#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wfn n LYS 42 N 0.00 0.19 -0.07 -2.67 3.00 -1.26 -2.65 118.16 114.69 2wfn n LYS 42 Ca 0.00 0.33 0.00 0.00 -0.00 0.00 0.00 58.31 58.65 2wfn n LYS 42 Cb 0.00 -1.80 0.29 0.00 0.00 0.00 0.00 35.03 33.51 2wfn n LYS 42 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2wfn h LYS 43 N 0.00 0.70 -0.56 1.64 1.79 -2.00 -3.26 116.57 114.87 2wfn h LYS 43 Ca 0.00 -0.10 0.10 0.00 -2.18 0.00 0.00 60.65 58.47 2wfn h LYS 43 Cb 0.46 -0.13 -0.08 0.00 -1.58 0.00 0.00 32.23 30.90 2wfn h LYS 43 CO 0.00 0.58 0.13 0.82 -1.08 0.00 0.00 179.45 179.90 2wfn h ILE 44 N 0.69 0.69 -0.65 1.86 2.04 -1.92 0.11 117.51 120.33 2wfn h ILE 44 Ca 0.17 -0.09 -0.06 0.00 1.00 0.00 0.00 64.86 65.87 2wfn h ILE 44 Cb 0.15 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 2wfn h ILE 44 CO -0.02 0.05 0.16 -0.61 0.00 0.00 0.00 178.15 177.73 2wfn h GLN 45 N 0.27 1.03 -0.45 2.37 4.15 -1.78 -0.17 115.11 120.53 2wfn h GLN 45 Ca 0.29 -0.25 -0.04 0.00 0.77 0.00 0.00 58.65 59.42 2wfn h GLN 45 Cb 0.41 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.94 2wfn h GLN 45 CO -0.36 0.93 0.12 0.37 -1.93 0.00 0.00 178.83 177.96 2wfn h GLN 46 N 0.96 0.71 -0.59 1.69 4.15 -1.46 -1.40 115.11 119.18 2wfn h GLN 46 Ca 0.20 -0.16 -0.05 0.00 0.77 0.00 0.00 58.65 59.41 2wfn h GLN 46 Cb 0.36 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.93 2wfn h GLN 46 CO 0.00 0.70 0.17 -0.91 -1.93 0.00 0.00 178.83 176.86 2wfn h ASN 47 N 0.60 0.87 -0.44 -0.69 2.35 -0.56 -0.87 115.58 116.82 2wfn h ASN 47 Ca 0.14 -0.21 -0.14 0.00 -0.55 0.00 0.00 56.30 55.54 2wfn h ASN 47 Cb 0.30 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 2wfn h ASN 47 CO -0.00 0.85 -0.25 0.74 -1.65 0.00 0.00 177.43 177.12 2wfn h THR 48 N 0.84 1.27 -0.21 2.81 2.02 -0.99 -1.66 112.91 116.99 2wfn h THR 48 Ca 0.19 -1.42 -0.11 0.00 0.77 0.00 0.00 66.41 65.84 2wfn h THR 48 Cb 0.30 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 2wfn h THR 48 CO -0.00 0.48 -0.35 -0.26 0.37 0.00 0.00 175.52 175.76 2wfn h PHE 49 N 0.80 0.51 -0.16 3.16 -1.00 -1.14 -1.48 116.94 117.63 2wfn h PHE 49 Ca 0.09 -0.13 -0.08 0.00 2.81 0.00 0.00 57.97 60.67 2wfn h PHE 49 Cb 0.84 -0.12 -0.00 0.00 3.61 0.00 0.00 35.95 40.28 2wfn h PHE 49 CO 0.06 0.73 -0.20 1.15 -1.61 0.00 0.00 178.31 178.44 2wfn h THR 50 N 0.37 1.35 -0.54 -1.55 2.02 -1.09 -2.59 112.91 110.88 2wfn h THR 50 Ca 0.04 -1.40 -0.03 0.00 0.77 0.00 0.00 66.41 65.79 2wfn h THR 50 Cb 0.79 1.89 -0.03 0.00 -1.74 0.00 0.00 68.15 69.06 2wfn h THR 50 CO 0.06 0.42 0.22 0.03 0.37 0.00 0.00 175.52 176.62 2wfn h ARG 51 N 0.05 0.78 -0.62 6.66 3.08 -1.21 -0.78 114.38 122.35 2wfn h ARG 51 Ca 0.02 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 59.91 2wfn h ARG 51 Cb 0.76 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.64 2wfn h ARG 51 CO 0.05 0.64 0.18 2.35 -1.07 0.00 0.00 179.97 182.12 2wfn h TRP 52 N 0.77 1.00 -0.34 3.04 7.01 -1.29 -1.72 115.95 124.42 2wfn h TRP 52 Ca 0.19 -0.10 -0.02 0.00 2.11 0.00 0.00 58.89 61.06 2wfn h TRP 52 Cb 0.15 -0.29 -0.02 0.00 -2.10 0.00 0.00 29.16 26.91 2wfn h TRP 52 CO 0.01 0.83 0.15 0.00 -2.79 0.00 0.00 178.44 176.63 2wfn h ASN 54 N 0.40 0.00 1.03 0.00 2.35 -1.07 -1.18 115.58 117.11 2wfn h ASN 54 Ca 0.11 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.80 2wfn h ASN 54 Cb 0.16 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 2wfn h ASN 54 CO -0.01 0.18 -0.31 -0.08 -1.65 0.00 0.00 177.43 175.56 2wfn h GLU 55 N 0.00 0.00 0.09 0.81 4.57 -1.17 -2.12 114.58 116.76 2wfn h GLU 55 Ca -0.00 0.00 -0.37 0.00 -1.18 0.00 0.00 59.36 57.81 2wfn h GLU 55 Cb 0.60 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.16 2wfn h GLU 55 CO 0.02 0.31 -2.09 0.72 -1.18 0.00 0.00 179.01 176.79 2wfn n HIS 56 N -3.40 0.96 0.24 0.92 8.25 -1.04 -4.34 115.22 116.81 2wfn n HIS 56 Ca 0.00 0.21 0.09 0.00 -0.26 0.00 0.00 57.72 57.77 2wfn n HIS 56 Cb 0.51 -1.13 0.59 0.00 1.12 0.00 0.00 29.99 31.08 2wfn n HIS 56 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2wfn h LEU 57 N 0.05 0.00 -2.04 2.41 3.38 -1.22 -2.97 115.31 114.92 2wfn h LEU 57 Ca -0.45 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.51 2wfn h LEU 57 Cb 2.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.76 2wfn h LEU 57 CO 0.05 0.19 -0.01 0.07 0.09 0.00 0.00 178.44 178.83 2wfn h LYS 58 N 0.00 0.00 0.00 1.13 5.09 -1.31 -1.51 116.57 119.97 2wfn h LYS 58 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 2wfn h LYS 58 Cb 0.44 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.77 2wfn h LYS 58 CO 0.02 0.01 0.00 0.00 -2.09 0.00 0.00 179.45 177.40 2wfn n VAL 60 N -2.82 2.30 -3.47 0.00 0.31 -0.73 -4.97 118.33 108.95 2wfn n VAL 60 Ca 0.02 -2.61 -0.25 0.00 -0.01 0.00 0.00 64.34 61.48 2wfn n VAL 60 Cb 0.33 -0.28 0.01 0.00 -0.91 0.00 0.00 33.84 32.99 2wfn n VAL 60 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2wfn n SER 61 N -1.07 -4.28 -4.42 4.52 7.64 -1.11 -4.98 113.62 109.92 2wfn n SER 61 Ca 0.25 -0.49 -0.21 0.00 1.01 0.00 0.00 58.87 59.43 2wfn n SER 61 Cb 0.86 -3.50 -0.10 0.00 -1.01 0.00 0.00 64.21 60.45 2wfn n SER 61 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2wfn s LYS 62 N -6.14 1.53 -0.27 1.43 1.02 -0.65 -5.01 119.74 111.65 2wfn s LYS 62 Ca 0.46 -1.78 -0.25 0.00 0.02 0.00 0.00 55.97 54.42 2wfn s LYS 62 Cb -0.24 -1.08 0.09 0.00 -0.52 0.00 0.00 37.83 36.09 2wfn s LYS 62 CO 0.57 0.01 0.86 0.50 -0.92 0.00 0.00 175.35 176.36 2wfn s ARG 63 N -3.75 0.69 0.15 1.68 3.52 -1.26 -3.07 118.95 116.91 2wfn s ARG 63 Ca 0.30 0.81 0.06 0.00 -0.13 0.00 0.00 55.73 56.77 2wfn s ARG 63 Cb 0.04 0.34 -0.04 0.00 -1.56 0.00 0.00 34.95 33.73 2wfn s ARG 63 CO 0.12 -0.09 0.03 0.96 -0.81 0.00 0.00 175.30 175.51 2wfn s ILE 64 N 0.29 3.96 -0.00 4.11 -4.36 -1.26 -5.03 121.20 118.91 2wfn s ILE 64 Ca 0.01 -1.25 0.01 0.00 -0.26 0.00 0.00 60.65 59.17 2wfn s ILE 64 Cb -0.05 -2.98 -0.02 0.00 1.25 0.00 0.00 42.46 40.67 2wfn s ILE 64 CO -0.02 -0.06 0.03 0.00 0.24 0.00 0.00 174.94 175.13 2wfn n ALA 65 N -0.02 2.04 -3.42 2.27 0.00 -1.26 -4.91 120.51 115.21 2wfn n ALA 65 Ca -0.10 -0.03 -0.15 0.00 0.00 0.00 0.00 53.44 53.16 2wfn n ALA 65 Cb 0.54 -0.03 -0.10 0.00 0.00 0.00 0.00 19.45 19.86 2wfn n ALA 65 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2wfn s ASN 66 N -2.20 1.14 0.63 0.00 3.84 -1.26 -5.02 114.94 112.07 2wfn s ASN 66 Ca -0.00 -0.27 0.36 0.00 0.21 0.00 0.00 52.86 53.16 2wfn s ASN 66 Cb 0.01 0.63 2.07 0.00 -0.55 0.00 0.00 41.25 43.41 2wfn s ASN 66 CO 0.05 -0.34 2.26 -0.07 -2.79 0.00 0.00 177.10 176.21 2wfn h LEU 67 N 8.26 0.00 -0.18 3.21 3.38 -1.94 0.12 115.31 128.15 2wfn h LEU 67 Ca -0.16 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.58 2wfn h LEU 67 Cb 1.13 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.89 2wfn h LEU 67 CO 0.30 0.00 -0.81 -0.61 0.09 0.00 0.00 178.44 177.40 2wfn h GLN 68 N 0.00 0.69 0.00 1.13 4.15 -1.95 -3.41 115.11 115.72 2wfn h GLN 68 Ca 0.01 -0.60 -0.14 0.00 0.77 0.00 0.00 58.65 58.69 2wfn h GLN 68 Cb 0.13 0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.93 2wfn h GLN 68 CO -0.00 1.21 -1.54 0.25 -1.93 0.00 0.00 178.83 176.82 2wfn n THR 69 N -3.90 0.54 1.46 2.39 -2.24 -0.82 -4.42 114.28 107.29 2wfn n THR 69 Ca -0.07 -0.29 0.13 0.00 -2.27 0.00 0.00 64.05 61.55 2wfn n THR 69 Cb 0.76 -0.81 0.73 0.00 -2.10 0.00 0.00 70.33 68.91 2wfn n THR 69 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2wfn n ASP 70 N -2.46 0.00 -0.23 3.42 9.92 0.36 -2.34 116.55 125.22 2wfn n ASP 70 Ca -0.14 -0.42 0.06 0.00 -0.53 0.00 0.00 54.79 53.75 2wfn n ASP 70 Cb 0.73 -0.16 -0.01 0.00 -0.64 0.00 0.00 41.12 41.03 2wfn n ASP 70 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2wfn n LEU 71 N -1.16 1.23 -0.04 0.64 4.77 -1.26 -4.54 117.00 116.64 2wfn n LEU 71 Ca 0.16 -0.72 -0.02 0.00 -0.03 0.00 0.00 56.01 55.41 2wfn n LEU 71 Cb 0.16 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.49 2wfn n LEU 71 CO 0.18 0.25 0.89 0.28 -1.33 0.00 0.00 177.39 177.66 2wfn h SER 72 N 1.13 0.58 1.20 -1.43 0.02 -1.65 -1.80 113.55 111.61 2wfn h SER 72 Ca 0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 2wfn h SER 72 Cb 0.40 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2wfn h SER 72 CO 0.00 0.68 0.00 -0.90 -1.14 0.00 0.00 176.83 175.47 2wfn n ASP 73 N -4.23 0.56 0.00 3.07 5.68 -1.26 -4.39 116.55 115.97 2wfn n ASP 73 Ca 0.02 0.57 0.00 0.00 -0.50 0.00 0.00 54.79 54.87 2wfn n ASP 73 Cb 0.29 -0.71 0.00 0.00 -1.14 0.00 0.00 41.12 39.55 2wfn n ASP 73 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wfn n GLY 74 N 1.09 2.14 0.05 6.12 0.00 -0.68 -4.69 105.19 109.23 2wfn n GLY 74 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 2wfn n GLY 74 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wfn h LEU 75 N 0.00 -0.01 -0.02 0.99 3.38 -1.90 -2.30 115.31 115.45 2wfn h LEU 75 Ca 0.00 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2wfn h LEU 75 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2wfn h LEU 75 CO 0.00 0.34 -0.12 0.54 0.09 0.00 0.00 178.44 179.29 2wfn n ARG 76 N -4.93 0.10 0.01 1.13 1.74 -1.26 -2.51 116.66 110.94 2wfn n ARG 76 Ca -0.08 -0.02 -0.18 0.00 -0.77 0.00 0.00 57.85 56.80 2wfn n ARG 76 Cb 0.19 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.01 2wfn n ARG 76 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2wfn h LEU 77 N 0.05 0.54 -0.34 0.55 5.85 -1.82 -2.75 115.31 117.40 2wfn h LEU 77 Ca 0.00 -0.78 -0.00 0.00 0.84 0.00 0.00 57.88 57.93 2wfn h LEU 77 Cb 0.47 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2wfn h LEU 77 CO 0.00 1.26 0.20 0.40 -0.34 0.00 0.00 178.44 179.96 2wfn h ILE 78 N -0.11 1.13 -0.65 4.05 2.04 -1.38 -2.00 117.51 120.59 2wfn h ILE 78 Ca -0.09 -0.32 0.07 0.00 1.00 0.00 0.00 64.86 65.52 2wfn h ILE 78 Cb 1.38 0.72 -0.06 0.00 -0.74 0.00 0.00 36.82 38.12 2wfn h ILE 78 CO 0.13 0.13 0.33 0.00 0.00 0.00 0.00 178.15 178.74 2wfn h ALA 79 N 1.07 0.87 -0.61 1.87 0.00 -1.58 0.29 119.26 121.17 2wfn h ALA 79 Ca 0.12 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2wfn h ALA 79 Cb 0.04 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2wfn h ALA 79 CO -0.02 -0.04 0.30 1.25 0.00 0.00 0.00 179.25 180.74 2wfn h LEU 80 N 0.59 0.79 -0.77 0.00 5.85 -1.34 -2.68 115.31 117.74 2wfn h LEU 80 Ca 0.31 -0.12 -0.11 0.00 0.84 0.00 0.00 57.88 58.79 2wfn h LEU 80 Cb 0.26 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2wfn h LEU 80 CO -0.22 0.69 -0.30 -0.07 -0.34 0.00 0.00 178.44 178.19 2wfn h LEU 81 N 0.83 0.60 -0.61 2.25 3.38 -0.67 -2.23 115.31 118.87 2wfn h LEU 81 Ca 0.21 -0.23 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 2wfn h LEU 81 Cb 0.10 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2wfn h LEU 81 CO -0.03 0.87 -0.35 -0.33 0.09 0.00 0.00 178.44 178.69 2wfn h GLU 82 N 0.50 0.72 0.04 1.13 5.08 -0.86 -2.02 114.58 119.17 2wfn h GLU 82 Ca 0.06 -0.35 -0.22 0.00 -1.00 0.00 0.00 59.36 57.86 2wfn h GLU 82 Cb 0.78 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 2wfn h GLU 82 CO 0.06 0.96 -1.01 -0.24 -1.00 0.00 0.00 179.01 177.78 2wfn h VAL 83 N 0.60 1.57 -0.30 3.13 3.04 -1.45 -2.07 116.25 120.78 2wfn h VAL 83 Ca 0.06 -3.00 -0.13 0.00 -1.01 0.00 0.00 66.70 62.63 2wfn h VAL 83 Cb 0.88 2.72 -0.00 0.00 -2.01 0.00 0.00 31.29 32.87 2wfn h VAL 83 CO 0.08 0.87 -0.31 -0.07 -1.01 0.00 0.00 177.57 177.13 2wfn h LEU 84 N 0.06 0.79 0.00 3.16 3.38 -1.36 -3.28 115.31 118.06 2wfn h LEU 84 Ca -0.06 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2wfn h LEU 84 Cb 1.71 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.24 2wfn h LEU 84 CO 0.15 1.10 -0.67 -1.54 0.09 0.00 0.00 178.44 177.57 2wfn n SER 85 N -4.23 0.60 -1.68 -0.43 3.41 -0.76 -4.95 113.62 105.58 2wfn n SER 85 Ca -0.04 -0.15 -0.21 0.00 -0.26 0.00 0.00 58.87 58.21 2wfn n SER 85 Cb 0.49 0.37 -0.08 0.00 -0.26 0.00 0.00 64.21 64.72 2wfn n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wfn n GLN 86 N -1.79 -1.47 -4.28 4.33 1.13 -0.79 -4.98 117.38 109.53 2wfn n GLN 86 Ca 0.04 1.22 -0.22 0.00 -1.94 0.00 0.00 57.00 56.09 2wfn n GLN 86 Cb 0.39 -5.63 -0.12 0.00 0.11 0.00 0.00 30.24 24.99 2wfn n GLN 86 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2wfn s LYS 87 N -3.89 1.05 0.87 -1.09 1.02 -1.17 -5.04 119.74 111.49 2wfn s LYS 87 Ca 0.00 -1.08 -0.13 0.00 0.02 0.00 0.00 55.97 54.78 2wfn s LYS 87 Cb 0.00 -1.23 0.12 0.00 -0.52 0.00 0.00 37.83 36.20 2wfn s LYS 87 CO 0.00 0.29 1.18 0.21 -0.92 0.00 0.00 175.35 176.11 2wfn s LYS 88 N -1.79 1.45 0.40 1.68 2.47 -1.26 -4.46 119.74 118.23 2wfn s LYS 88 Ca 0.04 0.09 -0.22 0.00 -1.56 0.00 0.00 55.97 54.32 2wfn s LYS 88 Cb -0.10 -1.89 -0.10 0.00 -1.46 0.00 0.00 37.83 34.27 2wfn s LYS 88 CO 0.03 -1.95 0.96 1.41 0.16 0.00 0.00 175.35 175.96 2wfn s MET 89 N -5.52 4.29 0.29 4.03 1.75 -1.26 -4.98 119.30 117.90 2wfn s MET 89 Ca 0.64 1.20 0.12 0.00 -1.25 0.00 0.00 55.69 56.41 2wfn s MET 89 Cb -0.11 -2.35 0.41 0.00 2.84 0.00 0.00 34.83 35.62 2wfn s MET 89 CO 0.51 0.02 1.63 1.12 -0.65 0.00 0.00 175.02 177.65 2wfn h HIS 90 N 2.24 0.00 -4.03 4.11 2.07 -1.96 -3.45 115.15 114.12 2wfn h HIS 90 Ca -0.48 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 56.93 2wfn h HIS 90 Cb 1.19 0.00 -0.15 0.00 2.57 0.00 0.00 27.41 31.02 2wfn h HIS 90 CO 0.61 0.57 -0.53 -0.98 -3.07 0.00 0.00 177.93 174.53 2wfn s ARG 91 N -3.59 0.72 0.60 5.12 1.70 -1.26 -5.16 118.95 117.08 2wfn s ARG 91 Ca -0.01 -1.09 -0.17 0.00 -0.47 0.00 0.00 55.73 53.99 2wfn s ARG 91 Cb 0.12 0.27 -0.03 0.00 -0.57 0.00 0.00 34.95 34.75 2wfn s ARG 91 CO 0.75 -0.18 1.10 0.15 -1.08 0.00 0.00 175.30 176.03 2wfn s LYS 92 N -3.88 3.13 0.31 3.89 1.02 -1.26 -5.07 119.74 117.87 2wfn s LYS 92 Ca 0.06 1.40 0.05 0.00 0.02 0.00 0.00 55.97 57.50 2wfn s LYS 92 Cb 0.06 -1.99 -0.06 0.00 -0.52 0.00 0.00 37.83 35.32 2wfn s LYS 92 CO -0.10 -0.99 0.02 -3.38 -0.92 0.00 0.00 175.35 169.97 2wfn s HIS 93 N -2.19 1.98 -0.13 3.18 -3.43 -1.26 -5.07 115.29 108.36 2wfn s HIS 93 Ca 0.68 -0.86 -0.29 0.00 -0.80 0.00 0.00 55.06 53.79 2wfn s HIS 93 Cb -0.20 -1.25 -0.03 0.00 -1.43 0.00 0.00 32.58 29.66 2wfn s HIS 93 CO 0.35 0.12 1.47 -0.80 -2.00 0.00 0.00 174.74 173.88 2wfn s ASN 94 N -3.48 6.74 0.23 7.38 0.02 -1.26 -4.90 114.94 119.67 2wfn s ASN 94 Ca 0.34 1.88 0.09 0.00 -1.02 0.00 0.00 52.86 54.14 2wfn s ASN 94 Cb 0.07 -2.54 0.19 0.00 0.02 0.00 0.00 41.25 39.00 2wfn s ASN 94 CO 0.14 -0.91 1.51 1.56 0.02 0.00 0.00 177.10 179.43 2wfn h GLN 95 N 9.13 0.03 -3.11 -0.60 1.08 -1.99 -3.38 115.11 116.28 2wfn h GLN 95 Ca -0.32 -0.03 -0.62 0.00 -1.45 0.00 0.00 58.65 56.22 2wfn h GLN 95 Cb 1.14 0.01 -0.41 0.00 -0.05 0.00 0.00 27.48 28.16 2wfn h GLN 95 CO 0.97 0.74 -0.61 1.03 -0.95 0.00 0.00 178.83 180.01 2wfn s ARG 96 N -3.39 2.24 -1.22 1.46 0.52 -1.26 -5.04 118.95 112.27 2wfn s ARG 96 Ca -0.01 -3.09 -0.21 0.00 -0.52 0.00 0.00 55.73 51.91 2wfn s ARG 96 Cb 0.12 -3.26 -0.01 0.00 0.52 0.00 0.00 34.95 32.32 2wfn s ARG 96 CO 0.78 -1.25 1.82 -1.25 0.02 0.00 0.00 175.30 175.42 2wfn s PRO 97 N -1.07 3.24 0.04 3.54 0.04 -1.26 -4.79 135.00 134.73 2wfn s PRO 97 Ca 0.23 -1.51 -0.26 0.00 0.04 0.00 0.00 61.00 59.51 2wfn s PRO 97 Cb -0.09 -5.38 -0.17 0.00 0.04 0.00 0.00 34.50 28.90 2wfn s PRO 97 CO -0.13 -3.07 1.48 1.15 0.04 0.00 0.00 177.00 176.47 2wfn h THR 98 N 5.98 0.89 -2.17 1.26 2.02 -1.96 -3.45 112.91 115.49 2wfn h THR 98 Ca 0.32 -0.41 -0.58 0.00 0.77 0.00 0.00 66.41 66.50 2wfn h THR 98 Cb 0.91 1.14 -0.11 0.00 -1.74 0.00 0.00 68.15 68.35 2wfn h THR 98 CO 1.34 0.09 -0.68 -0.36 0.37 0.00 0.00 175.52 176.28 2wfn s PHE 99 N -5.32 2.52 0.62 3.16 0.08 -1.26 -5.03 117.98 112.76 2wfn s PHE 99 Ca -0.15 -0.29 0.35 0.00 0.12 0.00 0.00 56.93 56.96 2wfn s PHE 99 Cb 0.04 -1.16 2.02 0.00 -0.57 0.00 0.00 43.02 43.35 2wfn s PHE 99 CO 0.62 0.64 2.27 0.07 -0.10 0.00 0.00 175.22 178.72 2wfn h ARG 100 N 2.02 0.00 -0.27 0.44 0.11 -1.99 0.24 114.38 114.94 2wfn h ARG 100 Ca -0.42 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.65 2wfn h ARG 100 Cb 1.25 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.32 2wfn h ARG 100 CO 0.61 0.00 0.13 0.37 0.10 0.00 0.00 179.97 181.19 2wfn h GLN 101 N 0.00 0.36 0.00 0.08 5.75 -1.97 0.20 115.11 119.53 2wfn h GLN 101 Ca 0.01 -0.03 -0.21 0.00 -0.15 0.00 0.00 58.65 58.27 2wfn h GLN 101 Cb 0.09 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.53 2wfn h GLN 101 CO -0.00 0.28 -1.20 0.52 -2.65 0.00 0.00 178.83 175.78 2wfn h MET 102 N 0.37 0.00 -0.47 1.69 2.86 -1.33 -3.13 114.93 114.92 2wfn h MET 102 Ca 0.10 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.61 2wfn h MET 102 Cb 0.03 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 2wfn h MET 102 CO -0.01 0.64 -0.21 1.96 1.06 0.00 0.00 176.91 180.34 2wfn h GLN 103 N 0.00 0.96 -0.74 1.72 4.20 -1.08 -1.87 115.11 118.31 2wfn h GLN 103 Ca -0.12 -0.40 -0.03 0.00 0.06 0.00 0.00 58.65 58.16 2wfn h GLN 103 Cb 1.74 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 29.45 2wfn h GLN 103 CO 0.09 1.07 0.34 -0.07 -0.67 0.00 0.00 178.83 179.59 2wfn h LEU 104 N 0.83 0.97 -0.45 1.46 -0.00 -0.72 -2.30 115.31 115.10 2wfn h LEU 104 Ca 0.11 -0.12 -0.10 0.00 -0.00 0.00 0.00 57.88 57.77 2wfn h LEU 104 Cb 0.78 -0.25 -0.01 0.00 -0.00 0.00 0.00 40.66 41.17 2wfn h LEU 104 CO 0.06 0.84 -0.12 -0.33 -0.00 0.00 0.00 178.44 178.89 2wfn h GLU 105 N 1.06 0.88 -0.60 1.13 5.08 -1.46 -0.67 114.58 120.00 2wfn h GLU 105 Ca 0.25 -0.34 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 2wfn h GLU 105 Cb 0.14 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 2wfn h GLU 105 CO -0.03 0.98 0.18 -0.91 -1.00 0.00 0.00 179.01 178.23 2wfn h ASN 106 N 0.71 0.84 0.61 1.42 4.21 -1.19 -1.79 115.58 120.40 2wfn h ASN 106 Ca 0.11 -0.14 -0.18 0.00 1.21 0.00 0.00 56.30 57.30 2wfn h ASN 106 Cb 0.66 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.63 2wfn h ASN 106 CO 0.05 0.80 -0.82 0.58 -1.29 0.00 0.00 177.43 176.74 2wfn h VAL 107 N 0.88 1.50 -0.23 2.81 2.07 -1.37 -2.99 116.25 118.92 2wfn h VAL 107 Ca 0.20 -2.57 -0.00 0.00 0.82 0.00 0.00 66.70 65.14 2wfn h VAL 107 Cb 0.27 2.41 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 2wfn h VAL 107 CO -0.01 0.75 0.13 0.28 0.02 0.00 0.00 177.57 178.74 2wfn h SER 108 N 0.09 0.29 0.22 0.57 0.02 -0.65 0.89 113.55 114.98 2wfn h SER 108 Ca -0.03 -0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 60.77 2wfn h SER 108 Cb 1.43 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.89 2wfn h SER 108 CO 0.12 0.29 -0.26 1.62 -1.14 0.00 0.00 176.83 177.47 2wfn h VAL 109 N 0.26 1.20 -0.36 2.27 3.04 -1.41 0.14 116.25 121.40 2wfn h VAL 109 Ca 0.08 -0.95 -0.10 0.00 -1.01 0.00 0.00 66.70 64.72 2wfn h VAL 109 Cb 0.07 1.46 -0.01 0.00 -2.01 0.00 0.00 31.29 30.80 2wfn h VAL 109 CO -0.01 0.28 -0.15 0.00 -1.01 0.00 0.00 177.57 176.67 2wfn h ALA 110 N 1.68 0.50 -0.01 3.17 0.00 -1.29 -2.06 119.26 121.26 2wfn h ALA 110 Ca 0.01 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.45 2wfn h ALA 110 Cb 0.49 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2wfn h ALA 110 CO 0.03 0.41 -0.61 -0.07 0.00 0.00 0.00 179.25 179.01 2wfn h LEU 111 N 0.52 0.02 -0.23 0.00 4.07 -0.40 -2.53 115.31 116.76 2wfn h LEU 111 Ca 0.08 -0.01 -0.06 0.00 0.08 0.00 0.00 57.88 57.97 2wfn h LEU 111 Cb 0.69 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.41 2wfn h LEU 111 CO 0.05 0.63 -0.09 -0.33 -1.08 0.00 0.00 178.44 177.62 2wfn h GLU 112 N 0.02 0.47 -0.55 1.13 5.08 -0.69 -1.00 114.58 119.04 2wfn h GLU 112 Ca -0.01 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 2wfn h GLU 112 Cb 1.08 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.29 2wfn h GLU 112 CO 0.08 0.72 0.31 0.35 -1.00 0.00 0.00 179.01 179.47 2wfn h PHE 113 N 0.19 0.72 -0.13 4.33 3.57 -1.36 0.54 116.94 124.81 2wfn h PHE 113 Ca 0.05 -0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.39 2wfn h PHE 113 Cb 0.57 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 2wfn h PHE 113 CO 0.06 0.50 -0.59 1.25 -2.23 0.00 0.00 178.31 177.30 2wfn h LEU 114 N 0.75 0.47 -0.05 0.59 5.85 -1.34 -2.90 115.31 118.69 2wfn h LEU 114 Ca 0.19 -0.26 -0.21 0.00 0.84 0.00 0.00 57.88 58.45 2wfn h LEU 114 Cb 0.01 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 40.92 2wfn h LEU 114 CO -0.03 0.95 -0.77 -0.78 -0.34 0.00 0.00 178.44 177.47 2wfn h ASP 115 N 0.32 0.77 0.00 1.25 1.82 -0.53 -2.77 116.42 117.27 2wfn h ASP 115 Ca -0.00 -0.70 0.00 0.00 -0.39 0.00 0.00 57.03 55.94 2wfn h ASP 115 Cb 1.12 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.90 2wfn h ASP 115 CO 0.10 1.36 0.00 -2.11 -1.61 0.00 0.00 179.24 176.98 2wfn n ARG 116 N -4.04 0.84 -0.35 0.28 1.85 0.12 -2.31 116.66 113.05 2wfn n ARG 116 Ca -0.09 0.00 0.08 0.00 -1.00 0.00 0.00 57.85 56.83 2wfn n ARG 116 Cb 0.74 -1.40 0.24 0.00 -1.05 0.00 0.00 32.46 30.99 2wfn n ARG 116 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 2wfn n GLU 117 N -0.90 3.06 -1.39 2.89 4.07 -1.09 -4.97 120.64 122.31 2wfn n GLU 117 Ca 0.16 -2.47 -0.13 0.00 -0.06 0.00 0.00 57.16 54.66 2wfn n GLU 117 Cb 0.07 -1.56 -0.06 0.00 -0.06 0.00 0.00 31.44 29.84 2wfn n GLU 117 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2wfn n SER 118 N 0.58 -4.89 -4.62 4.31 7.64 -0.98 -4.98 113.62 110.68 2wfn n SER 118 Ca 0.18 0.33 -0.42 0.00 1.01 0.00 0.00 58.87 59.98 2wfn n SER 118 Cb 0.65 -3.57 -0.05 0.00 -1.01 0.00 0.00 64.21 60.23 2wfn n SER 118 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2wfn s ILE 119 N -2.40 4.85 -0.05 0.44 1.01 -1.05 -5.02 121.20 118.97 2wfn s ILE 119 Ca 0.00 1.25 -0.30 0.00 0.00 0.00 0.00 60.65 61.60 2wfn s ILE 119 Cb 0.00 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 2wfn s ILE 119 CO 0.00 -0.15 1.31 -0.54 0.00 0.00 0.00 174.94 175.56 2wfn s LYS 120 N 2.83 4.30 -0.26 2.79 1.02 -1.26 -4.50 119.74 124.66 2wfn s LYS 120 Ca 0.31 1.81 -0.10 0.00 0.02 0.00 0.00 55.97 58.01 2wfn s LYS 120 Cb -0.15 -3.62 -0.05 0.00 -0.52 0.00 0.00 37.83 33.50 2wfn s LYS 120 CO 0.10 -0.56 0.16 -0.51 -0.92 0.00 0.00 175.35 173.62 2wfn s LEU 121 N 2.60 3.93 -1.27 3.17 1.43 -1.26 -5.01 118.68 122.27 2wfn s LEU 121 Ca 0.60 -0.01 -0.10 0.00 -1.03 0.00 0.00 54.13 53.59 2wfn s LEU 121 Cb -0.27 -2.07 0.17 0.00 0.03 0.00 0.00 46.19 44.04 2wfn s LEU 121 CO 0.23 -0.01 1.83 0.55 0.23 0.00 0.00 176.35 179.19 2wfn n VAL 122 N 4.76 4.34 -3.33 -1.59 3.14 -1.26 -4.63 118.33 119.76 2wfn n VAL 122 Ca -0.15 -4.43 -0.11 0.00 -2.96 0.00 0.00 64.34 56.69 2wfn n VAL 122 Cb 0.52 -2.37 0.01 0.00 -1.06 0.00 0.00 33.84 30.94 2wfn n VAL 122 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2wfn n SER 123 N 4.04 -6.68 -3.89 6.55 7.64 -1.26 -5.04 113.62 114.99 2wfn n SER 123 Ca 0.39 -0.47 -0.27 0.00 1.01 0.00 0.00 58.87 59.53 2wfn n SER 123 Cb 0.37 -4.21 -0.17 0.00 -1.01 0.00 0.00 64.21 59.19 2wfn n SER 123 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2wfn s ILE 124 N -3.10 0.99 0.42 0.44 1.09 -1.26 -5.07 121.20 114.71 2wfn s ILE 124 Ca 0.11 -0.34 0.08 0.00 -1.10 0.00 0.00 60.65 59.40 2wfn s ILE 124 Cb -0.03 -1.07 -0.00 0.00 -1.06 0.00 0.00 42.46 40.30 2wfn s ILE 124 CO 0.80 0.29 0.47 1.51 -0.10 0.00 0.00 174.94 177.91 2wfn s ASP 125 N 1.71 5.31 0.28 3.58 -4.77 -1.26 -5.03 116.67 116.48 2wfn s ASP 125 Ca 0.04 -0.62 -0.04 0.00 -3.30 0.00 0.00 52.55 48.64 2wfn s ASP 125 Cb -0.13 -0.58 0.36 0.00 -1.09 0.00 0.00 42.92 41.48 2wfn s ASP 125 CO -0.08 -0.72 1.95 0.28 0.70 0.00 0.00 175.17 177.30 2wfn h SER 126 N 0.84 1.04 -0.78 2.11 0.02 -1.91 -2.60 113.55 112.27 2wfn h SER 126 Ca -0.40 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 60.54 2wfn h SER 126 Cb 1.27 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 63.51 2wfn h SER 126 CO 0.52 0.76 0.52 0.50 -1.14 0.00 0.00 176.83 177.98 2wfn h LYS 127 N 1.23 0.97 -0.76 3.45 3.64 -1.96 -2.08 116.57 121.05 2wfn h LYS 127 Ca 0.33 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.61 2wfn h LYS 127 Cb -0.13 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.44 2wfn h LYS 127 CO -0.07 0.64 0.33 0.00 -2.27 0.00 0.00 179.45 178.08 2wfn h ALA 128 N 1.53 1.15 0.08 5.00 0.00 -1.87 -1.42 119.26 123.74 2wfn h ALA 128 Ca 0.30 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 2wfn h ALA 128 Cb -0.01 -0.30 0.02 0.00 0.00 0.00 0.00 17.79 17.49 2wfn h ALA 128 CO -0.08 0.63 -0.72 0.82 0.00 0.00 0.00 179.25 179.90 2wfn h ILE 129 N 1.10 1.48 -0.40 0.00 2.04 -1.52 0.02 117.51 120.23 2wfn h ILE 129 Ca 0.26 -2.35 -0.03 0.00 1.00 0.00 0.00 64.86 63.74 2wfn h ILE 129 Cb 0.17 2.96 -0.02 0.00 -0.74 0.00 0.00 36.82 39.19 2wfn h ILE 129 CO -0.03 0.67 0.12 0.58 0.00 0.00 0.00 178.15 179.49 2wfn h VAL 130 N -0.27 1.22 0.00 1.67 2.07 -1.36 -2.68 116.25 116.90 2wfn h VAL 130 Ca -0.11 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2wfn h VAL 130 Cb 1.50 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 2wfn h VAL 130 CO 0.14 0.26 0.00 0.47 0.02 0.00 0.00 177.57 178.45 2wfn n ASP 131 N -4.59 0.00 -0.77 0.57 8.00 -0.54 -4.80 116.55 114.43 2wfn n ASP 131 Ca -0.00 0.23 -0.00 0.00 0.71 0.00 0.00 54.79 55.73 2wfn n ASP 131 Cb 0.19 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.89 2wfn n ASP 131 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wfn n GLY 132 N 0.99 0.70 3.55 0.44 0.00 -1.01 -4.99 105.19 104.87 2wfn n GLY 132 Ca 0.09 -0.58 -0.40 0.00 0.00 0.00 0.00 46.02 45.13 2wfn n GLY 132 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2wfn s ASN 133 N -3.01 6.10 0.28 1.61 2.47 -0.02 -4.89 114.94 117.48 2wfn s ASN 133 Ca 0.00 -0.71 0.00 0.00 0.42 0.00 0.00 52.86 52.57 2wfn s ASN 133 Cb -0.00 -2.56 0.53 0.00 -1.45 0.00 0.00 41.25 37.76 2wfn s ASN 133 CO 0.01 -1.86 1.83 0.25 -3.72 0.00 0.00 177.10 173.61 2wfn h LEU 134 N 13.69 0.87 -0.33 3.21 5.85 -1.91 -1.05 115.31 135.65 2wfn h LEU 134 Ca -0.09 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2wfn h LEU 134 Cb 1.05 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 2wfn h LEU 134 CO 1.32 0.46 0.17 0.50 -0.34 0.00 0.00 178.44 180.55 2wfn h LYS 135 N 0.95 0.46 0.00 1.25 3.64 -1.98 -1.74 116.57 119.15 2wfn h LYS 135 Ca 0.48 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.71 2wfn h LYS 135 Cb 0.48 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 2wfn h LYS 135 CO -0.27 0.40 -0.45 -0.07 -2.27 0.00 0.00 179.45 176.80 2wfn h LEU 136 N 0.40 0.00 -0.28 5.20 3.38 -1.82 -2.83 115.31 119.36 2wfn h LEU 136 Ca 0.11 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 2wfn h LEU 136 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2wfn h LEU 136 CO -0.02 0.45 -0.15 0.40 0.09 0.00 0.00 178.44 179.21 2wfn h ILE 137 N 0.00 1.30 -0.22 1.22 2.04 -1.04 -1.75 117.51 119.06 2wfn h ILE 137 Ca -0.00 -1.25 -0.01 0.00 1.00 0.00 0.00 64.86 64.59 2wfn h ILE 137 Cb 1.20 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 38.77 2wfn h ILE 137 CO 0.06 0.40 0.08 -0.07 0.00 0.00 0.00 178.15 178.61 2wfn h LEU 138 N 0.35 0.28 -0.75 1.44 3.38 -1.32 -1.78 115.31 116.91 2wfn h LEU 138 Ca 0.06 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 2wfn h LEU 138 Cb 0.67 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2wfn h LEU 138 CO 0.04 0.27 -0.31 1.23 0.09 0.00 0.00 178.44 179.76 2wfn h GLY 139 N 0.46 0.65 0.99 0.83 0.00 -1.30 -2.26 103.07 102.44 2wfn h GLY 139 Ca 0.08 -0.59 -0.08 0.00 0.00 0.00 0.00 47.33 46.73 2wfn h GLY 139 CO -0.01 0.54 -0.05 -2.00 0.00 0.00 0.00 176.54 175.02 2wfn h LEU 140 N 0.51 0.79 -0.36 3.11 7.12 -0.51 -2.55 115.31 123.43 2wfn h LEU 140 Ca 0.06 -0.34 -0.10 0.00 0.13 0.00 0.00 57.88 57.63 2wfn h LEU 140 Cb 0.80 -0.21 -0.01 0.00 -0.53 0.00 0.00 40.66 40.70 2wfn h LEU 140 CO 0.07 0.94 -0.17 0.40 -0.13 0.00 0.00 178.44 179.54 2wfn h ILE 141 N 0.63 1.28 -0.67 4.05 1.08 -1.35 -2.89 117.51 119.64 2wfn h ILE 141 Ca 0.11 -1.30 -0.00 0.00 -0.39 0.00 0.00 64.86 63.29 2wfn h ILE 141 Cb 0.57 1.35 -0.03 0.00 -3.07 0.00 0.00 36.82 35.64 2wfn h ILE 141 CO 0.03 0.43 0.41 -0.25 -0.69 0.00 0.00 178.15 178.08 2wfn h TRP 142 N 0.54 0.86 -0.66 1.37 2.91 -1.40 0.61 115.95 120.18 2wfn h TRP 142 Ca 0.08 0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.15 2wfn h TRP 142 Cb 0.72 -0.29 -0.05 0.00 -0.51 0.00 0.00 29.16 29.03 2wfn h TRP 142 CO 0.06 0.56 0.39 1.15 -1.03 0.00 0.00 178.44 179.57 2wfn h THR 143 N 0.91 1.04 -0.35 2.65 2.02 -1.34 0.75 112.91 118.59 2wfn h THR 143 Ca 0.24 -0.26 -0.12 0.00 0.77 0.00 0.00 66.41 67.04 2wfn h THR 143 Cb -0.06 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.56 2wfn h THR 143 CO -0.05 0.14 -0.27 -0.07 0.37 0.00 0.00 175.52 175.64 2wfn h LEU 144 N 0.75 0.74 -0.33 2.58 3.38 -1.01 -2.04 115.31 119.37 2wfn h LEU 144 Ca 0.28 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2wfn h LEU 144 Cb 0.09 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2wfn h LEU 144 CO -0.14 0.97 0.02 0.40 0.09 0.00 0.00 178.44 179.79 2wfn h ILE 145 N 0.62 1.25 -0.70 1.22 2.04 -0.48 -1.20 117.51 120.26 2wfn h ILE 145 Ca 0.08 -0.90 -0.02 0.00 1.00 0.00 0.00 64.86 65.02 2wfn h ILE 145 Cb 0.78 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 38.01 2wfn h ILE 145 CO 0.06 0.30 0.37 -0.07 0.00 0.00 0.00 178.15 178.81 2wfn h LEU 146 N 0.39 0.88 0.03 1.44 3.38 -0.80 -1.76 115.31 118.86 2wfn h LEU 146 Ca 0.10 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2wfn h LEU 146 Cb 0.41 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.94 2wfn h LEU 146 CO 0.01 0.74 -0.53 -0.74 0.09 0.00 0.00 178.44 178.01 2wfn h HIS 147 N 0.96 0.48 0.10 1.13 2.76 -1.30 -1.14 115.15 118.14 2wfn h HIS 147 Ca 0.24 -0.28 -0.37 0.00 -2.20 0.00 0.00 60.37 57.76 2wfn h HIS 147 Cb 0.06 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 28.95 2wfn h HIS 147 CO -0.00 1.13 -2.08 0.66 -1.30 0.00 0.00 177.93 176.34 2wfn n TYR 148 N -4.29 1.03 0.02 5.26 4.01 -0.46 -1.97 117.16 120.76 2wfn n TYR 148 Ca -0.11 0.22 -0.04 0.00 -0.16 0.00 0.00 57.90 57.81 2wfn n TYR 148 Cb 0.66 -1.14 -0.10 0.00 -0.31 0.00 0.00 39.34 38.45 2wfn n TYR 148 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2wfn h SER 149 N 0.06 0.00 0.00 7.72 0.02 -1.47 -3.40 113.55 116.47 2wfn h SER 149 Ca -0.45 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.36 2wfn h SER 149 Cb 2.01 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 64.53 2wfn h SER 149 CO 0.06 0.78 -1.28 -0.38 -1.14 0.00 0.00 176.83 174.87 2wfn n ILE 150 N -3.01 1.04 0.04 3.27 5.41 -1.08 -4.79 119.36 120.25 2wfn n ILE 150 Ca -0.11 -0.01 0.06 0.00 1.00 0.00 0.00 62.75 63.69 2wfn n ILE 150 Cb 0.93 -1.82 -0.07 0.00 -0.71 0.00 0.00 39.64 37.97 2wfn n ILE 150 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2wfn n SER 151 N -3.80 0.61 -0.05 4.38 3.41 -0.43 -3.70 113.62 114.03 2wfn n SER 151 Ca -0.20 0.25 -0.16 0.00 -0.26 0.00 0.00 58.87 58.51 2wfn n SER 151 Cb 0.52 0.72 -0.06 0.00 -0.26 0.00 0.00 64.21 65.13 2wfn n SER 151 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 2wfn h MET 152 N 0.00 0.71 0.00 4.33 -1.53 -1.61 -3.39 114.93 113.44 2wfn h MET 152 Ca -0.09 -0.51 0.00 0.00 -3.44 0.00 0.00 59.70 55.65 2wfn h MET 152 Cb 1.28 0.08 0.00 0.00 -0.55 0.00 0.00 31.60 32.42 2wfn h MET 152 CO 0.02 1.13 0.00 -2.30 0.14 0.00 0.00 176.91 175.90 2wfn n PRO 153 N -4.10 0.00 -5.07 0.39 -0.02 -1.26 -5.12 135.00 119.81 2wfn n PRO 153 Ca -0.06 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.10 2wfn n PRO 153 Cb 0.63 -0.43 -0.17 0.00 -0.02 0.00 0.00 33.50 33.50 2wfn n PRO 153 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2wfn s MET 154 N -0.01 2.99 0.27 -0.52 -1.94 -1.24 -5.14 119.30 113.71 2wfn s MET 154 Ca 0.00 -0.86 0.00 0.00 -1.71 0.00 0.00 55.69 53.12 2wfn s MET 154 Cb 0.00 -2.30 0.00 0.00 2.01 0.00 0.00 34.83 34.54 2wfn s MET 154 CO 0.00 0.13 0.00 0.00 -0.01 0.00 0.00 175.02 175.14 2wfn n GLN 166 N 3.66 -1.79 -1.80 2.03 10.64 -1.26 -4.46 117.38 124.40 2wfn n GLN 166 Ca -0.19 1.40 -0.37 0.00 -1.83 0.00 0.00 57.00 56.01 2wfn n GLN 166 Cb 0.53 -2.07 0.06 0.00 -0.86 0.00 0.00 30.24 27.89 2wfn n GLN 166 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 2wfn s THR 167 N -4.66 2.14 0.52 -0.39 -4.23 -1.26 -4.85 115.64 102.92 2wfn s THR 167 Ca 0.00 0.09 0.25 0.00 -1.18 0.00 0.00 61.69 60.85 2wfn s THR 167 Cb 0.00 -3.04 0.40 0.00 1.34 0.00 0.00 72.50 71.20 2wfn s THR 167 CO 0.00 -0.02 1.99 1.55 -0.54 0.00 0.00 174.62 177.60 2wfn h PRO 168 N 0.66 0.03 -0.15 3.99 0.13 -1.96 -2.60 132.00 132.10 2wfn h PRO 168 Ca -0.51 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 2wfn h PRO 168 Cb 1.33 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 2wfn h PRO 168 CO 0.54 0.02 0.04 -0.22 -0.23 0.00 0.00 178.00 178.15 2wfn h LYS 169 N 0.03 0.24 0.00 0.86 3.64 -1.97 -2.66 116.57 116.71 2wfn h LYS 169 Ca 0.26 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 2wfn h LYS 169 Cb 1.01 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 2wfn h LYS 169 CO -0.01 0.38 0.00 0.00 -2.27 0.00 0.00 179.45 177.55 2wfn n GLN 170 N -4.83 0.25 -0.06 1.90 10.64 -1.02 -2.07 117.38 122.19 2wfn n GLN 170 Ca -0.05 0.27 -0.12 0.00 -1.83 0.00 0.00 57.00 55.27 2wfn n GLN 170 Cb 0.15 -1.83 -0.06 0.00 -0.86 0.00 0.00 30.24 27.64 2wfn n GLN 170 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2wfn h ARG 171 N 0.00 0.38 -0.41 2.61 2.47 -1.32 0.01 114.38 118.12 2wfn h ARG 171 Ca 0.00 -0.17 -0.10 0.00 -1.26 0.00 0.00 59.98 58.45 2wfn h ARG 171 Cb 0.65 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.95 2wfn h ARG 171 CO 0.00 0.70 -0.14 1.25 0.56 0.00 0.00 179.97 182.34 2wfn h LEU 172 N 0.06 0.84 -0.73 3.04 5.85 -1.35 -1.12 115.31 121.90 2wfn h LEU 172 Ca 0.04 -0.38 -0.02 0.00 0.84 0.00 0.00 57.88 58.36 2wfn h LEU 172 Cb 0.59 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 2wfn h LEU 172 CO 0.03 1.03 0.40 0.25 -0.34 0.00 0.00 178.44 179.80 2wfn h LEU 173 N 0.64 0.92 -1.02 2.25 5.85 -1.47 -1.86 115.31 120.62 2wfn h LEU 173 Ca 0.10 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2wfn h LEU 173 Cb 0.68 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 2wfn h LEU 173 CO 0.05 0.75 0.22 1.23 -0.34 0.00 0.00 178.44 180.35 2wfn h GLY 174 N 1.01 0.98 0.98 3.75 0.00 -0.82 -0.67 103.07 108.29 2wfn h GLY 174 Ca 0.26 -0.53 -0.10 0.00 0.00 0.00 0.00 47.33 46.95 2wfn h GLY 174 CO -0.04 0.50 -0.19 -0.25 0.00 0.00 0.00 176.54 176.56 2wfn h TRP 175 N 0.90 0.86 -0.25 5.60 7.01 -0.89 -3.06 115.95 126.11 2wfn h TRP 175 Ca 0.21 -0.22 -0.10 0.00 2.11 0.00 0.00 58.89 60.89 2wfn h TRP 175 Cb 0.22 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 27.07 2wfn h TRP 175 CO 0.02 0.95 -0.27 0.82 -2.79 0.00 0.00 178.44 177.16 2wfn h ILE 176 N 0.52 1.27 -0.50 2.65 2.04 -1.23 -3.13 117.51 119.13 2wfn h ILE 176 Ca 0.08 -1.31 0.07 0.00 1.00 0.00 0.00 64.86 64.69 2wfn h ILE 176 Cb 0.73 1.38 -0.06 0.00 -0.74 0.00 0.00 36.82 38.13 2wfn h ILE 176 CO 0.05 0.42 0.17 -0.61 0.00 0.00 0.00 178.15 178.18 2wfn h GLN 177 N 0.43 0.33 0.00 2.37 5.75 -1.01 -0.99 115.11 122.00 2wfn h GLN 177 Ca 0.06 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 2wfn h GLN 177 Cb 0.70 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.18 2wfn h GLN 177 CO 0.05 0.22 -0.44 0.27 -2.65 0.00 0.00 178.83 176.28 2wfn n ASN 178 N -5.02 0.44 0.10 -0.69 0.23 -1.22 -2.79 115.26 106.31 2wfn n ASN 178 Ca 0.05 -0.12 -0.04 0.00 -0.53 0.00 0.00 54.58 53.94 2wfn n ASN 178 Cb 0.21 0.14 0.13 0.00 -2.08 0.00 0.00 39.78 38.17 2wfn n ASN 178 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 2wfn h LYS 179 N 0.00 0.19 -2.30 -3.83 1.79 -1.35 -3.36 116.57 107.71 2wfn h LYS 179 Ca 0.00 -0.13 -0.59 0.00 -2.18 0.00 0.00 60.65 57.75 2wfn h LYS 179 Cb 0.52 0.02 -0.41 0.00 -1.58 0.00 0.00 32.23 30.78 2wfn h LYS 179 CO 0.00 0.74 -0.74 1.28 -1.08 0.00 0.00 179.45 179.65 2wfn n LEU 180 N -3.85 2.53 0.21 2.94 4.77 -0.43 -4.87 117.00 118.29 2wfn n LEU 180 Ca -0.02 -5.16 0.08 0.00 -0.03 0.00 0.00 56.01 50.88 2wfn n LEU 180 Cb 0.62 -0.29 0.40 0.00 -2.33 0.00 0.00 43.42 41.82 2wfn n LEU 180 CO 0.44 2.00 0.75 1.55 -1.33 0.00 0.00 177.39 180.80 2wfn h PRO 181 N 4.42 0.00 0.00 3.23 0.13 -1.68 -2.95 132.00 135.14 2wfn h PRO 181 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2wfn h PRO 181 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2wfn h PRO 181 CO 0.70 0.27 0.00 0.00 -0.23 0.00 0.00 178.00 178.74 2wfn n GLN 182 N -3.42 0.02 -4.45 0.86 0.00 -1.26 -4.82 117.38 104.32 2wfn n GLN 182 Ca 0.00 0.01 -0.32 0.00 0.00 0.00 0.00 57.00 56.69 2wfn n GLN 182 Cb 0.47 -1.50 -0.10 0.00 0.00 0.00 0.00 30.24 29.10 2wfn n GLN 182 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2wfn s LEU 183 N -2.98 3.13 -1.13 2.61 1.43 -1.12 -5.07 118.68 115.56 2wfn s LEU 183 Ca 0.14 -0.18 -0.13 0.00 -1.03 0.00 0.00 54.13 52.93 2wfn s LEU 183 Cb 0.19 -1.81 0.19 0.00 0.03 0.00 0.00 46.19 44.79 2wfn s LEU 183 CO 0.52 0.27 1.29 -2.16 0.23 0.00 0.00 176.35 176.50 2wfn s PRO 184 N -1.50 4.03 -0.12 1.29 0.04 -1.26 -4.97 135.00 132.51 2wfn s PRO 184 Ca 0.17 -2.61 -0.19 0.00 0.04 0.00 0.00 61.00 58.41 2wfn s PRO 184 Cb -0.11 -4.90 -0.04 0.00 0.04 0.00 0.00 34.50 29.49 2wfn s PRO 184 CO 0.08 -1.63 0.51 0.42 0.04 0.00 0.00 177.00 176.42 2wfn s ILE 185 N 1.01 5.17 0.00 0.56 1.09 -1.26 -4.92 121.20 122.85 2wfn s ILE 185 Ca 0.37 1.01 0.00 0.00 -1.10 0.00 0.00 60.65 60.94 2wfn s ILE 185 Cb -0.05 -3.84 0.00 0.00 -1.06 0.00 0.00 42.46 37.50 2wfn s ILE 185 CO -0.03 0.31 0.00 0.41 -0.10 0.00 0.00 174.94 175.53 2wfn n THR 186 N 3.73 0.00 -4.57 2.92 -1.04 -1.26 -4.98 114.28 109.08 2wfn n THR 186 Ca -0.06 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.68 2wfn n THR 186 Cb 0.51 -0.42 -0.09 0.00 -1.82 0.00 0.00 70.33 68.52 2wfn n THR 186 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2wfn s ASN 187 N -3.14 3.15 -0.55 8.00 4.22 -1.26 -5.07 114.94 120.28 2wfn s ASN 187 Ca 0.00 -1.54 0.03 0.00 -2.14 0.00 0.00 52.86 49.21 2wfn s ASN 187 Cb 0.00 0.20 0.41 0.00 1.28 0.00 0.00 41.25 43.14 2wfn s ASN 187 CO 0.00 -0.74 1.48 0.49 -2.04 0.00 0.00 177.10 176.29 2wfn n PHE 188 N -0.94 3.16 0.00 1.54 3.72 -1.26 -4.66 117.46 119.02 2wfn n PHE 188 Ca -0.08 -2.73 0.00 0.00 -0.05 0.00 0.00 57.45 54.59 2wfn n PHE 188 Cb 0.66 -0.58 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 2wfn n PHE 188 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2wfn n SER 189 N -0.58 0.00 0.11 4.37 3.41 -1.26 -4.16 113.62 115.51 2wfn n SER 189 Ca 0.47 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 59.07 2wfn n SER 189 Cb 0.59 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.82 2wfn n SER 189 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2wfn h ARG 190 N 0.00 0.21 0.00 4.33 3.08 -1.93 -2.66 114.38 117.41 2wfn h ARG 190 Ca 0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2wfn h ARG 190 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2wfn h ARG 190 CO 0.00 0.53 0.00 -0.25 -1.07 0.00 0.00 179.97 179.18 2wfn n ASP 191 N -4.09 0.00 0.00 7.04 8.00 -1.26 -2.41 116.55 123.83 2wfn n ASP 191 Ca -0.01 0.47 0.00 0.00 0.71 0.00 0.00 54.79 55.96 2wfn n ASP 191 Cb 0.42 -0.48 0.00 0.00 -0.02 0.00 0.00 41.12 41.04 2wfn n ASP 191 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 2wfn n TRP 192 N -1.48 0.00 0.10 1.24 7.02 -1.00 -4.58 117.44 118.73 2wfn n TRP 192 Ca 0.01 -0.02 -0.02 0.00 -1.02 0.00 0.00 57.50 56.45 2wfn n TRP 192 Cb 0.06 -0.00 0.21 0.00 -2.42 0.00 0.00 31.31 29.16 2wfn n TRP 192 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 2wfn h GLN 193 N 0.00 0.23 0.00 -0.99 4.20 -1.48 -3.00 115.11 114.07 2wfn h GLN 193 Ca 0.00 -0.11 -0.11 0.00 0.06 0.00 0.00 58.65 58.49 2wfn h GLN 193 Cb 0.02 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 2wfn h GLN 193 CO 0.00 0.63 -0.52 0.66 -0.67 0.00 0.00 178.83 178.93 2wfn h SER 194 N 0.19 0.00 0.00 1.46 4.64 -1.86 -3.43 113.55 114.55 2wfn h SER 194 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2wfn h SER 194 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2wfn h SER 194 CO 0.07 0.52 0.00 0.61 -0.87 0.00 0.00 176.83 177.16 2wfn n GLY 195 N 0.22 1.28 0.22 -0.77 0.00 -1.13 -4.18 105.19 100.83 2wfn n GLY 195 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2wfn n GLY 195 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wfn h ARG 196 N 3.20 0.69 -0.08 1.61 2.47 -1.90 -2.71 114.38 117.66 2wfn h ARG 196 Ca 0.00 -0.18 -0.10 0.00 -1.26 0.00 0.00 59.98 58.45 2wfn h ARG 196 Cb 0.00 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.22 2wfn h ARG 196 CO 0.00 0.72 -0.39 0.00 0.56 0.00 0.00 179.97 180.86 2wfn h ALA 197 N 0.95 1.20 -0.22 0.04 0.00 -1.89 -0.81 119.26 118.52 2wfn h ALA 197 Ca 0.13 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2wfn h ALA 197 Cb 0.35 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2wfn h ALA 197 CO 0.01 0.55 0.05 -0.07 0.00 0.00 0.00 179.25 179.78 2wfn h LEU 198 N 0.14 0.34 -1.15 0.00 4.07 -1.87 -0.52 115.31 116.32 2wfn h LEU 198 Ca 0.01 -0.24 -0.00 0.00 0.08 0.00 0.00 57.88 57.73 2wfn h LEU 198 Cb 0.76 -0.09 -0.04 0.00 1.08 0.00 0.00 40.66 42.37 2wfn h LEU 198 CO 0.06 0.49 0.50 1.23 -1.08 0.00 0.00 178.44 179.64 2wfn h GLY 199 N 0.17 1.15 0.97 0.83 0.00 -1.18 -0.60 103.07 104.41 2wfn h GLY 199 Ca 0.07 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 2wfn h GLY 199 CO 0.00 0.45 0.09 0.00 0.00 0.00 0.00 176.54 177.07 2wfn h ALA 200 N 1.45 0.63 -0.33 3.60 0.00 -1.01 -2.17 119.26 121.43 2wfn h ALA 200 Ca 0.29 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2wfn h ALA 200 Cb -0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2wfn h ALA 200 CO -0.06 0.35 -0.03 1.25 0.00 0.00 0.00 179.25 180.76 2wfn h LEU 201 N 0.65 0.60 -0.75 0.00 6.46 -0.63 0.23 115.31 121.86 2wfn h LEU 201 Ca 0.15 -0.33 -0.05 0.00 -0.12 0.00 0.00 57.88 57.52 2wfn h LEU 201 Cb 0.37 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 40.11 2wfn h LEU 201 CO 0.01 0.79 0.26 0.58 -0.62 0.00 0.00 178.44 179.46 2wfn h VAL 202 N 0.40 1.26 0.00 1.05 2.07 -1.13 -2.01 116.25 117.89 2wfn h VAL 202 Ca 0.09 -0.86 -0.12 0.00 0.82 0.00 0.00 66.70 66.63 2wfn h VAL 202 Cb 0.50 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 2wfn h VAL 202 CO 0.02 0.34 -0.57 -0.78 0.02 0.00 0.00 177.57 176.61 2wfn h ASP 203 N 1.10 0.00 -0.60 0.57 1.82 -1.32 -2.90 116.42 115.09 2wfn h ASP 203 Ca 0.25 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.80 2wfn h ASP 203 Cb 0.27 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.25 2wfn h ASP 203 CO -0.01 0.57 0.05 -1.28 -1.61 0.00 0.00 179.24 176.95 2wfn h SER 204 N 0.00 1.02 0.38 2.28 0.87 -0.49 -1.02 113.55 116.58 2wfn h SER 204 Ca -0.01 -0.26 -0.15 0.00 -1.23 0.00 0.00 61.79 60.14 2wfn h SER 204 Cb 1.17 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.85 2wfn h SER 204 CO 0.07 1.04 -0.62 0.00 -0.53 0.00 0.00 176.83 176.79 2wfn s ALA 206 N -3.72 -0.94 -0.18 0.00 0.00 -1.10 -4.98 121.76 110.85 2wfn s ALA 206 Ca -0.04 -0.48 -0.30 0.00 0.00 0.00 0.00 51.96 51.15 2wfn s ALA 206 Cb 0.12 -2.16 -0.07 0.00 0.00 0.00 0.00 23.12 21.00 2wfn s ALA 206 CO 0.80 -2.04 2.15 -2.30 0.00 0.00 0.00 175.76 174.36 2wfn n PRO 207 N 4.58 2.04 0.00 0.00 -0.02 -0.40 -2.64 135.00 138.57 2wfn n PRO 207 Ca 0.08 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2wfn n PRO 207 Cb 0.48 -3.05 0.00 0.00 -0.02 0.00 0.00 33.50 30.91 2wfn n PRO 207 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wfn n GLY 208 N 5.53 1.19 0.17 -1.23 0.00 -1.26 -4.83 105.19 104.75 2wfn n GLY 208 Ca 0.29 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.15 2wfn n GLY 208 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wfn h LEU 209 N 0.00 0.60 -5.98 0.99 3.38 -1.74 -2.77 115.31 109.78 2wfn h LEU 209 Ca 0.00 -0.62 -0.56 0.00 0.09 0.00 0.00 57.88 56.80 2wfn h LEU 209 Cb 0.00 -0.17 -0.40 0.00 0.09 0.00 0.00 40.66 40.17 2wfn h LEU 209 CO 0.00 1.11 -0.97 0.00 0.09 0.00 0.00 178.44 178.67 2wfn h PRO 211 N 3.74 0.05 -0.85 0.00 0.13 -1.82 -3.08 132.00 130.16 2wfn h PRO 211 Ca 0.11 -0.02 -0.47 0.00 -0.87 0.00 0.00 66.00 64.75 2wfn h PRO 211 Cb 0.82 -0.00 -0.27 0.00 0.13 0.00 0.00 31.00 31.68 2wfn h PRO 211 CO 0.58 0.41 0.49 -0.40 -0.23 0.00 0.00 178.00 178.85 2wfn n ASP 212 N -4.10 4.05 0.14 1.44 5.75 -1.26 -4.61 116.55 117.97 2wfn n ASP 212 Ca -0.02 -3.68 0.06 0.00 -0.01 0.00 0.00 54.79 51.14 2wfn n ASP 212 Cb 0.41 -0.80 0.52 0.00 -1.03 0.00 0.00 41.12 40.22 2wfn n ASP 212 CO 0.00 0.00 0.00 4.11 -0.11 0.00 0.00 177.20 181.20 2wfn h TRP 213 N 1.17 0.22 -0.68 2.11 5.08 -1.87 -2.92 115.95 119.06 2wfn h TRP 213 Ca 0.54 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.49 2wfn h TRP 213 Cb 2.29 -0.07 -0.03 0.00 -3.00 0.00 0.00 29.16 28.35 2wfn h TRP 213 CO 1.44 0.18 0.36 0.22 -1.28 0.00 0.00 178.44 179.35 2wfn h ASP 214 N 0.24 0.86 -0.90 0.11 1.82 -1.88 -2.84 116.42 113.84 2wfn h ASP 214 Ca 0.06 -0.11 -0.49 0.00 -0.39 0.00 0.00 57.03 56.11 2wfn h ASP 214 Cb 0.04 -0.22 -0.28 0.00 0.68 0.00 0.00 39.33 39.55 2wfn h ASP 214 CO -0.01 0.73 0.62 -1.54 -1.61 0.00 0.00 179.24 177.43 2wfn n SER 215 N -4.49 4.19 -4.81 2.28 3.41 -1.10 -4.95 113.62 108.15 2wfn n SER 215 Ca 0.05 -3.47 -0.35 0.00 -0.26 0.00 0.00 58.87 54.84 2wfn n SER 215 Cb 0.10 -0.83 -0.07 0.00 -0.26 0.00 0.00 64.21 63.16 2wfn n SER 215 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 2wfn s TRP 216 N -3.03 3.51 -0.41 7.33 0.51 -1.07 -5.01 118.94 120.77 2wfn s TRP 216 Ca 0.52 1.57 -0.29 0.00 -2.12 0.00 0.00 56.10 55.79 2wfn s TRP 216 Cb 0.43 -2.79 0.01 0.00 -0.81 0.00 0.00 33.47 30.31 2wfn s TRP 216 CO 0.08 0.11 1.48 0.34 -0.51 0.00 0.00 176.95 178.45 2wfn s ASP 217 N -1.91 6.23 0.39 2.95 3.68 -1.26 -4.88 116.67 121.87 2wfn s ASP 217 Ca 0.54 0.86 0.28 0.00 2.13 0.00 0.00 52.55 56.35 2wfn s ASP 217 Cb -0.14 -2.54 1.34 0.00 -1.45 0.00 0.00 42.92 40.14 2wfn s ASP 217 CO 0.19 -1.51 1.84 0.00 0.13 0.00 0.00 175.17 175.82 2wfn h ALA 218 N 11.14 1.00 -0.21 3.66 0.00 -1.95 -1.50 119.26 131.40 2wfn h ALA 218 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2wfn h ALA 218 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2wfn h ALA 218 CO 1.09 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 179.21 2wfn n SER 219 N -2.51 1.65 -3.48 0.00 3.41 -1.26 -4.27 113.62 107.15 2wfn n SER 219 Ca -0.00 -1.79 -0.27 0.00 -0.26 0.00 0.00 58.87 56.55 2wfn n SER 219 Cb 0.15 -0.14 -0.09 0.00 -0.26 0.00 0.00 64.21 63.87 2wfn n SER 219 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2wfn n LYS 220 N 0.33 2.30 -0.07 4.33 5.02 -0.57 -4.98 118.16 124.53 2wfn n LYS 220 Ca 0.15 -4.55 -0.12 0.00 -2.02 0.00 0.00 58.31 51.77 2wfn n LYS 220 Cb 0.31 -2.20 -0.05 0.00 -0.02 0.00 0.00 35.03 33.07 2wfn n LYS 220 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2wfn h PRO 221 N 4.37 0.40 -0.43 1.97 0.13 -1.74 -2.61 132.00 134.08 2wfn h PRO 221 Ca 0.19 -0.15 -0.10 0.00 -0.87 0.00 0.00 66.00 65.06 2wfn h PRO 221 Cb 0.69 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.78 2wfn h PRO 221 CO 0.79 0.64 -0.15 0.28 -0.23 0.00 0.00 178.00 179.33 2wfn h VAL 222 N 0.12 1.26 -0.39 1.56 2.07 -1.86 -1.19 116.25 117.83 2wfn h VAL 222 Ca 0.05 -1.24 -0.03 0.00 0.82 0.00 0.00 66.70 66.30 2wfn h VAL 222 Cb 0.49 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 2wfn h VAL 222 CO 0.02 0.42 0.11 0.74 0.02 0.00 0.00 177.57 178.88 2wfn h THR 223 N 0.71 1.22 -0.23 2.57 2.02 -1.94 -0.96 112.91 116.30 2wfn h THR 223 Ca 0.11 -0.74 -0.03 0.00 0.77 0.00 0.00 66.41 66.52 2wfn h THR 223 Cb 0.65 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 2wfn h THR 223 CO 0.05 0.26 0.04 0.78 0.37 0.00 0.00 175.52 177.01 2wfn h ASN 224 N 0.48 0.36 -0.53 4.18 2.35 -1.32 -2.53 115.58 118.57 2wfn h ASN 224 Ca 0.12 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.60 2wfn h ASN 224 Cb 0.29 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 2wfn h ASN 224 CO -0.00 0.53 0.26 0.00 -1.65 0.00 0.00 177.43 176.56 2wfn h ALA 225 N 0.85 0.69 -0.81 -0.83 0.00 -1.18 -2.15 119.26 115.82 2wfn h ALA 225 Ca 0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2wfn h ALA 225 Cb 0.32 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2wfn h ALA 225 CO 0.00 0.25 0.36 -0.09 0.00 0.00 0.00 179.25 179.77 2wfn h ARG 226 N 0.71 1.18 -0.16 0.00 2.43 -1.17 -1.18 114.38 116.19 2wfn h ARG 226 Ca 0.18 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2wfn h ARG 226 Cb 0.12 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2wfn h ARG 226 CO -0.02 0.93 0.00 1.49 -1.51 0.00 0.00 179.97 180.86 2wfn h GLU 227 N 1.16 0.28 -0.34 0.20 4.57 -1.26 -0.87 114.58 118.33 2wfn h GLU 227 Ca 0.28 -0.09 -0.02 0.00 -1.18 0.00 0.00 59.36 58.35 2wfn h GLU 227 Cb 0.16 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 2wfn h GLU 227 CO -0.03 0.50 0.13 0.00 -1.18 0.00 0.00 179.01 178.43 2wfn h ALA 228 N 0.77 0.44 0.00 2.92 0.00 -1.29 -2.55 119.26 119.55 2wfn h ALA 228 Ca 0.05 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 2wfn h ALA 228 Cb 0.37 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2wfn h ALA 228 CO 0.01 0.04 -0.23 0.52 0.00 0.00 0.00 179.25 179.59 2wfn h MET 229 N 0.39 0.00 -0.05 0.00 2.86 -1.24 -2.02 114.93 114.88 2wfn h MET 229 Ca 0.11 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 2wfn h MET 229 Cb 0.19 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 2wfn h MET 229 CO -0.01 0.23 -0.02 0.37 1.06 0.00 0.00 176.91 178.54 2wfn h GLN 230 N 0.00 0.09 -0.49 1.72 5.75 -1.01 -1.95 115.11 119.22 2wfn h GLN 230 Ca -0.00 -0.04 -0.07 0.00 -0.15 0.00 0.00 58.65 58.38 2wfn h GLN 230 Cb 0.85 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.38 2wfn h GLN 230 CO 0.03 0.47 0.01 1.96 -2.65 0.00 0.00 178.83 178.64 2wfn h GLN 231 N -0.29 0.82 -0.25 1.69 1.08 -1.38 -0.97 115.11 115.81 2wfn h GLN 231 Ca 0.01 -0.22 -0.09 0.00 -1.45 0.00 0.00 58.65 56.90 2wfn h GLN 231 Cb 0.44 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.76 2wfn h GLN 231 CO 0.01 0.82 -0.21 0.00 -0.95 0.00 0.00 178.83 178.49 2wfn h ALA 232 N 1.24 1.17 0.06 3.87 0.00 -1.38 -1.29 119.26 122.92 2wfn h ALA 232 Ca 0.15 -0.32 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 2wfn h ALA 232 Cb 0.46 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.14 2wfn h ALA 232 CO 0.02 0.53 -0.73 0.22 0.00 0.00 0.00 179.25 179.29 2wfn h ASP 233 N 0.41 0.55 -0.18 0.00 3.58 -1.05 -0.41 116.42 119.31 2wfn h ASP 233 Ca 0.07 -0.83 -0.22 0.00 0.42 0.00 0.00 57.03 56.47 2wfn h ASP 233 Cb 0.60 -0.17 0.01 0.00 1.72 0.00 0.00 39.33 41.49 2wfn h ASP 233 CO 0.04 1.31 -0.73 0.44 -2.88 0.00 0.00 179.24 177.42 2wfn h ASP 234 N -0.15 0.96 0.00 2.28 3.32 -1.16 -3.14 116.42 118.53 2wfn h ASP 234 Ca -0.11 -0.61 0.00 0.00 0.02 0.00 0.00 57.03 56.33 2wfn h ASP 234 Cb 1.47 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2wfn h ASP 234 CO 0.14 1.41 0.00 0.79 -1.72 0.00 0.00 179.24 179.86 2wfn n TRP 235 N -3.95 0.00 0.00 4.55 7.02 -0.49 -4.62 117.44 119.94 2wfn n TRP 235 Ca -0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.41 2wfn n TRP 235 Cb 0.72 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.61 2wfn n TRP 235 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2wfn n LEU 236 N -0.23 0.00 -1.21 -0.99 4.77 -1.01 -0.75 117.00 117.58 2wfn n LEU 236 Ca 0.00 -0.35 -0.09 0.00 -0.03 0.00 0.00 56.01 55.54 2wfn n LEU 236 Cb 0.01 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.11 2wfn n LEU 236 CO 0.00 0.00 -0.06 0.61 -1.33 0.00 0.00 177.39 176.61 2wfn n GLY 237 N 1.02 0.09 3.37 -0.72 0.00 -0.57 -3.32 105.19 105.06 2wfn n GLY 237 Ca 0.00 -0.46 -0.44 0.00 0.00 0.00 0.00 46.02 45.12 2wfn n GLY 237 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wfn s ILE 238 N -2.62 5.10 0.47 -0.61 1.01 -0.27 -4.96 121.20 119.31 2wfn s ILE 238 Ca 0.07 -1.13 -0.22 0.00 0.00 0.00 0.00 60.65 59.37 2wfn s ILE 238 Cb -0.03 -4.06 -0.08 0.00 0.01 0.00 0.00 42.46 38.30 2wfn s ILE 238 CO 0.08 -0.58 1.09 -2.16 0.00 0.00 0.00 174.94 173.37 2wfn s PRO 239 N 1.61 3.77 -1.31 2.79 0.04 -1.26 -3.35 135.00 137.28 2wfn s PRO 239 Ca 0.04 1.56 -0.18 0.00 0.04 0.00 0.00 61.00 62.46 2wfn s PRO 239 Cb -0.24 -2.26 0.06 0.00 0.04 0.00 0.00 34.50 32.10 2wfn s PRO 239 CO 0.06 -0.49 1.79 1.04 0.04 0.00 0.00 177.00 179.44 2wfn n GLN 240 N -0.71 3.14 0.27 4.56 6.02 -1.26 -4.68 117.38 124.72 2wfn n GLN 240 Ca 0.08 -3.20 0.16 0.00 -0.01 0.00 0.00 57.00 54.03 2wfn n GLN 240 Cb 0.50 -3.48 0.70 0.00 1.02 0.00 0.00 30.24 28.99 2wfn n GLN 240 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 177.06 175.66 2wfn h VAL 241 N 5.42 0.21 -4.49 5.09 -1.51 -1.91 -3.40 116.25 115.66 2wfn h VAL 241 Ca 0.46 -0.59 -0.65 0.00 -1.23 0.00 0.00 66.70 64.68 2wfn h VAL 241 Cb 0.85 1.48 -0.29 0.00 -2.13 0.00 0.00 31.29 31.20 2wfn h VAL 241 CO 1.50 0.07 -0.87 -0.51 -1.23 0.00 0.00 177.57 176.53 2wfn s ILE 242 N -3.80 1.87 0.28 7.19 2.07 -1.26 -4.10 121.20 123.44 2wfn s ILE 242 Ca -0.00 -1.05 -0.06 0.00 -1.41 0.00 0.00 60.65 58.13 2wfn s ILE 242 Cb 0.10 -1.56 -0.06 0.00 0.13 0.00 0.00 42.46 41.08 2wfn s ILE 242 CO 0.56 0.49 0.56 0.42 -1.91 0.00 0.00 174.94 175.05 2wfn s THR 243 N -0.59 5.00 0.29 4.00 -4.23 -1.26 -4.93 115.64 113.92 2wfn s THR 243 Ca 0.09 0.16 0.03 0.00 -1.18 0.00 0.00 61.69 60.79 2wfn s THR 243 Cb -0.09 -3.71 0.30 0.00 1.34 0.00 0.00 72.50 70.35 2wfn s THR 243 CO -0.00 -0.27 1.66 -0.65 -0.54 0.00 0.00 174.62 174.81 2wfn h PRO 244 N 1.86 0.25 0.00 3.99 0.11 -1.93 0.79 132.00 137.09 2wfn h PRO 244 Ca -0.47 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 2wfn h PRO 244 Cb 1.18 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2wfn h PRO 244 CO 0.67 0.17 -0.37 0.93 -0.21 0.00 0.00 178.00 179.19 2wfn h GLU 245 N 0.26 0.00 0.23 1.05 3.07 -1.94 -3.13 114.58 114.12 2wfn h GLU 245 Ca 0.56 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 59.11 2wfn h GLU 245 Cb 1.13 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 29.08 2wfn h GLU 245 CO -0.62 0.37 -1.37 0.93 -1.40 0.00 0.00 179.01 176.92 2wfn h GLU 246 N 0.00 0.52 -0.00 2.33 5.08 -1.25 -3.09 114.58 118.17 2wfn h GLU 246 Ca -0.00 -0.87 -0.10 0.00 -1.00 0.00 0.00 59.36 57.38 2wfn h GLU 246 Cb 0.67 0.32 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 2wfn h GLU 246 CO 0.05 1.41 -0.48 0.97 -1.00 0.00 0.00 179.01 179.96 2wfn h ILE 247 N 0.09 1.35 0.00 3.13 2.10 -1.38 -2.94 117.51 119.86 2wfn h ILE 247 Ca -0.24 -1.66 0.00 0.00 1.08 0.00 0.00 64.86 64.05 2wfn h ILE 247 Cb 2.08 1.89 0.00 0.00 -1.09 0.00 0.00 36.82 39.70 2wfn h ILE 247 CO 0.26 0.47 -0.70 1.33 -1.08 0.00 0.00 178.15 178.43 2wfn n VAL 248 N -3.97 0.33 -1.63 2.19 0.24 -1.19 -4.56 118.33 109.75 2wfn n VAL 248 Ca -0.02 -0.28 -0.48 0.00 -2.04 0.00 0.00 64.34 61.53 2wfn n VAL 248 Cb 0.50 -0.08 -0.04 0.00 -1.47 0.00 0.00 33.84 32.75 2wfn n VAL 248 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2wfn n ASP 249 N -2.10 2.32 0.19 -1.34 2.03 -1.11 -4.84 116.55 111.70 2wfn n ASP 249 Ca 0.03 1.11 0.12 0.00 0.52 0.00 0.00 54.79 56.57 2wfn n ASP 249 Cb 0.44 -1.32 0.62 0.00 -0.72 0.00 0.00 41.12 40.14 2wfn n ASP 249 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2wfn h PRO 250 N 4.80 0.00 -0.13 -0.67 0.11 -1.92 -2.66 132.00 131.54 2wfn h PRO 250 Ca -0.46 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 2wfn h PRO 250 Cb 1.30 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.37 2wfn h PRO 250 CO 0.80 0.00 -0.30 0.09 -0.21 0.00 0.00 178.00 178.38 2wfn n ASN 251 N -2.33 2.08 -4.74 -2.05 3.02 -1.26 -5.05 115.26 104.94 2wfn n ASN 251 Ca -0.02 -3.78 -0.41 0.00 -0.03 0.00 0.00 54.58 50.35 2wfn n ASN 251 Cb 0.11 -0.56 -0.04 0.00 -0.61 0.00 0.00 39.78 38.68 2wfn n ASN 251 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2wfn s VAL 252 N -3.20 3.65 0.40 2.41 0.11 -1.00 -4.87 120.40 117.90 2wfn s VAL 252 Ca 0.40 1.42 -0.19 0.00 -2.93 0.00 0.00 61.98 60.68 2wfn s VAL 252 Cb 0.38 -3.90 -0.10 0.00 -1.53 0.00 0.00 36.38 31.22 2wfn s VAL 252 CO -0.03 0.24 0.89 1.51 -3.33 0.00 0.00 175.10 174.37 2wfn s ASP 253 N -0.01 6.86 0.45 3.54 -4.77 -1.26 -4.91 116.67 116.57 2wfn s ASP 253 Ca 0.51 1.55 0.13 0.00 -3.30 0.00 0.00 52.55 51.44 2wfn s ASP 253 Cb -0.32 -2.48 1.02 0.00 -1.09 0.00 0.00 42.92 40.05 2wfn s ASP 253 CO 0.37 -0.33 2.02 -0.33 0.70 0.00 0.00 175.17 177.60 2wfn h GLU 254 N 1.92 0.08 -0.48 2.11 5.08 -1.97 -3.04 114.58 118.27 2wfn h GLU 254 Ca -0.48 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 57.76 2wfn h GLU 254 Cb 1.18 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 2wfn h GLU 254 CO 0.62 0.18 -0.11 0.45 -1.00 0.00 0.00 179.01 179.15 2wfn h HIS 255 N 0.08 0.99 -0.31 4.33 3.86 -1.94 -0.95 115.15 121.21 2wfn h HIS 255 Ca 0.02 -0.19 -0.05 0.00 -1.16 0.00 0.00 60.37 58.99 2wfn h HIS 255 Cb 0.22 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 2wfn h HIS 255 CO 0.00 0.95 0.01 0.77 0.86 0.00 0.00 177.93 180.52 2wfn h SER 256 N 0.80 0.53 -0.56 2.45 0.02 -1.91 -2.21 113.55 112.67 2wfn h SER 256 Ca 0.13 -0.30 -0.07 0.00 -0.84 0.00 0.00 61.79 60.71 2wfn h SER 256 Cb 0.63 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 2wfn h SER 256 CO 0.04 0.70 0.07 0.58 -1.14 0.00 0.00 176.83 177.08 2wfn h VAL 257 N 0.34 1.26 -0.93 2.27 2.07 -1.54 -2.78 116.25 116.93 2wfn h VAL 257 Ca 0.09 -1.02 0.04 0.00 0.82 0.00 0.00 66.70 66.63 2wfn h VAL 257 Cb 0.42 0.82 -0.06 0.00 -1.52 0.00 0.00 31.29 30.95 2wfn h VAL 257 CO 0.01 0.37 0.61 0.24 0.02 0.00 0.00 177.57 178.82 2wfn h MET 258 N 0.84 1.14 -0.49 1.57 2.86 -1.13 -1.12 114.93 118.59 2wfn h MET 258 Ca 0.17 -0.07 0.03 0.00 -2.06 0.00 0.00 59.70 57.77 2wfn h MET 258 Cb 0.45 -0.26 -0.04 0.00 0.06 0.00 0.00 31.60 31.82 2wfn h MET 258 CO 0.02 0.75 0.27 1.15 1.06 0.00 0.00 176.91 180.16 2wfn h THR 259 N 1.17 1.00 -0.10 2.22 2.02 -1.14 -1.82 112.91 116.27 2wfn h THR 259 Ca 0.37 -0.18 -0.03 0.00 0.77 0.00 0.00 66.41 67.35 2wfn h THR 259 Cb 0.01 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 66.84 2wfn h THR 259 CO -0.12 0.10 -0.04 0.22 0.37 0.00 0.00 175.52 176.05 2wfn h TYR 260 N 0.53 0.24 0.00 3.16 3.20 -1.21 -3.27 116.97 119.62 2wfn h TYR 260 Ca 0.21 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 2wfn h TYR 260 Cb 0.08 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 2wfn h TYR 260 CO -0.08 0.54 -0.11 -0.07 -1.64 0.00 0.00 178.16 176.79 2wfn h LEU 261 N -0.13 0.00 0.00 2.82 3.38 -1.13 -2.85 115.31 117.40 2wfn h LEU 261 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2wfn h LEU 261 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2wfn h LEU 261 CO 0.01 0.11 0.00 -1.54 0.09 0.00 0.00 178.44 177.11 2wfn n SER 262 N -3.27 0.00 0.03 -0.43 3.41 -0.69 -1.92 113.62 110.75 2wfn n SER 262 Ca 0.00 0.49 0.12 0.00 -0.26 0.00 0.00 58.87 59.23 2wfn n SER 262 Cb 0.35 -0.50 0.31 0.00 -0.26 0.00 0.00 64.21 64.11 2wfn n SER 262 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wfn n GLN 263 N -1.50 0.12 0.05 4.33 6.02 -1.08 -4.31 117.38 121.02 2wfn n GLN 263 Ca 0.02 0.05 -0.17 0.00 -0.01 0.00 0.00 57.00 56.88 2wfn n GLN 263 Cb 0.09 -1.59 -0.08 0.00 1.02 0.00 0.00 30.24 29.69 2wfn n GLN 263 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 2wfn h PHE 264 N 0.00 0.84 0.00 1.08 -1.00 -1.60 -3.25 116.94 113.01 2wfn h PHE 264 Ca 0.00 -0.46 -0.00 0.00 2.81 0.00 0.00 57.97 60.32 2wfn h PHE 264 Cb 0.60 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 40.06 2wfn h PHE 264 CO 0.00 1.29 -0.01 -1.35 -1.61 0.00 0.00 178.31 176.63 2wfn h PRO 265 N 0.32 0.00 -0.24 1.51 0.11 -1.77 -2.85 132.00 129.07 2wfn h PRO 265 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2wfn h PRO 265 Cb 1.65 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.76 2wfn h PRO 265 CO 0.19 0.01 0.00 0.36 -0.21 0.00 0.00 178.00 178.34 2wfn n LYS 266 N -3.77 2.79 -2.32 1.05 0.00 -1.25 -5.04 118.16 109.62 2wfn n LYS 266 Ca -0.03 -2.24 -0.36 0.00 -0.00 0.00 0.00 58.31 55.68 2wfn n LYS 266 Cb 0.09 -1.42 -0.01 0.00 -0.00 0.00 0.00 35.03 33.69 2wfn n LYS 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wfn s ALA 267 N -1.68 2.83 -0.07 0.58 0.00 -1.08 -5.06 121.76 117.28 2wfn s ALA 267 Ca 0.26 0.82 0.04 0.00 0.00 0.00 0.00 51.96 53.08 2wfn s ALA 267 Cb 0.18 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.96 2wfn s ALA 267 CO 0.10 -0.63 -0.19 0.15 0.00 0.00 0.00 175.76 175.19 2wfn s LYS 268 N -3.04 2.33 0.05 0.00 -0.14 -1.21 -5.10 119.74 112.63 2wfn s LYS 268 Ca 0.68 -0.68 -0.31 0.00 -1.36 0.00 0.00 55.97 54.31 2wfn s LYS 268 Cb -0.24 -1.85 -0.07 0.00 -1.68 0.00 0.00 37.83 33.99 2wfn s LYS 268 CO 0.28 0.15 1.38 -1.17 -0.76 0.00 0.00 175.35 175.24 2wfn s LEU 269 N 0.36 4.34 0.38 3.17 0.20 -1.26 -4.23 118.68 121.64 2wfn s LEU 269 Ca -0.14 2.20 -0.22 0.00 0.69 0.00 0.00 54.13 56.66 2wfn s LEU 269 Cb -0.16 -3.57 -0.10 0.00 -0.43 0.00 0.00 46.19 41.93 2wfn s LEU 269 CO 0.06 -0.67 0.92 -0.54 -0.29 0.00 0.00 176.35 175.82 2wfn s LYS 270 N 1.77 4.33 0.25 1.98 1.02 0.07 -5.00 119.74 124.15 2wfn s LYS 270 Ca 0.64 1.14 -0.04 0.00 0.02 0.00 0.00 55.97 57.73 2wfn s LYS 270 Cb -0.34 -2.43 0.41 0.00 -0.52 0.00 0.00 37.83 34.96 2wfn s LYS 270 CO 0.28 0.10 1.80 -1.35 -0.92 0.00 0.00 175.35 175.26 2wfn h PRO 271 N 2.40 0.71 -0.63 -1.68 0.11 -1.95 -3.16 132.00 127.80 2wfn h PRO 271 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2wfn h PRO 271 Cb 1.18 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2wfn h PRO 271 CO 0.63 0.47 0.00 0.41 -0.21 0.00 0.00 178.00 179.29 2wfn n GLY 272 N -1.32 1.66 3.75 -0.55 0.00 -1.26 -4.98 105.19 102.50 2wfn n GLY 272 Ca 0.14 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 2wfn n GLY 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wfn s ALA 273 N -1.74 3.65 -0.88 4.61 0.00 -1.20 -4.95 121.76 121.26 2wfn s ALA 273 Ca 0.26 1.39 -0.22 0.00 0.00 0.00 0.00 51.96 53.39 2wfn s ALA 273 Cb 0.18 -3.58 0.08 0.00 0.00 0.00 0.00 23.12 19.80 2wfn s ALA 273 CO 0.11 -0.81 1.22 -1.25 0.00 0.00 0.00 175.76 175.04 2wfn s PRO 274 N -0.54 3.44 -0.36 0.00 0.04 -1.26 -4.99 135.00 131.32 2wfn s PRO 274 Ca 0.59 -1.15 -0.17 0.00 0.04 0.00 0.00 61.00 60.31 2wfn s PRO 274 Cb -0.43 -4.82 -0.00 0.00 0.04 0.00 0.00 34.50 29.29 2wfn s PRO 274 CO 0.46 -1.98 0.44 -0.51 0.04 0.00 0.00 177.00 175.46 2wfn s LEU 275 N 4.13 4.49 0.17 -3.56 2.01 -1.26 -4.56 118.68 120.11 2wfn s LEU 275 Ca 0.35 -0.25 0.10 0.00 0.01 0.00 0.00 54.13 54.35 2wfn s LEU 275 Cb -0.06 -2.46 -0.04 0.00 0.01 0.00 0.00 46.19 43.64 2wfn s LEU 275 CO -0.02 -0.46 -0.18 0.00 1.01 0.00 0.00 176.35 176.70 2wfn s ARG 276 N 2.22 1.73 0.00 1.70 1.70 -1.04 -4.97 118.95 120.28 2wfn s ARG 276 Ca 0.15 -1.38 0.18 0.00 -0.47 0.00 0.00 55.73 54.21 2wfn s ARG 276 Cb -0.16 -1.99 -0.18 0.00 -0.57 0.00 0.00 34.95 32.04 2wfn s ARG 276 CO 0.13 0.43 0.64 -0.35 -1.08 0.00 0.00 175.30 175.07 2wfn n PRO 277 N 0.30 0.64 -0.28 3.89 -0.04 -1.26 -4.36 135.00 133.89 2wfn n PRO 277 Ca -0.13 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2wfn n PRO 277 Cb 0.55 -1.72 0.00 0.00 -0.04 0.00 0.00 33.50 32.29 2wfn n PRO 277 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09