#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 0.18 -0.08 -2.67 3.00 -1.26 -2.67 118.16 114.66 2wfn n LYS 42 Ca 0.00 0.31 0.00 0.00 -0.00 0.00 0.00 58.31 58.63 2wfn n LYS 42 Cb 0.00 -1.79 0.29 0.00 0.00 0.00 0.00 35.03 33.53 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 0.72 -0.55 1.64 1.79 -2.00 -3.26 116.57 114.90 2wfn h LYS 43 Ca 0.00 -0.09 0.10 0.00 -2.18 0.00 0.00 60.65 58.48 2wfn h LYS 43 Cb 0.48 -0.14 -0.08 0.00 -1.58 0.00 0.00 32.23 30.91 2wfn h LYS 43 CO 0.00 0.57 0.12 0.82 -1.08 0.00 0.00 179.45 179.88 2wfn h ILE 44 N 0.72 0.69 -0.68 1.86 2.04 -1.93 0.10 117.51 120.30 2wfn h ILE 44 Ca 0.18 -0.09 -0.08 0.00 1.00 0.00 0.00 64.86 65.87 2wfn h ILE 44 Cb 0.11 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 2wfn h ILE 44 CO -0.02 0.05 0.13 -0.61 0.00 0.00 0.00 178.15 177.69 2wfn h GLN 45 N 0.26 1.12 -0.45 2.37 4.15 -1.78 -0.31 115.11 120.47 2wfn h GLN 45 Ca 0.28 -0.29 -0.05 0.00 0.77 0.00 0.00 58.65 59.36 2wfn h GLN 45 Cb 0.40 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.93 2wfn h GLN 45 CO -0.36 1.01 0.09 0.37 -1.93 0.00 0.00 178.83 178.01 2wfn h GLN 46 N 1.05 0.74 -0.59 1.69 4.15 -1.47 -1.55 115.11 119.13 2wfn h GLN 46 Ca 0.21 -0.19 -0.05 0.00 0.77 0.00 0.00 58.65 59.39 2wfn h GLN 46 Cb 0.42 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.00 2wfn h GLN 46 CO 0.01 0.75 0.17 -0.91 -1.93 0.00 0.00 178.83 176.92 2wfn h ASN 47 N 0.60 0.88 -0.43 -0.69 2.35 -0.57 -0.96 115.58 116.76 2wfn h ASN 47 Ca 0.14 -0.22 -0.13 0.00 -0.55 0.00 0.00 56.30 55.54 2wfn h ASN 47 Cb 0.36 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 2wfn h ASN 47 CO 0.01 0.86 -0.25 0.74 -1.65 0.00 0.00 177.43 177.14 2wfn h THR 48 N 0.85 1.27 -0.25 2.81 2.02 -1.03 -1.68 112.91 116.90 2wfn h THR 48 Ca 0.19 -1.41 -0.11 0.00 0.77 0.00 0.00 66.41 65.85 2wfn h THR 48 Cb 0.31 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2wfn h THR 48 CO -0.00 0.48 -0.30 -0.26 0.37 0.00 0.00 175.52 175.81 2wfn h PHE 49 N 0.75 0.57 -0.16 3.16 -1.00 -1.18 -1.44 116.94 117.64 2wfn h PHE 49 Ca 0.09 -0.14 -0.06 0.00 2.81 0.00 0.00 57.97 60.67 2wfn h PHE 49 Cb 0.83 -0.13 -0.00 0.00 3.61 0.00 0.00 35.95 40.25 2wfn h PHE 49 CO 0.06 0.75 -0.15 1.15 -1.61 0.00 0.00 178.31 178.51 2wfn h THR 50 N 0.43 1.34 -0.56 -1.55 2.02 -1.12 -2.52 112.91 110.95 2wfn h THR 50 Ca 0.06 -1.30 -0.03 0.00 0.77 0.00 0.00 66.41 65.91 2wfn h THR 50 Cb 0.74 1.83 -0.03 0.00 -1.74 0.00 0.00 68.15 68.96 2wfn h THR 50 CO 0.06 0.39 0.23 0.03 0.37 0.00 0.00 175.52 176.60 2wfn h ARG 51 N 0.03 0.81 -0.61 6.66 3.08 -1.21 -0.72 114.38 122.41 2wfn h ARG 51 Ca 0.03 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 2wfn h ARG 51 Cb 0.68 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.56 2wfn h ARG 51 CO 0.04 0.66 0.22 2.35 -1.07 0.00 0.00 179.97 182.17 2wfn h TRP 52 N 0.80 0.96 -0.39 3.04 7.01 -1.28 -1.71 115.95 124.38 2wfn h TRP 52 Ca 0.19 -0.08 -0.02 0.00 2.11 0.00 0.00 58.89 61.09 2wfn h TRP 52 Cb 0.14 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 26.90 2wfn h TRP 52 CO 0.01 0.77 0.17 0.00 -2.79 0.00 0.00 178.44 176.60 2wfn h ASN 54 N 0.48 0.00 1.01 0.00 2.35 -1.05 -1.17 115.58 117.21 2wfn h ASN 54 Ca 0.13 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.81 2wfn h ASN 54 Cb 0.15 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 2wfn h ASN 54 CO -0.01 0.18 -0.33 -0.08 -1.65 0.00 0.00 177.43 175.53 2wfn h GLU 55 N 0.00 0.00 0.09 0.81 4.57 -1.15 -2.11 114.58 116.80 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 0.63 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.19 2wfn h GLU 55 CO 0.02 0.33 -2.07 0.72 -1.18 0.00 0.00 179.01 176.84 2wfn n HIS 56 N -3.41 1.01 0.24 0.92 8.25 -1.05 -4.33 115.22 116.84 2wfn n HIS 56 Ca 0.00 0.22 0.09 0.00 -0.26 0.00 0.00 57.72 57.78 2wfn n HIS 56 Cb 0.52 -1.14 0.59 0.00 1.12 0.00 0.00 29.99 31.09 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 -2.95 115.31 114.95 2wfn h LEU 57 Ca -0.44 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 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 0.06 0.19 -0.04 0.07 0.09 0.00 0.00 178.44 178.81 2wfn h LYS 58 N 0.00 0.00 0.00 1.13 5.09 -1.31 -1.59 116.57 119.90 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 0.04 0.00 0.00 -2.09 0.00 0.00 179.45 177.42 2wfn n VAL 60 N -2.76 2.28 -3.29 0.00 0.31 -0.71 -4.97 118.33 109.18 2wfn n VAL 60 Ca 0.02 -2.64 -0.23 0.00 -0.01 0.00 0.00 64.34 61.47 2wfn n VAL 60 Cb 0.32 -0.27 0.01 0.00 -0.91 0.00 0.00 33.84 32.98 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 -1.09 -4.36 -4.42 4.52 7.64 -1.09 -4.98 113.62 109.84 2wfn n SER 61 Ca 0.24 -0.37 -0.21 0.00 1.01 0.00 0.00 58.87 59.54 2wfn n SER 61 Cb 0.84 -3.58 -0.10 0.00 -1.01 0.00 0.00 64.21 60.36 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 -5.95 1.53 -0.27 1.43 1.02 -0.68 -5.01 119.74 111.81 2wfn s LYS 62 Ca 0.38 -1.77 -0.25 0.00 0.02 0.00 0.00 55.97 54.35 2wfn s LYS 62 Cb -0.19 -1.11 0.09 0.00 -0.52 0.00 0.00 37.83 36.10 2wfn s LYS 62 CO 0.47 0.03 0.83 0.50 -0.92 0.00 0.00 175.35 176.26 2wfn s ARG 63 N -3.74 0.73 0.15 1.68 3.52 -1.26 -3.09 118.95 116.94 2wfn s ARG 63 Ca 0.29 0.83 0.06 0.00 -0.13 0.00 0.00 55.73 56.78 2wfn s ARG 63 Cb 0.04 0.35 -0.04 0.00 -1.56 0.00 0.00 34.95 33.74 2wfn s ARG 63 CO 0.12 -0.09 0.04 0.96 -0.81 0.00 0.00 175.30 175.51 2wfn s ILE 64 N 0.27 4.02 -0.00 4.11 -4.36 -1.26 -5.03 121.20 118.94 2wfn s ILE 64 Ca 0.01 -1.21 0.01 0.00 -0.26 0.00 0.00 60.65 59.20 2wfn s ILE 64 Cb -0.05 -3.01 -0.02 0.00 1.25 0.00 0.00 42.46 40.63 2wfn s ILE 64 CO -0.01 -0.05 0.03 0.00 0.24 0.00 0.00 174.94 175.15 2wfn n ALA 65 N -0.01 2.05 -3.42 2.27 0.00 -1.26 -4.91 120.51 115.23 2wfn n ALA 65 Ca -0.09 -0.04 -0.15 0.00 0.00 0.00 0.00 53.44 53.16 2wfn n ALA 65 Cb 0.54 -0.04 -0.10 0.00 0.00 0.00 0.00 19.45 19.84 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 1.11 0.62 0.00 3.84 -1.26 -5.02 114.94 112.03 2wfn s ASN 66 Ca -0.01 -0.25 0.35 0.00 0.21 0.00 0.00 52.86 53.16 2wfn s ASN 66 Cb 0.01 0.64 1.99 0.00 -0.55 0.00 0.00 41.25 43.34 2wfn s ASN 66 CO 0.06 -0.34 2.24 -0.07 -2.79 0.00 0.00 177.10 176.21 2wfn h LEU 67 N 8.26 0.00 -0.23 3.21 3.38 -1.94 0.14 115.31 128.13 2wfn h LEU 67 Ca -0.16 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.59 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 0.29 0.00 -0.77 -0.61 0.09 0.00 0.00 178.44 177.45 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 0.02 -0.56 -0.13 0.00 0.77 0.00 0.00 58.65 58.74 2wfn h GLN 68 Cb 0.15 0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.93 2wfn h GLN 68 CO -0.00 1.18 -1.50 0.25 -1.93 0.00 0.00 178.83 176.82 2wfn n THR 69 N -3.91 0.51 1.53 2.39 -2.24 -0.82 -4.42 114.28 107.32 2wfn n THR 69 Ca -0.07 -0.27 0.14 0.00 -2.27 0.00 0.00 64.05 61.58 2wfn n THR 69 Cb 0.74 -0.81 0.76 0.00 -2.10 0.00 0.00 70.33 68.92 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 -2.43 0.00 -0.24 3.42 9.92 0.41 -2.37 116.55 125.27 2wfn n ASP 70 Ca -0.13 -0.51 0.06 0.00 -0.53 0.00 0.00 54.79 53.68 2wfn n ASP 70 Cb 0.72 -0.14 -0.01 0.00 -0.64 0.00 0.00 41.12 41.05 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 -1.14 1.26 -0.01 0.64 4.77 -1.26 -4.54 117.00 116.73 2wfn n LEU 71 Ca 0.17 -0.74 -0.02 0.00 -0.03 0.00 0.00 56.01 55.39 2wfn n LEU 71 Cb 0.15 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.48 2wfn n LEU 71 CO 0.18 0.25 0.84 0.28 -1.33 0.00 0.00 177.39 177.62 2wfn h SER 72 N 1.20 0.52 1.18 -1.43 0.02 -1.66 -1.83 113.55 111.55 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 0.39 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2wfn h SER 72 CO 0.00 0.67 0.00 -0.90 -1.14 0.00 0.00 176.83 175.46 2wfn n ASP 73 N -4.20 0.45 0.00 3.07 5.68 -1.26 -4.38 116.55 115.90 2wfn n ASP 73 Ca 0.01 0.55 0.00 0.00 -0.50 0.00 0.00 54.79 54.85 2wfn n ASP 73 Cb 0.32 -0.67 0.00 0.00 -1.14 0.00 0.00 41.12 39.63 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 1.18 2.19 0.06 6.12 0.00 -0.69 -4.69 105.19 109.37 2wfn n GLY 74 Ca 0.06 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 -0.03 -0.01 0.99 3.38 -1.90 -2.37 115.31 115.37 2wfn h LEU 75 Ca 0.00 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2wfn h LEU 75 Cb 0.00 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2wfn h LEU 75 CO 0.00 0.31 -0.11 0.54 0.09 0.00 0.00 178.44 179.27 2wfn n ARG 76 N -4.95 0.05 0.02 1.13 1.74 -1.26 -2.50 116.66 110.90 2wfn n ARG 76 Ca -0.08 -0.01 -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 30.02 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 0.03 0.60 -0.37 0.55 5.85 -1.82 -2.75 115.31 117.39 2wfn h LEU 77 Ca 0.00 -0.78 -0.01 0.00 0.84 0.00 0.00 57.88 57.93 2wfn h LEU 77 Cb 0.48 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2wfn h LEU 77 CO 0.00 1.30 0.19 0.40 -0.34 0.00 0.00 178.44 179.99 2wfn h ILE 78 N -0.04 1.16 -0.65 4.05 2.04 -1.38 -2.03 117.51 120.66 2wfn h ILE 78 Ca -0.10 -0.44 0.07 0.00 1.00 0.00 0.00 64.86 65.40 2wfn h ILE 78 Cb 1.43 0.76 -0.06 0.00 -0.74 0.00 0.00 36.82 38.22 2wfn h ILE 78 CO 0.14 0.17 0.34 0.00 0.00 0.00 0.00 178.15 178.79 2wfn h ALA 79 N 1.04 0.88 -0.61 1.87 0.00 -1.58 0.34 119.26 121.20 2wfn h ALA 79 Ca 0.13 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2wfn h ALA 79 Cb 0.10 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2wfn h ALA 79 CO -0.02 -0.02 0.27 1.25 0.00 0.00 0.00 179.25 180.73 2wfn h LEU 80 N 0.61 0.82 -0.71 0.00 5.85 -1.35 -2.65 115.31 117.88 2wfn h LEU 80 Ca 0.30 -0.15 -0.12 0.00 0.84 0.00 0.00 57.88 58.76 2wfn h LEU 80 Cb 0.25 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 2wfn h LEU 80 CO -0.22 0.74 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.27 2wfn h LEU 81 N 0.84 0.71 -0.67 2.25 3.38 -0.71 -2.28 115.31 118.83 2wfn h LEU 81 Ca 0.21 -0.27 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 2wfn h LEU 81 Cb 0.15 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2wfn h LEU 81 CO -0.02 0.95 -0.24 -0.33 0.09 0.00 0.00 178.44 178.89 2wfn h GLU 82 N 0.59 0.78 0.03 1.13 5.08 -0.85 -1.98 114.58 119.37 2wfn h GLU 82 Ca 0.07 -0.32 -0.21 0.00 -1.00 0.00 0.00 59.36 57.90 2wfn h GLU 82 Cb 0.78 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 2wfn h GLU 82 CO 0.06 0.94 -0.98 -0.24 -1.00 0.00 0.00 179.01 177.80 2wfn h VAL 83 N 0.68 1.55 -0.29 3.13 3.04 -1.45 -2.08 116.25 120.83 2wfn h VAL 83 Ca 0.09 -2.89 -0.14 0.00 -1.01 0.00 0.00 66.70 62.75 2wfn h VAL 83 Cb 0.75 2.65 -0.00 0.00 -2.01 0.00 0.00 31.29 32.68 2wfn h VAL 83 CO 0.06 0.84 -0.35 -0.07 -1.01 0.00 0.00 177.57 177.04 2wfn h LEU 84 N 0.07 0.81 0.00 3.16 3.38 -1.35 -3.28 115.31 118.10 2wfn h LEU 84 Ca -0.05 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.43 2wfn h LEU 84 Cb 1.66 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.18 2wfn h LEU 84 CO 0.15 1.14 -0.68 -1.54 0.09 0.00 0.00 178.44 177.60 2wfn n SER 85 N -4.20 0.61 -1.75 -0.43 3.41 -0.75 -4.95 113.62 105.57 2wfn n SER 85 Ca -0.04 -0.13 -0.21 0.00 -0.26 0.00 0.00 58.87 58.23 2wfn n SER 85 Cb 0.51 0.37 -0.08 0.00 -0.26 0.00 0.00 64.21 64.75 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 -1.82 -1.50 -4.25 4.33 1.13 -0.79 -4.98 117.38 109.51 2wfn n GLN 86 Ca 0.04 1.20 -0.22 0.00 -1.94 0.00 0.00 57.00 56.08 2wfn n GLN 86 Cb 0.39 -5.64 -0.12 0.00 0.11 0.00 0.00 30.24 24.98 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 -4.00 1.01 0.85 -1.09 1.02 -1.17 -5.04 119.74 111.33 2wfn s LYS 87 Ca 0.00 -1.08 -0.13 0.00 0.02 0.00 0.00 55.97 54.79 2wfn s LYS 87 Cb 0.00 -1.18 0.11 0.00 -0.52 0.00 0.00 37.83 36.24 2wfn s LYS 87 CO 0.00 0.27 1.18 0.21 -0.92 0.00 0.00 175.35 176.09 2wfn s LYS 88 N -1.83 1.59 0.42 1.68 2.47 -1.26 -4.45 119.74 118.36 2wfn s LYS 88 Ca 0.03 0.11 -0.22 0.00 -1.56 0.00 0.00 55.97 54.33 2wfn s LYS 88 Cb -0.10 -1.91 -0.10 0.00 -1.46 0.00 0.00 37.83 34.26 2wfn s LYS 88 CO 0.03 -1.86 0.97 1.41 0.16 0.00 0.00 175.35 176.07 2wfn s MET 89 N -5.53 4.22 0.29 4.03 1.75 -1.26 -4.98 119.30 117.82 2wfn s MET 89 Ca 0.64 1.22 0.12 0.00 -1.25 0.00 0.00 55.69 56.42 2wfn s MET 89 Cb -0.11 -2.29 0.40 0.00 2.84 0.00 0.00 34.83 35.67 2wfn s MET 89 CO 0.51 -0.05 1.62 1.12 -0.65 0.00 0.00 175.02 177.57 2wfn h HIS 90 N 2.10 0.00 -4.05 4.11 2.07 -1.96 -3.45 115.15 113.97 2wfn h HIS 90 Ca -0.49 0.00 -0.11 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 31.03 2wfn h HIS 90 CO 0.61 0.58 -0.54 -0.98 -3.07 0.00 0.00 177.93 174.53 2wfn s ARG 91 N -3.56 0.73 0.60 5.12 1.70 -1.26 -5.16 118.95 117.11 2wfn s ARG 91 Ca -0.01 -1.11 -0.17 0.00 -0.47 0.00 0.00 55.73 53.98 2wfn s ARG 91 Cb 0.12 0.27 -0.03 0.00 -0.57 0.00 0.00 34.95 34.74 2wfn s ARG 91 CO 0.75 -0.19 1.10 0.15 -1.08 0.00 0.00 175.30 176.03 2wfn s LYS 92 N -3.90 3.16 0.31 3.89 1.02 -1.26 -5.07 119.74 117.89 2wfn s LYS 92 Ca 0.06 1.42 0.05 0.00 0.02 0.00 0.00 55.97 57.52 2wfn s LYS 92 Cb 0.07 -2.00 -0.06 0.00 -0.52 0.00 0.00 37.83 35.32 2wfn s LYS 92 CO -0.10 -0.97 0.01 -3.38 -0.92 0.00 0.00 175.35 169.99 2wfn s HIS 93 N -2.16 1.99 -0.14 3.18 -3.43 -1.26 -5.07 115.29 108.40 2wfn s HIS 93 Ca 0.68 -0.85 -0.29 0.00 -0.80 0.00 0.00 55.06 53.80 2wfn s HIS 93 Cb -0.20 -1.26 -0.03 0.00 -1.43 0.00 0.00 32.58 29.66 2wfn s HIS 93 CO 0.34 0.13 1.47 -0.80 -2.00 0.00 0.00 174.74 173.88 2wfn s ASN 94 N -3.48 6.73 0.22 7.38 0.02 -1.26 -4.90 114.94 119.65 2wfn s ASN 94 Ca 0.34 1.86 0.08 0.00 -1.02 0.00 0.00 52.86 54.12 2wfn s ASN 94 Cb 0.07 -2.54 0.18 0.00 0.02 0.00 0.00 41.25 38.98 2wfn s ASN 94 CO 0.14 -0.92 1.51 1.56 0.02 0.00 0.00 177.10 179.41 2wfn h GLN 95 N 9.17 0.05 -3.17 -0.60 1.08 -1.99 -3.38 115.11 116.27 2wfn h GLN 95 Ca -0.32 -0.05 -0.63 0.00 -1.45 0.00 0.00 58.65 56.20 2wfn h GLN 95 Cb 1.14 0.01 -0.41 0.00 -0.05 0.00 0.00 27.48 28.17 2wfn h GLN 95 CO 0.97 0.76 -0.61 1.03 -0.95 0.00 0.00 178.83 180.03 2wfn s ARG 96 N -3.39 2.22 -1.22 1.46 0.52 -1.26 -5.04 118.95 112.24 2wfn s ARG 96 Ca -0.01 -3.02 -0.20 0.00 -0.52 0.00 0.00 55.73 51.97 2wfn s ARG 96 Cb 0.12 -3.31 0.00 0.00 0.52 0.00 0.00 34.95 32.29 2wfn s ARG 96 CO 0.79 -1.22 1.81 -1.25 0.02 0.00 0.00 175.30 175.44 2wfn s PRO 97 N -0.95 3.33 0.04 3.54 0.04 -1.26 -4.79 135.00 134.95 2wfn s PRO 97 Ca 0.22 -1.56 -0.26 0.00 0.04 0.00 0.00 61.00 59.44 2wfn s PRO 97 Cb -0.13 -5.40 -0.17 0.00 0.04 0.00 0.00 34.50 28.85 2wfn s PRO 97 CO -0.10 -2.97 1.48 1.15 0.04 0.00 0.00 177.00 176.60 2wfn h THR 98 N 5.94 0.86 -2.20 1.26 2.02 -1.96 -3.45 112.91 115.38 2wfn h THR 98 Ca 0.33 -0.38 -0.58 0.00 0.77 0.00 0.00 66.41 66.55 2wfn h THR 98 Cb 0.91 1.09 -0.12 0.00 -1.74 0.00 0.00 68.15 68.29 2wfn h THR 98 CO 1.36 0.09 -0.70 -0.36 0.37 0.00 0.00 175.52 176.28 2wfn s PHE 99 N -5.36 2.51 0.62 3.16 0.08 -1.26 -5.03 117.98 112.71 2wfn s PHE 99 Ca -0.15 -0.28 0.35 0.00 0.12 0.00 0.00 56.93 56.98 2wfn s PHE 99 Cb 0.04 -1.11 2.01 0.00 -0.57 0.00 0.00 43.02 43.38 2wfn s PHE 99 CO 0.62 0.66 2.25 0.07 -0.10 0.00 0.00 175.22 178.72 2wfn h ARG 100 N 2.05 0.00 -0.27 0.44 0.11 -1.99 0.32 114.38 115.05 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 0.60 0.00 0.12 0.37 0.10 0.00 0.00 179.97 181.17 2wfn h GLN 101 N 0.00 0.36 0.00 0.08 5.75 -1.97 0.18 115.11 119.51 2wfn h GLN 101 Ca 0.01 -0.03 -0.22 0.00 -0.15 0.00 0.00 58.65 58.26 2wfn h GLN 101 Cb 0.13 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.57 2wfn h GLN 101 CO -0.00 0.29 -1.23 0.52 -2.65 0.00 0.00 178.83 175.77 2wfn h MET 102 N 0.37 0.00 -0.45 1.69 2.86 -1.31 -3.14 114.93 114.94 2wfn h MET 102 Ca 0.10 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.62 2wfn h MET 102 Cb 0.05 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 2wfn h MET 102 CO -0.01 0.66 -0.19 1.96 1.06 0.00 0.00 176.91 180.39 2wfn h GLN 103 N 0.00 0.89 -0.52 1.72 4.20 -1.08 -1.90 115.11 118.42 2wfn h GLN 103 Ca -0.12 -0.36 -0.06 0.00 0.06 0.00 0.00 58.65 58.17 2wfn h GLN 103 Cb 1.77 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 29.49 2wfn h GLN 103 CO 0.09 1.00 0.07 -0.07 -0.67 0.00 0.00 178.83 179.26 2wfn h LEU 104 N 0.78 0.79 -0.45 1.46 3.38 -0.76 -2.32 115.31 118.20 2wfn h LEU 104 Ca 0.11 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 2wfn h LEU 104 Cb 0.73 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2wfn h LEU 104 CO 0.06 0.81 -0.16 -0.33 0.09 0.00 0.00 178.44 178.91 2wfn h GLU 105 N 0.79 0.89 -0.60 1.13 5.08 -1.47 -0.64 114.58 119.77 2wfn h GLU 105 Ca 0.16 -0.37 -0.05 0.00 -1.00 0.00 0.00 59.36 58.11 2wfn h GLU 105 Cb 0.37 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 2wfn h GLU 105 CO 0.01 1.02 0.16 -0.91 -1.00 0.00 0.00 179.01 178.29 2wfn h ASN 106 N 0.73 0.86 0.63 1.42 4.21 -1.20 -1.78 115.58 120.44 2wfn h ASN 106 Ca 0.11 -0.15 -0.18 0.00 1.21 0.00 0.00 56.30 57.28 2wfn h ASN 106 Cb 0.72 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 37.68 2wfn h ASN 106 CO 0.05 0.82 -0.82 0.58 -1.29 0.00 0.00 177.43 176.78 2wfn h VAL 107 N 0.88 1.51 -0.22 2.81 2.07 -1.38 -2.98 116.25 118.95 2wfn h VAL 107 Ca 0.19 -2.58 -0.00 0.00 0.82 0.00 0.00 66.70 65.13 2wfn h VAL 107 Cb 0.29 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 2wfn h VAL 107 CO -0.00 0.75 0.12 0.28 0.02 0.00 0.00 177.57 178.73 2wfn h SER 108 N 0.08 0.27 0.23 0.57 0.02 -0.67 0.72 113.55 114.77 2wfn h SER 108 Ca -0.03 -0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 60.78 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 0.28 -0.25 1.62 -1.14 0.00 0.00 176.83 177.46 2wfn h VAL 109 N 0.24 1.20 -0.32 2.27 3.04 -1.40 0.14 116.25 121.41 2wfn h VAL 109 Ca 0.08 -0.92 -0.09 0.00 -1.01 0.00 0.00 66.70 64.76 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 0.27 -0.13 0.00 -1.01 0.00 0.00 177.57 176.68 2wfn h ALA 110 N 1.70 0.45 -0.02 3.17 0.00 -1.28 -2.08 119.26 121.20 2wfn h ALA 110 Ca 0.01 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 2wfn h ALA 110 Cb 0.47 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2wfn h ALA 110 CO 0.03 0.33 -0.56 -0.07 0.00 0.00 0.00 179.25 178.98 2wfn h LEU 111 N 0.43 0.07 -0.24 0.00 4.07 -0.45 -2.45 115.31 116.74 2wfn h LEU 111 Ca 0.08 -0.04 -0.06 0.00 0.08 0.00 0.00 57.88 57.94 2wfn h LEU 111 Cb 0.65 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.36 2wfn h LEU 111 CO 0.04 0.62 -0.09 -0.33 -1.08 0.00 0.00 178.44 177.60 2wfn h GLU 112 N 0.05 0.48 -0.59 1.13 5.08 -0.70 -0.78 114.58 119.25 2wfn h GLU 112 Ca -0.00 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 2wfn h GLU 112 Cb 1.01 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.21 2wfn h GLU 112 CO 0.08 0.73 0.34 0.35 -1.00 0.00 0.00 179.01 179.50 2wfn h PHE 113 N 0.20 0.77 -0.15 4.33 3.57 -1.36 0.47 116.94 124.78 2wfn h PHE 113 Ca 0.06 -0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.40 2wfn h PHE 113 Cb 0.57 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2wfn h PHE 113 CO 0.06 0.53 -0.56 1.25 -2.23 0.00 0.00 178.31 177.36 2wfn h LEU 114 N 0.81 0.50 -0.07 0.59 5.85 -1.31 -2.90 115.31 118.78 2wfn h LEU 114 Ca 0.21 -0.27 -0.20 0.00 0.84 0.00 0.00 57.88 58.46 2wfn h LEU 114 Cb -0.01 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 40.89 2wfn h LEU 114 CO -0.04 0.96 -0.73 -0.78 -0.34 0.00 0.00 178.44 177.51 2wfn h ASP 115 N 0.34 0.77 0.00 1.25 1.82 -0.54 -2.80 116.42 117.27 2wfn h ASP 115 Ca 0.00 -0.68 0.00 0.00 -0.39 0.00 0.00 57.03 55.96 2wfn h ASP 115 Cb 1.08 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.86 2wfn h ASP 115 CO 0.10 1.34 0.00 -2.11 -1.61 0.00 0.00 179.24 176.96 2wfn n ARG 116 N -4.06 0.84 -0.33 0.28 1.85 0.10 -2.29 116.66 113.06 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 0.72 -1.37 0.23 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 -0.87 3.03 -1.38 2.89 4.07 -1.10 -4.97 120.64 122.32 2wfn n GLU 117 Ca 0.15 -2.43 -0.13 0.00 -0.06 0.00 0.00 57.16 54.69 2wfn n GLU 117 Cb 0.07 -1.53 -0.06 0.00 -0.06 0.00 0.00 31.44 29.86 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 0.53 -4.87 -4.63 4.31 7.64 -0.97 -4.98 113.62 110.65 2wfn n SER 118 Ca 0.17 0.32 -0.42 0.00 1.01 0.00 0.00 58.87 59.96 2wfn n SER 118 Cb 0.63 -3.52 -0.05 0.00 -1.01 0.00 0.00 64.21 60.26 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 -2.38 4.85 -0.07 0.44 1.01 -1.06 -5.02 121.20 118.97 2wfn s ILE 119 Ca 0.00 1.32 -0.30 0.00 0.00 0.00 0.00 60.65 61.67 2wfn s ILE 119 Cb 0.00 -4.09 -0.03 0.00 0.01 0.00 0.00 42.46 38.35 2wfn s ILE 119 CO 0.00 -0.12 1.30 -0.54 0.00 0.00 0.00 174.94 175.58 2wfn s LYS 120 N 2.81 4.29 -0.26 2.79 1.02 -1.26 -4.50 119.74 124.63 2wfn s LYS 120 Ca 0.32 1.78 -0.11 0.00 0.02 0.00 0.00 55.97 57.97 2wfn s LYS 120 Cb -0.15 -3.65 -0.05 0.00 -0.52 0.00 0.00 37.83 33.46 2wfn s LYS 120 CO 0.10 -0.58 0.21 -0.51 -0.92 0.00 0.00 175.35 173.64 2wfn s LEU 121 N 2.75 4.06 -1.39 3.17 2.01 -1.26 -5.01 118.68 123.00 2wfn s LEU 121 Ca 0.59 0.09 -0.11 0.00 0.01 0.00 0.00 54.13 54.70 2wfn s LEU 121 Cb -0.26 -2.16 0.09 0.00 0.01 0.00 0.00 46.19 43.86 2wfn s LEU 121 CO 0.21 -0.03 2.15 0.52 1.01 0.00 0.00 176.35 180.22 2wfn n VAL 122 N 4.76 3.99 -3.34 -1.59 0.31 -1.26 -4.63 118.33 116.58 2wfn n VAL 122 Ca -0.14 -3.62 -0.12 0.00 -0.01 0.00 0.00 64.34 60.46 2wfn n VAL 122 Cb 0.52 -2.48 0.01 0.00 -0.91 0.00 0.00 33.84 30.99 2wfn n VAL 122 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2wfn n SER 123 N 4.72 -6.66 -3.89 4.52 7.64 -1.26 -5.04 113.62 113.66 2wfn n SER 123 Ca 0.50 -0.48 -0.27 0.00 1.01 0.00 0.00 58.87 59.63 2wfn n SER 123 Cb 0.36 -4.21 -0.17 0.00 -1.01 0.00 0.00 64.21 59.18 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 -3.11 0.99 0.43 0.44 1.09 -1.26 -5.07 121.20 114.70 2wfn s ILE 124 Ca 0.12 -0.33 0.08 0.00 -1.10 0.00 0.00 60.65 59.42 2wfn s ILE 124 Cb -0.03 -1.06 -0.00 0.00 -1.06 0.00 0.00 42.46 40.31 2wfn s ILE 124 CO 0.80 0.30 0.47 1.51 -0.10 0.00 0.00 174.94 177.92 2wfn s ASP 125 N 1.72 5.30 0.27 3.58 -4.77 -1.26 -5.03 116.67 116.47 2wfn s ASP 125 Ca 0.04 -0.62 -0.04 0.00 -3.30 0.00 0.00 52.55 48.62 2wfn s ASP 125 Cb -0.13 -0.56 0.34 0.00 -1.09 0.00 0.00 42.92 41.49 2wfn s ASP 125 CO -0.08 -0.73 1.95 0.28 0.70 0.00 0.00 175.17 177.29 2wfn h SER 126 N 0.83 1.06 -0.80 2.11 0.02 -1.91 -2.62 113.55 112.24 2wfn h SER 126 Ca -0.40 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 60.55 2wfn h SER 126 Cb 1.27 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 63.50 2wfn h SER 126 CO 0.52 0.77 0.53 0.50 -1.14 0.00 0.00 176.83 178.00 2wfn h LYS 127 N 1.25 0.98 -0.75 3.45 3.64 -1.96 -2.07 116.57 121.12 2wfn h LYS 127 Ca 0.34 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.62 2wfn h LYS 127 Cb -0.14 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.43 2wfn h LYS 127 CO -0.07 0.65 0.32 0.00 -2.27 0.00 0.00 179.45 178.07 2wfn h ALA 128 N 1.53 1.15 0.07 5.00 0.00 -1.87 -1.43 119.26 123.71 2wfn h ALA 128 Ca 0.31 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 2wfn h ALA 128 Cb 0.01 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.52 2wfn h ALA 128 CO -0.09 0.62 -0.60 0.82 0.00 0.00 0.00 179.25 180.00 2wfn h ILE 129 N 1.08 1.52 -0.41 0.00 2.04 -1.52 0.23 117.51 120.44 2wfn h ILE 129 Ca 0.25 -2.31 -0.02 0.00 1.00 0.00 0.00 64.86 63.78 2wfn h ILE 129 Cb 0.17 3.00 -0.02 0.00 -0.74 0.00 0.00 36.82 39.23 2wfn h ILE 129 CO -0.03 0.65 0.17 0.58 0.00 0.00 0.00 178.15 179.53 2wfn h VAL 130 N -0.38 1.19 0.00 1.67 2.07 -1.37 -2.62 116.25 116.82 2wfn h VAL 130 Ca -0.09 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2wfn h VAL 130 Cb 1.40 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.98 2wfn h VAL 130 CO 0.11 0.21 0.00 0.47 0.02 0.00 0.00 177.57 178.39 2wfn n ASP 131 N -4.65 0.00 -0.91 0.57 8.00 -0.54 -4.80 116.55 114.22 2wfn n ASP 131 Ca 0.00 0.21 -0.01 0.00 0.71 0.00 0.00 54.79 55.70 2wfn n ASP 131 Cb 0.14 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 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 0.62 3.55 0.44 0.00 -0.99 -4.99 105.19 104.82 2wfn n GLY 132 Ca 0.09 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 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 -3.04 6.13 0.26 1.61 2.47 0.06 -4.90 114.94 117.53 2wfn s ASN 133 Ca 0.01 -0.72 -0.01 0.00 0.42 0.00 0.00 52.86 52.57 2wfn s ASN 133 Cb -0.01 -2.56 0.49 0.00 -1.45 0.00 0.00 41.25 37.72 2wfn s ASN 133 CO 0.04 -1.83 1.82 0.25 -3.72 0.00 0.00 177.10 173.65 2wfn h LEU 134 N 13.54 0.78 -0.35 3.21 5.85 -1.91 -1.12 115.31 135.31 2wfn h LEU 134 Ca -0.10 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2wfn h LEU 134 Cb 1.04 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 2wfn h LEU 134 CO 1.32 0.41 0.20 0.50 -0.34 0.00 0.00 178.44 180.53 2wfn h LYS 135 N 0.86 0.48 0.00 1.25 3.64 -1.98 -1.61 116.57 119.22 2wfn h LYS 135 Ca 0.45 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.69 2wfn h LYS 135 Cb 0.46 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2wfn h LYS 135 CO -0.27 0.39 -0.43 -0.07 -2.27 0.00 0.00 179.45 176.80 2wfn h LEU 136 N 0.44 0.00 -0.28 5.20 3.38 -1.82 -2.79 115.31 119.45 2wfn h LEU 136 Ca 0.12 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 2wfn h LEU 136 Cb 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2wfn h LEU 136 CO -0.02 0.43 -0.18 0.40 0.09 0.00 0.00 178.44 179.17 2wfn h ILE 137 N 0.00 1.30 -0.26 1.22 2.04 -1.02 -1.70 117.51 119.09 2wfn h ILE 137 Ca -0.00 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.54 2wfn h ILE 137 Cb 1.19 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.79 2wfn h ILE 137 CO 0.06 0.41 0.09 -0.07 0.00 0.00 0.00 178.15 178.64 2wfn h LEU 138 N 0.35 0.32 -0.77 1.44 3.38 -1.29 -1.68 115.31 117.06 2wfn h LEU 138 Ca 0.06 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 2wfn h LEU 138 Cb 0.71 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2wfn h LEU 138 CO 0.05 0.30 -0.29 1.23 0.09 0.00 0.00 178.44 179.82 2wfn h GLY 139 N 0.51 0.66 0.97 0.83 0.00 -1.30 -2.32 103.07 102.42 2wfn h GLY 139 Ca 0.09 -0.58 -0.07 0.00 0.00 0.00 0.00 47.33 46.76 2wfn h GLY 139 CO -0.01 0.53 -0.03 -2.00 0.00 0.00 0.00 176.54 175.03 2wfn h LEU 140 N 0.52 0.74 -0.42 3.11 5.85 -0.44 -2.58 115.31 122.10 2wfn h LEU 140 Ca 0.07 -0.33 -0.10 0.00 0.84 0.00 0.00 57.88 58.36 2wfn h LEU 140 Cb 0.77 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2wfn h LEU 140 CO 0.06 0.89 -0.14 0.40 -0.34 0.00 0.00 178.44 179.32 2wfn h ILE 141 N 0.58 1.28 -0.63 4.05 1.08 -1.35 -2.82 117.51 119.70 2wfn h ILE 141 Ca 0.11 -1.26 -0.01 0.00 -0.39 0.00 0.00 64.86 63.32 2wfn h ILE 141 Cb 0.53 1.21 -0.03 0.00 -3.07 0.00 0.00 36.82 35.46 2wfn h ILE 141 CO 0.03 0.42 0.35 -0.25 -0.69 0.00 0.00 178.15 178.01 2wfn h TRP 142 N 0.66 0.84 -0.61 1.37 2.91 -1.41 0.83 115.95 120.54 2wfn h TRP 142 Ca 0.10 -0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.16 2wfn h TRP 142 Cb 0.68 -0.27 -0.05 0.00 -0.51 0.00 0.00 29.16 29.01 2wfn h TRP 142 CO 0.05 0.58 0.34 1.15 -1.03 0.00 0.00 178.44 179.54 2wfn h THR 143 N 0.87 1.00 -0.57 2.65 2.02 -1.31 0.48 112.91 118.05 2wfn h THR 143 Ca 0.22 -0.23 -0.09 0.00 0.77 0.00 0.00 66.41 67.08 2wfn h THR 143 Cb 0.01 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 2wfn h THR 143 CO -0.04 0.12 -0.01 -0.07 0.37 0.00 0.00 175.52 175.89 2wfn h LEU 144 N 0.66 0.98 -0.35 2.58 4.07 -0.99 -1.99 115.31 120.25 2wfn h LEU 144 Ca 0.26 -0.27 -0.05 0.00 0.08 0.00 0.00 57.88 57.90 2wfn h LEU 144 Cb 0.11 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 2wfn h LEU 144 CO -0.15 1.04 0.03 0.40 -1.08 0.00 0.00 178.44 178.68 2wfn h ILE 145 N 0.91 1.25 -0.71 1.22 2.04 -0.45 -1.25 117.51 120.51 2wfn h ILE 145 Ca 0.16 -0.90 -0.02 0.00 1.00 0.00 0.00 64.86 65.10 2wfn h ILE 145 Cb 0.55 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.75 2wfn h ILE 145 CO 0.03 0.30 0.36 -0.07 0.00 0.00 0.00 178.15 178.77 2wfn h LEU 146 N 0.42 0.92 0.04 1.44 3.38 -0.84 -1.71 115.31 118.96 2wfn h LEU 146 Ca 0.10 -0.12 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 2wfn h LEU 146 Cb 0.40 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 40.93 2wfn h LEU 146 CO 0.01 0.78 -0.56 -0.74 0.09 0.00 0.00 178.44 178.03 2wfn h HIS 147 N 0.99 0.49 0.11 1.13 2.76 -1.29 -1.05 115.15 118.28 2wfn h HIS 147 Ca 0.25 -0.29 -0.37 0.00 -2.20 0.00 0.00 60.37 57.76 2wfn h HIS 147 Cb 0.09 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 28.98 2wfn h HIS 147 CO 0.00 1.14 -2.07 0.66 -1.30 0.00 0.00 177.93 176.36 2wfn n TYR 148 N -4.27 1.07 0.02 5.26 4.01 -0.48 -1.97 117.16 120.80 2wfn n TYR 148 Ca -0.11 0.23 -0.04 0.00 -0.16 0.00 0.00 57.90 57.81 2wfn n TYR 148 Cb 0.67 -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 -3.40 113.55 116.48 2wfn h SER 149 Ca -0.45 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.36 2wfn h SER 149 Cb 2.02 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 64.53 2wfn h SER 149 CO 0.06 0.79 -1.29 -0.38 -1.14 0.00 0.00 176.83 174.87 2wfn n ILE 150 N -3.01 1.04 0.05 3.27 5.41 -1.08 -4.79 119.36 120.25 2wfn n ILE 150 Ca -0.11 -0.01 0.09 0.00 1.00 0.00 0.00 62.75 63.71 2wfn n ILE 150 Cb 0.94 -1.82 -0.07 0.00 -0.71 0.00 0.00 39.64 37.98 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 0.55 -0.04 4.38 3.41 -0.40 -3.69 113.62 114.03 2wfn n SER 151 Ca -0.20 0.22 -0.16 0.00 -0.26 0.00 0.00 58.87 58.46 2wfn n SER 151 Cb 0.53 0.91 -0.07 0.00 -0.26 0.00 0.00 64.21 65.32 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 -3.40 114.93 113.43 2wfn h MET 152 Ca -0.05 -0.54 0.00 0.00 -3.44 0.00 0.00 59.70 55.67 2wfn h MET 152 Cb 1.14 0.10 0.00 0.00 -0.55 0.00 0.00 31.60 32.29 2wfn h MET 152 CO 0.01 1.16 0.00 -2.30 0.14 0.00 0.00 176.91 175.92 2wfn n PRO 153 N -4.07 0.00 -4.15 0.39 -0.02 -1.26 -5.12 135.00 120.76 2wfn n PRO 153 Ca -0.07 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.08 2wfn n PRO 153 Cb 0.66 -0.43 -0.16 0.00 -0.02 0.00 0.00 33.50 33.56 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 -0.00 2.93 0.00 -0.52 -1.94 -1.24 -5.14 119.30 113.39 2wfn s MET 154 Ca 0.00 -0.81 0.00 0.00 -1.71 0.00 0.00 55.69 53.17 2wfn s MET 154 Cb 0.00 -2.52 0.00 0.00 2.01 0.00 0.00 34.83 34.32 2wfn s MET 154 CO 0.00 -0.20 0.00 0.36 -0.01 0.00 0.00 175.02 175.17 2wfn n LYS 165 N 4.59 0.00 -3.81 2.03 2.85 -1.26 -4.46 118.16 118.11 2wfn n LYS 165 Ca -0.21 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 56.94 2wfn n LYS 165 Cb 0.50 -1.95 -0.08 0.00 -0.65 0.00 0.00 35.03 32.85 2wfn n LYS 165 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 177.40 178.49 2wfn s GLN 166 N 0.00 0.72 0.62 -1.58 -2.07 -1.26 -5.16 119.66 110.93 2wfn s GLN 166 Ca 0.00 -0.53 -0.19 0.00 -1.82 0.00 0.00 55.36 52.82 2wfn s GLN 166 Cb 0.00 0.30 -0.02 0.00 -1.09 0.00 0.00 33.01 32.20 2wfn s GLN 166 CO 0.00 -0.21 1.28 0.95 -1.32 0.00 0.00 175.29 175.99 2wfn s THR 167 N -2.37 2.19 0.52 3.63 -4.23 -1.26 -4.85 115.64 109.27 2wfn s THR 167 Ca -0.06 0.12 0.25 0.00 -1.18 0.00 0.00 61.69 60.81 2wfn s THR 167 Cb -0.02 -3.05 0.40 0.00 1.34 0.00 0.00 72.50 71.17 2wfn s THR 167 CO -0.03 -0.02 1.99 1.55 -0.54 0.00 0.00 174.62 177.57 2wfn h PRO 168 N 0.72 0.02 -0.15 3.99 0.13 -1.96 -2.61 132.00 132.15 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 1.32 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 2wfn h PRO 168 CO 0.54 0.02 0.04 -0.22 -0.23 0.00 0.00 178.00 178.14 2wfn h LYS 169 N 0.02 0.24 0.00 0.86 3.64 -1.97 -2.67 116.57 116.70 2wfn h LYS 169 Ca 0.26 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 2wfn h LYS 169 Cb 1.03 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 2wfn h LYS 169 CO -0.01 0.39 0.00 0.00 -2.27 0.00 0.00 179.45 177.56 2wfn n GLN 170 N -4.83 0.24 -0.05 1.90 10.64 -1.03 -2.10 117.38 122.16 2wfn n GLN 170 Ca -0.05 0.26 -0.13 0.00 -1.83 0.00 0.00 57.00 55.26 2wfn n GLN 170 Cb 0.16 -1.81 -0.07 0.00 -0.86 0.00 0.00 30.24 27.66 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 0.31 -0.46 2.61 2.47 -1.33 0.12 114.38 118.10 2wfn h ARG 171 Ca 0.00 -0.14 -0.09 0.00 -1.26 0.00 0.00 59.98 58.49 2wfn h ARG 171 Cb 0.64 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.94 2wfn h ARG 171 CO 0.00 0.65 -0.06 1.25 0.56 0.00 0.00 179.97 182.37 2wfn h LEU 172 N -0.04 0.84 -0.72 3.04 5.85 -1.36 -1.02 115.31 121.90 2wfn h LEU 172 Ca 0.03 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 2wfn h LEU 172 Cb 0.56 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2wfn h LEU 172 CO 0.02 0.98 0.36 0.25 -0.34 0.00 0.00 178.44 179.72 2wfn h LEU 173 N 0.69 0.93 -1.03 2.25 5.85 -1.47 -1.80 115.31 120.72 2wfn h LEU 173 Ca 0.12 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2wfn h LEU 173 Cb 0.59 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 2wfn h LEU 173 CO 0.04 0.79 0.31 1.23 -0.34 0.00 0.00 178.44 180.46 2wfn h GLY 174 N 1.00 1.07 0.97 3.75 0.00 -0.76 -0.77 103.07 108.34 2wfn h GLY 174 Ca 0.25 -0.53 -0.10 0.00 0.00 0.00 0.00 47.33 46.94 2wfn h GLY 174 CO -0.03 0.51 -0.20 -0.25 0.00 0.00 0.00 176.54 176.57 2wfn h TRP 175 N 0.99 0.85 -0.27 5.60 7.01 -0.85 -3.04 115.95 126.23 2wfn h TRP 175 Ca 0.24 -0.22 -0.10 0.00 2.11 0.00 0.00 58.89 60.92 2wfn h TRP 175 Cb 0.14 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 26.99 2wfn h TRP 175 CO 0.01 0.95 -0.24 0.82 -2.79 0.00 0.00 178.44 177.20 2wfn h ILE 176 N 0.51 1.26 -0.55 2.65 2.04 -1.22 -3.13 117.51 119.07 2wfn h ILE 176 Ca 0.07 -1.26 0.07 0.00 1.00 0.00 0.00 64.86 64.74 2wfn h ILE 176 Cb 0.74 1.32 -0.06 0.00 -0.74 0.00 0.00 36.82 38.09 2wfn h ILE 176 CO 0.06 0.40 0.24 -0.61 0.00 0.00 0.00 178.15 178.24 2wfn h GLN 177 N 0.46 0.44 0.00 2.37 5.75 -1.02 -1.05 115.11 122.06 2wfn h GLN 177 Ca 0.07 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 2wfn h GLN 177 Cb 0.66 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.11 2wfn h GLN 177 CO 0.05 0.29 -0.46 0.27 -2.65 0.00 0.00 178.83 176.33 2wfn n ASN 178 N -4.94 0.46 0.10 -0.69 0.23 -1.22 -2.77 115.26 106.43 2wfn n ASN 178 Ca 0.06 -0.17 -0.04 0.00 -0.53 0.00 0.00 54.58 53.90 2wfn n ASN 178 Cb 0.20 0.18 0.14 0.00 -2.08 0.00 0.00 39.78 38.21 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 0.17 -2.31 -3.83 1.79 -1.35 -3.36 116.57 107.68 2wfn h LYS 179 Ca 0.00 -0.12 -0.59 0.00 -2.18 0.00 0.00 60.65 57.76 2wfn h LYS 179 Cb 0.51 0.02 -0.41 0.00 -1.58 0.00 0.00 32.23 30.77 2wfn h LYS 179 CO 0.00 0.72 -0.75 1.28 -1.08 0.00 0.00 179.45 179.62 2wfn n LEU 180 N -3.86 2.40 0.21 2.94 4.77 -0.45 -4.87 117.00 118.13 2wfn n LEU 180 Ca -0.02 -5.13 0.08 0.00 -0.03 0.00 0.00 56.01 50.91 2wfn n LEU 180 Cb 0.61 -0.26 0.40 0.00 -2.33 0.00 0.00 43.42 41.85 2wfn n LEU 180 CO 0.44 2.00 0.75 1.55 -1.33 0.00 0.00 177.39 180.79 2wfn h PRO 181 N 4.45 0.00 0.00 3.23 0.13 -1.68 -2.97 132.00 135.16 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 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 2wfn h PRO 181 CO 0.69 0.28 0.00 0.00 -0.23 0.00 0.00 178.00 178.74 2wfn n GLN 182 N -3.43 0.04 -4.45 0.86 0.00 -1.26 -4.82 117.38 104.32 2wfn n GLN 182 Ca 0.00 0.06 -0.32 0.00 0.00 0.00 0.00 57.00 56.74 2wfn n GLN 182 Cb 0.47 -1.55 -0.10 0.00 0.00 0.00 0.00 30.24 29.05 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 -3.26 3.18 -1.15 2.61 1.43 -1.12 -5.07 118.68 115.30 2wfn s LEU 183 Ca 0.13 -0.14 -0.13 0.00 -1.03 0.00 0.00 54.13 52.96 2wfn s LEU 183 Cb 0.17 -1.82 0.19 0.00 0.03 0.00 0.00 46.19 44.76 2wfn s LEU 183 CO 0.52 0.28 1.33 -2.16 0.23 0.00 0.00 176.35 176.55 2wfn s PRO 184 N -1.41 4.05 -0.13 1.29 0.04 -1.26 -4.97 135.00 132.62 2wfn s PRO 184 Ca 0.17 -2.62 -0.19 0.00 0.04 0.00 0.00 61.00 58.40 2wfn s PRO 184 Cb -0.11 -4.94 -0.04 0.00 0.04 0.00 0.00 34.50 29.45 2wfn s PRO 184 CO 0.07 -1.66 0.51 0.42 0.04 0.00 0.00 177.00 176.39 2wfn s ILE 185 N 1.12 5.16 0.00 0.56 1.09 -1.26 -4.92 121.20 122.95 2wfn s ILE 185 Ca 0.39 1.02 0.00 0.00 -1.10 0.00 0.00 60.65 60.96 2wfn s ILE 185 Cb -0.05 -3.85 0.00 0.00 -1.06 0.00 0.00 42.46 37.50 2wfn s ILE 185 CO -0.03 0.29 0.00 0.41 -0.10 0.00 0.00 174.94 175.51 2wfn n THR 186 N 3.84 0.00 -4.55 2.92 -1.04 -1.26 -4.98 114.28 109.21 2wfn n THR 186 Ca -0.06 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.69 2wfn n THR 186 Cb 0.51 -0.45 -0.09 0.00 -1.82 0.00 0.00 70.33 68.48 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 -3.06 3.03 -0.55 8.00 4.22 -1.26 -5.07 114.94 120.24 2wfn s ASN 187 Ca 0.00 -1.53 0.03 0.00 -2.14 0.00 0.00 52.86 49.22 2wfn s ASN 187 Cb 0.00 0.19 0.41 0.00 1.28 0.00 0.00 41.25 43.13 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 -0.91 3.16 0.00 1.54 3.72 -1.26 -4.66 117.46 119.06 2wfn n PHE 188 Ca -0.07 -2.73 0.00 0.00 -0.05 0.00 0.00 57.45 54.60 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 0.12 4.37 3.41 -1.26 -4.16 113.62 115.52 2wfn n SER 189 Ca 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 2wfn n SER 189 Cb 0.60 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.86 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 0.19 0.00 4.33 3.08 -1.93 -2.57 114.38 117.47 2wfn h ARG 190 Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 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 0.48 0.00 -0.25 -1.07 0.00 0.00 179.97 179.13 2wfn n ASP 191 N -4.13 0.00 -0.01 7.04 8.00 -1.26 -2.40 116.55 123.79 2wfn n ASP 191 Ca -0.01 0.48 0.00 0.00 0.71 0.00 0.00 54.79 55.97 2wfn n ASP 191 Cb 0.38 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 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 -1.49 0.00 0.10 1.24 7.02 -0.97 -4.58 117.44 118.76 2wfn n TRP 192 Ca 0.02 -0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.47 2wfn n TRP 192 Cb 0.07 -0.00 0.23 0.00 -2.42 0.00 0.00 31.31 29.19 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 0.06 0.21 0.00 -0.99 4.20 -1.47 -2.99 115.11 114.13 2wfn h GLN 193 Ca 0.00 -0.10 -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 0.60 -0.54 0.66 -0.67 0.00 0.00 178.83 178.88 2wfn h SER 194 N 0.18 0.00 0.00 1.46 4.64 -1.86 -3.43 113.55 114.54 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 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 2wfn h SER 194 CO 0.06 0.54 0.00 0.61 -0.87 0.00 0.00 176.83 177.18 2wfn n GLY 195 N 0.23 1.18 0.23 -0.77 0.00 -1.13 -4.18 105.19 100.75 2wfn n GLY 195 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 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 3.31 0.75 -0.07 1.61 2.47 -1.91 -2.73 114.38 117.81 2wfn h ARG 196 Ca 0.00 -0.23 -0.10 0.00 -1.26 0.00 0.00 59.98 58.39 2wfn h ARG 196 Cb 0.00 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.24 2wfn h ARG 196 CO 0.00 0.82 -0.41 0.00 0.56 0.00 0.00 179.97 180.94 2wfn h ALA 197 N 0.90 1.18 -0.19 0.04 0.00 -1.89 -0.86 119.26 118.44 2wfn h ALA 197 Ca 0.12 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2wfn h ALA 197 Cb 0.48 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2wfn h ALA 197 CO 0.02 0.57 0.05 -0.07 0.00 0.00 0.00 179.25 179.82 2wfn h LEU 198 N 0.13 0.28 -1.15 0.00 4.07 -1.87 -0.48 115.31 116.29 2wfn h LEU 198 Ca 0.01 -0.23 0.00 0.00 0.08 0.00 0.00 57.88 57.75 2wfn h LEU 198 Cb 0.79 -0.07 -0.04 0.00 1.08 0.00 0.00 40.66 42.41 2wfn h LEU 198 CO 0.06 0.43 0.51 1.23 -1.08 0.00 0.00 178.44 179.59 2wfn h GLY 199 N 0.12 1.16 0.95 0.83 0.00 -1.23 -0.51 103.07 104.39 2wfn h GLY 199 Ca 0.06 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 46.89 2wfn h GLY 199 CO 0.00 0.45 0.11 0.00 0.00 0.00 0.00 176.54 177.10 2wfn h ALA 200 N 1.45 0.58 -0.34 3.60 0.00 -1.03 -2.14 119.26 121.39 2wfn h ALA 200 Ca 0.29 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2wfn h ALA 200 Cb -0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2wfn h ALA 200 CO -0.06 0.26 0.01 1.25 0.00 0.00 0.00 179.25 180.72 2wfn h LEU 201 N 0.58 0.57 -0.79 0.00 6.46 -0.64 0.14 115.31 121.64 2wfn h LEU 201 Ca 0.14 -0.30 -0.05 0.00 -0.12 0.00 0.00 57.88 57.55 2wfn h LEU 201 Cb 0.31 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.05 2wfn h LEU 201 CO 0.00 0.73 0.28 0.58 -0.62 0.00 0.00 178.44 179.41 2wfn h VAL 202 N 0.40 1.26 0.00 1.05 2.07 -1.12 -1.99 116.25 117.93 2wfn h VAL 202 Ca 0.10 -0.87 -0.13 0.00 0.82 0.00 0.00 66.70 66.62 2wfn h VAL 202 Cb 0.43 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2wfn h VAL 202 CO 0.02 0.35 -0.60 -0.78 0.02 0.00 0.00 177.57 176.57 2wfn h ASP 203 N 1.14 0.00 -0.64 0.57 1.82 -1.31 -2.89 116.42 115.11 2wfn h ASP 203 Ca 0.25 0.00 -0.08 0.00 -0.39 0.00 0.00 57.03 56.81 2wfn h ASP 203 Cb 0.26 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.25 2wfn h ASP 203 CO -0.01 0.60 0.08 -1.28 -1.61 0.00 0.00 179.24 177.02 2wfn h SER 204 N 0.00 1.05 0.38 2.28 0.87 -0.49 -1.05 113.55 116.59 2wfn h SER 204 Ca -0.01 -0.26 -0.15 0.00 -1.23 0.00 0.00 61.79 60.15 2wfn h SER 204 Cb 1.21 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.88 2wfn h SER 204 CO 0.08 1.05 -0.62 0.00 -0.53 0.00 0.00 176.83 176.81 2wfn s ALA 206 N -3.73 -0.95 -0.15 0.00 0.00 -1.10 -4.98 121.76 110.85 2wfn s ALA 206 Ca -0.04 -0.45 -0.30 0.00 0.00 0.00 0.00 51.96 51.17 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 2.13 -2.30 0.00 0.00 0.00 175.76 174.35 2wfn n PRO 207 N 4.60 2.15 0.00 0.00 -0.02 -0.41 -2.62 135.00 138.70 2wfn n PRO 207 Ca 0.08 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2wfn n PRO 207 Cb 0.48 -3.08 0.00 0.00 -0.02 0.00 0.00 33.50 30.88 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 5.41 1.20 0.16 -1.23 0.00 -1.26 -4.83 105.19 104.64 2wfn n GLY 208 Ca 0.28 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.14 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 0.57 -5.97 0.99 3.38 -1.74 -2.78 115.31 109.75 2wfn h LEU 209 Ca 0.00 -0.61 -0.55 0.00 0.09 0.00 0.00 57.88 56.81 2wfn h LEU 209 Cb 0.00 -0.17 -0.40 0.00 0.09 0.00 0.00 40.66 40.18 2wfn h LEU 209 CO 0.00 1.08 -0.97 0.00 0.09 0.00 0.00 178.44 178.64 2wfn h PRO 211 N 3.72 0.00 -0.84 0.00 0.13 -1.82 -3.08 132.00 130.11 2wfn h PRO 211 Ca 0.11 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.79 2wfn h PRO 211 Cb 0.81 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.68 2wfn h PRO 211 CO 0.59 0.40 0.47 -0.40 -0.23 0.00 0.00 178.00 178.82 2wfn n ASP 212 N -3.99 3.78 0.13 1.44 5.75 -1.26 -4.62 116.55 117.78 2wfn n ASP 212 Ca -0.02 -3.68 0.06 0.00 -0.01 0.00 0.00 54.79 51.15 2wfn n ASP 212 Cb 0.44 -0.79 0.52 0.00 -1.03 0.00 0.00 41.12 40.26 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 1.10 0.25 -0.75 2.11 5.08 -1.87 -2.89 115.95 118.98 2wfn h TRP 213 Ca 0.53 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.49 2wfn h TRP 213 Cb 2.39 -0.08 -0.03 0.00 -3.00 0.00 0.00 29.16 28.43 2wfn h TRP 213 CO 1.44 0.18 0.39 0.22 -1.28 0.00 0.00 178.44 179.39 2wfn h ASP 214 N 0.27 0.95 -0.90 0.11 1.82 -1.88 -2.84 116.42 113.94 2wfn h ASP 214 Ca 0.07 -0.11 -0.48 0.00 -0.39 0.00 0.00 57.03 56.12 2wfn h ASP 214 Cb -0.00 -0.24 -0.28 0.00 0.68 0.00 0.00 39.33 39.49 2wfn h ASP 214 CO -0.01 0.79 0.61 -1.54 -1.61 0.00 0.00 179.24 177.47 2wfn n SER 215 N -4.44 3.98 -4.81 2.28 3.41 -1.09 -4.95 113.62 108.00 2wfn n SER 215 Ca 0.07 -3.46 -0.35 0.00 -0.26 0.00 0.00 58.87 54.87 2wfn n SER 215 Cb 0.11 -0.82 -0.07 0.00 -0.26 0.00 0.00 64.21 63.17 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 -3.00 3.50 -0.41 7.33 0.51 -1.08 -5.00 118.94 120.78 2wfn s TRP 216 Ca 0.52 1.58 -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 0.09 0.09 1.47 0.34 -0.51 0.00 0.00 176.95 178.43 2wfn s ASP 217 N -1.93 6.26 0.41 2.95 3.68 -1.26 -4.88 116.67 121.90 2wfn s ASP 217 Ca 0.54 0.86 0.29 0.00 2.13 0.00 0.00 52.55 56.37 2wfn s ASP 217 Cb -0.14 -2.54 1.39 0.00 -1.45 0.00 0.00 42.92 40.19 2wfn s ASP 217 CO 0.18 -1.49 1.88 0.00 0.13 0.00 0.00 175.17 175.87 2wfn h ALA 218 N 11.04 1.00 -0.22 3.66 0.00 -1.95 -1.55 119.26 131.25 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 1.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2wfn h ALA 218 CO 1.08 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 179.20 2wfn n SER 219 N -2.57 1.62 -3.48 0.00 3.41 -1.26 -4.27 113.62 107.07 2wfn n SER 219 Ca -0.00 -1.80 -0.27 0.00 -0.26 0.00 0.00 58.87 56.54 2wfn n SER 219 Cb 0.15 -0.14 -0.09 0.00 -0.26 0.00 0.00 64.21 63.88 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 0.32 2.30 -0.08 4.33 5.02 -0.58 -4.98 118.16 124.49 2wfn n LYS 220 Ca 0.14 -4.55 -0.12 0.00 -2.02 0.00 0.00 58.31 51.76 2wfn n LYS 220 Cb 0.30 -2.20 -0.05 0.00 -0.02 0.00 0.00 35.03 33.06 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 0.45 -0.43 1.97 0.13 -1.74 -2.60 132.00 134.15 2wfn h PRO 221 Ca 0.19 -0.17 -0.11 0.00 -0.87 0.00 0.00 66.00 65.04 2wfn h PRO 221 Cb 0.69 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.78 2wfn h PRO 221 CO 0.79 0.68 -0.17 0.28 -0.23 0.00 0.00 178.00 179.35 2wfn h VAL 222 N 0.18 1.27 -0.38 1.56 2.07 -1.86 -1.34 116.25 117.75 2wfn h VAL 222 Ca 0.06 -1.27 -0.03 0.00 0.82 0.00 0.00 66.70 66.28 2wfn h VAL 222 Cb 0.51 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 2wfn h VAL 222 CO 0.02 0.43 0.12 0.74 0.02 0.00 0.00 177.57 178.90 2wfn h THR 223 N 0.73 1.22 -0.21 2.57 2.02 -1.94 -0.84 112.91 116.45 2wfn h THR 223 Ca 0.11 -0.71 -0.02 0.00 0.77 0.00 0.00 66.41 66.56 2wfn h THR 223 Cb 0.68 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 2wfn h THR 223 CO 0.05 0.25 0.04 0.78 0.37 0.00 0.00 175.52 177.01 2wfn h ASN 224 N 0.47 0.32 -0.56 4.18 2.35 -1.33 -2.57 115.58 118.44 2wfn h ASN 224 Ca 0.12 -0.24 -0.02 0.00 -0.55 0.00 0.00 56.30 55.61 2wfn h ASN 224 Cb 0.26 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.52 2wfn h ASN 224 CO -0.00 0.48 0.26 0.00 -1.65 0.00 0.00 177.43 176.51 2wfn h ALA 225 N 0.85 0.72 -0.86 -0.83 0.00 -1.21 -2.17 119.26 115.77 2wfn h ALA 225 Ca 0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2wfn h ALA 225 Cb 0.29 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2wfn h ALA 225 CO 0.00 0.30 0.42 -0.09 0.00 0.00 0.00 179.25 179.88 2wfn h ARG 226 N 0.76 1.23 -0.20 0.00 2.43 -1.15 -1.18 114.38 116.27 2wfn h ARG 226 Ca 0.19 -0.18 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 2wfn h ARG 226 Cb 0.14 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2wfn h ARG 226 CO -0.02 0.94 0.00 1.49 -1.51 0.00 0.00 179.97 180.87 2wfn h GLU 227 N 1.22 0.34 -0.36 0.20 4.57 -1.27 -0.78 114.58 118.50 2wfn h GLU 227 Ca 0.29 -0.11 -0.03 0.00 -1.18 0.00 0.00 59.36 58.34 2wfn h GLU 227 Cb 0.11 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 2wfn h GLU 227 CO -0.04 0.54 0.10 0.00 -1.18 0.00 0.00 179.01 178.43 2wfn h ALA 228 N 0.79 0.47 0.00 2.92 0.00 -1.27 -2.56 119.26 119.61 2wfn h ALA 228 Ca 0.06 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 2wfn h ALA 228 Cb 0.38 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2wfn h ALA 228 CO 0.01 0.12 -0.25 0.52 0.00 0.00 0.00 179.25 179.65 2wfn h MET 229 N 0.42 0.00 -0.05 0.00 2.86 -1.23 -1.97 114.93 114.95 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 0.27 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 2wfn h MET 229 CO -0.00 0.25 -0.02 0.37 1.06 0.00 0.00 176.91 178.57 2wfn h GLN 230 N 0.00 0.10 -0.45 1.72 5.75 -1.00 -1.87 115.11 119.36 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 0.88 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.41 2wfn h GLN 230 CO 0.03 0.47 -0.02 1.96 -2.65 0.00 0.00 178.83 178.62 2wfn h GLN 231 N -0.27 0.75 -0.22 1.69 1.08 -1.39 -0.81 115.11 115.95 2wfn h GLN 231 Ca 0.01 -0.20 -0.09 0.00 -1.45 0.00 0.00 58.65 56.92 2wfn h GLN 231 Cb 0.43 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.76 2wfn h GLN 231 CO 0.01 0.77 -0.27 0.00 -0.95 0.00 0.00 178.83 178.39 2wfn h ALA 232 N 1.28 1.14 0.09 3.87 0.00 -1.36 -1.44 119.26 122.84 2wfn h ALA 232 Ca 0.14 -0.34 -0.19 0.00 0.00 0.00 0.00 54.91 54.51 2wfn h ALA 232 Cb 0.45 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.15 2wfn h ALA 232 CO 0.02 0.54 -0.79 0.22 0.00 0.00 0.00 179.25 179.24 2wfn h ASP 233 N 0.37 0.54 -0.19 0.00 3.58 -1.02 -0.41 116.42 119.28 2wfn h ASP 233 Ca 0.05 -0.87 -0.21 0.00 0.42 0.00 0.00 57.03 56.43 2wfn h ASP 233 Cb 0.66 -0.17 0.01 0.00 1.72 0.00 0.00 39.33 41.55 2wfn h ASP 233 CO 0.05 1.36 -0.67 0.44 -2.88 0.00 0.00 179.24 177.53 2wfn h ASP 234 N -0.20 0.94 0.00 2.28 3.32 -1.14 -3.15 116.42 118.47 2wfn h ASP 234 Ca -0.12 -0.56 0.00 0.00 0.02 0.00 0.00 57.03 56.36 2wfn h ASP 234 Cb 1.56 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.83 2wfn h ASP 234 CO 0.15 1.36 0.00 0.79 -1.72 0.00 0.00 179.24 179.82 2wfn n TRP 235 N -3.96 0.00 0.00 4.55 7.02 -0.55 -4.63 117.44 119.87 2wfn n TRP 235 Ca -0.06 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.42 2wfn n TRP 235 Cb 0.69 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.58 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 -1.11 -0.99 4.77 -1.02 -0.78 117.00 117.64 2wfn n LEU 236 Ca 0.00 -0.38 -0.09 0.00 -0.03 0.00 0.00 56.01 55.51 2wfn n LEU 236 Cb 0.02 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2wfn n LEU 236 CO 0.00 0.00 -0.08 0.61 -1.33 0.00 0.00 177.39 176.59 2wfn n GLY 237 N 0.90 0.06 3.37 -0.72 0.00 -0.58 -3.32 105.19 104.91 2wfn n GLY 237 Ca 0.00 -0.49 -0.44 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.54 5.18 0.48 -0.61 1.01 -0.27 -4.96 121.20 119.49 2wfn s ILE 238 Ca 0.04 -1.13 -0.22 0.00 0.00 0.00 0.00 60.65 59.34 2wfn s ILE 238 Cb -0.02 -4.12 -0.08 0.00 0.01 0.00 0.00 42.46 38.25 2wfn s ILE 238 CO 0.05 -0.61 1.11 -2.16 0.00 0.00 0.00 174.94 173.32 2wfn s PRO 239 N 1.63 3.74 -1.31 2.79 0.04 -1.26 -3.38 135.00 137.24 2wfn s PRO 239 Ca 0.04 1.59 -0.18 0.00 0.04 0.00 0.00 61.00 62.49 2wfn s PRO 239 Cb -0.25 -2.26 0.06 0.00 0.04 0.00 0.00 34.50 32.09 2wfn s PRO 239 CO 0.06 -0.52 1.82 1.04 0.04 0.00 0.00 177.00 179.43 2wfn n GLN 240 N -0.72 3.06 0.27 4.56 6.02 -1.26 -4.68 117.38 124.62 2wfn n GLN 240 Ca 0.08 -3.14 0.15 0.00 -0.01 0.00 0.00 57.00 54.09 2wfn n GLN 240 Cb 0.50 -3.48 0.69 0.00 1.02 0.00 0.00 30.24 28.97 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 5.38 0.23 -4.54 5.09 -1.51 -1.91 -3.40 116.25 115.59 2wfn h VAL 241 Ca 0.45 -0.62 -0.67 0.00 -1.23 0.00 0.00 66.70 64.64 2wfn h VAL 241 Cb 0.84 1.50 -0.30 0.00 -2.13 0.00 0.00 31.29 31.20 2wfn h VAL 241 CO 1.51 0.07 -0.88 -0.51 -1.23 0.00 0.00 177.57 176.54 2wfn s ILE 242 N -3.79 1.92 0.29 7.19 2.07 -1.26 -4.10 121.20 123.51 2wfn s ILE 242 Ca -0.00 -1.05 -0.07 0.00 -1.41 0.00 0.00 60.65 58.12 2wfn s ILE 242 Cb 0.10 -1.59 -0.06 0.00 0.13 0.00 0.00 42.46 41.04 2wfn s ILE 242 CO 0.56 0.53 0.58 0.42 -1.91 0.00 0.00 174.94 175.12 2wfn s THR 243 N -0.58 4.97 0.29 4.00 -4.23 -1.26 -4.93 115.64 113.90 2wfn s THR 243 Ca 0.09 0.22 0.04 0.00 -1.18 0.00 0.00 61.69 60.85 2wfn s THR 243 Cb -0.09 -3.71 0.30 0.00 1.34 0.00 0.00 72.50 70.33 2wfn s THR 243 CO -0.01 -0.30 1.67 -0.65 -0.54 0.00 0.00 174.62 174.80 2wfn h PRO 244 N 1.79 0.30 0.00 3.99 0.11 -1.93 0.69 132.00 136.96 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 1.19 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2wfn h PRO 244 CO 0.66 0.20 -0.38 0.93 -0.21 0.00 0.00 178.00 179.20 2wfn h GLU 245 N 0.31 0.00 0.18 1.05 3.07 -1.94 -3.13 114.58 114.11 2wfn h GLU 245 Ca 0.56 0.00 -0.28 0.00 -0.50 0.00 0.00 59.36 59.14 2wfn h GLU 245 Cb 1.11 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 29.05 2wfn h GLU 245 CO -0.58 0.38 -1.21 0.93 -1.40 0.00 0.00 179.01 177.14 2wfn h GLU 246 N 0.00 0.51 -0.01 2.33 5.08 -1.28 -3.07 114.58 118.15 2wfn h GLU 246 Ca -0.00 -0.78 -0.10 0.00 -1.00 0.00 0.00 59.36 57.48 2wfn h GLU 246 Cb 0.69 0.28 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 2wfn h GLU 246 CO 0.05 1.36 -0.46 0.97 -1.00 0.00 0.00 179.01 179.93 2wfn h ILE 247 N 0.05 1.33 0.00 3.13 2.10 -1.38 -2.92 117.51 119.83 2wfn h ILE 247 Ca -0.20 -1.60 0.00 0.00 1.08 0.00 0.00 64.86 64.14 2wfn h ILE 247 Cb 1.92 1.85 0.00 0.00 -1.09 0.00 0.00 36.82 39.51 2wfn h ILE 247 CO 0.23 0.46 -0.69 -0.37 -1.08 0.00 0.00 178.15 176.70 2wfn h VAL 248 N 0.02 0.00 -2.09 2.19 -1.51 -1.67 -3.41 116.25 109.77 2wfn h VAL 248 Ca -0.00 -0.50 -0.63 0.00 -1.23 0.00 0.00 66.70 64.34 2wfn h VAL 248 Cb 0.83 1.04 0.07 0.00 -2.13 0.00 0.00 31.29 31.10 2wfn h VAL 248 CO 0.06 0.00 0.54 -0.67 -1.23 0.00 0.00 177.57 176.27 2wfn n ASP 249 N -2.11 2.20 0.18 4.19 2.03 -1.10 -4.84 116.55 117.10 2wfn n ASP 249 Ca 0.03 1.12 0.11 0.00 0.52 0.00 0.00 54.79 56.57 2wfn n ASP 249 Cb 0.44 -1.31 0.60 0.00 -0.72 0.00 0.00 41.12 40.13 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 4.62 0.00 -0.14 -0.67 0.11 -1.92 -2.63 132.00 131.38 2wfn h PRO 250 Ca -0.45 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 32.38 2wfn h PRO 250 CO 0.79 0.00 -0.25 0.09 -0.21 0.00 0.00 178.00 178.42 2wfn n ASN 251 N -2.30 2.21 -4.76 -2.05 3.02 -1.26 -5.05 115.26 105.07 2wfn n ASN 251 Ca -0.01 -3.68 -0.41 0.00 -0.03 0.00 0.00 54.58 50.45 2wfn n ASN 251 Cb 0.11 -0.55 -0.02 0.00 -0.61 0.00 0.00 39.78 38.71 2wfn n ASN 251 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2wfn s VAL 252 N -3.16 2.74 0.38 2.41 -7.23 -0.99 -4.87 120.40 109.68 2wfn s VAL 252 Ca 0.40 0.71 -0.18 0.00 -1.81 0.00 0.00 61.98 61.10 2wfn s VAL 252 Cb 0.37 -3.45 -0.10 0.00 0.56 0.00 0.00 36.38 33.75 2wfn s VAL 252 CO -0.02 0.16 0.85 1.51 -0.31 0.00 0.00 175.10 177.29 2wfn s ASP 253 N -0.27 6.85 0.46 4.85 -4.77 -1.26 -4.92 116.67 117.61 2wfn s ASP 253 Ca 0.51 1.50 0.14 0.00 -3.30 0.00 0.00 52.55 51.40 2wfn s ASP 253 Cb -0.40 -2.46 1.06 0.00 -1.09 0.00 0.00 42.92 40.03 2wfn s ASP 253 CO 0.50 -0.30 2.04 -0.33 0.70 0.00 0.00 175.17 177.78 2wfn h GLU 254 N 2.02 0.04 -0.52 2.11 5.08 -1.96 -3.05 114.58 118.30 2wfn h GLU 254 Ca -0.48 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 57.77 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 0.63 0.15 -0.07 0.45 -1.00 0.00 0.00 179.01 179.17 2wfn h HIS 255 N 0.04 1.02 -0.30 4.33 3.86 -1.94 -0.87 115.15 121.30 2wfn h HIS 255 Ca 0.01 -0.19 -0.05 0.00 -1.16 0.00 0.00 60.37 58.98 2wfn h HIS 255 Cb 0.21 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 2wfn h HIS 255 CO 0.00 0.95 -0.00 0.77 0.86 0.00 0.00 177.93 180.51 2wfn h SER 256 N 0.84 0.53 -0.59 2.45 0.02 -1.91 -2.17 113.55 112.72 2wfn h SER 256 Ca 0.14 -0.31 -0.09 0.00 -0.84 0.00 0.00 61.79 60.70 2wfn h SER 256 Cb 0.60 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 2wfn h SER 256 CO 0.04 0.71 0.04 0.58 -1.14 0.00 0.00 176.83 177.06 2wfn h VAL 257 N 0.33 1.26 -0.87 2.27 2.07 -1.55 -2.79 116.25 116.97 2wfn h VAL 257 Ca 0.09 -1.09 0.04 0.00 0.82 0.00 0.00 66.70 66.55 2wfn h VAL 257 Cb 0.44 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 30.96 2wfn h VAL 257 CO 0.02 0.40 0.56 0.24 0.02 0.00 0.00 177.57 178.81 2wfn h MET 258 N 0.92 1.06 -0.54 1.57 2.86 -1.12 -1.22 114.93 118.46 2wfn h MET 258 Ca 0.17 -0.06 0.04 0.00 -2.06 0.00 0.00 59.70 57.78 2wfn h MET 258 Cb 0.51 -0.24 -0.04 0.00 0.06 0.00 0.00 31.60 31.89 2wfn h MET 258 CO 0.02 0.70 0.30 1.15 1.06 0.00 0.00 176.91 180.14 2wfn h THR 259 N 1.09 1.01 -0.10 2.22 2.02 -1.14 -1.87 112.91 116.13 2wfn h THR 259 Ca 0.35 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 67.31 2wfn h THR 259 Cb 0.02 0.37 -0.00 0.00 -1.74 0.00 0.00 68.15 66.79 2wfn h THR 259 CO -0.12 0.11 -0.03 0.22 0.37 0.00 0.00 175.52 176.07 2wfn h TYR 260 N 0.59 0.22 0.00 3.16 3.20 -1.20 -3.28 116.97 119.66 2wfn h TYR 260 Ca 0.23 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 2wfn h TYR 260 Cb 0.08 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.30 2wfn h TYR 260 CO -0.08 0.52 -0.11 -0.07 -1.64 0.00 0.00 178.16 176.78 2wfn h LEU 261 N -0.14 0.00 -0.05 2.82 3.38 -1.14 -2.88 115.31 117.31 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 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 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 -3.26 0.03 0.04 -0.43 3.41 -0.71 -1.86 113.62 110.84 2wfn n SER 262 Ca 0.00 0.51 0.12 0.00 -0.26 0.00 0.00 58.87 59.25 2wfn n SER 262 Cb 0.36 -0.52 0.28 0.00 -0.26 0.00 0.00 64.21 64.08 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 -1.54 0.16 0.03 4.33 6.02 -1.09 -4.29 117.38 121.02 2wfn n GLN 263 Ca 0.02 0.06 -0.15 0.00 -0.01 0.00 0.00 57.00 56.91 2wfn n GLN 263 Cb 0.08 -1.62 -0.05 0.00 1.02 0.00 0.00 30.24 29.68 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 -1.58 -3.24 116.94 113.03 2wfn h PHE 264 Ca 0.00 -0.41 -0.00 0.00 2.81 0.00 0.00 57.97 60.36 2wfn h PHE 264 Cb 0.64 -0.11 -0.00 0.00 3.61 0.00 0.00 35.95 40.09 2wfn h PHE 264 CO 0.00 1.23 -0.02 -1.35 -1.61 0.00 0.00 178.31 176.56 2wfn h PRO 265 N 0.37 0.00 -0.23 1.51 0.11 -1.77 -2.87 132.00 129.12 2wfn h PRO 265 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2wfn h PRO 265 Cb 1.50 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.61 2wfn h PRO 265 CO 0.17 0.02 0.00 0.36 -0.21 0.00 0.00 178.00 178.34 2wfn n LYS 266 N -3.64 2.77 -2.28 1.05 0.00 -1.24 -5.04 118.16 109.77 2wfn n LYS 266 Ca -0.03 -2.19 -0.36 0.00 -0.00 0.00 0.00 58.31 55.74 2wfn n LYS 266 Cb 0.11 -1.38 -0.00 0.00 -0.00 0.00 0.00 35.03 33.76 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 -1.61 2.80 -0.08 0.58 0.00 -1.09 -5.06 121.76 117.31 2wfn s ALA 267 Ca 0.24 0.84 0.03 0.00 0.00 0.00 0.00 51.96 53.08 2wfn s ALA 267 Cb 0.17 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.93 2wfn s ALA 267 CO 0.10 -0.69 -0.19 0.15 0.00 0.00 0.00 175.76 175.13 2wfn s LYS 268 N -3.07 2.39 0.05 0.00 -0.14 -1.21 -5.10 119.74 112.65 2wfn s LYS 268 Ca 0.69 -0.68 -0.31 0.00 -1.36 0.00 0.00 55.97 54.32 2wfn s LYS 268 Cb -0.25 -1.88 -0.06 0.00 -1.68 0.00 0.00 37.83 33.96 2wfn s LYS 268 CO 0.29 0.14 1.35 -1.17 -0.76 0.00 0.00 175.35 175.20 2wfn s LEU 269 N 0.40 4.34 0.38 3.17 2.96 -1.26 -4.24 118.68 124.44 2wfn s LEU 269 Ca -0.15 2.16 -0.21 0.00 -0.22 0.00 0.00 54.13 55.71 2wfn s LEU 269 Cb -0.16 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 42.85 2wfn s LEU 269 CO 0.06 -0.65 0.91 -0.54 -1.32 0.00 0.00 176.35 174.82 2wfn s LYS 270 N 1.70 4.29 0.23 1.98 1.02 0.04 -5.00 119.74 124.00 2wfn s LYS 270 Ca 0.63 1.11 -0.06 0.00 0.02 0.00 0.00 55.97 57.67 2wfn s LYS 270 Cb -0.33 -2.40 0.38 0.00 -0.52 0.00 0.00 37.83 34.96 2wfn s LYS 270 CO 0.28 0.09 1.77 -1.35 -0.92 0.00 0.00 175.35 175.22 2wfn h PRO 271 N 2.34 0.58 -0.64 -1.68 0.11 -1.95 -3.16 132.00 127.60 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 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2wfn h PRO 271 CO 0.63 0.39 0.00 0.41 -0.21 0.00 0.00 178.00 179.21 2wfn n GLY 272 N -1.31 1.65 3.75 -0.55 0.00 -1.26 -4.98 105.19 102.49 2wfn n GLY 272 Ca 0.12 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.73 3.64 -0.85 4.61 0.00 -1.20 -4.95 121.76 121.29 2wfn s ALA 273 Ca 0.25 1.37 -0.22 0.00 0.00 0.00 0.00 51.96 53.36 2wfn s ALA 273 Cb 0.17 -3.57 0.07 0.00 0.00 0.00 0.00 23.12 19.80 2wfn s ALA 273 CO 0.11 -0.79 1.20 -1.25 0.00 0.00 0.00 175.76 175.03 2wfn s PRO 274 N -0.54 3.39 -0.36 0.00 0.04 -1.26 -4.99 135.00 131.27 2wfn s PRO 274 Ca 0.59 -1.07 -0.15 0.00 0.04 0.00 0.00 61.00 60.41 2wfn s PRO 274 Cb -0.43 -4.72 -0.00 0.00 0.04 0.00 0.00 34.50 29.39 2wfn s PRO 274 CO 0.45 -1.97 0.34 -0.51 0.04 0.00 0.00 177.00 175.35 2wfn s LEU 275 N 4.22 4.62 0.17 -3.56 1.43 -1.26 -4.55 118.68 119.75 2wfn s LEU 275 Ca 0.34 -0.44 0.10 0.00 -1.03 0.00 0.00 54.13 53.10 2wfn s LEU 275 Cb -0.07 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.82 2wfn s LEU 275 CO 0.00 -0.38 -0.18 0.00 0.23 0.00 0.00 176.35 176.03 2wfn s ARG 276 N 1.93 1.76 0.01 1.70 1.70 -1.05 -4.97 118.95 120.04 2wfn s ARG 276 Ca 0.10 -1.36 0.18 0.00 -0.47 0.00 0.00 55.73 54.17 2wfn s ARG 276 Cb -0.17 -2.01 -0.18 0.00 -0.57 0.00 0.00 34.95 32.02 2wfn s ARG 276 CO 0.12 0.43 0.66 -0.35 -1.08 0.00 0.00 175.30 175.07 2wfn n PRO 277 N 0.30 0.64 -0.26 3.89 -0.04 -1.26 -4.35 135.00 133.91 2wfn n PRO 277 Ca -0.13 0.12 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