#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wp0 s LYS 2 N 0.00 2.05 0.33 0.03 2.20 -1.26 -5.11 119.74 117.99 2wp0 s LYS 2 Ca 0.00 -1.03 -0.29 0.00 -0.36 0.00 0.00 55.97 54.29 2wp0 s LYS 2 Cb 0.00 -2.24 -0.11 0.00 -1.51 0.00 0.00 37.83 33.98 2wp0 s LYS 2 CO 0.00 0.52 1.40 1.21 -0.36 0.00 0.00 175.35 178.12 2wp0 s ASN 3 N -1.90 6.59 0.26 1.43 2.47 -1.26 -4.84 114.94 117.69 2wp0 s ASN 3 Ca 0.18 2.82 -0.03 0.00 0.42 0.00 0.00 52.86 56.25 2wp0 s ASN 3 Cb -0.11 -2.65 0.39 0.00 -1.45 0.00 0.00 41.25 37.43 2wp0 s ASN 3 CO 0.10 -0.70 1.86 0.15 -3.72 0.00 0.00 177.10 174.79 2wp0 h PHE 4 N 3.62 1.09 -0.11 0.43 3.57 -1.99 0.47 116.94 124.03 2wp0 h PHE 4 Ca -0.49 0.03 -0.18 0.00 3.53 0.00 0.00 57.97 60.86 2wp0 h PHE 4 Cb 1.23 -0.35 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 2wp0 h PHE 4 CO 0.56 0.54 -0.69 1.88 -2.23 0.00 0.00 178.31 178.37 2wp0 h TYR 5 N 1.06 0.62 -0.19 0.41 -1.99 -1.99 0.59 116.97 115.48 2wp0 h TYR 5 Ca 0.41 -0.26 -0.21 0.00 2.00 0.00 0.00 58.73 60.68 2wp0 h TYR 5 Cb 0.21 -0.10 0.01 0.00 2.00 0.00 0.00 36.73 38.85 2wp0 h TYR 5 CO -0.02 1.02 -0.69 -0.44 -0.00 0.00 0.00 178.16 178.03 2wp0 h ASP 6 N 0.33 0.93 0.44 3.88 3.32 -1.91 -3.04 116.42 120.37 2wp0 h ASP 6 Ca -0.02 -0.60 -0.01 0.00 0.02 0.00 0.00 57.03 56.41 2wp0 h ASP 6 Cb 1.26 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.51 2wp0 h ASP 6 CO 0.12 1.38 -0.51 -0.25 -1.72 0.00 0.00 179.24 178.26 2wp0 h TRP 7 N 0.54 -1.43 -0.95 4.55 7.01 0.51 -2.18 115.95 123.99 2wp0 h TRP 7 Ca -0.03 0.02 0.13 0.00 2.11 0.00 0.00 58.89 61.12 2wp0 h TRP 7 Cb 1.32 0.57 -0.09 0.00 -2.10 0.00 0.00 29.16 28.85 2wp0 h TRP 7 CO 0.09 -0.66 0.57 0.97 -2.79 0.00 0.00 178.44 176.61 2wp0 h ILE 8 N -0.97 0.85 0.38 2.65 2.10 0.07 -0.40 117.51 122.18 2wp0 h ILE 8 Ca -0.05 -0.29 -0.01 0.00 1.08 0.00 0.00 64.86 65.58 2wp0 h ILE 8 Cb 0.86 -0.09 -0.03 0.00 -1.09 0.00 0.00 36.82 36.48 2wp0 h ILE 8 CO -0.10 0.16 -0.48 0.11 -1.08 0.00 0.00 178.15 176.75 2wp0 h LYS 9 N 0.86 -0.86 -0.36 2.19 1.57 -1.38 0.11 116.57 118.70 2wp0 h LYS 9 Ca 0.49 0.06 0.08 0.00 -1.87 0.00 0.00 60.65 59.41 2wp0 h LYS 9 Cb 0.57 0.19 -0.09 0.00 0.08 0.00 0.00 32.23 32.99 2wp0 h LYS 9 CO -0.30 -0.57 -0.27 0.93 -0.57 0.00 0.00 179.45 178.67 2wp0 h GLU 10 N -0.89 -0.21 -0.65 3.15 5.08 -0.73 -2.23 114.58 118.11 2wp0 h GLU 10 Ca -0.05 0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.43 2wp0 h GLU 10 Cb 0.80 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 30.02 2wp0 h GLU 10 CO -0.12 -0.14 0.24 0.35 -1.00 0.00 0.00 179.01 178.35 2wp0 h PHE 11 N -0.22 0.42 -0.96 4.33 3.57 -0.85 -1.13 116.94 122.11 2wp0 h PHE 11 Ca 0.17 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.77 2wp0 h PHE 11 Cb 0.50 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.08 2wp0 h PHE 11 CO -0.48 0.09 0.62 0.82 -2.23 0.00 0.00 178.31 177.13 2wp0 h ILE 12 N 0.42 1.06 -0.11 1.41 1.08 -0.17 -1.86 117.51 119.33 2wp0 h ILE 12 Ca 0.33 -0.37 -0.05 0.00 -0.39 0.00 0.00 64.86 64.38 2wp0 h ILE 12 Cb 0.44 -0.12 -0.00 0.00 -3.07 0.00 0.00 36.82 34.07 2wp0 h ILE 12 CO -0.33 0.20 -0.14 -0.09 -0.69 0.00 0.00 178.15 177.10 2wp0 h ARG 13 N 1.09 0.29 -0.76 2.37 2.43 -0.97 -2.63 114.38 116.20 2wp0 h ARG 13 Ca 0.42 -0.16 0.03 0.00 -0.81 0.00 0.00 59.98 59.46 2wp0 h ARG 13 Cb 0.22 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.73 2wp0 h ARG 13 CO -0.17 0.72 0.48 -0.44 -1.51 0.00 0.00 179.97 179.06 2wp0 h ASP 14 N -0.12 0.79 0.19 -3.80 5.19 -1.36 -0.35 116.42 116.96 2wp0 h ASP 14 Ca 0.01 -0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.43 2wp0 h ASP 14 Cb 0.68 -0.17 -0.03 0.00 0.18 0.00 0.00 39.33 39.99 2wp0 h ASP 14 CO 0.03 0.54 -0.30 -0.61 -3.12 0.00 0.00 179.24 175.79 2wp0 h GLN 15 N 0.94 -0.54 -0.54 3.56 4.15 -1.29 0.31 115.11 121.70 2wp0 h GLN 15 Ca 0.31 0.04 -0.06 0.00 0.77 0.00 0.00 58.65 59.70 2wp0 h GLN 15 Cb 0.02 0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 2wp0 h GLN 15 CO -0.11 -0.36 0.10 0.78 -1.93 0.00 0.00 178.83 177.31 2wp0 h GLY 16 N -0.56 0.95 1.00 2.39 0.00 -1.29 -2.10 103.07 103.45 2wp0 h GLY 16 Ca 0.01 -0.62 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 2wp0 h GLY 16 CO -0.13 0.57 -0.19 0.83 0.00 0.00 0.00 176.54 177.62 2wp0 h GLU 17 N 0.77 -0.51 -1.01 4.80 5.08 -0.77 -1.19 114.58 121.75 2wp0 h GLU 17 Ca 0.17 0.03 0.20 0.00 -1.00 0.00 0.00 59.36 58.76 2wp0 h GLU 17 Cb 0.38 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 29.64 2wp0 h GLU 17 CO 0.01 -0.33 0.61 0.35 -1.00 0.00 0.00 179.01 178.64 2wp0 h PHE 18 N -0.54 1.07 0.16 4.33 3.57 -0.30 0.47 116.94 125.70 2wp0 h PHE 18 Ca -0.05 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 2wp0 h PHE 18 Cb 0.41 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 38.83 2wp0 h PHE 18 CO -0.05 0.22 -0.08 0.82 -2.23 0.00 0.00 178.31 177.00 2wp0 h ILE 19 N 0.75 0.89 -0.55 1.41 2.04 -1.03 -1.63 117.51 119.38 2wp0 h ILE 19 Ca 0.59 -0.21 0.03 0.00 1.00 0.00 0.00 64.86 66.27 2wp0 h ILE 19 Cb 0.93 1.02 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 2wp0 h ILE 19 CO -0.39 0.05 0.32 0.00 0.00 0.00 0.00 178.15 178.13 2wp0 h ALA 20 N 0.52 0.72 -0.82 1.87 0.00 0.06 -1.14 119.26 120.45 2wp0 h ALA 20 Ca -0.02 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.99 2wp0 h ALA 20 Cb 0.24 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 17.81 2wp0 h ALA 20 CO 0.04 0.03 0.45 0.37 0.00 0.00 0.00 179.25 180.13 2wp0 h GLN 21 N 0.63 0.71 -0.01 0.00 4.15 0.09 -1.34 115.11 119.34 2wp0 h GLN 21 Ca 0.23 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.61 2wp0 h GLN 21 Cb 0.06 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.59 2wp0 h GLN 21 CO -0.11 0.47 -0.22 1.04 -1.93 0.00 0.00 178.83 178.08 2wp0 n GLN 22 N -4.79 0.96 -0.45 1.69 1.13 -0.63 -4.44 117.38 110.86 2wp0 n GLN 22 Ca 0.14 -0.56 0.39 0.00 -1.94 0.00 0.00 57.00 55.03 2wp0 n GLN 22 Cb 0.32 -1.49 0.72 0.00 0.11 0.00 0.00 30.24 29.90 2wp0 n GLN 22 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2wp0 h SER 23 N 1.38 0.11 0.82 1.08 4.64 -0.02 0.14 113.55 121.71 2wp0 h SER 23 Ca 0.00 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2wp0 h SER 23 Cb 0.51 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2wp0 h SER 23 CO 0.00 -0.03 -0.34 0.61 -0.87 0.00 0.00 176.83 176.20 2wp0 n GLY 24 N -1.72 -1.40 0.25 -0.77 0.00 -1.26 -4.46 105.19 95.84 2wp0 n GLY 24 Ca 0.33 -0.22 0.03 0.00 0.00 0.00 0.00 46.02 46.15 2wp0 n GLY 24 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2wp0 n TRP 25 N -1.72 0.18 -0.15 1.61 4.27 0.50 -0.44 117.44 121.70 2wp0 n TRP 25 Ca 0.05 0.85 -0.11 0.00 -3.89 0.00 0.00 57.50 54.40 2wp0 n TRP 25 Cb 0.37 -0.86 -0.01 0.00 -1.36 0.00 0.00 31.31 29.45 2wp0 n TRP 25 CO 0.00 0.00 0.00 1.25 -2.29 0.00 0.00 177.69 176.65 2wp0 h LEU 26 N 0.00 0.82 -0.67 5.67 5.85 -1.83 -1.94 115.31 123.21 2wp0 h LEU 26 Ca 0.31 -0.36 -0.14 0.00 0.84 0.00 0.00 57.88 58.52 2wp0 h LEU 26 Cb 0.48 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2wp0 h LEU 26 CO -0.70 0.99 -0.62 -0.08 -0.34 0.00 0.00 178.44 177.69 2wp0 h GLU 27 N 0.64 0.18 -2.00 1.25 4.81 -1.11 -2.12 114.58 116.24 2wp0 h GLU 27 Ca 0.11 -0.13 -0.28 0.00 -0.13 0.00 0.00 59.36 58.94 2wp0 h GLU 27 Cb 0.63 0.02 -0.10 0.00 0.63 0.00 0.00 28.75 29.93 2wp0 h GLU 27 CO 0.04 0.74 -0.15 1.28 -0.73 0.00 0.00 179.01 180.19 2wp0 n LEU 28 N -3.85 5.60 0.00 1.64 4.77 0.41 -3.14 117.00 122.44 2wp0 n LEU 28 Ca -0.02 -3.42 0.00 0.00 -0.03 0.00 0.00 56.01 52.54 2wp0 n LEU 28 Cb 0.62 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.36 2wp0 n LEU 28 CO 0.44 1.69 0.00 -1.84 -1.33 0.00 0.00 177.39 176.35 2wp0 n GLU 29 N 2.00 0.00 0.00 3.23 0.28 -1.18 -4.87 120.64 120.10 2wp0 n GLU 29 Ca 0.44 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.44 2wp0 n GLU 29 Cb 0.80 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.67 2wp0 n GLU 29 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2wp0 n ARG 30 N 0.00 0.00 0.00 3.44 1.74 -0.81 -4.82 116.66 116.21 2wp0 n ARG 30 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2wp0 n ARG 30 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2wp0 n ARG 30 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2wp0 n SER 31 N 0.00 0.00 -0.48 0.55 3.41 -1.26 -4.74 113.62 111.10 2wp0 n SER 31 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2wp0 n SER 31 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2wp0 n SER 31 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2wp0 n SER 32 N 0.00 0.61 0.02 4.04 7.64 -1.26 -3.94 113.62 120.73 2wp0 n SER 32 Ca 0.00 -1.27 0.21 0.00 1.01 0.00 0.00 58.87 58.82 2wp0 n SER 32 Cb 0.00 -0.30 0.72 0.00 -1.01 0.00 0.00 64.21 63.61 2wp0 n SER 32 CO 0.00 0.00 0.00 0.10 -3.01 0.00 0.00 175.04 172.13 2wp0 h TYR 33 N 0.35 0.00 -0.22 1.43 -0.00 -1.90 -2.10 116.97 114.53 2wp0 h TYR 33 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.73 58.60 2wp0 h TYR 33 Cb 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.03 2wp0 h TYR 33 CO 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 178.16 177.77 2wp0 h ALA 34 N 1.68 0.34 -0.27 0.10 0.00 -1.93 -2.87 119.26 116.30 2wp0 h ALA 34 Ca 0.24 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 2wp0 h ALA 34 Cb 1.03 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2wp0 h ALA 34 CO -0.00 0.43 -0.29 -0.22 0.00 0.00 0.00 179.25 179.17 2wp0 h LYS 35 N 0.35 0.55 0.20 0.00 3.64 -1.72 0.16 116.57 119.75 2wp0 h LYS 35 Ca 0.01 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 2wp0 h LYS 35 Cb 0.98 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.77 2wp0 h LYS 35 CO 0.09 0.78 -0.16 -0.07 -2.27 0.00 0.00 179.45 177.82 2wp0 h LEU 36 N 0.48 -0.42 -0.26 5.20 4.07 -1.49 0.30 115.31 123.18 2wp0 h LEU 36 Ca 0.06 0.04 0.05 0.00 0.08 0.00 0.00 57.88 58.11 2wp0 h LEU 36 Cb 0.74 0.14 -0.05 0.00 1.08 0.00 0.00 40.66 42.57 2wp0 h LEU 36 CO 0.06 -0.25 -0.08 0.40 -1.08 0.00 0.00 178.44 177.49 2wp0 h ILE 37 N -0.37 0.71 -0.24 1.22 2.04 -1.30 0.30 117.51 119.86 2wp0 h ILE 37 Ca -0.01 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 2wp0 h ILE 37 Cb 0.34 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 37.07 2wp0 h ILE 37 CO -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 178.15 177.76 2wp0 h ALA 38 N 1.24 -0.65 -0.29 1.87 0.00 -0.22 0.54 119.26 121.76 2wp0 h ALA 38 Ca 0.13 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2wp0 h ALA 38 Cb 0.22 0.97 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2wp0 h ALA 38 CO -0.28 -0.82 0.13 1.96 0.00 0.00 0.00 179.25 180.24 2wp0 h GLN 39 N -0.29 0.27 -0.67 0.00 4.20 0.04 0.13 115.11 118.79 2wp0 h GLN 39 Ca 0.04 -0.02 0.08 0.00 0.06 0.00 0.00 58.65 58.82 2wp0 h GLN 39 Cb 0.41 -0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.07 2wp0 h GLN 39 CO -0.38 0.18 0.34 1.15 -0.67 0.00 0.00 178.83 179.44 2wp0 h THR 40 N 0.28 0.88 0.46 -0.54 2.02 -0.17 0.33 112.91 116.18 2wp0 h THR 40 Ca 0.12 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 2wp0 h THR 40 Cb 0.05 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 2wp0 h THR 40 CO -0.09 0.11 -0.22 0.40 0.37 0.00 0.00 175.52 176.09 2wp0 h ILE 41 N 0.59 0.55 -0.69 3.11 2.04 1.00 0.16 117.51 124.27 2wp0 h ILE 41 Ca 0.32 -0.03 0.15 0.00 1.00 0.00 0.00 64.86 66.30 2wp0 h ILE 41 Cb 0.30 0.57 -0.11 0.00 -0.74 0.00 0.00 36.82 36.83 2wp0 h ILE 41 CO -0.24 0.01 0.05 0.28 0.00 0.00 0.00 178.15 178.25 2wp0 h SER 42 N -0.63 -0.22 -0.00 1.72 0.02 -0.25 0.18 113.55 114.37 2wp0 h SER 42 Ca -0.06 0.17 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2wp0 h SER 42 Cb 0.48 0.28 -0.04 0.00 0.14 0.00 0.00 62.40 63.26 2wp0 h SER 42 CO 0.10 -0.12 -0.34 -0.74 -1.14 0.00 0.00 176.83 174.59 2wp0 h HIS 43 N 0.15 -1.01 -0.61 3.45 -0.00 0.18 -0.96 115.15 116.35 2wp0 h HIS 43 Ca 0.38 0.03 0.10 0.00 -0.00 0.00 0.00 60.37 60.88 2wp0 h HIS 43 Cb 0.64 0.44 -0.07 0.00 -0.00 0.00 0.00 27.41 28.42 2wp0 h HIS 43 CO -0.36 -0.37 0.21 0.28 -0.00 0.00 0.00 177.93 177.70 2wp0 h VAL 44 N -0.43 0.75 0.00 5.26 2.07 -0.14 -1.53 116.25 122.23 2wp0 h VAL 44 Ca 0.01 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2wp0 h VAL 44 Cb 0.46 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2wp0 h VAL 44 CO -0.23 0.07 0.00 0.18 0.02 0.00 0.00 177.57 177.61 2wp0 n LEU 45 N -5.02 0.67 -0.63 2.57 4.32 0.56 -1.11 117.00 118.36 2wp0 n LEU 45 Ca 0.09 0.70 0.12 0.00 -0.02 0.00 0.00 56.01 56.89 2wp0 n LEU 45 Cb 0.28 -0.65 0.37 0.00 -1.62 0.00 0.00 43.42 41.80 2wp0 n LEU 45 CO 0.21 -0.69 0.78 0.59 -1.22 0.00 0.00 177.39 177.06 2wp0 n ASN 46 N -2.28 1.92 0.00 -1.43 3.02 -0.39 -4.92 115.26 111.19 2wp0 n ASN 46 Ca 0.01 -1.71 0.00 0.00 -0.03 0.00 0.00 54.58 52.85 2wp0 n ASN 46 Cb 0.18 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 2wp0 n ASN 46 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wp0 n GLY 47 N 1.20 0.79 3.27 7.41 0.00 -0.27 -5.07 105.19 112.53 2wp0 n GLY 47 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 2wp0 n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wp0 n GLY 48 N -2.00 -2.51 3.59 -0.02 0.00 -1.08 -4.88 105.19 98.29 2wp0 n GLY 48 Ca 0.00 -0.75 -0.25 0.00 0.00 0.00 0.00 46.02 45.02 2wp0 n GLY 48 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wp0 s SER 49 N -1.80 3.96 -0.28 1.61 1.04 0.29 -4.62 113.70 113.90 2wp0 s SER 49 Ca 0.55 -1.09 0.01 0.00 0.48 0.00 0.00 55.95 55.91 2wp0 s SER 49 Cb -0.11 -0.44 0.08 0.00 0.10 0.00 0.00 66.02 65.64 2wp0 s SER 49 CO 0.66 -0.21 0.01 -0.76 0.98 0.00 0.00 173.24 173.91 2wp0 s LEU 50 N -3.66 3.12 -0.53 2.42 1.43 -0.28 -0.26 118.68 120.92 2wp0 s LEU 50 Ca 0.34 -1.55 -0.20 0.00 -1.03 0.00 0.00 54.13 51.68 2wp0 s LEU 50 Cb 0.01 -1.24 0.06 0.00 0.03 0.00 0.00 46.19 45.04 2wp0 s LEU 50 CO 0.18 -0.31 0.71 -0.76 0.23 0.00 0.00 176.35 176.40 2wp0 s LEU 51 N 1.30 4.79 -0.18 1.79 1.02 0.49 0.45 118.68 128.35 2wp0 s LEU 51 Ca 0.02 -0.84 -0.16 0.00 0.02 0.00 0.00 54.13 53.17 2wp0 s LEU 51 Cb -0.19 -2.51 -0.04 0.00 0.02 0.00 0.00 46.19 43.47 2wp0 s LEU 51 CO -0.11 -1.00 0.40 -0.69 0.02 0.00 0.00 176.35 174.98 2wp0 s VAL 52 N 2.96 5.21 0.19 -1.59 1.01 0.16 -1.50 120.40 126.84 2wp0 s VAL 52 Ca 0.18 0.75 0.05 0.00 0.00 0.00 0.00 61.98 62.96 2wp0 s VAL 52 Cb -0.18 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 2wp0 s VAL 52 CO 0.13 0.28 -0.09 -0.94 0.00 0.00 0.00 175.10 174.49 2wp0 s SER 53 N 0.87 2.04 -0.07 3.32 1.04 -0.76 -0.76 113.70 119.38 2wp0 s SER 53 Ca 0.20 -1.07 -0.18 0.00 0.48 0.00 0.00 55.95 55.39 2wp0 s SER 53 Cb -0.15 -0.04 0.04 0.00 0.10 0.00 0.00 66.02 65.97 2wp0 s SER 53 CO 0.08 -0.33 0.42 0.00 0.98 0.00 0.00 173.24 174.38 2wp0 s ALA 54 N -3.25 -1.06 0.86 5.32 0.00 -1.26 -2.01 121.76 120.36 2wp0 s ALA 54 Ca 0.21 0.81 -0.10 0.00 0.00 0.00 0.00 51.96 52.88 2wp0 s ALA 54 Cb 0.03 -0.21 0.11 0.00 0.00 0.00 0.00 23.12 23.05 2wp0 s ALA 54 CO 0.04 -0.26 1.12 0.16 0.00 0.00 0.00 175.76 176.82 2wp0 s ASP 55 N -0.76 3.53 0.00 0.00 1.47 -0.94 -4.85 116.67 115.11 2wp0 s ASP 55 Ca -0.08 1.97 0.05 0.00 1.18 0.00 0.00 52.55 55.66 2wp0 s ASP 55 Cb -0.04 -2.51 0.27 0.00 -0.34 0.00 0.00 42.92 40.30 2wp0 s ASP 55 CO 0.04 -2.68 0.98 -1.54 0.68 0.00 0.00 175.17 172.65 2wp0 n SER 56 N -3.95 0.00 0.02 2.11 3.41 -1.26 -0.54 113.62 113.42 2wp0 n SER 56 Ca 0.10 0.16 0.11 0.00 -0.26 0.00 0.00 58.87 58.99 2wp0 n SER 56 Cb 0.53 -0.25 -0.04 0.00 -0.26 0.00 0.00 64.21 64.19 2wp0 n SER 56 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2wp0 n SER 57 N -1.25 0.55 -2.22 4.04 7.64 -1.26 -4.42 113.62 116.70 2wp0 n SER 57 Ca 0.03 -0.19 -0.27 0.00 1.01 0.00 0.00 58.87 59.45 2wp0 n SER 57 Cb 0.04 1.03 0.03 0.00 -1.01 0.00 0.00 64.21 64.30 2wp0 n SER 57 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2wp0 n ARG 58 N -2.06 3.39 -0.06 1.43 3.00 0.30 -4.71 116.66 117.96 2wp0 n ARG 58 Ca 0.01 -4.08 -0.14 0.00 -0.01 0.00 0.00 57.85 53.63 2wp0 n ARG 58 Cb 0.47 -2.27 -0.07 0.00 0.00 0.00 0.00 32.46 30.58 2wp0 n ARG 58 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2wp0 h HIS 59 N 2.29 0.62 -1.15 -1.55 3.86 -1.77 -2.84 115.15 114.61 2wp0 h HIS 59 Ca 0.40 -0.22 0.33 0.00 -1.16 0.00 0.00 60.37 59.72 2wp0 h HIS 59 Cb 1.21 -0.12 -0.06 0.00 1.06 0.00 0.00 27.41 29.50 2wp0 h HIS 59 CO 0.95 0.93 0.80 0.11 0.86 0.00 0.00 177.93 181.58 2wp0 h TRP 60 N 0.13 0.18 0.16 2.45 5.08 -1.94 0.14 115.95 122.15 2wp0 h TRP 60 Ca 0.01 0.01 -0.32 0.00 1.08 0.00 0.00 58.89 59.66 2wp0 h TRP 60 Cb 0.88 -0.05 0.00 0.00 -3.00 0.00 0.00 29.16 27.00 2wp0 h TRP 60 CO 0.09 0.01 -1.58 0.35 -1.28 0.00 0.00 178.44 176.04 2wp0 h PHE 61 N 0.10 0.61 -0.10 0.12 3.57 -1.87 -1.26 116.94 118.11 2wp0 h PHE 61 Ca 0.58 -0.44 0.03 0.00 3.53 0.00 0.00 57.97 61.67 2wp0 h PHE 61 Cb 2.07 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 40.75 2wp0 h PHE 61 CO -0.00 1.49 -0.12 1.25 -2.23 0.00 0.00 178.31 178.70 2wp0 h LEU 62 N 0.09 -0.37 -0.29 0.59 6.46 -1.04 0.19 115.31 120.93 2wp0 h LEU 62 Ca -0.27 0.07 0.07 0.00 -0.12 0.00 0.00 57.88 57.63 2wp0 h LEU 62 Cb 2.06 0.18 -0.08 0.00 -0.73 0.00 0.00 40.66 42.09 2wp0 h LEU 62 CO 0.18 -0.16 -0.26 -1.13 -0.62 0.00 0.00 178.44 176.46 2wp0 h ASN 63 N -0.16 -0.83 -0.77 1.25 -0.73 -0.81 -0.25 115.58 113.28 2wp0 h ASN 63 Ca 0.08 0.15 0.13 0.00 1.87 0.00 0.00 56.30 58.53 2wp0 h ASN 63 Cb 0.27 0.40 -0.09 0.00 0.27 0.00 0.00 38.32 39.17 2wp0 h ASN 63 CO -0.19 -0.28 0.36 0.22 -0.37 0.00 0.00 177.43 177.16 2wp0 h TYR 64 N -0.24 0.62 -0.02 0.67 3.20 -0.94 -1.01 116.97 119.25 2wp0 h TYR 64 Ca 0.15 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 2wp0 h TYR 64 Cb 0.48 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 2wp0 h TYR 64 CO -0.43 0.14 0.01 0.82 -1.64 0.00 0.00 178.16 177.06 2wp0 h ILE 65 N 0.54 1.13 -0.63 1.81 2.04 0.38 -1.52 117.51 121.26 2wp0 h ILE 65 Ca 0.41 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.89 2wp0 h ILE 65 Cb 0.57 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 2wp0 h ILE 65 CO -0.36 0.10 0.40 -0.07 0.00 0.00 0.00 178.15 178.23 2wp0 h LEU 66 N -0.12 0.74 0.00 1.44 4.07 -0.30 -1.62 115.31 119.52 2wp0 h LEU 66 Ca 0.01 -0.04 -0.02 0.00 0.08 0.00 0.00 57.88 57.91 2wp0 h LEU 66 Cb 0.16 -0.19 -0.00 0.00 1.08 0.00 0.00 40.66 41.71 2wp0 h LEU 66 CO -0.00 0.56 -0.23 0.77 -1.08 0.00 0.00 178.44 178.46 2wp0 h SER 67 N 0.86 0.00 0.55 -0.43 4.64 -1.21 -2.75 113.55 115.21 2wp0 h SER 67 Ca 0.23 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.26 2wp0 h SER 67 Cb -0.06 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.00 2wp0 h SER 67 CO -0.05 0.08 -1.52 0.78 -0.87 0.00 0.00 176.83 175.25 2wp0 h ASN 68 N 0.00 0.18 -0.32 4.97 2.35 -0.94 -2.65 115.58 119.17 2wp0 h ASN 68 Ca -0.00 -0.28 -0.12 0.00 -0.55 0.00 0.00 56.30 55.35 2wp0 h ASN 68 Cb 1.06 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.37 2wp0 h ASN 68 CO 0.01 1.24 -0.27 -0.07 -1.65 0.00 0.00 177.43 176.69 2wp0 h LEU 69 N 0.03 0.78 -6.92 1.61 3.38 -1.40 -3.38 115.31 109.42 2wp0 h LEU 69 Ca -0.22 -0.45 -0.61 0.00 0.09 0.00 0.00 57.88 56.68 2wp0 h LEU 69 Cb 1.97 -0.22 -0.41 0.00 0.09 0.00 0.00 40.66 42.09 2wp0 h LEU 69 CO 0.12 1.07 -0.68 0.20 0.09 0.00 0.00 178.44 179.24 2wp0 s ASN 70 N -6.56 3.90 0.73 -0.43 0.01 -1.04 -4.70 114.94 106.86 2wp0 s ASN 70 Ca -0.12 -3.54 -0.12 0.00 -0.71 0.00 0.00 52.86 48.36 2wp0 s ASN 70 Cb 0.09 -1.30 0.04 0.00 0.41 0.00 0.00 41.25 40.48 2wp0 s ASN 70 CO 0.83 -0.12 1.10 -2.16 -1.51 0.00 0.00 177.10 175.24 2wp0 s PRO 71 N -0.91 2.42 0.15 -0.60 0.04 -1.00 -4.58 135.00 130.53 2wp0 s PRO 71 Ca 0.26 1.29 -0.21 0.00 0.04 0.00 0.00 61.00 62.38 2wp0 s PRO 71 Cb -0.05 -1.91 0.04 0.00 0.04 0.00 0.00 34.50 32.63 2wp0 s PRO 71 CO -0.15 -1.53 1.65 0.87 0.04 0.00 0.00 177.00 177.87 2wp0 h LYS 72 N -0.67 -0.15 -4.50 4.56 1.57 -1.98 -3.15 116.57 112.24 2wp0 h LYS 72 Ca -0.45 0.01 -0.73 0.00 -1.87 0.00 0.00 60.65 57.61 2wp0 h LYS 72 Cb 1.24 0.03 -0.21 0.00 0.08 0.00 0.00 32.23 33.37 2wp0 h LYS 72 CO 0.52 -0.10 0.39 0.34 -0.57 0.00 0.00 179.45 180.03 2wp0 s ASP 73 N -5.10 6.58 0.59 0.86 -1.08 -1.26 -4.90 116.67 112.36 2wp0 s ASP 73 Ca -0.14 -2.15 0.28 0.00 -0.52 0.00 0.00 52.55 50.02 2wp0 s ASP 73 Cb 0.13 -2.31 1.63 0.00 -1.46 0.00 0.00 42.92 40.91 2wp0 s ASP 73 CO 0.69 -0.89 2.09 -0.07 0.52 0.00 0.00 175.17 177.51 2wp0 h LEU 74 N 9.32 0.00 0.00 -1.34 3.38 -1.94 -3.47 115.31 121.26 2wp0 h LEU 74 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2wp0 h LEU 74 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2wp0 h LEU 74 CO 0.97 0.00 0.00 0.29 0.09 0.00 0.00 178.44 179.79 2wp0 n LYS 75 N -3.83 0.00 -0.06 1.13 5.02 -1.26 -1.96 118.16 117.19 2wp0 n LYS 75 Ca 0.02 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.35 2wp0 n LYS 75 Cb 0.34 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.43 2wp0 n LYS 75 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2wp0 n GLU 76 N 7.24 1.52 -0.88 1.97 -0.58 -1.26 -5.02 120.64 123.62 2wp0 n GLU 76 Ca 0.00 -1.44 -0.33 0.00 -0.42 0.00 0.00 57.16 54.97 2wp0 n GLU 76 Cb 0.00 -1.17 0.14 0.00 -0.57 0.00 0.00 31.44 29.83 2wp0 n GLU 76 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2wp0 n ARG 77 N 0.34 -0.16 -0.93 3.49 1.74 -0.83 -5.01 116.66 115.29 2wp0 n ARG 77 Ca 0.07 0.02 -0.30 0.00 -0.77 0.00 0.00 57.85 56.87 2wp0 n ARG 77 Cb 0.29 -2.22 0.17 0.00 -1.02 0.00 0.00 32.46 29.68 2wp0 n ARG 77 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2wp0 s PRO 78 N -4.08 0.73 -0.39 5.56 0.02 -1.26 -4.99 135.00 130.59 2wp0 s PRO 78 Ca 0.66 1.01 -0.22 0.00 0.02 0.00 0.00 61.00 62.47 2wp0 s PRO 78 Cb -0.25 -1.73 0.01 0.00 0.02 0.00 0.00 34.50 32.55 2wp0 s PRO 78 CO 0.58 -2.66 0.72 -1.17 -0.33 0.00 0.00 177.00 174.14 2wp0 s LEU 79 N -6.53 4.25 0.13 -5.54 2.96 -1.26 -4.99 118.68 107.70 2wp0 s LEU 79 Ca 0.65 0.07 -0.24 0.00 -0.22 0.00 0.00 54.13 54.40 2wp0 s LEU 79 Cb -0.21 -2.89 -0.07 0.00 0.50 0.00 0.00 46.19 43.51 2wp0 s LEU 79 CO 0.59 -0.74 0.72 -0.76 -1.32 0.00 0.00 176.35 174.84 2wp0 s LEU 80 N 2.99 4.57 -1.17 -0.68 1.43 -1.26 -4.96 118.68 119.60 2wp0 s LEU 80 Ca 0.28 1.53 -0.21 0.00 -1.03 0.00 0.00 54.13 54.70 2wp0 s LEU 80 Cb -0.13 -3.19 0.01 0.00 0.03 0.00 0.00 46.19 42.91 2wp0 s LEU 80 CO 0.18 0.21 1.77 -0.55 0.23 0.00 0.00 176.35 178.19 2wp0 s SER 81 N -1.04 6.06 -0.08 2.29 0.15 -1.26 -4.92 113.70 114.90 2wp0 s SER 81 Ca 0.34 -1.85 0.05 0.00 0.70 0.00 0.00 55.95 55.19 2wp0 s SER 81 Cb -0.22 -2.58 -0.00 0.00 -1.71 0.00 0.00 66.02 61.51 2wp0 s SER 81 CO 0.24 -1.96 -0.24 -0.69 1.20 0.00 0.00 173.24 171.79 2wp0 s VAL 82 N 7.00 1.99 -0.09 4.45 1.01 -1.26 -1.13 120.40 132.37 2wp0 s VAL 82 Ca 0.59 -1.00 0.03 0.00 0.00 0.00 0.00 61.98 61.60 2wp0 s VAL 82 Cb 0.01 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.69 2wp0 s VAL 82 CO 0.05 0.55 -0.18 -0.63 0.00 0.00 0.00 175.10 174.89 2wp0 s ILE 83 N 0.14 1.60 -0.91 2.22 1.09 0.17 -4.94 121.20 120.57 2wp0 s ILE 83 Ca -0.12 -0.75 -0.24 0.00 -1.10 0.00 0.00 60.65 58.44 2wp0 s ILE 83 Cb -0.16 -1.42 -0.00 0.00 -1.06 0.00 0.00 42.46 39.82 2wp0 s ILE 83 CO 0.06 0.46 1.72 -0.62 -0.10 0.00 0.00 174.94 176.46 2wp0 s ASP 84 N 0.57 5.71 0.35 3.58 2.15 -1.26 0.40 116.67 128.17 2wp0 s ASP 84 Ca -0.15 -0.85 0.20 0.00 0.43 0.00 0.00 52.55 52.18 2wp0 s ASP 84 Cb -0.17 -2.56 0.19 0.00 -0.30 0.00 0.00 42.92 40.09 2wp0 s ASP 84 CO 0.05 -2.21 1.46 0.15 -0.17 0.00 0.00 175.17 174.46 2wp0 h PHE 85 N 10.99 0.00 -0.55 -5.34 3.57 -1.25 -3.01 116.94 121.35 2wp0 h PHE 85 Ca 0.08 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.67 2wp0 h PHE 85 Cb 1.02 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.69 2wp0 h PHE 85 CO 1.22 0.19 0.13 -0.91 -2.23 0.00 0.00 178.31 176.70 2wp0 h ASN 86 N 0.00 0.03 0.22 0.41 -0.26 -1.82 -2.93 115.58 111.23 2wp0 h ASN 86 Ca -0.01 0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.83 2wp0 h ASN 86 Cb 1.15 0.13 0.00 0.00 -1.06 0.00 0.00 38.32 38.54 2wp0 h ASN 86 CO 0.02 0.04 -0.09 0.00 -1.06 0.00 0.00 177.43 176.34 2wp0 n ALA 87 N -2.54 2.75 -1.76 -0.83 0.00 -1.14 -4.86 120.51 112.12 2wp0 n ALA 87 Ca 0.07 -0.31 -0.32 0.00 0.00 0.00 0.00 53.44 52.89 2wp0 n ALA 87 Cb 0.28 -1.30 0.01 0.00 0.00 0.00 0.00 19.45 18.43 2wp0 n ALA 87 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2wp0 s SER 88 N -2.32 6.08 0.51 0.00 0.15 -1.11 -4.96 113.70 112.05 2wp0 s SER 88 Ca 0.33 1.58 0.29 0.00 0.70 0.00 0.00 55.95 58.84 2wp0 s SER 88 Cb 0.20 -2.50 1.29 0.00 -1.71 0.00 0.00 66.02 63.30 2wp0 s SER 88 CO 0.44 -0.97 1.97 0.28 1.20 0.00 0.00 173.24 176.16 2wp0 h SER 89 N 0.08 0.00 0.67 5.45 0.02 -1.91 -3.11 113.55 114.74 2wp0 h SER 89 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2wp0 h SER 89 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2wp0 h SER 89 CO 0.60 0.12 -0.48 0.49 -1.14 0.00 0.00 176.83 176.42 2wp0 n PHE 90 N -3.36 0.16 -1.69 3.45 3.72 -1.26 -4.88 117.46 113.60 2wp0 n PHE 90 Ca -0.01 0.05 -0.55 0.00 -0.05 0.00 0.00 57.45 56.90 2wp0 n PHE 90 Cb 0.32 -0.40 -0.06 0.00 -0.94 0.00 0.00 39.48 38.40 2wp0 n PHE 90 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 2wp0 n TYR 91 N -1.68 2.05 -2.43 1.38 9.36 -1.18 -4.60 117.16 120.06 2wp0 n TYR 91 Ca 0.05 0.43 -0.42 0.00 3.32 0.00 0.00 57.90 61.29 2wp0 n TYR 91 Cb 0.37 -2.49 -0.03 0.00 -0.63 0.00 0.00 39.34 36.56 2wp0 n TYR 91 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2wp0 s PRO 92 N 3.17 4.48 0.00 2.98 0.05 -1.26 -4.93 135.00 139.49 2wp0 s PRO 92 Ca 0.95 1.79 0.00 0.00 0.05 0.00 0.00 61.00 63.79 2wp0 s PRO 92 Cb -0.97 -3.30 0.00 0.00 0.05 0.00 0.00 34.50 30.28 2wp0 s PRO 92 CO 0.60 -0.14 0.00 1.63 0.05 0.00 0.00 177.00 179.13 2wp0 n LYS 93 N 3.20 0.00 -3.40 4.56 4.01 -1.26 -4.43 118.16 120.85 2wp0 n LYS 93 Ca 0.06 0.00 -0.44 0.00 -0.51 0.00 0.00 58.31 57.42 2wp0 n LYS 93 Cb 0.46 0.00 -0.06 0.00 -0.51 0.00 0.00 35.03 34.91 2wp0 n LYS 93 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 2wp0 s ASN 94 N 1.00 6.03 0.00 4.39 3.84 -1.26 -4.41 114.94 124.52 2wp0 s ASN 94 Ca 0.00 -1.76 0.00 0.00 0.21 0.00 0.00 52.86 51.31 2wp0 s ASN 94 Cb 0.00 -2.14 0.00 0.00 -0.55 0.00 0.00 41.25 38.56 2wp0 s ASN 94 CO 0.00 -0.78 0.00 -0.67 -2.79 0.00 0.00 177.10 172.86 2wp0 n ASP 95 N 5.14 0.00 0.22 -4.21 4.64 -1.26 -4.98 116.55 116.09 2wp0 n ASP 95 Ca -0.12 0.00 0.10 0.00 -1.38 0.00 0.00 54.79 53.39 2wp0 n ASP 95 Cb 0.41 0.00 0.41 0.00 -1.04 0.00 0.00 41.12 40.90 2wp0 n ASP 95 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2wp0 h ALA 96 N 0.00 0.97 -0.42 -1.67 0.00 -1.85 -2.94 119.26 113.35 2wp0 h ALA 96 Ca 0.00 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2wp0 h ALA 96 Cb 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2wp0 h ALA 96 CO 0.00 0.25 -0.02 -0.91 0.00 0.00 0.00 179.25 178.58 2wp0 h ASN 97 N 0.00 0.66 0.02 0.00 -0.26 -1.94 0.56 115.58 114.62 2wp0 h ASN 97 Ca -0.00 -0.15 -0.06 0.00 -0.56 0.00 0.00 56.30 55.52 2wp0 h ASN 97 Cb 0.82 -0.18 0.01 0.00 -1.06 0.00 0.00 38.32 37.91 2wp0 h ASN 97 CO 0.03 0.74 -0.26 -0.07 -1.06 0.00 0.00 177.43 176.80 2wp0 h LEU 98 N 0.65 0.20 -0.76 1.61 4.07 -1.93 -1.55 115.31 117.60 2wp0 h LEU 98 Ca 0.13 -0.86 0.15 0.00 0.08 0.00 0.00 57.88 57.38 2wp0 h LEU 98 Cb 0.43 -0.06 -0.14 0.00 1.08 0.00 0.00 40.66 41.96 2wp0 h LEU 98 CO 0.02 1.03 -0.22 0.28 -1.08 0.00 0.00 178.44 178.47 2wp0 h SER 99 N -0.61 -0.80 0.11 -0.43 0.02 -1.33 -0.54 113.55 109.97 2wp0 h SER 99 Ca -0.04 0.23 -0.16 0.00 -0.84 0.00 0.00 61.79 60.98 2wp0 h SER 99 Cb 1.09 0.50 -0.01 0.00 0.14 0.00 0.00 62.40 64.13 2wp0 h SER 99 CO 0.05 -0.26 -0.60 0.25 -1.14 0.00 0.00 176.83 175.13 2wp0 h LEU 100 N -0.02 0.55 -0.18 5.07 5.85 0.18 -0.60 115.31 126.16 2wp0 h LEU 100 Ca 0.35 -0.31 -0.13 0.00 0.84 0.00 0.00 57.88 58.63 2wp0 h LEU 100 Cb 0.57 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2wp0 h LEU 100 CO -0.79 1.02 -0.38 0.00 -0.34 0.00 0.00 178.44 177.95 2wp0 h ALA 101 N 0.98 0.29 -0.22 1.25 0.00 -0.72 -2.14 119.26 118.70 2wp0 h ALA 101 Ca -0.00 -0.45 -0.15 0.00 0.00 0.00 0.00 54.91 54.31 2wp0 h ALA 101 Cb 1.14 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2wp0 h ALA 101 CO 0.11 0.38 -0.48 1.15 0.00 0.00 0.00 179.25 180.41 2wp0 h THR 102 N 0.24 1.31 0.21 0.00 2.02 -0.97 -1.84 112.91 113.88 2wp0 h THR 102 Ca 0.00 -1.68 -0.01 0.00 0.77 0.00 0.00 66.41 65.49 2wp0 h THR 102 Cb 0.99 1.65 0.00 0.00 -1.74 0.00 0.00 68.15 69.05 2wp0 h THR 102 CO 0.09 0.53 -0.10 0.40 0.37 0.00 0.00 175.52 176.81 2wp0 h ILE 103 N 0.47 0.83 -0.06 3.11 2.04 -1.15 -0.01 117.51 122.75 2wp0 h ILE 103 Ca 0.03 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.71 2wp0 h ILE 103 Cb 1.01 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 38.04 2wp0 h ILE 103 CO 0.09 0.04 0.07 -0.33 0.00 0.00 0.00 178.15 178.03 2wp0 h GLU 104 N -0.37 0.00 0.04 2.37 5.08 -1.22 -2.24 114.58 118.24 2wp0 h GLU 104 Ca -0.03 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.03 2wp0 h GLU 104 Cb 0.29 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 2wp0 h GLU 104 CO 0.05 0.00 -1.66 1.98 -1.00 0.00 0.00 179.01 178.38 2wp0 h MET 105 N 0.00 0.09 0.03 2.33 4.05 -0.88 -3.38 114.93 117.17 2wp0 h MET 105 Ca 0.03 -0.15 -0.10 0.00 -0.28 0.00 0.00 59.70 59.20 2wp0 h MET 105 Cb 0.17 0.06 0.01 0.00 -0.80 0.00 0.00 31.60 31.04 2wp0 h MET 105 CO -0.00 0.78 -0.40 1.15 0.23 0.00 0.00 176.91 178.66 2wp0 h THR 106 N 0.02 1.55 -2.95 -0.77 2.02 -0.72 -3.46 112.91 108.59 2wp0 h THR 106 Ca -0.27 -2.15 -0.52 0.00 0.77 0.00 0.00 66.41 64.24 2wp0 h THR 106 Cb 1.99 2.90 -0.01 0.00 -1.74 0.00 0.00 68.15 71.30 2wp0 h THR 106 CO 0.10 0.60 -0.25 -0.31 0.37 0.00 0.00 175.52 176.03 2wp0 s TYR 107 N -2.88 3.48 -0.05 3.16 2.02 -0.87 -5.01 117.35 117.20 2wp0 s TYR 107 Ca -0.15 0.44 -0.17 0.00 -0.37 0.00 0.00 57.07 56.82 2wp0 s TYR 107 Cb 0.01 -1.94 -0.31 0.00 -0.40 0.00 0.00 41.96 39.32 2wp0 s TYR 107 CO 0.77 0.27 0.76 1.96 -1.57 0.00 0.00 175.55 177.74 2wp0 h GLN 108 N 1.72 0.35 -0.75 -0.62 4.20 -1.89 -3.44 115.11 114.68 2wp0 h GLN 108 Ca -0.48 -0.59 -0.28 0.00 0.06 0.00 0.00 58.65 57.36 2wp0 h GLN 108 Cb 1.19 0.22 -0.20 0.00 0.30 0.00 0.00 27.48 29.00 2wp0 h GLN 108 CO 0.66 1.28 -0.62 -1.71 -0.67 0.00 0.00 178.83 177.78 2wp0 n ASN 109 N -3.88 -2.44 -4.82 1.46 5.15 -1.26 -5.07 115.26 104.40 2wp0 n ASN 109 Ca -0.20 -3.04 -0.32 0.00 -0.60 0.00 0.00 54.58 50.42 2wp0 n ASN 109 Cb 0.95 1.28 0.01 0.00 -0.53 0.00 0.00 39.78 41.49 2wp0 n ASN 109 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2wp0 s PRO 110 N 0.43 3.39 -0.01 1.20 0.04 -1.26 0.10 135.00 138.89 2wp0 s PRO 110 Ca 0.32 1.10 -0.01 0.00 0.04 0.00 0.00 61.00 62.45 2wp0 s PRO 110 Cb 0.14 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.64 2wp0 s PRO 110 CO -0.17 -0.75 0.02 1.41 0.04 0.00 0.00 177.00 177.56 2wp0 s MET 111 N -4.28 0.02 -0.15 4.56 1.75 0.64 -4.41 119.30 117.42 2wp0 s MET 111 Ca 0.61 0.05 -0.21 0.00 -1.25 0.00 0.00 55.69 54.89 2wp0 s MET 111 Cb -0.14 -0.02 -0.03 0.00 2.84 0.00 0.00 34.83 37.48 2wp0 s MET 111 CO 0.40 -0.02 0.64 -0.06 -0.65 0.00 0.00 175.02 175.32 2wp0 s PHE 112 N 0.14 3.44 -0.42 4.11 0.08 0.02 -0.38 117.98 124.97 2wp0 s PHE 112 Ca -0.01 1.02 -0.01 0.00 0.12 0.00 0.00 56.93 58.04 2wp0 s PHE 112 Cb -0.02 -2.78 0.11 0.00 -0.57 0.00 0.00 43.02 39.77 2wp0 s PHE 112 CO -0.00 -0.07 0.20 -0.46 -0.10 0.00 0.00 175.22 174.79 2wp0 s TRP 113 N 1.48 3.59 0.04 0.36 -0.11 -0.56 0.78 118.94 124.52 2wp0 s TRP 113 Ca 0.31 -2.60 0.04 0.00 1.22 0.00 0.00 56.10 55.07 2wp0 s TRP 113 Cb -0.16 -3.15 -0.04 0.00 -1.50 0.00 0.00 33.47 28.62 2wp0 s TRP 113 CO 0.12 -0.95 -0.03 -1.58 -4.62 0.00 0.00 176.95 169.89 2wp0 s HIS 114 N 0.91 2.94 -0.15 5.86 5.65 -1.03 -1.83 115.29 127.64 2wp0 s HIS 114 Ca 0.10 -0.02 -0.02 0.00 0.25 0.00 0.00 55.06 55.37 2wp0 s HIS 114 Cb -0.22 -1.58 0.05 0.00 -1.18 0.00 0.00 32.58 29.65 2wp0 s HIS 114 CO -0.05 0.43 0.01 0.08 -0.65 0.00 0.00 174.74 174.57 2wp0 s VAL 115 N -1.15 0.60 0.00 0.89 1.01 -0.85 -0.78 120.40 120.11 2wp0 s VAL 115 Ca 0.21 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.81 2wp0 s VAL 115 Cb -0.11 -0.94 0.00 0.00 0.00 0.00 0.00 36.38 35.32 2wp0 s VAL 115 CO 0.12 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.82 2wp0 n GLY 116 N 5.04 -0.70 3.75 4.51 0.00 0.15 -2.22 105.19 115.72 2wp0 n GLY 116 Ca -0.09 -2.06 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 2wp0 n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wp0 s LYS 117 N 0.00 4.17 -0.70 1.61 1.02 -1.26 -4.38 119.74 120.21 2wp0 s LYS 117 Ca 0.00 2.48 -0.23 0.00 0.02 0.00 0.00 55.97 58.24 2wp0 s LYS 117 Cb 0.00 -3.05 0.06 0.00 -0.52 0.00 0.00 37.83 34.33 2wp0 s LYS 117 CO 0.00 -0.54 1.05 0.42 -0.92 0.00 0.00 175.35 175.36 2wp0 s ILE 118 N -0.17 4.21 -2.02 2.17 1.01 -1.26 -4.18 121.20 120.97 2wp0 s ILE 118 Ca 0.60 -0.28 0.27 0.00 0.00 0.00 0.00 60.65 61.24 2wp0 s ILE 118 Cb -0.45 -4.74 0.34 0.00 0.01 0.00 0.00 42.46 37.62 2wp0 s ILE 118 CO 0.48 -1.55 1.60 -0.62 0.00 0.00 0.00 174.94 174.85 2wp0 n GLU 119 N 8.01 1.14 -3.97 2.79 1.02 -1.26 -4.90 120.64 123.46 2wp0 n GLU 119 Ca -0.00 -0.69 -0.10 0.00 -0.02 0.00 0.00 57.16 56.35 2wp0 n GLU 119 Cb 0.46 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.33 2wp0 n GLU 119 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2wp0 s ASN 120 N -2.33 0.06 0.34 1.62 4.22 -1.26 -5.03 114.94 112.55 2wp0 s ASN 120 Ca 0.28 -0.89 0.18 0.00 -2.14 0.00 0.00 52.86 50.29 2wp0 s ASN 120 Cb 0.20 0.43 0.43 0.00 1.28 0.00 0.00 41.25 43.59 2wp0 s ASN 120 CO 0.46 -0.88 1.61 -0.33 -2.04 0.00 0.00 177.10 175.92 2wp0 h GLU 121 N 2.56 0.00 0.39 3.55 4.39 -1.91 -1.92 114.58 121.64 2wp0 h GLU 121 Ca -0.32 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.37 2wp0 h GLU 121 Cb 1.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.87 2wp0 h GLU 121 CO 0.49 0.41 -0.24 0.78 -1.16 0.00 0.00 179.01 179.29 2wp0 h GLY 122 N 2.74 -0.64 1.23 -3.84 0.00 -1.85 0.78 103.07 101.50 2wp0 h GLY 122 Ca -0.00 0.27 -0.15 0.00 0.00 0.00 0.00 47.33 47.45 2wp0 h GLY 122 CO 0.05 -0.24 -0.34 -2.00 0.00 0.00 0.00 176.54 174.01 2wp0 h LEU 123 N -0.61 0.90 -0.16 3.11 5.85 -1.74 -2.79 115.31 119.87 2wp0 h LEU 123 Ca -0.04 -0.39 0.05 0.00 0.84 0.00 0.00 57.88 58.34 2wp0 h LEU 123 Cb 0.51 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.22 2wp0 h LEU 123 CO 0.04 1.15 -0.24 0.50 -0.34 0.00 0.00 178.44 179.55 2wp0 h LYS 124 N 0.71 -0.29 -0.87 1.25 3.64 -1.29 -0.79 116.57 118.94 2wp0 h LYS 124 Ca 0.07 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.60 2wp0 h LYS 124 Cb 0.91 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.73 2wp0 h LYS 124 CO 0.08 -0.19 0.56 1.15 -2.27 0.00 0.00 179.45 178.78 2wp0 h THR 125 N -0.30 0.87 0.06 1.00 2.02 -0.63 -0.53 112.91 115.40 2wp0 h THR 125 Ca 0.11 -0.25 -0.26 0.00 0.77 0.00 0.00 66.41 66.78 2wp0 h THR 125 Cb 0.46 0.09 0.01 0.00 -1.74 0.00 0.00 68.15 66.97 2wp0 h THR 125 CO -0.33 0.13 -1.10 0.40 0.37 0.00 0.00 175.52 175.00 2wp0 h ILE 126 N 0.72 1.39 0.00 3.11 2.04 -1.15 -2.54 117.51 121.07 2wp0 h ILE 126 Ca 0.43 -2.59 -0.05 0.00 1.00 0.00 0.00 64.86 63.65 2wp0 h ILE 126 Cb 0.63 2.61 -0.01 0.00 -0.74 0.00 0.00 36.82 39.31 2wp0 h ILE 126 CO -0.19 0.77 -0.23 -0.07 0.00 0.00 0.00 178.15 178.44 2wp0 h LEU 127 N 0.21 0.00 -0.07 1.44 3.38 -0.00 0.53 115.31 120.79 2wp0 h LEU 127 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2wp0 h LEU 127 Cb 1.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.51 2wp0 h LEU 127 CO 0.19 0.23 -0.15 0.18 0.09 0.00 0.00 178.44 178.99 2wp0 n LEU 128 N -3.36 0.26 0.00 1.67 4.32 -0.32 -4.91 117.00 114.66 2wp0 n LEU 128 Ca 0.00 0.21 -0.05 0.00 -0.02 0.00 0.00 56.01 56.16 2wp0 n LEU 128 Cb 0.45 -0.32 0.04 0.00 -1.62 0.00 0.00 43.42 41.97 2wp0 n LEU 128 CO 0.34 0.06 0.06 -1.54 -1.22 0.00 0.00 177.39 175.08 2wp0 n SER 129 N -1.31 -2.05 -0.46 -1.43 3.41 0.18 -4.95 113.62 107.01 2wp0 n SER 129 Ca 0.10 -0.25 0.11 0.00 -0.26 0.00 0.00 58.87 58.57 2wp0 n SER 129 Cb 0.31 -0.15 0.07 0.00 -0.26 0.00 0.00 64.21 64.18 2wp0 n SER 129 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2wp0 n LYS 130 N -2.44 1.17 -1.72 4.33 4.76 -1.26 -4.90 118.16 118.10 2wp0 n LYS 130 Ca 0.02 -0.93 -0.43 0.00 -2.87 0.00 0.00 58.31 54.10 2wp0 n LYS 130 Cb 0.09 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 31.77 2wp0 n LYS 130 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2wp0 n ILE 131 N -0.10 0.40 -1.44 -0.18 5.41 -1.26 -4.90 119.36 117.29 2wp0 n ILE 131 Ca 0.10 -0.10 -0.48 0.00 1.00 0.00 0.00 62.75 63.27 2wp0 n ILE 131 Cb 0.45 -1.90 -0.03 0.00 -0.71 0.00 0.00 39.64 37.45 2wp0 n ILE 131 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2wp0 n PRO 132 N 3.19 0.25 -4.33 0.38 -0.02 -1.26 -4.76 135.00 128.45 2wp0 n PRO 132 Ca 0.13 0.09 -0.23 0.00 -2.02 0.00 0.00 63.50 61.47 2wp0 n PRO 132 Cb 0.35 -1.17 -0.07 0.00 -0.02 0.00 0.00 33.50 32.58 2wp0 n PRO 132 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2wp0 n SER 133 N 1.85 0.44 -3.10 2.55 3.41 -1.26 -0.80 113.62 116.71 2wp0 n SER 133 Ca 0.17 -3.18 -0.12 0.00 -0.26 0.00 0.00 58.87 55.48 2wp0 n SER 133 Cb 0.26 1.29 -0.04 0.00 -0.26 0.00 0.00 64.21 65.46 2wp0 n SER 133 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2wp0 s PHE 134 N -3.19 -0.68 -0.31 7.33 5.99 0.23 -4.83 117.98 122.52 2wp0 s PHE 134 Ca 0.28 -0.97 -0.19 0.00 0.00 0.00 0.00 56.93 56.06 2wp0 s PHE 134 Cb 0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 43.02 42.88 2wp0 s PHE 134 CO 0.20 -1.09 0.54 -0.51 -0.00 0.00 0.00 175.22 174.37 2wp0 s LEU 135 N 0.90 4.19 -0.67 6.12 1.43 -1.26 -2.46 118.68 126.93 2wp0 s LEU 135 Ca 0.26 0.26 -0.07 0.00 -1.03 0.00 0.00 54.13 53.56 2wp0 s LEU 135 Cb -0.03 -2.67 0.17 0.00 0.03 0.00 0.00 46.19 43.70 2wp0 s LEU 135 CO -0.08 -0.42 0.53 0.26 0.23 0.00 0.00 176.35 176.86 2wp0 s TRP 136 N 2.43 3.52 0.36 0.29 0.52 0.04 0.17 118.94 126.27 2wp0 s TRP 136 Ca 0.21 -2.41 0.09 0.00 0.02 0.00 0.00 56.10 54.01 2wp0 s TRP 136 Cb -0.15 -3.42 -0.06 0.00 -1.15 0.00 0.00 33.47 28.69 2wp0 s TRP 136 CO 0.12 -0.90 -0.01 -0.51 0.02 0.00 0.00 176.95 175.66 2wp0 s LEU 137 N 0.16 2.90 0.00 2.99 1.43 -0.71 0.33 118.68 125.79 2wp0 s LEU 137 Ca 0.16 -1.12 0.22 0.00 -1.03 0.00 0.00 54.13 52.36 2wp0 s LEU 137 Cb -0.18 -1.18 -0.00 0.00 0.03 0.00 0.00 46.19 44.86 2wp0 s LEU 137 CO -0.05 -0.28 1.08 0.49 0.23 0.00 0.00 176.35 177.82 2wp0 n PHE 138 N -0.93 0.00 -3.68 0.29 3.72 -1.26 -0.90 117.46 114.70 2wp0 n PHE 138 Ca -0.04 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.24 2wp0 n PHE 138 Cb 0.64 -0.01 -0.09 0.00 -0.94 0.00 0.00 39.48 39.07 2wp0 n PHE 138 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 2wp0 s GLU 139 N -2.60 0.56 -0.95 -1.08 2.12 -1.26 -4.74 118.70 110.75 2wp0 s GLU 139 Ca 0.16 0.84 -0.24 0.00 0.36 0.00 0.00 54.97 56.10 2wp0 s GLU 139 Cb 0.18 0.17 0.05 0.00 0.26 0.00 0.00 34.13 34.79 2wp0 s GLU 139 CO 0.64 -0.11 1.40 -1.83 -0.54 0.00 0.00 175.26 174.81 2wp0 s GLU 140 N 0.86 3.50 0.21 4.30 -1.05 -1.26 -4.72 118.70 120.55 2wp0 s GLU 140 Ca -0.05 -0.94 -0.08 0.00 -0.15 0.00 0.00 54.97 53.75 2wp0 s GLU 140 Cb -0.05 -5.08 0.15 0.00 -0.44 0.00 0.00 34.13 28.71 2wp0 s GLU 140 CO -0.07 -2.18 1.79 1.25 0.95 0.00 0.00 175.26 176.99 2wp0 h LEU 141 N 12.78 1.06 -7.96 1.83 7.12 -1.99 -3.44 115.31 124.72 2wp0 h LEU 141 Ca 0.09 -0.16 -0.13 0.00 0.13 0.00 0.00 57.88 57.82 2wp0 h LEU 141 Cb 1.02 -0.27 -0.17 0.00 -0.53 0.00 0.00 40.66 40.70 2wp0 h LEU 141 CO 1.39 0.93 -0.56 -0.75 -0.13 0.00 0.00 178.44 179.32 2wp0 s LYS 142 N -5.61 0.58 0.26 1.25 2.47 -1.26 -5.07 119.74 112.36 2wp0 s LYS 142 Ca -0.12 -0.83 -0.04 0.00 -1.56 0.00 0.00 55.97 53.41 2wp0 s LYS 142 Cb 0.15 0.22 0.31 0.00 -1.46 0.00 0.00 37.83 37.05 2wp0 s LYS 142 CO 0.83 -0.14 1.83 0.93 0.16 0.00 0.00 175.35 178.97 2wp0 h GLU 143 N 3.61 1.04 -5.26 4.03 5.08 -2.01 -3.30 114.58 117.77 2wp0 h GLU 143 Ca -0.33 -0.17 -0.69 0.00 -1.00 0.00 0.00 59.36 57.17 2wp0 h GLU 143 Cb 1.18 -0.18 -0.15 0.00 0.50 0.00 0.00 28.75 30.11 2wp0 h GLU 143 CO 0.53 0.84 1.38 -0.51 -1.00 0.00 0.00 179.01 180.25 2wp0 s ASP 144 N -6.43 6.80 0.06 1.42 -0.00 -1.26 -4.90 116.67 112.37 2wp0 s ASP 144 Ca -0.11 -2.36 -0.04 0.00 -0.00 0.00 0.00 52.55 50.04 2wp0 s ASP 144 Cb 0.16 -2.46 -0.02 0.00 -0.00 0.00 0.00 42.92 40.60 2wp0 s ASP 144 CO 0.82 -1.05 0.06 0.00 -0.00 0.00 0.00 175.17 175.00 2wp0 s LEU 146 N -2.80 3.48 0.05 0.00 2.96 0.13 -4.90 118.68 117.60 2wp0 s LEU 146 Ca 0.05 -0.37 -0.21 0.00 -0.22 0.00 0.00 54.13 53.37 2wp0 s LEU 146 Cb 0.06 -1.89 -0.06 0.00 0.50 0.00 0.00 46.19 44.80 2wp0 s LEU 146 CO -0.10 -0.08 0.63 -0.76 -1.32 0.00 0.00 176.35 174.73 2wp0 s LEU 147 N 1.56 4.49 -0.05 -0.68 1.43 -1.26 -1.73 118.68 122.44 2wp0 s LEU 147 Ca 0.05 1.31 0.02 0.00 -1.03 0.00 0.00 54.13 54.47 2wp0 s LEU 147 Cb -0.16 -3.01 0.02 0.00 0.03 0.00 0.00 46.19 43.08 2wp0 s LEU 147 CO 0.02 0.17 -0.08 -0.76 0.23 0.00 0.00 176.35 175.94 2wp0 s LEU 148 N -0.65 1.50 -0.11 1.79 1.43 -0.08 -4.96 118.68 117.61 2wp0 s LEU 148 Ca 0.32 -0.19 -0.29 0.00 -1.03 0.00 0.00 54.13 52.94 2wp0 s LEU 148 Cb -0.20 -0.58 -0.05 0.00 0.03 0.00 0.00 46.19 45.39 2wp0 s LEU 148 CO 0.20 -0.01 1.84 -0.54 0.23 0.00 0.00 176.35 178.07 2wp0 s LYS 149 N 0.73 3.85 0.10 1.70 1.02 -1.26 -4.39 119.74 121.48 2wp0 s LYS 149 Ca -0.12 2.11 -0.20 0.00 0.02 0.00 0.00 55.97 57.78 2wp0 s LYS 149 Cb -0.14 -4.13 -0.08 0.00 -0.52 0.00 0.00 37.83 32.96 2wp0 s LYS 149 CO 0.01 -1.26 1.67 1.49 -0.92 0.00 0.00 175.35 176.34 2wp0 h GLU 150 N 11.26 0.30 -0.58 1.68 4.81 -1.94 -3.25 114.58 126.87 2wp0 h GLU 150 Ca -0.41 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 2wp0 h GLU 150 Cb 1.20 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2wp0 h GLU 150 CO 0.97 0.33 0.00 0.72 -0.73 0.00 0.00 179.01 180.30 2wp0 n HIS 151 N -4.85 0.92 -1.93 0.92 8.25 -1.26 -4.91 115.22 112.35 2wp0 n HIS 151 Ca -0.04 -0.37 -0.42 0.00 -0.26 0.00 0.00 57.72 56.63 2wp0 n HIS 151 Cb 0.10 -0.16 -0.03 0.00 1.12 0.00 0.00 29.99 31.03 2wp0 n HIS 151 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2wp0 s ASP 152 N -0.77 6.59 0.53 0.41 -1.08 -1.23 -4.89 116.67 116.23 2wp0 s ASP 152 Ca 0.32 2.58 0.35 0.00 -0.52 0.00 0.00 52.55 55.28 2wp0 s ASP 152 Cb 0.20 -2.58 1.64 0.00 -1.46 0.00 0.00 42.92 40.72 2wp0 s ASP 152 CO 0.16 -0.84 2.04 0.77 0.52 0.00 0.00 175.17 177.82 2wp0 h SER 153 N 7.23 0.00 -0.50 -0.34 4.64 -1.93 -2.17 113.55 120.48 2wp0 h SER 153 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2wp0 h SER 153 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2wp0 h SER 153 CO 0.92 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 177.06 2wp0 n LEU 154 N -2.89 3.37 -0.21 5.97 4.77 -1.26 -4.60 117.00 122.15 2wp0 n LEU 154 Ca -0.01 -2.03 -0.05 0.00 -0.03 0.00 0.00 56.01 53.90 2wp0 n LEU 154 Cb 0.19 -0.34 0.01 0.00 -2.33 0.00 0.00 43.42 40.95 2wp0 n LEU 154 CO 0.22 0.83 0.63 0.25 -1.33 0.00 0.00 177.39 177.99 2wp0 h LEU 155 N 2.90 -1.14 -0.89 2.23 5.85 -1.70 -2.29 115.31 120.27 2wp0 h LEU 155 Ca 0.00 0.23 0.11 0.00 0.84 0.00 0.00 57.88 59.06 2wp0 h LEU 155 Cb 0.86 0.57 -0.08 0.00 0.37 0.00 0.00 40.66 42.38 2wp0 h LEU 155 CO 0.01 -0.30 0.52 0.44 -0.34 0.00 0.00 178.44 178.77 2wp0 h ASP 156 N -0.15 0.74 -0.68 1.25 3.32 -1.83 -0.54 116.42 118.53 2wp0 h ASP 156 Ca 0.24 0.06 -0.08 0.00 0.02 0.00 0.00 57.03 57.27 2wp0 h ASP 156 Cb 0.55 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.99 2wp0 h ASP 156 CO -0.68 0.39 0.13 1.88 -1.72 0.00 0.00 179.24 179.24 2wp0 h TYR 157 N 0.83 1.18 0.00 4.55 0.05 -1.77 -3.12 116.97 118.69 2wp0 h TYR 157 Ca 0.44 -0.16 -0.04 0.00 0.05 0.00 0.00 58.73 59.03 2wp0 h TYR 157 Cb 0.46 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 2wp0 h TYR 157 CO -0.05 0.98 -0.20 0.87 -1.05 0.00 0.00 178.16 178.71 2wp0 h LYS 158 N 1.04 0.00 0.17 4.88 1.57 -0.60 -2.59 116.57 121.04 2wp0 h LYS 158 Ca 0.21 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.98 2wp0 h LYS 158 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2wp0 h LYS 158 CO 0.01 0.20 -0.08 -0.07 -0.57 0.00 0.00 179.45 178.94 2wp0 h LEU 159 N 0.00 -0.20 -0.34 2.94 3.38 -1.37 -1.36 115.31 118.37 2wp0 h LEU 159 Ca -0.00 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 57.89 2wp0 h LEU 159 Cb 0.69 0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.41 2wp0 h LEU 159 CO 0.03 0.03 -0.31 -0.07 0.09 0.00 0.00 178.44 178.21 2wp0 h LEU 160 N -0.43 -1.01 -0.35 1.67 3.38 -1.57 0.17 115.31 117.17 2wp0 h LEU 160 Ca -0.02 0.18 0.07 0.00 0.09 0.00 0.00 57.88 58.19 2wp0 h LEU 160 Cb 0.33 0.47 -0.06 0.00 0.09 0.00 0.00 40.66 41.49 2wp0 h LEU 160 CO 0.04 -0.32 -0.06 -0.61 0.09 0.00 0.00 178.44 177.58 2wp0 h GLN 161 N -0.27 0.03 -0.38 1.13 4.15 -1.46 0.90 115.11 119.21 2wp0 h GLN 161 Ca 0.16 -0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.54 2wp0 h GLN 161 Cb 0.52 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.19 2wp0 h GLN 161 CO -0.49 0.02 0.08 -0.07 -1.93 0.00 0.00 178.83 176.44 2wp0 h LEU 162 N 0.03 0.59 0.28 -2.39 3.38 -0.99 0.48 115.31 116.68 2wp0 h LEU 162 Ca 0.17 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2wp0 h LEU 162 Cb 0.25 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2wp0 h LEU 162 CO -0.34 0.68 -0.18 0.15 0.09 0.00 0.00 178.44 178.84 2wp0 h PHE 163 N 0.48 -0.46 -0.80 1.13 3.57 0.19 0.55 116.94 121.59 2wp0 h PHE 163 Ca 0.12 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.74 2wp0 h PHE 163 Cb 0.33 0.17 -0.08 0.00 2.79 0.00 0.00 35.95 39.15 2wp0 h PHE 163 CO 0.02 -0.28 0.41 0.87 -2.23 0.00 0.00 178.31 177.10 2wp0 h LYS 164 N -0.44 0.61 -0.06 1.11 1.57 0.11 0.77 116.57 120.23 2wp0 h LYS 164 Ca -0.03 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2wp0 h LYS 164 Cb 0.37 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2wp0 h LYS 164 CO 0.02 0.40 -0.00 1.25 -0.57 0.00 0.00 179.45 180.55 2wp0 h LEU 165 N 0.62 -0.03 0.06 2.94 5.85 0.59 -1.23 115.31 124.11 2wp0 h LEU 165 Ca 0.42 0.01 0.02 0.00 0.84 0.00 0.00 57.88 59.17 2wp0 h LEU 165 Cb 0.53 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2wp0 h LEU 165 CO -0.33 -0.01 -0.15 0.15 -0.34 0.00 0.00 178.44 177.76 2wp0 h PHE 166 N 0.01 -0.40 -0.38 1.25 3.57 0.26 -0.54 116.94 120.72 2wp0 h PHE 166 Ca 0.03 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.59 2wp0 h PHE 166 Cb 0.03 0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.89 2wp0 h PHE 166 CO -0.11 -0.23 0.08 1.49 -2.23 0.00 0.00 178.31 177.31 2wp0 h GLU 167 N -0.29 0.20 -0.63 1.11 4.81 0.56 -0.64 114.58 119.70 2wp0 h GLU 167 Ca 0.03 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.27 2wp0 h GLU 167 Cb 0.32 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 2wp0 h GLU 167 CO -0.11 0.13 0.40 -0.91 -0.73 0.00 0.00 179.01 177.79 2wp0 h ASN 168 N 0.20 0.67 -0.36 1.04 2.35 -1.18 -2.27 115.58 116.04 2wp0 h ASN 168 Ca 0.18 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 2wp0 h ASN 168 Cb 0.21 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 2wp0 h ASN 168 CO -0.24 0.48 0.11 0.00 -1.65 0.00 0.00 177.43 176.13 2wp0 h ALA 169 N 1.25 0.47 -0.51 -0.83 0.00 -0.48 -0.40 119.26 118.76 2wp0 h ALA 169 Ca 0.24 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2wp0 h ALA 169 Cb -0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2wp0 h ALA 169 CO -0.08 0.11 0.26 1.25 0.00 0.00 0.00 179.25 180.80 2wp0 h LEU 170 N 0.43 0.66 -0.42 0.00 5.85 -0.95 -2.54 115.31 118.34 2wp0 h LEU 170 Ca 0.12 -0.11 -0.18 0.00 0.84 0.00 0.00 57.88 58.55 2wp0 h LEU 170 Cb 0.25 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2wp0 h LEU 170 CO -0.00 0.59 -0.79 -0.26 -0.34 0.00 0.00 178.44 177.64 2wp0 h PHE 171 N 0.68 0.20 -0.25 1.25 -1.00 -1.36 -0.36 116.94 116.11 2wp0 h PHE 171 Ca 0.18 -0.10 -0.01 0.00 2.81 0.00 0.00 57.97 60.84 2wp0 h PHE 171 Cb 0.09 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.61 2wp0 h PHE 171 CO -0.01 0.87 0.09 0.77 -1.61 0.00 0.00 178.31 178.42 2wp0 h SER 172 N 0.09 0.31 0.30 2.17 0.02 -0.98 -1.00 113.55 114.45 2wp0 h SER 172 Ca -0.03 -0.02 -0.33 0.00 -0.84 0.00 0.00 61.79 60.57 2wp0 h SER 172 Cb 1.38 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.80 2wp0 h SER 172 CO 0.11 0.30 -1.87 0.55 -1.14 0.00 0.00 176.83 174.78 2wp0 n VAL 173 N -4.43 1.70 0.05 2.27 3.14 -0.97 -1.07 118.33 119.02 2wp0 n VAL 173 Ca 0.01 -0.73 0.02 0.00 -2.96 0.00 0.00 64.34 60.68 2wp0 n VAL 173 Cb 0.13 -1.39 0.37 0.00 -1.06 0.00 0.00 33.84 31.89 2wp0 n VAL 173 CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 2wp0 h LEU 174 N 0.04 0.37 -2.08 6.55 5.85 -0.97 -2.06 115.31 123.01 2wp0 h LEU 174 Ca -0.36 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.30 2wp0 h LEU 174 Cb 2.03 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.96 2wp0 h LEU 174 CO 0.08 0.43 0.00 -1.22 -0.34 0.00 0.00 178.44 177.40 2wp0 n TYR 175 N -4.33 0.60 -1.92 1.25 4.01 -0.39 -4.95 117.16 111.44 2wp0 n TYR 175 Ca 0.01 -0.30 -0.18 0.00 -0.16 0.00 0.00 57.90 57.27 2wp0 n TYR 175 Cb 0.21 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.20 2wp0 n TYR 175 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2wp0 n ASN 176 N 1.20 -5.17 0.01 7.72 5.15 -0.78 -4.85 115.26 118.54 2wp0 n ASN 176 Ca 0.19 0.22 0.13 0.00 -0.60 0.00 0.00 54.58 54.52 2wp0 n ASN 176 Cb 0.52 -4.24 0.49 0.00 -0.53 0.00 0.00 39.78 36.01 2wp0 n ASN 176 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2wp0 n LYS 177 N -2.59 0.03 -3.76 1.20 5.02 -0.24 -4.88 118.16 112.95 2wp0 n LYS 177 Ca -0.19 0.02 -0.13 0.00 -2.02 0.00 0.00 58.31 55.98 2wp0 n LYS 177 Cb 0.62 -1.53 -0.09 0.00 -0.02 0.00 0.00 35.03 34.01 2wp0 n LYS 177 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wp0 s VAL 178 N -3.01 0.05 -0.33 -0.18 1.01 -0.62 -4.99 120.40 112.31 2wp0 s VAL 178 Ca 0.13 -0.40 -0.09 0.00 0.00 0.00 0.00 61.98 61.62 2wp0 s VAL 178 Cb 0.18 -0.60 0.02 0.00 0.00 0.00 0.00 36.38 35.98 2wp0 s VAL 178 CO 0.59 -0.22 0.14 -0.89 0.00 0.00 0.00 175.10 174.72 2wp0 s THR 179 N -1.10 4.27 -2.97 3.92 2.01 -1.26 -4.50 115.64 116.00 2wp0 s THR 179 Ca -0.12 -0.78 0.24 0.00 0.31 0.00 0.00 61.69 61.34 2wp0 s THR 179 Cb -0.05 -3.30 0.21 0.00 0.01 0.00 0.00 72.50 69.37 2wp0 s THR 179 CO 0.04 -0.08 1.29 -0.11 -0.69 0.00 0.00 174.62 175.06