 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.96 3gwp n THR 271 Cb 0.24 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.68 3gwp n THR 271 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 3gwp s VAL 272 N 1.80 0.11 0.30 12.58 -7.23 -1.03 -4.91 120.40 122.01 3gwp s VAL 272 Ca 0.00 -0.88 -0.29 0.00 -1.81 0.00 0.00 61.98 59.00 3gwp s VAL 272 Cb 0.00 -1.14 -0.11 0.00 0.56 0.00 0.00 36.38 35.69 3gwp s VAL 272 CO 0.00 -0.49 1.47 -2.84 -0.31 0.00 0.00 175.10 172.93 3gwp s PRO 273 N -3.33 4.21 0.00 4.82 0.02 -1.23 -1.96 135.00 137.54 3gwp s PRO 273 Ca 0.01 2.41 0.00 0.00 0.02 0.00 0.00 61.00 63.43 3gwp s PRO 273 Cb 0.02 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.48 3gwp s PRO 273 CO -0.08 -0.46 0.00 0.41 -0.33 0.00 0.00 177.00 176.54 3gwp n GLY 274 N 1.67 3.20 0.81 0.52 0.00 -1.26 -4.83 105.19 105.31 3gwp n GLY 274 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 3gwp n GLY 274 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3gwp n ILE 275 N -1.45 1.23 0.00 -0.61 5.41 -1.08 -5.05 119.36 117.81 3gwp n ILE 275 Ca 0.00 0.33 0.00 0.00 1.00 0.00 0.00 62.75 64.08 3gwp n ILE 275 Cb 0.00 -1.74 0.00 0.00 -0.71 0.00 0.00 39.64 37.19 3gwp n ILE 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3gwp n GLY 276 N 3.01 3.30 1.80 7.39 0.00 -0.83 -2.38 105.19 117.48 3gwp n GLY 276 Ca -0.03 -0.13 0.07 0.00 0.00 0.00 0.00 46.02 45.93 3gwp n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gwp n GLY 277 N 0.00 3.04 0.20 -0.02 0.00 -1.26 -4.38 105.19 102.76 3gwp n GLY 277 Ca 0.00 -0.93 0.07 0.00 0.00 0.00 0.00 46.02 45.17 3gwp n GLY 277 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3gwp h GLU 278 N 3.89 0.00 -6.23 1.61 4.57 -1.88 -3.44 114.58 113.10 3gwp h GLU 278 Ca 0.00 0.00 -0.61 0.00 -1.18 0.00 0.00 59.36 57.57 3gwp h GLU 278 Cb 1.89 0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 30.34 3gwp h GLU 278 CO 0.45 0.31 -0.76 0.00 -1.18 0.00 0.00 179.01 177.83 3gwp n GLY 280 N -0.57 2.01 3.78 0.00 0.00 0.22 -4.99 105.19 105.64 3gwp n GLY 280 Ca -0.05 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.31 3gwp n GLY 280 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gwp s SER 281 N 0.00 6.03 -0.01 1.61 0.01 -1.18 -4.78 113.70 115.37 3gwp s SER 281 Ca 0.00 2.14 0.18 0.00 1.31 0.00 0.00 55.95 59.57 3gwp s SER 281 Cb 0.00 -2.58 0.53 0.00 0.21 0.00 0.00 66.02 64.18 3gwp s SER 281 CO 0.00 -1.01 1.43 0.35 0.41 0.00 0.00 173.24 174.43 3gwp n THR 282 N -0.98 0.88 -1.86 1.44 -2.24 -1.26 -4.95 114.28 105.32 3gwp n THR 282 Ca 0.10 -0.80 -0.12 0.00 -2.27 0.00 0.00 64.05 60.95 3gwp n THR 282 Cb 0.51 0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 69.05 3gwp n THR 282 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3gwp n PHE 283 N 1.17 -0.88 -2.06 4.78 3.72 -1.26 -1.28 117.46 121.65 3gwp n PHE 283 Ca 0.20 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.42 3gwp n PHE 283 Cb 0.53 -2.60 -0.03 0.00 -0.94 0.00 0.00 39.48 36.44 3gwp n PHE 283 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gwp n GLY 284 N -0.49 0.36 0.55 1.37 0.00 -1.26 -4.88 105.19 100.83 3gwp n GLY 284 Ca -0.13 -0.15 0.05 0.00 0.00 0.00 0.00 46.02 45.79 3gwp n GLY 284 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3gwp n VAL 285 N -3.49 0.99 0.06 1.61 0.24 -0.40 -4.65 118.33 112.69 3gwp n VAL 285 Ca -0.20 -1.00 -0.02 0.00 -2.04 0.00 0.00 64.34 61.09 3gwp n VAL 285 Cb 0.63 0.50 0.25 0.00 -1.47 0.00 0.00 33.84 33.76 3gwp n VAL 285 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 3gwp h VAL 286 N 1.76 1.26 -0.18 3.34 3.04 -1.82 -3.06 116.25 120.58 3gwp h VAL 286 Ca 0.00 -1.22 0.01 0.00 -1.01 0.00 0.00 66.70 64.48 3gwp h VAL 286 Cb 0.70 1.41 -0.01 0.00 -2.01 0.00 0.00 31.29 31.38 3gwp h VAL 286 CO 0.00 0.38 0.10 -0.09 -1.01 0.00 0.00 177.57 176.95 3gwp h ARG 287 N 0.31 0.20 -1.93 4.17 2.43 -1.87 -1.69 114.38 116.00 3gwp h ARG 287 Ca 0.05 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3gwp h ARG 287 Cb 0.64 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 3gwp h ARG 287 CO 0.05 0.13 0.00 -1.13 -1.51 0.00 0.00 179.97 177.51 3gwp n SER 288 N -5.00 0.22 0.00 -3.80 3.41 -1.16 -0.85 113.62 106.44 3gwp n SER 288 Ca -0.03 -0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 3gwp n SER 288 Cb 0.04 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3gwp n SER 288 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3gwp n TYR 290 N 1.02 0.00 -0.17 7.33 4.01 -0.64 -0.76 117.16 127.95 3gwp n TYR 290 Ca 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3gwp n TYR 290 Cb 0.04 0.00 0.25 0.00 -0.31 0.00 0.00 39.34 39.32 3gwp n TYR 290 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 3gwp h GLN 291 N 0.00 0.89 -0.60 -0.72 4.15 -1.27 -1.13 115.11 116.43 3gwp h GLN 291 Ca 0.00 -0.09 -0.01 0.00 0.77 0.00 0.00 58.65 59.32 3gwp h GLN 291 Cb 0.00 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 27.48 3gwp h GLN 291 CO 0.00 0.65 0.32 0.78 -1.93 0.00 0.00 178.83 178.65 3gwp h GLY 292 N 0.95 0.90 0.87 2.39 0.00 -1.14 -1.06 103.07 105.97 3gwp h GLY 292 Ca 0.23 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 3gwp h GLY 292 CO -0.04 0.40 0.06 -2.00 0.00 0.00 0.00 176.54 174.96 3gwp h LEU 293 N 0.81 0.25 -1.34 3.11 5.85 -1.43 -0.17 115.31 122.39 3gwp h LEU 293 Ca 0.21 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.82 3gwp h LEU 293 Cb 0.06 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 3gwp h LEU 293 CO -0.03 0.36 0.51 0.15 -0.34 0.00 0.00 178.44 179.09 3gwp h PHE 294 N 0.11 0.81 0.00 1.25 3.57 -0.97 -1.03 116.94 120.68 3gwp h PHE 294 Ca 0.06 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.58 3gwp h PHE 294 Cb 0.20 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.68 3gwp h PHE 294 CO -0.01 0.41 -0.38 1.28 -2.23 0.00 0.00 178.31 177.38 3gwp n LEU 295 N -4.49 0.70 -0.03 0.59 4.77 -0.43 -4.48 117.00 113.64 3gwp n LEU 295 Ca 0.12 0.34 -0.10 0.00 -0.03 0.00 0.00 56.01 56.34 3gwp n LEU 295 Cb 0.25 -0.25 -0.04 0.00 -2.33 0.00 0.00 43.42 41.06 3gwp n LEU 295 CO 0.33 -0.08 0.63 0.00 -1.33 0.00 0.00 177.39 176.94 3gwp h ALA 296 N 2.56 -0.38 -0.80 -1.18 0.00 0.37 -0.29 119.26 119.55 3gwp h ALA 296 Ca 0.00 0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.09 3gwp h ALA 296 Cb 0.72 0.67 -0.06 0.00 0.00 0.00 0.00 17.79 19.12 3gwp h ALA 296 CO 0.00 -0.81 0.53 -1.35 0.00 0.00 0.00 179.25 177.62 3gwp h PRO 297 N -0.38 0.50 0.10 0.00 0.11 -1.79 -0.04 132.00 130.50 3gwp h PRO 297 Ca 0.11 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 3gwp h PRO 297 Cb 0.56 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.56 3gwp h PRO 297 CO -0.40 0.33 -0.05 1.25 -0.21 0.00 0.00 178.00 178.92 3gwp h HIS 298 N 0.52 -0.12 -0.53 0.65 2.76 -1.68 -3.34 115.15 113.40 3gwp h HIS 298 Ca 0.39 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.56 3gwp h HIS 298 Cb 0.78 0.04 -0.03 0.00 1.55 0.00 0.00 27.41 29.75 3gwp h HIS 298 CO -0.00 0.33 0.34 0.82 -1.30 0.00 0.00 177.93 178.12 3gwp h ILE 299 N -0.93 1.14 0.00 6.26 1.08 -0.89 -2.85 117.51 121.32 3gwp h ILE 299 Ca -0.01 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.16 3gwp h ILE 299 Cb 0.51 0.38 0.00 0.00 -3.07 0.00 0.00 36.82 34.64 3gwp h ILE 299 CO 0.02 0.15 0.00 -1.20 -0.69 0.00 0.00 178.15 176.43 3gwp n SER 300 N -4.44 0.00 0.00 1.72 7.64 -0.05 -2.53 113.62 115.96 3gwp n SER 300 Ca 0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.93 3gwp n SER 300 Cb 0.06 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 3gwp n SER 300 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3gwp n GLU 302 N 0.53 0.00 -0.09 1.43 -0.58 -1.08 -1.37 120.64 119.49 3gwp n GLU 302 Ca 0.00 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.61 3gwp n GLU 302 Cb 0.00 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.82 3gwp n GLU 302 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3gwp h ALA 303 N 0.00 0.40 -0.16 0.62 0.00 -1.40 -2.32 119.26 116.40 3gwp h ALA 303 Ca 0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 3gwp h ALA 303 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3gwp h ALA 303 CO 0.00 0.43 0.07 1.25 0.00 0.00 0.00 179.25 181.00 3gwp h LEU 304 N 0.41 0.21 -0.93 0.00 5.85 -1.51 -0.84 115.31 118.51 3gwp h LEU 304 Ca 0.04 -0.13 0.12 0.00 0.84 0.00 0.00 57.88 58.75 3gwp h LEU 304 Cb 0.88 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.77 3gwp h LEU 304 CO 0.07 0.27 0.55 0.11 -0.34 0.00 0.00 178.44 179.11 3gwp h LYS 305 N 0.12 0.84 -0.80 1.25 1.57 -1.83 0.81 116.57 118.53 3gwp h LYS 305 Ca 0.05 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 3gwp h LYS 305 Cb 0.12 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 3gwp h LYS 305 CO -0.01 0.55 0.35 0.78 -0.57 0.00 0.00 179.45 180.55 3gwp h GLY 306 N 0.86 1.25 1.29 3.86 0.00 -0.90 -1.12 103.07 108.31 3gwp h GLY 306 Ca 0.47 -0.65 -0.14 0.00 0.00 0.00 0.00 47.33 47.00 3gwp h GLY 306 CO -0.28 0.62 -0.36 0.00 0.00 0.00 0.00 176.54 176.51 3gwp h ALA 307 N 1.23 0.72 -0.47 3.60 0.00 0.25 -0.60 119.26 123.99 3gwp h ALA 307 Ca 0.27 -0.44 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 3gwp h ALA 307 Cb 0.17 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3gwp h ALA 307 CO -0.03 0.66 0.02 0.82 0.00 0.00 0.00 179.25 180.72 3gwp h ILE 308 N 0.65 1.26 -0.56 0.00 2.04 -0.69 0.29 117.51 120.50 3gwp h ILE 308 Ca 0.06 -1.03 -0.03 0.00 1.00 0.00 0.00 64.86 64.86 3gwp h ILE 308 Cb 0.91 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.96 3gwp h ILE 308 CO 0.08 0.36 0.22 0.25 0.00 0.00 0.00 178.15 179.06 3gwp h LEU 309 N 0.67 0.78 -0.64 1.44 5.85 -1.13 -2.45 115.31 119.83 3gwp h LEU 309 Ca 0.14 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 3gwp h LEU 309 Cb 0.48 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3gwp h LEU 309 CO 0.02 0.74 0.38 0.00 -0.34 0.00 0.00 178.44 179.24 3gwp h SER 311 N 0.87 0.17 -0.01 0.00 0.87 -0.75 -3.28 113.55 111.43 3gwp h SER 311 Ca 0.23 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.78 3gwp h SER 311 Cb -0.01 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 3gwp h SER 311 CO -0.04 0.12 -0.04 -0.09 -0.53 0.00 0.00 176.83 176.25 3gwp h ARG 312 N 0.21 0.05 -1.25 2.24 9.65 -1.33 -2.13 114.38 121.82 3gwp h ARG 312 Ca 0.06 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.91 3gwp h ARG 312 Cb -0.01 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.57 3gwp h ARG 312 CO -0.03 0.67 0.00 1.51 2.80 0.00 0.00 179.97 184.93 3gwp n ILE 313 N -4.74 0.05 0.00 1.20 3.06 -0.45 -0.93 119.36 117.55 3gwp n ILE 313 Ca -0.09 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.16 3gwp n ILE 313 Cb 0.34 -0.35 0.00 0.00 0.54 0.00 0.00 39.64 40.16 3gwp n ILE 313 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 3gwp n GLU 315 N 0.78 0.00 0.26 9.51 2.13 -0.80 -2.07 120.64 130.45 3gwp n GLU 315 Ca 0.00 0.00 0.14 0.00 0.66 0.00 0.00 57.16 57.96 3gwp n GLU 315 Cb 0.03 0.00 0.67 0.00 0.27 0.00 0.00 31.44 32.41 3gwp n GLU 315 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 3gwp h LEU 316 N 0.00 0.00 -0.01 4.31 3.38 -1.31 -2.27 115.31 119.41 3gwp h LEU 316 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3gwp h LEU 316 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3gwp h LEU 316 CO 0.00 0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.65 3gwp n ALA 317 N -2.21 2.28 0.00 1.53 0.00 -0.88 -4.94 120.51 116.29 3gwp n ALA 317 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3gwp n ALA 317 Cb 0.30 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.29 3gwp n ALA 317 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gwp n GLY 318 N 1.37 1.10 3.69 0.00 0.00 -0.85 -5.11 105.19 105.39 3gwp n GLY 318 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 3gwp n GLY 318 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gwp s PHE 319 N -2.00 3.15 0.28 1.61 0.08 -1.26 -5.03 117.98 114.82 3gwp s PHE 319 Ca 0.00 0.16 -0.29 0.00 0.12 0.00 0.00 56.93 56.92 3gwp s PHE 319 Cb 0.00 -1.75 -0.10 0.00 -0.57 0.00 0.00 43.02 40.60 3gwp s PHE 319 CO 0.00 0.48 1.19 -1.21 -0.10 0.00 0.00 175.22 175.58 3gwp s GLU 320 N -1.16 4.52 0.15 0.44 2.02 -1.22 -3.97 118.70 119.47 3gwp s GLU 320 Ca 0.16 1.97 0.01 0.00 0.02 0.00 0.00 54.97 57.13 3gwp s GLU 320 Cb -0.11 -3.15 -0.00 0.00 0.10 0.00 0.00 34.13 30.96 3gwp s GLU 320 CO 0.06 0.02 0.05 1.33 0.02 0.00 0.00 175.26 176.74 3gwp n VAL 321 N 1.25 0.00 -0.58 2.63 0.24 -1.26 -1.14 118.33 119.46 3gwp n VAL 321 Ca 0.00 -0.85 -0.30 0.00 -2.04 0.00 0.00 64.34 61.15 3gwp n VAL 321 Cb 0.44 0.29 0.21 0.00 -1.47 0.00 0.00 33.84 33.31 3gwp n VAL 321 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 3gwp n PRO 323 N -0.34 -2.03 -1.56 7.34 -0.02 -1.26 -5.02 135.00 132.11 3gwp n PRO 323 Ca -0.03 -0.57 -0.30 0.00 -2.02 0.00 0.00 63.50 60.58 3gwp n PRO 323 Cb 0.22 -1.91 0.08 0.00 -0.02 0.00 0.00 33.50 31.86 3gwp n PRO 323 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3gwp s LYS 324 N -3.87 2.40 0.57 -0.52 3.01 -1.26 -4.87 119.74 115.19 3gwp s LYS 324 Ca 0.62 0.75 0.25 0.00 -1.01 0.00 0.00 55.97 56.57 3gwp s LYS 324 Cb -0.18 -1.95 1.60 0.00 -1.01 0.00 0.00 37.83 36.30 3gwp s LYS 324 CO 0.66 -1.43 2.19 0.10 0.51 0.00 0.00 175.35 177.38 3gwp h TYR 325 N -0.95 0.00 -0.27 3.18 -0.00 -1.86 -3.07 116.97 114.00 3gwp h TYR 325 Ca -0.46 0.00 -0.12 0.00 -0.00 0.00 0.00 58.73 58.15 3gwp h TYR 325 Cb 1.25 0.00 -0.07 0.00 -0.00 0.00 0.00 36.73 37.90 3gwp h TYR 325 CO 0.52 0.00 -0.14 -0.40 -0.00 0.00 0.00 178.16 178.14 3gwp n ASP 326 N -4.09 2.48 -4.87 0.10 5.75 -1.26 -4.95 116.55 109.71 3gwp n ASP 326 Ca -0.02 -3.69 -0.30 0.00 -0.01 0.00 0.00 54.79 50.77 3gwp n ASP 326 Cb 0.14 -0.60 -0.05 0.00 -1.03 0.00 0.00 41.12 39.59 3gwp n ASP 326 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3gwp s GLU 327 N -3.19 3.24 0.26 0.11 2.02 -1.16 -5.07 118.70 114.92 3gwp s GLU 327 Ca 0.43 -0.54 -0.30 0.00 0.02 0.00 0.00 54.97 54.58 3gwp s GLU 327 Cb 0.39 -2.92 -0.10 0.00 0.10 0.00 0.00 34.13 31.60 3gwp s GLU 327 CO -0.00 0.59 1.39 -1.59 0.02 0.00 0.00 175.26 175.66 3gwp s LYS 328 N -2.54 4.31 0.08 1.61 0.00 -1.26 -4.96 119.74 116.98 3gwp s LYS 328 Ca 0.33 2.25 0.06 0.00 0.00 0.00 0.00 55.97 58.61 3gwp s LYS 328 Cb -0.13 -3.11 -0.04 0.00 0.00 0.00 0.00 37.83 34.56 3gwp s LYS 328 CO 0.26 -0.34 -0.08 1.03 0.00 0.00 0.00 175.35 176.22 3gwp s ARG 329 N -0.73 2.28 -0.04 1.78 0.52 -1.26 -4.71 118.95 116.78 3gwp s ARG 329 Ca 0.56 -0.93 0.15 0.00 -0.52 0.00 0.00 55.73 54.99 3gwp s ARG 329 Cb -0.41 -2.38 -0.23 0.00 0.52 0.00 0.00 34.95 32.45 3gwp s ARG 329 CO 0.45 0.53 0.29 -1.13 0.02 0.00 0.00 175.30 175.47 3gwp n SER 330 N 0.89 1.43 -3.63 0.23 3.41 -1.26 -4.83 113.62 109.86 3gwp n SER 330 Ca -0.13 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.34 3gwp n SER 330 Cb 0.52 1.56 -0.06 0.00 -0.26 0.00 0.00 64.21 65.97 3gwp n SER 330 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 3gwp s ASP 331 N -3.98 0.64 0.00 4.04 1.47 -1.26 -3.94 116.67 113.64 3gwp s ASP 331 Ca -0.06 -1.39 0.21 0.00 1.18 0.00 0.00 52.55 52.49 3gwp s ASP 331 Cb 0.09 0.57 0.75 0.00 -0.34 0.00 0.00 42.92 44.00 3gwp s ASP 331 CO 0.64 -1.13 1.55 2.30 0.68 0.00 0.00 175.17 179.21 3gwp n ILE 332 N -0.47 0.21 -3.03 2.11 -5.35 -1.17 -4.94 119.36 106.71 3gwp n ILE 332 Ca 0.02 -0.35 -0.33 0.00 -0.27 0.00 0.00 62.75 61.82 3gwp n ILE 332 Cb 0.63 0.38 -0.06 0.00 -1.74 0.00 0.00 39.64 38.84 3gwp n ILE 332 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3gwp s ILE 333 N -1.79 4.58 -0.05 7.28 1.01 -1.26 -4.35 121.20 126.61 3gwp s ILE 333 Ca 0.32 1.14 -0.01 0.00 0.00 0.00 0.00 60.65 62.10 3gwp s ILE 333 Cb 0.18 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 39.05 3gwp s ILE 333 CO 0.26 -0.20 0.02 -1.58 0.00 0.00 0.00 174.94 173.44 3gwp s GLN 334 N -2.98 0.33 0.07 2.79 2.00 -0.71 -4.68 119.66 116.47 3gwp s GLN 334 Ca 0.56 0.19 -0.11 0.00 -2.00 0.00 0.00 55.36 54.00 3gwp s GLN 334 Cb -0.10 -0.73 -0.06 0.00 0.80 0.00 0.00 33.01 32.91 3gwp s GLN 334 CO 0.16 -0.28 0.41 -1.12 -0.50 0.00 0.00 175.29 173.96 3gwp s SER 335 N 1.86 6.68 -0.19 6.67 0.01 -1.26 -1.89 113.70 125.59 3gwp s SER 335 Ca 0.02 0.84 -0.03 0.00 1.31 0.00 0.00 55.95 58.09 3gwp s SER 335 Cb -0.12 -2.20 0.06 0.00 0.21 0.00 0.00 66.02 63.97 3gwp s SER 335 CO -0.04 0.20 0.04 -0.63 0.41 0.00 0.00 173.24 173.22 3gwp s ILE 336 N -1.34 0.43 -0.51 1.44 1.01 -0.16 -4.51 121.20 117.56 3gwp s ILE 336 Ca 0.31 -0.49 -0.22 0.00 0.00 0.00 0.00 60.65 60.25 3gwp s ILE 336 Cb -0.14 -0.95 0.04 0.00 0.01 0.00 0.00 42.46 41.41 3gwp s ILE 336 CO 0.17 -0.21 0.81 -0.75 0.00 0.00 0.00 174.94 174.96 3gwp s LYS 337 N 1.90 3.28 0.11 2.79 2.20 -0.29 -1.01 119.74 128.72 3gwp s LYS 337 Ca -0.00 -0.42 0.16 0.00 -0.36 0.00 0.00 55.97 55.35 3gwp s LYS 337 Cb -0.17 -4.04 -0.09 0.00 -1.51 0.00 0.00 37.83 32.02 3gwp s LYS 337 CO -0.08 -1.32 0.97 0.74 -0.36 0.00 0.00 175.35 175.30 3gwp h PHE 338 N 9.14 0.00 -5.00 4.03 0.04 -1.55 -3.22 116.94 120.37 3gwp h PHE 338 Ca -0.26 0.00 -0.41 0.00 2.80 0.00 0.00 57.97 60.10 3gwp h PHE 338 Cb 1.08 0.00 0.06 0.00 2.20 0.00 0.00 35.95 39.30 3gwp h PHE 338 CO 0.84 0.55 -0.63 0.09 -0.60 0.00 0.00 178.31 178.56 3gwp n ASN 339 N -2.96 -5.95 -3.63 2.17 5.03 -0.23 -4.98 115.26 104.71 3gwp n ASN 339 Ca -0.07 -0.39 -0.09 0.00 0.87 0.00 0.00 54.58 54.91 3gwp n ASN 339 Cb 0.81 -4.77 -0.07 0.00 -1.02 0.00 0.00 39.78 34.73 3gwp n ASN 339 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3gwp s ASP 340 N -2.89 -0.42 -0.03 6.41 2.15 -1.26 -5.01 116.67 115.62 3gwp s ASP 340 Ca 0.40 0.79 -0.24 0.00 0.43 0.00 0.00 52.55 53.93 3gwp s ASP 340 Cb -0.18 0.79 -0.21 0.00 -0.30 0.00 0.00 42.92 43.02 3gwp s ASP 340 CO 0.50 -0.16 1.13 0.50 -0.17 0.00 0.00 175.17 176.97 3gwp h LYS 341 N 4.00 0.16 -0.59 4.34 3.64 -1.94 -3.10 116.57 123.08 3gwp h LYS 341 Ca -0.27 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 58.94 3gwp h LYS 341 Cb 1.18 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.00 3gwp h LYS 341 CO 0.13 0.79 0.22 -0.44 -2.27 0.00 0.00 179.45 177.88 3gwp h ASP 342 N -0.43 0.83 -0.64 4.20 3.32 -1.99 -1.12 116.42 120.60 3gwp h ASP 342 Ca -0.01 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 56.83 3gwp h ASP 342 Cb 0.82 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 3gwp h ASP 342 CO 0.03 0.79 0.29 0.11 -1.72 0.00 0.00 179.24 178.74 3gwp h LYS 343 N 0.83 0.96 -0.29 3.56 1.57 -1.96 0.07 116.57 121.31 3gwp h LYS 343 Ca 0.20 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 3gwp h LYS 343 Cb 0.23 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3gwp h LYS 343 CO -0.01 0.77 -0.02 1.25 -0.57 0.00 0.00 179.45 180.86 3gwp h LEU 344 N 0.95 0.53 -0.12 2.94 5.85 -1.40 -2.38 115.31 121.68 3gwp h LEU 344 Ca 0.23 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 3gwp h LEU 344 Cb 0.15 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 3gwp h LEU 344 CO -0.02 0.73 0.06 0.40 -0.34 0.00 0.00 178.44 179.26 3gwp h ILE 345 N 0.31 1.11 -0.79 4.05 1.08 -0.92 -2.79 117.51 119.56 3gwp h ILE 345 Ca 0.08 -0.31 0.02 0.00 -0.39 0.00 0.00 64.86 64.26 3gwp h ILE 345 Cb 0.47 1.10 -0.04 0.00 -3.07 0.00 0.00 36.82 35.29 3gwp h ILE 345 CO 0.02 0.10 0.52 -0.33 -0.69 0.00 0.00 178.15 177.77 3gwp h GLU 346 N 0.07 1.00 -0.34 2.37 4.39 -1.01 -1.84 114.58 119.23 3gwp h GLU 346 Ca 0.04 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 3gwp h GLU 346 Cb 0.10 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 3gwp h GLU 346 CO -0.01 0.66 0.03 0.35 -1.16 0.00 0.00 179.01 178.89 3gwp h PHE 347 N 1.03 0.61 -0.26 4.33 3.57 -1.32 -1.66 116.94 123.24 3gwp h PHE 347 Ca 0.30 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 3gwp h PHE 347 Cb -0.05 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 3gwp h PHE 347 CO -0.00 0.66 0.13 0.00 -2.23 0.00 0.00 178.31 176.86 3gwp h LYS 349 N 0.29 0.82 -0.59 0.00 1.57 -1.30 0.78 116.57 118.13 3gwp h LYS 349 Ca 0.09 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 3gwp h LYS 349 Cb 0.11 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 3gwp h LYS 349 CO -0.01 0.54 -0.01 0.78 -0.57 0.00 0.00 179.45 180.18 3gwp h GLY 350 N 0.85 1.12 1.01 3.86 0.00 -0.82 0.43 103.07 109.52 3gwp h GLY 350 Ca 0.40 -0.82 -0.11 0.00 0.00 0.00 0.00 47.33 46.80 3gwp h GLY 350 CO -0.17 0.76 -0.18 -2.22 0.00 0.00 0.00 176.54 174.73 3gwp h ILE 351 N 0.95 1.28 -0.39 2.60 1.08 -0.19 -2.44 117.51 120.40 3gwp h ILE 351 Ca 0.17 -1.31 -0.01 0.00 -0.39 0.00 0.00 64.86 63.31 3gwp h ILE 351 Cb 0.56 1.30 -0.02 0.00 -3.07 0.00 0.00 36.82 35.59 3gwp h ILE 351 CO 0.03 0.44 0.19 -0.61 -0.69 0.00 0.00 178.15 177.51 3gwp h GLN 352 N 0.62 0.56 0.00 2.37 5.75 -0.77 -2.47 115.11 121.17 3gwp h GLN 352 Ca 0.09 -0.08 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3gwp h GLN 352 Cb 0.73 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 29.18 3gwp h GLN 352 CO 0.06 0.49 -0.01 0.00 -2.65 0.00 0.00 178.83 176.72 3gwp h THR 353 N 0.49 0.03 -0.97 2.39 1.03 -0.86 -2.60 112.91 112.42 3gwp h THR 353 Ca 0.13 -0.34 -0.51 0.00 -0.01 0.00 0.00 66.41 65.69 3gwp h THR 353 Cb 0.12 1.33 -0.30 0.00 -1.07 0.00 0.00 68.15 68.22 3gwp h THR 353 CO -0.02 0.01 0.64 0.61 -0.01 0.00 0.00 175.52 176.75 3gwp n GLY 354 N -0.39 4.43 3.60 2.99 0.00 -0.92 -4.90 105.19 110.00 3gwp n GLY 354 Ca -0.01 -1.06 -0.30 0.00 0.00 0.00 0.00 46.02 44.65 3gwp n GLY 354 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gwp s SER 355 N -1.24 4.56 0.11 1.61 0.01 -0.98 -4.60 113.70 113.17 3gwp s SER 355 Ca 0.55 -0.30 -0.14 0.00 1.31 0.00 0.00 55.95 57.38 3gwp s SER 355 Cb 0.47 -0.95 -0.07 0.00 0.21 0.00 0.00 66.02 65.67 3gwp s SER 355 CO 0.11 0.20 1.44 1.55 0.41 0.00 0.00 173.24 176.95 3gwp h PRO 356 N 3.76 0.76 -5.56 12.44 0.13 -1.90 -3.37 132.00 138.25 3gwp h PRO 356 Ca -0.48 -0.39 -0.65 0.00 -0.87 0.00 0.00 66.00 63.61 3gwp h PRO 356 Cb 1.17 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.19 3gwp h PRO 356 CO 0.54 1.02 -0.53 0.42 -0.23 0.00 0.00 178.00 179.22 3gwp s ILE 357 N -4.41 5.11 -1.34 -3.56 -1.09 -1.25 -4.58 121.20 110.09 3gwp s ILE 357 Ca -0.12 0.07 -0.07 0.00 -2.23 0.00 0.00 60.65 58.30 3gwp s ILE 357 Cb 0.09 -3.25 0.02 0.00 -1.58 0.00 0.00 42.46 37.74 3gwp s ILE 357 CO 0.84 0.55 1.08 0.47 -1.23 0.00 0.00 174.94 176.65 3gwp n ASP 358 N 2.60 -4.75 -0.04 3.58 8.00 -1.26 -4.36 116.55 120.32 3gwp n ASP 358 Ca -0.18 -0.61 -0.14 0.00 0.71 0.00 0.00 54.79 54.56 3gwp n ASP 358 Cb 0.54 -4.83 -0.08 0.00 -0.02 0.00 0.00 41.12 36.72 3gwp n ASP 358 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3gwp h SER 359 N -2.37 0.39 -0.15 -2.24 4.64 -1.77 -3.20 113.55 108.85 3gwp h SER 359 Ca -0.58 -0.56 0.04 0.00 -0.47 0.00 0.00 61.79 60.22 3gwp h SER 359 Cb 1.36 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 3gwp h SER 359 CO 0.56 0.88 0.12 2.19 -0.87 0.00 0.00 176.83 179.72 3gwp h PHE 360 N -0.08 0.00 -3.04 4.77 -0.00 -1.91 -3.39 116.94 113.28 3gwp h PHE 360 Ca 0.00 0.00 -0.58 0.00 -0.00 0.00 0.00 57.97 57.39 3gwp h PHE 360 Cb 0.82 0.00 0.11 0.00 -0.00 0.00 0.00 35.95 36.88 3gwp h PHE 360 CO 0.11 0.00 0.39 0.28 -0.00 0.00 0.00 178.31 179.09 3gwp n VAL 361 N -4.23 1.98 -2.25 0.88 0.31 -1.21 -4.94 118.33 108.87 3gwp n VAL 361 Ca 0.01 -0.49 -0.42 0.00 -0.01 0.00 0.00 64.34 63.42 3gwp n VAL 361 Cb 0.24 -1.39 -0.03 0.00 -0.91 0.00 0.00 33.84 31.76 3gwp n VAL 361 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3gwp s SER 362 N -0.38 6.88 -0.63 4.52 0.15 -1.26 -4.95 113.70 118.03 3gwp s SER 362 Ca 0.57 2.12 -0.07 0.00 0.70 0.00 0.00 55.95 59.27 3gwp s SER 362 Cb -0.61 -2.57 0.16 0.00 -1.71 0.00 0.00 66.02 61.30 3gwp s SER 362 CO 0.61 -0.67 0.49 0.00 1.20 0.00 0.00 173.24 174.87 3gwp s GLU 364 N 0.35 1.73 0.44 0.00 0.41 -1.26 -4.75 118.70 115.62 3gwp s GLU 364 Ca 0.14 -1.93 -0.22 0.00 -0.41 0.00 0.00 54.97 52.56 3gwp s GLU 364 Cb -0.19 -1.32 -0.09 0.00 -1.78 0.00 0.00 34.13 30.75 3gwp s GLU 364 CO -0.04 -0.02 1.01 -2.14 -0.49 0.00 0.00 175.26 173.58 3gwp s PRO 365 N -3.74 4.07 0.08 0.39 0.02 -1.26 -4.70 135.00 129.86 3gwp s PRO 365 Ca 0.33 1.32 0.01 0.00 0.02 0.00 0.00 61.00 62.68 3gwp s PRO 365 Cb 0.06 -2.27 -0.04 0.00 0.02 0.00 0.00 34.50 32.28 3gwp s PRO 365 CO 0.15 -0.19 -0.06 1.67 -0.33 0.00 0.00 177.00 178.24 3gwp s TRP 366 N -1.95 0.76 0.00 6.54 1.48 -0.44 -4.93 118.94 120.40 3gwp s TRP 366 Ca 0.62 -0.91 0.00 0.00 -1.06 0.00 0.00 56.10 54.75 3gwp s TRP 366 Cb -0.15 -0.46 0.00 0.00 -1.16 0.00 0.00 33.47 31.69 3gwp s TRP 366 CO 0.20 -0.21 0.00 -0.25 -4.06 0.00 0.00 176.95 172.63 3gwp n ASP 367 N 0.17 0.00 -0.06 -2.66 9.92 -1.26 -1.82 116.55 120.84 3gwp n ASP 367 Ca -0.14 0.00 -0.06 0.00 -0.53 0.00 0.00 54.79 54.06 3gwp n ASP 367 Cb 0.60 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.98 3gwp n ASP 367 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 3gwp n PRO 369 N 0.00 1.75 -0.24 -0.24 -0.04 -1.26 -5.03 135.00 129.94 3gwp n PRO 369 Ca 0.00 -0.01 0.08 0.00 -0.04 0.00 0.00 63.50 63.53 3gwp n PRO 369 Cb 0.00 -1.34 0.13 0.00 -0.04 0.00 0.00 33.50 32.24 3gwp n PRO 369 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3gwp n GLY 370 N 2.15 4.17 3.20 0.55 0.00 -1.26 -5.05 105.19 108.95 3gwp n GLY 370 Ca -0.21 -0.99 -0.17 0.00 0.00 0.00 0.00 46.02 44.65 3gwp n GLY 370 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gwp s TYR 371 N -2.43 1.25 -0.11 1.61 1.51 -1.26 -5.09 117.35 112.84 3gwp s TYR 371 Ca 0.28 -0.54 -0.18 0.00 -1.01 0.00 0.00 57.07 55.62 3gwp s TYR 371 Cb 0.25 -0.68 -0.15 0.00 -0.11 0.00 0.00 41.96 41.27 3gwp s TYR 371 CO 0.01 0.08 0.54 1.15 -1.11 0.00 0.00 175.55 176.22 3gwp h THR 372 N 3.82 1.03 -3.72 -0.71 2.02 -2.02 -3.46 112.91 109.87 3gwp h THR 372 Ca -0.40 -1.67 -0.51 0.00 0.77 0.00 0.00 66.41 64.60 3gwp h THR 372 Cb 1.19 1.91 0.01 0.00 -1.74 0.00 0.00 68.15 69.53 3gwp h THR 372 CO 0.47 0.34 0.48 -1.81 0.37 0.00 0.00 175.52 175.37 3gwp s ASP 373 N -5.86 7.26 0.81 4.18 1.11 -1.26 -5.03 116.67 117.88 3gwp s ASP 373 Ca -0.12 2.22 -0.11 0.00 0.18 0.00 0.00 52.55 54.73 3gwp s ASP 373 Cb -0.01 -2.62 0.08 0.00 1.07 0.00 0.00 42.92 41.44 3gwp s ASP 373 CO 0.42 -0.17 1.10 -1.10 1.18 0.00 0.00 175.17 176.60 3gwp s GLN 374 N -1.10 1.95 -0.02 8.23 -0.21 -1.26 -4.79 119.66 122.46 3gwp s GLN 374 Ca 0.46 1.16 0.02 0.00 0.02 0.00 0.00 55.36 57.02 3gwp s GLN 374 Cb -0.31 -1.86 0.01 0.00 1.00 0.00 0.00 33.01 31.84 3gwp s GLN 374 CO 0.39 -1.86 -0.07 0.14 -2.12 0.00 0.00 175.29 171.78 3gwp s VAL 375 N -2.88 0.60 0.48 1.09 -7.23 -0.75 0.27 120.40 111.98 3gwp s VAL 375 Ca 0.62 -0.25 0.07 0.00 -1.81 0.00 0.00 61.98 60.61 3gwp s VAL 375 Cb -0.18 -0.55 0.00 0.00 0.56 0.00 0.00 36.38 36.21 3gwp s VAL 375 CO 0.56 0.20 0.35 -0.51 -0.31 0.00 0.00 175.10 175.40 3gwp s ILE 376 N 0.29 2.13 -0.29 -0.62 2.07 -0.88 -1.33 121.20 122.56 3gwp s ILE 376 Ca -0.04 -1.48 -0.00 0.00 -1.41 0.00 0.00 60.65 57.72 3gwp s ILE 376 Cb -0.08 -2.60 0.18 0.00 0.13 0.00 0.00 42.46 40.09 3gwp s ILE 376 CO 0.00 0.00 0.57 0.00 -1.91 0.00 0.00 174.94 173.60 3gwp s ALA 378 N -2.64 -2.14 -0.00 1.50 0.00 0.98 -2.14 121.76 117.32 3gwp s ALA 378 Ca 0.40 1.61 -0.00 0.00 0.00 0.00 0.00 51.96 53.98 3gwp s ALA 378 Cb -0.01 -2.17 0.00 0.00 0.00 0.00 0.00 23.12 20.94 3gwp s ALA 378 CO 0.24 -1.40 0.01 0.00 0.00 0.00 0.00 175.76 174.61 3gwp s ALA 379 N 2.82 -0.00 -0.34 0.00 0.00 -1.26 -0.74 121.76 122.24 3gwp s ALA 379 Ca 0.18 0.04 -0.07 0.00 0.00 0.00 0.00 51.96 52.11 3gwp s ALA 379 Cb -0.14 -0.03 0.21 0.00 0.00 0.00 0.00 23.12 23.16 3gwp s ALA 379 CO -0.21 -0.01 1.10 0.20 0.00 0.00 0.00 175.76 176.84 3gwp s GLY 380 N 0.10 -1.88 0.38 0.00 0.00 -1.26 -4.90 107.32 99.76 3gwp s GLY 380 Ca -0.01 0.72 0.06 0.00 0.00 0.00 0.00 44.72 45.49 3gwp s GLY 380 CO -0.00 4.33 0.02 0.00 0.00 0.00 0.00 173.10 177.44 3gwp s ALA 381 N 1.13 2.91 -0.08 3.20 0.00 -1.26 -3.91 121.76 123.75 3gwp s ALA 381 Ca 0.22 -2.22 -0.26 0.00 0.00 0.00 0.00 51.96 49.70 3gwp s ALA 381 Cb 0.12 0.30 -0.22 0.00 0.00 0.00 0.00 23.12 23.31 3gwp s ALA 381 CO -0.11 -0.16 0.98 0.74 0.00 0.00 0.00 175.76 177.20 3gwp h PHE 382 N 1.89 -0.02 -3.45 0.00 0.04 -1.96 -3.42 116.94 110.02 3gwp h PHE 382 Ca -0.43 -0.00 -0.60 0.00 2.80 0.00 0.00 57.97 59.74 3gwp h PHE 382 Cb 1.24 0.01 -0.10 0.00 2.20 0.00 0.00 35.95 39.30 3gwp h PHE 382 CO 0.69 0.67 0.08 0.42 -0.60 0.00 0.00 178.31 179.57 3gwp s ILE 383 N -3.21 5.04 0.11 -0.55 -1.09 -1.26 -5.01 121.20 115.22 3gwp s ILE 383 Ca -0.17 1.10 -0.31 0.00 -2.23 0.00 0.00 60.65 59.04 3gwp s ILE 383 Cb -0.01 -3.91 -0.10 0.00 -1.58 0.00 0.00 42.46 36.86 3gwp s ILE 383 CO 0.65 0.11 1.85 -1.58 -1.23 0.00 0.00 174.94 174.74 3gwp s GLN 384 N 1.99 4.13 -1.05 2.79 0.74 -1.26 -2.47 119.66 124.54 3gwp s GLN 384 Ca 0.26 2.61 0.00 0.00 0.05 0.00 0.00 55.36 58.28 3gwp s GLN 384 Cb -0.16 -3.66 0.00 0.00 1.10 0.00 0.00 33.01 30.29 3gwp s GLN 384 CO 0.10 -0.86 0.00 0.41 -0.55 0.00 0.00 175.29 174.39 3gwp n GLY 385 N 4.28 -0.06 3.70 2.59 0.00 -1.26 -5.00 105.19 109.44 3gwp n GLY 385 Ca 0.18 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 3gwp n GLY 385 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3gwp s SER 386 N -2.47 7.28 0.21 1.61 0.15 -1.03 -4.94 113.70 114.51 3gwp s SER 386 Ca 0.00 1.70 0.20 0.00 0.70 0.00 0.00 55.95 58.55 3gwp s SER 386 Cb 0.00 -2.57 0.02 0.00 -1.71 0.00 0.00 66.02 61.76 3gwp s SER 386 CO 0.00 -0.35 1.11 0.28 1.20 0.00 0.00 173.24 175.48 3gwp h SER 387 N 6.89 0.00 0.97 5.45 0.02 -1.84 -3.29 113.55 121.74 3gwp h SER 387 Ca -0.39 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.53 3gwp h SER 387 Cb 1.20 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 3gwp h SER 387 CO 0.79 0.21 -0.13 -0.29 -1.14 0.00 0.00 176.83 176.27 3gwp h ILE 388 N 0.00 0.33 -3.72 3.27 6.09 -1.89 -3.19 117.51 118.40 3gwp h ILE 388 Ca -0.04 -0.86 -0.49 0.00 -1.37 0.00 0.00 64.86 62.09 3gwp h ILE 388 Cb 1.20 1.66 0.01 0.00 0.47 0.00 0.00 36.82 40.16 3gwp h ILE 388 CO 0.02 0.13 0.13 -1.61 -3.07 0.00 0.00 178.15 173.75 3gwp s GLU 389 N -3.67 3.75 0.05 2.19 2.02 -1.24 0.57 118.70 122.36 3gwp s GLU 389 Ca 0.01 0.46 -0.35 0.00 0.02 0.00 0.00 54.97 55.11 3gwp s GLU 389 Cb 0.10 -2.37 -0.14 0.00 0.10 0.00 0.00 34.13 31.82 3gwp s GLU 389 CO 0.60 -0.08 1.66 -0.11 0.02 0.00 0.00 175.26 177.35 3gwp n LEU 390 N -1.49 3.02 -3.60 1.80 7.94 -1.26 -4.01 117.00 119.41 3gwp n LEU 390 Ca 0.02 1.05 -0.09 0.00 -1.11 0.00 0.00 56.01 55.88 3gwp n LEU 390 Cb 0.54 -1.37 -0.02 0.00 0.53 0.00 0.00 43.42 43.10 3gwp n LEU 390 CO 0.49 -0.30 0.50 -0.94 -1.11 0.00 0.00 177.39 176.03 3gwp s SER 391 N 2.05 -0.40 0.02 1.96 1.04 -0.28 -4.51 113.70 113.58 3gwp s SER 391 Ca 0.85 -0.22 -0.15 0.00 0.48 0.00 0.00 55.95 56.90 3gwp s SER 391 Cb -0.73 0.59 0.03 0.00 0.10 0.00 0.00 66.02 66.00 3gwp s SER 391 CO 0.45 -1.02 0.34 0.00 0.98 0.00 0.00 173.24 173.99 3gwp s ALA 392 N -3.65 -0.81 -0.03 5.32 0.00 0.08 -1.77 121.76 120.91 3gwp s ALA 392 Ca 0.06 0.22 -0.26 0.00 0.00 0.00 0.00 51.96 51.97 3gwp s ALA 392 Cb -0.02 0.22 0.06 0.00 0.00 0.00 0.00 23.12 23.38 3gwp s ALA 392 CO -0.05 -0.36 0.57 0.16 0.00 0.00 0.00 175.76 176.08 3gwp s ASP 393 N -1.76 -0.52 -0.28 0.00 -4.77 -1.12 -0.02 116.67 108.21 3gwp s ASP 393 Ca -0.08 0.50 -0.22 0.00 -3.30 0.00 0.00 52.55 49.45 3gwp s ASP 393 Cb -0.02 0.47 0.11 0.00 -1.09 0.00 0.00 42.92 42.39 3gwp s ASP 393 CO 0.00 -0.58 0.92 0.00 0.70 0.00 0.00 175.17 176.21 3gwp s ALA 394 N -1.33 -1.99 0.28 2.11 0.00 -0.91 -1.59 121.76 118.33 3gwp s ALA 394 Ca -0.11 2.05 -0.24 0.00 0.00 0.00 0.00 51.96 53.66 3gwp s ALA 394 Cb -0.01 -1.45 -0.09 0.00 0.00 0.00 0.00 23.12 21.57 3gwp s ALA 394 CO 0.07 -0.30 0.87 -1.25 0.00 0.00 0.00 175.76 175.15 3gwp s PRO 395 N 0.69 4.50 -0.71 0.00 0.04 -1.26 -2.08 135.00 136.18 3gwp s PRO 395 Ca -0.02 1.19 -0.27 0.00 0.04 0.00 0.00 61.00 61.94 3gwp s PRO 395 Cb -0.05 -2.88 0.03 0.00 0.04 0.00 0.00 34.50 31.64 3gwp s PRO 395 CO -0.09 0.35 1.28 0.42 0.04 0.00 0.00 177.00 179.00 3gwp s ILE 396 N -1.53 3.76 -0.15 0.56 1.01 0.14 -4.69 121.20 120.30 3gwp s ILE 396 Ca 0.47 0.48 -0.31 0.00 0.00 0.00 0.00 60.65 61.29 3gwp s ILE 396 Cb -0.19 -4.86 0.13 0.00 0.01 0.00 0.00 42.46 37.56 3gwp s ILE 396 CO 0.23 -1.75 1.09 0.00 0.00 0.00 0.00 174.94 174.52 3gwp s ARG 397 N 5.65 0.48 0.35 2.79 1.70 -1.26 -4.44 118.95 124.21 3gwp s ARG 397 Ca 0.37 -0.06 -0.28 0.00 -0.47 0.00 0.00 55.73 55.29 3gwp s ARG 397 Cb -0.08 0.22 -0.11 0.00 -0.57 0.00 0.00 34.95 34.41 3gwp s ARG 397 CO 0.17 -0.19 1.40 -2.00 -1.08 0.00 0.00 175.30 173.60 3gwp s GLU 398 N -2.00 4.24 -0.21 3.89 2.56 -1.26 0.53 118.70 126.45 3gwp s GLU 398 Ca 0.05 2.39 0.04 0.00 0.00 0.00 0.00 54.97 57.45 3gwp s GLU 398 Cb -0.01 -3.02 0.40 0.00 2.00 0.00 0.00 34.13 33.50 3gwp s GLU 398 CO -0.04 -0.36 1.40 -0.35 -0.56 0.00 0.00 175.26 175.35 3gwp n PRO 399 N 0.69 2.24 -3.11 4.30 -0.04 -1.26 -4.95 135.00 132.87 3gwp n PRO 399 Ca 0.01 -1.71 -0.07 0.00 -0.04 0.00 0.00 63.50 61.69 3gwp n PRO 399 Cb 0.41 -1.76 0.01 0.00 -0.04 0.00 0.00 33.50 32.11 3gwp n PRO 399 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3gwp n TYR 400 N -0.14 -3.01 -3.60 0.54 4.01 0.19 -1.07 117.16 114.07 3gwp n TYR 400 Ca 0.27 1.18 -0.38 0.00 -0.16 0.00 0.00 57.90 58.81 3gwp n TYR 400 Cb 1.02 -3.83 -0.11 0.00 -0.31 0.00 0.00 39.34 36.11 3gwp n TYR 400 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3gwp s ILE 401 N -2.80 5.27 0.32 -0.72 1.01 -1.26 -2.25 121.20 120.77 3gwp s ILE 401 Ca 0.09 0.15 -0.04 0.00 0.00 0.00 0.00 60.65 60.86 3gwp s ILE 401 Cb -0.02 -3.50 -0.05 0.00 0.01 0.00 0.00 42.46 38.90 3gwp s ILE 401 CO 0.78 0.26 0.57 0.00 0.00 0.00 0.00 174.94 176.55 3gwp s ALA 402 N 1.69 3.63 -0.43 9.38 0.00 -0.18 -4.52 121.76 131.33 3gwp s ALA 402 Ca 0.07 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.40 3gwp s ALA 402 Cb -0.16 -2.27 0.13 0.00 0.00 0.00 0.00 23.12 20.82 3gwp s ALA 402 CO 0.10 0.13 0.22 0.71 0.00 0.00 0.00 175.76 176.92 3gwp s TYR 403 N -2.20 2.03 0.38 0.00 1.51 -0.62 -0.98 117.35 117.47 3gwp s TYR 403 Ca 0.43 -2.39 -0.18 0.00 -1.01 0.00 0.00 57.07 53.92 3gwp s TYR 403 Cb -0.10 -1.92 -0.10 0.00 -0.11 0.00 0.00 41.96 39.73 3gwp s TYR 403 CO 0.33 -0.80 0.85 -1.17 -1.11 0.00 0.00 175.55 173.65 3gwp s LEU 404 N 0.48 3.99 -0.22 -1.29 0.20 -0.79 -2.78 118.68 118.26 3gwp s LEU 404 Ca 0.17 1.48 -0.29 0.00 0.69 0.00 0.00 54.13 56.18 3gwp s LEU 404 Cb -0.24 -4.31 0.15 0.00 -0.43 0.00 0.00 46.19 41.36 3gwp s LEU 404 CO -0.02 -0.29 1.14 0.00 -0.29 0.00 0.00 176.35 176.88 3gwp s GLN 405 N -3.12 0.39 0.09 1.98 -2.07 -0.73 -1.74 119.66 114.46 3gwp s GLN 405 Ca 0.58 0.17 0.00 0.00 -1.82 0.00 0.00 55.36 54.29 3gwp s GLN 405 Cb -0.10 0.19 0.00 0.00 -1.09 0.00 0.00 33.01 32.01 3gwp s GLN 405 CO 0.16 -0.11 0.00 0.41 -1.32 0.00 0.00 175.29 174.43 3gwp n GLY 406 N 0.98 -3.06 0.00 2.60 0.00 -1.21 -1.12 105.19 103.38 3gwp n GLY 406 Ca -0.08 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.13 3gwp n GLY 406 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gwp n GLY 407 N -0.42 2.76 0.37 -0.02 0.00 0.19 -4.32 105.19 103.74 3gwp n GLY 407 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.68 3gwp n GLY 407 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3gwp h LEU 408 N 0.00 1.06 -8.28 0.99 3.38 -1.89 -3.09 115.31 107.49 3gwp h LEU 408 Ca 0.00 -0.01 -0.55 0.00 0.09 0.00 0.00 57.88 57.41 3gwp h LEU 408 Cb 0.00 -0.24 -0.30 0.00 0.09 0.00 0.00 40.66 40.21 3gwp h LEU 408 CO 0.00 0.73 -0.84 0.42 0.09 0.00 0.00 178.44 178.84 3gwp s THR 409 N -6.08 1.39 0.31 0.22 -4.23 -1.26 -4.80 115.64 101.19 3gwp s THR 409 Ca -0.13 -0.73 0.07 0.00 -1.18 0.00 0.00 61.69 59.72 3gwp s THR 409 Cb 0.19 -1.18 0.30 0.00 1.34 0.00 0.00 72.50 73.16 3gwp s THR 409 CO 0.81 0.40 1.78 0.15 -0.54 0.00 0.00 174.62 177.22 3gwp h PHE 410 N 5.94 1.05 -0.81 3.99 3.57 -1.79 -0.89 116.94 127.98 3gwp h PHE 410 Ca -0.35 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.27 3gwp h PHE 410 Cb 1.16 -0.31 -0.07 0.00 2.79 0.00 0.00 35.95 39.51 3gwp h PHE 410 CO 0.41 0.23 0.47 -0.44 -2.23 0.00 0.00 178.31 176.75 3gwp h ASP 411 N 0.74 0.68 -0.68 0.41 3.32 -1.96 0.19 116.42 119.12 3gwp h ASP 411 Ca 0.58 0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.60 3gwp h ASP 411 Cb 0.93 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.36 3gwp h ASP 411 CO -0.38 0.40 0.13 -0.74 -1.72 0.00 0.00 179.24 176.93 3gwp h HIS 412 N 0.80 1.19 -0.21 4.55 2.76 -1.57 0.19 115.15 122.86 3gwp h HIS 412 Ca 0.39 -0.15 -0.02 0.00 -2.20 0.00 0.00 60.37 58.38 3gwp h HIS 412 Cb 0.33 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 3gwp h HIS 412 CO -0.06 0.98 0.05 0.00 -1.30 0.00 0.00 177.93 177.60 3gwp h ALA 413 N 1.08 0.27 -0.33 5.26 0.00 -1.13 -0.98 119.26 123.44 3gwp h ALA 413 Ca 0.21 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.02 3gwp h ALA 413 Cb 0.42 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 3gwp h ALA 413 CO 0.01 -0.08 0.04 -0.22 0.00 0.00 0.00 179.25 179.00 3gwp h LYS 414 N 0.15 0.14 -0.75 0.00 3.64 -0.36 0.03 116.57 119.43 3gwp h LYS 414 Ca 0.07 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 3gwp h LYS 414 Cb 0.28 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 3gwp h LYS 414 CO 0.00 0.09 0.30 0.82 -2.27 0.00 0.00 179.45 178.40 3gwp h ILE 415 N 0.15 1.25 -0.66 2.00 2.04 -0.55 -1.63 117.51 120.11 3gwp h ILE 415 Ca 0.16 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 3gwp h ILE 415 Cb 0.19 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 3gwp h ILE 415 CO -0.23 0.32 0.28 1.23 0.00 0.00 0.00 178.15 179.75 3gwp h GLY 416 N 1.07 1.04 0.78 5.37 0.00 -0.62 -2.14 103.07 108.56 3gwp h GLY 416 Ca 0.25 -0.55 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 3gwp h GLY 416 CO -0.02 0.52 -0.04 -2.22 0.00 0.00 0.00 176.54 174.77 3gwp h ILE 417 N 0.92 1.29 -0.87 2.60 2.04 -0.83 -2.25 117.51 120.41 3gwp h ILE 417 Ca 0.22 -1.01 0.03 0.00 1.00 0.00 0.00 64.86 65.11 3gwp h ILE 417 Cb 0.17 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.81 3gwp h ILE 417 CO -0.02 0.30 0.57 -0.07 0.00 0.00 0.00 178.15 178.93 3gwp h LEU 418 N 0.03 0.94 -0.45 1.44 4.07 -1.25 0.19 115.31 120.28 3gwp h LEU 418 Ca 0.04 -0.01 -0.12 0.00 0.08 0.00 0.00 57.88 57.87 3gwp h LEU 418 Cb 0.48 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.99 3gwp h LEU 418 CO 0.02 0.65 -0.18 0.40 -1.08 0.00 0.00 178.44 178.25 3gwp h ILE 419 N 1.09 1.27 0.02 1.22 2.04 -1.33 -2.29 117.51 119.54 3gwp h ILE 419 Ca 0.35 -1.32 -0.00 0.00 1.00 0.00 0.00 64.86 64.88 3gwp h ILE 419 Cb 0.02 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 3gwp h ILE 419 CO -0.10 0.45 -0.01 0.00 0.00 0.00 0.00 178.15 178.49 3gwp h ALA 420 N 0.85 -0.02 -0.09 1.87 0.00 -0.86 -3.14 119.26 117.86 3gwp h ALA 420 Ca 0.10 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 3gwp h ALA 420 Cb 0.74 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3gwp h ALA 420 CO 0.06 -0.29 -0.30 1.25 0.00 0.00 0.00 179.25 179.96 3gwp h LEU 421 N -0.47 0.16 -0.20 0.00 5.85 -0.72 -2.40 115.31 117.53 3gwp h LEU 421 Ca -0.00 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3gwp h LEU 421 Cb 0.45 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.43 3gwp h LEU 421 CO 0.00 0.47 0.00 -1.20 -0.34 0.00 0.00 178.44 177.37 3gwp n SER 422 N -4.13 0.28 0.09 1.25 7.64 -0.86 -0.87 113.62 117.02 3gwp n SER 422 Ca -0.01 0.56 0.03 0.00 1.01 0.00 0.00 58.87 60.46 3gwp n SER 422 Cb 0.38 -0.62 -0.01 0.00 -1.01 0.00 0.00 64.21 62.95 3gwp n SER 422 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 3gwp h ARG 423 N 0.00 0.00 0.00 1.43 2.43 -1.38 -3.39 114.38 113.47 3gwp h ARG 423 Ca 0.00 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 3gwp h ARG 423 Cb 0.37 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 3gwp h ARG 423 CO 0.00 0.31 -1.57 -0.89 -1.51 0.00 0.00 179.97 176.31 3gwp n ILE 424 N -3.00 1.51 -3.00 1.20 5.41 -1.02 -4.87 119.36 115.59 3gwp n ILE 424 Ca -0.03 -0.07 -0.43 0.00 1.00 0.00 0.00 62.75 63.22 3gwp n ILE 424 Cb 0.74 -2.14 -0.06 0.00 -0.71 0.00 0.00 39.64 37.48 3gwp n ILE 424 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3gwp s VAL 425 N -2.60 4.69 -2.16 1.39 1.01 -0.05 -5.14 120.40 117.53 3gwp s VAL 425 Ca -0.31 0.32 0.31 0.00 0.00 0.00 0.00 61.98 62.30 3gwp s VAL 425 Cb 0.08 -4.30 0.79 0.00 0.00 0.00 0.00 36.38 32.95 3gwp s VAL 425 CO 0.45 -0.71 2.07 0.29 0.00 0.00 0.00 175.10 177.20