#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wpb n GLU 4 N 0.00 2.68 -1.93 -1.09 2.13 -1.26 -4.88 120.64 116.29 1wpb n GLU 4 Ca 0.00 0.98 -0.38 0.00 0.66 0.00 0.00 57.16 58.41 1wpb n GLU 4 Cb 0.00 -2.87 0.02 0.00 0.27 0.00 0.00 31.44 28.86 1wpb n GLU 4 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1wpb s SER 5 N 3.11 5.70 0.51 4.31 0.15 -1.26 -4.91 113.70 121.31 1wpb s SER 5 Ca 0.85 2.66 0.32 0.00 0.70 0.00 0.00 55.95 60.47 1wpb s SER 5 Cb -0.52 -2.63 1.44 0.00 -1.71 0.00 0.00 66.02 62.61 1wpb s SER 5 CO 0.40 -1.27 1.82 0.71 1.20 0.00 0.00 173.24 176.10 1wpb h THR 6 N 1.79 0.46 0.00 6.45 1.35 -1.90 -1.48 112.91 119.59 1wpb h THR 6 Ca -0.50 -0.03 -0.02 0.00 -0.55 0.00 0.00 66.41 65.30 1wpb h THR 6 Cb 1.28 0.37 -0.00 0.00 -1.73 0.00 0.00 68.15 68.07 1wpb h THR 6 CO 0.59 0.02 -0.12 0.24 -0.25 0.00 0.00 175.52 176.00 1wpb h MET 7 N 0.08 0.00 -0.00 4.72 2.86 -1.91 -1.85 114.93 118.83 1wpb h MET 7 Ca 0.54 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.18 1wpb h MET 7 Cb 1.98 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.64 1wpb h MET 7 CO -0.07 0.12 -0.02 0.39 1.06 0.00 0.00 176.91 178.39 1wpb n GLU 8 N -3.82 1.10 -1.82 1.72 -0.58 -0.56 -4.97 120.64 111.72 1wpb n GLU 8 Ca -0.02 -0.29 -0.33 0.00 -0.42 0.00 0.00 57.16 56.10 1wpb n GLU 8 Cb 0.22 -1.49 0.04 0.00 -0.57 0.00 0.00 31.44 29.63 1wpb n GLU 8 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wpb s MET 9 N -2.09 2.86 0.68 3.49 0.23 -0.70 -5.00 119.30 118.76 1wpb s MET 9 Ca 0.42 1.44 -0.10 0.00 -1.03 0.00 0.00 55.69 56.42 1wpb s MET 9 Cb 0.21 -1.95 0.01 0.00 -1.53 0.00 0.00 34.83 31.57 1wpb s MET 9 CO 0.38 -1.21 1.05 0.95 -2.03 0.00 0.00 175.02 174.16 1wpb s THR 10 N -2.23 3.58 0.36 3.16 -4.23 -1.26 -4.87 115.64 110.15 1wpb s THR 10 Ca 0.68 0.40 0.05 0.00 -1.18 0.00 0.00 61.69 61.64 1wpb s THR 10 Cb -0.21 -3.49 0.20 0.00 1.34 0.00 0.00 72.50 70.34 1wpb s THR 10 CO 0.39 -0.62 1.95 0.78 -0.54 0.00 0.00 174.62 176.58 1wpb h ASN 11 N -0.54 0.49 -0.95 3.99 2.35 -1.99 -1.14 115.58 117.80 1wpb h ASN 11 Ca -0.45 -0.06 0.02 0.00 -0.55 0.00 0.00 56.30 55.26 1wpb h ASN 11 Cb 1.25 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 39.44 1wpb h ASN 11 CO 0.63 0.48 0.62 0.00 -1.65 0.00 0.00 177.43 177.52 1wpb h ALA 12 N 1.59 1.23 -0.36 -0.83 0.00 -1.99 -1.41 119.26 117.49 1wpb h ALA 12 Ca 0.13 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 1wpb h ALA 12 Cb 0.17 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1wpb h ALA 12 CO -0.01 0.55 -0.35 1.96 0.00 0.00 0.00 179.25 181.39 1wpb h GLN 13 N 1.24 0.84 -0.74 0.00 4.20 -1.68 -0.18 115.11 118.80 1wpb h GLN 13 Ca 0.36 -0.42 0.08 0.00 0.06 0.00 0.00 58.65 58.73 1wpb h GLN 13 Cb -0.07 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.65 1wpb h GLN 13 CO -0.10 1.06 0.41 0.00 -0.67 0.00 0.00 178.83 179.52 1wpb h ARG 14 N 0.70 0.69 -0.32 1.46 2.47 -1.03 -0.74 114.38 117.61 1wpb h ARG 14 Ca 0.07 -0.04 -0.13 0.00 -1.26 0.00 0.00 59.98 58.61 1wpb h ARG 14 Cb 0.92 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 29.08 1wpb h ARG 14 CO 0.08 0.46 -0.32 1.25 0.56 0.00 0.00 179.97 182.00 1wpb h LEU 15 N 0.71 0.83 -0.48 3.04 5.85 -0.98 0.90 115.31 125.18 1wpb h LEU 15 Ca 0.34 -0.47 0.04 0.00 0.84 0.00 0.00 57.88 58.64 1wpb h LEU 15 Cb 0.28 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 1wpb h LEU 15 CO -0.22 1.13 0.24 0.40 -0.34 0.00 0.00 178.44 179.65 1wpb h ILE 16 N 0.54 0.95 -0.42 4.05 2.04 -0.78 -0.68 117.51 123.21 1wpb h ILE 16 Ca 0.05 -0.16 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 1wpb h ILE 16 Cb 0.90 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1wpb h ILE 16 CO 0.08 0.08 0.06 -0.07 0.00 0.00 0.00 178.15 178.31 1wpb h LEU 17 N 0.46 0.67 -0.65 1.44 3.38 -1.02 -0.41 115.31 119.18 1wpb h LEU 17 Ca 0.21 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.93 1wpb h LEU 17 Cb 0.13 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1wpb h LEU 17 CO -0.16 0.76 0.42 -1.28 0.09 0.00 0.00 178.44 178.28 1wpb h SER 18 N 0.55 0.71 -0.64 -0.43 0.87 -0.57 -0.70 113.55 113.35 1wpb h SER 18 Ca 0.13 -0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.64 1wpb h SER 18 Cb 0.38 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 1wpb h SER 18 CO 0.01 0.50 0.25 0.78 -0.53 0.00 0.00 176.83 177.85 1wpb h ASN 19 N 0.84 0.91 -0.40 6.23 2.35 -0.92 -2.28 115.58 122.31 1wpb h ASN 19 Ca 0.25 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1wpb h ASN 19 Cb -0.04 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.07 1wpb h ASN 19 CO -0.08 0.82 0.23 1.56 -1.65 0.00 0.00 177.43 178.31 1wpb h GLN 20 N 0.97 0.55 -0.25 0.81 4.20 0.34 -1.34 115.11 120.39 1wpb h GLN 20 Ca 0.22 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.80 1wpb h GLN 20 Cb 0.21 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 1wpb h GLN 20 CO -0.02 0.43 -0.16 1.88 -0.67 0.00 0.00 178.83 180.29 1wpb h TYR 21 N 0.52 0.46 -0.56 2.96 0.05 -0.96 0.16 116.97 119.59 1wpb h TYR 21 Ca 0.14 -0.07 -0.02 0.00 0.05 0.00 0.00 58.73 58.83 1wpb h TYR 21 Cb 0.03 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 37.62 1wpb h TYR 21 CO -0.03 0.57 0.27 0.87 -1.05 0.00 0.00 178.16 178.79 1wpb h LYS 22 N 0.39 0.81 -0.49 4.88 1.57 -1.11 -1.86 116.57 120.77 1wpb h LYS 22 Ca 0.07 -0.12 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 1wpb h LYS 22 Cb 0.51 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 1wpb h LYS 22 CO 0.03 0.67 -0.14 0.52 -0.57 0.00 0.00 179.45 179.96 1wpb h MET 23 N 0.76 0.94 -0.54 3.15 2.86 -0.58 -2.38 114.93 119.15 1wpb h MET 23 Ca 0.19 -0.35 -0.04 0.00 -2.06 0.00 0.00 59.70 57.44 1wpb h MET 23 Cb 0.13 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 1wpb h MET 23 CO -0.02 1.02 0.18 0.52 1.06 0.00 0.00 176.91 179.66 1wpb h MET 24 N 0.83 0.80 -0.52 1.72 2.86 -0.57 -0.78 114.93 119.28 1wpb h MET 24 Ca 0.13 -0.14 -0.09 0.00 -2.06 0.00 0.00 59.70 57.53 1wpb h MET 24 Cb 0.69 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.20 1wpb h MET 24 CO 0.05 0.69 -0.05 1.15 1.06 0.00 0.00 176.91 179.81 1wpb h THR 25 N 0.79 1.26 -0.43 2.22 2.02 -1.12 0.22 112.91 117.87 1wpb h THR 25 Ca 0.18 -1.15 -0.12 0.00 0.77 0.00 0.00 66.41 66.10 1wpb h THR 25 Cb 0.22 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1wpb h THR 25 CO -0.01 0.41 -0.19 0.24 0.37 0.00 0.00 175.52 176.33 1wpb h MET 26 N 0.83 0.85 0.00 6.66 2.86 -0.82 -2.16 114.93 123.15 1wpb h MET 26 Ca 0.15 -0.33 -0.18 0.00 -2.06 0.00 0.00 59.70 57.27 1wpb h MET 26 Cb 0.56 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.15 1wpb h MET 26 CO 0.03 0.97 -1.00 -0.07 1.06 0.00 0.00 176.91 177.90 1wpb h LEU 27 N 0.74 0.00 -5.92 1.22 3.38 -0.89 -3.39 115.31 110.45 1wpb h LEU 27 Ca 0.11 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.57 1wpb h LEU 27 Cb 0.72 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.07 1wpb h LEU 27 CO 0.06 0.76 -1.11 -0.67 0.09 0.00 0.00 178.44 177.57 1wpb n ASP 28 N -3.19 1.22 0.14 -0.43 2.03 0.76 -4.97 116.55 112.10 1wpb n ASP 28 Ca -0.03 -3.05 0.18 0.00 0.52 0.00 0.00 54.79 52.41 1wpb n ASP 28 Cb 0.87 -0.62 0.77 0.00 -0.72 0.00 0.00 41.12 41.43 1wpb n ASP 28 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1wpb h PRO 29 N 3.17 0.00 0.00 -0.67 0.13 -1.59 -1.11 132.00 131.93 1wpb h PRO 29 Ca 0.10 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1wpb h PRO 29 Cb 0.90 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 1wpb h PRO 29 CO 0.54 0.00 -0.01 0.00 -0.23 0.00 0.00 178.00 178.30 1wpb h ALA 30 N 1.68 1.61 -0.64 -0.56 0.00 -1.93 -1.82 119.26 117.59 1wpb h ALA 30 Ca 0.15 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.84 1wpb h ALA 30 Cb 0.76 -0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.42 1wpb h ALA 30 CO -0.00 0.01 0.22 0.09 0.00 0.00 0.00 179.25 179.57 1wpb n ASN 31 N -3.98 4.25 -0.33 0.00 3.02 -0.42 -4.69 115.26 113.12 1wpb n ASN 31 Ca -0.03 -3.32 0.16 0.00 -0.03 0.00 0.00 54.58 51.36 1wpb n ASN 31 Cb 0.09 -0.71 0.39 0.00 -0.61 0.00 0.00 39.78 38.94 1wpb n ASN 31 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wpb h ALA 32 N 2.13 1.87 -0.31 5.41 0.00 -1.44 -1.84 119.26 125.07 1wpb h ALA 32 Ca 0.26 0.07 -0.14 0.00 0.00 0.00 0.00 54.91 55.10 1wpb h ALA 32 Cb 2.18 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 1wpb h ALA 32 CO 0.66 -0.24 -0.39 0.93 0.00 0.00 0.00 179.25 180.21 1wpb h GLU 33 N 0.62 0.74 -0.35 0.00 4.39 -1.85 0.19 114.58 118.34 1wpb h GLU 33 Ca 0.57 -0.38 -0.01 0.00 0.34 0.00 0.00 59.36 59.88 1wpb h GLU 33 Cb 1.09 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.73 1wpb h GLU 33 CO -0.35 1.00 0.16 -0.09 -1.16 0.00 0.00 179.01 178.58 1wpb h ARG 34 N 0.61 0.50 -0.33 2.33 2.43 -1.73 -1.63 114.38 116.56 1wpb h ARG 34 Ca 0.05 -0.08 -0.17 0.00 -0.81 0.00 0.00 59.98 58.98 1wpb h ARG 34 Cb 0.93 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.39 1wpb h ARG 34 CO 0.09 0.46 -0.46 1.88 -1.51 0.00 0.00 179.97 180.43 1wpb h TYR 35 N 0.42 1.07 -0.63 2.20 0.05 -1.01 -2.76 116.97 116.31 1wpb h TYR 35 Ca 0.12 -0.35 -0.05 0.00 0.05 0.00 0.00 58.73 58.51 1wpb h TYR 35 Cb 0.12 -0.22 -0.03 0.00 1.01 0.00 0.00 36.73 37.62 1wpb h TYR 35 CO -0.01 1.17 0.21 -0.09 -1.05 0.00 0.00 178.16 178.38 1wpb h ARG 36 N 0.70 0.94 -0.25 4.88 9.65 -0.56 -0.35 114.38 129.39 1wpb h ARG 36 Ca 0.04 -0.18 0.01 0.00 -1.10 0.00 0.00 59.98 58.75 1wpb h ARG 36 Cb 1.05 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 29.46 1wpb h ARG 36 CO 0.11 0.80 0.14 -0.09 2.80 0.00 0.00 179.97 183.73 1wpb h ARG 37 N 0.92 0.29 -0.58 0.20 2.43 -1.25 -0.50 114.38 115.89 1wpb h ARG 37 Ca 0.21 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.32 1wpb h ARG 37 Cb 0.25 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1wpb h ARG 37 CO -0.01 0.19 0.20 -0.07 -1.51 0.00 0.00 179.97 178.77 1wpb h LEU 38 N 0.30 0.82 -0.88 3.80 3.38 -1.22 -1.79 115.31 119.71 1wpb h LEU 38 Ca 0.10 -0.19 0.04 0.00 0.09 0.00 0.00 57.88 57.91 1wpb h LEU 38 Cb -0.00 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.48 1wpb h LEU 38 CO -0.05 0.80 0.57 -0.61 0.09 0.00 0.00 178.44 179.24 1wpb h GLN 39 N 0.80 1.05 -0.44 1.13 4.15 -0.85 -0.35 115.11 120.61 1wpb h GLN 39 Ca 0.19 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.53 1wpb h GLN 39 Cb 0.25 -0.24 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 1wpb h GLN 39 CO -0.01 0.70 0.21 1.15 -1.93 0.00 0.00 178.83 178.95 1wpb h THR 40 N 1.08 1.18 -0.61 2.39 2.02 -0.66 0.54 112.91 118.85 1wpb h THR 40 Ca 0.36 -0.50 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 1wpb h THR 40 Cb 0.05 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 1wpb h THR 40 CO -0.13 0.19 0.34 0.40 0.37 0.00 0.00 175.52 176.69 1wpb h ILE 41 N 0.56 1.19 -0.08 3.11 2.04 -0.77 -0.05 117.51 123.52 1wpb h ILE 41 Ca 0.15 -0.48 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 1wpb h ILE 41 Cb 0.11 0.40 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1wpb h ILE 41 CO -0.02 0.21 -0.04 0.40 0.00 0.00 0.00 178.15 178.70 1wpb h ILE 42 N 0.83 1.33 -0.48 -0.67 1.08 -0.94 -0.98 117.51 117.68 1wpb h ILE 42 Ca 0.22 -1.08 -0.02 0.00 -0.39 0.00 0.00 64.86 63.59 1wpb h ILE 42 Cb 0.03 1.89 -0.02 0.00 -3.07 0.00 0.00 36.82 35.65 1wpb h ILE 42 CO -0.04 0.30 0.24 -0.33 -0.69 0.00 0.00 178.15 177.63 1wpb h GLU 43 N -0.22 0.69 -0.00 2.37 5.08 -0.64 -2.96 114.58 118.89 1wpb h GLU 43 Ca 0.02 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1wpb h GLU 43 Cb 0.50 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1wpb h GLU 43 CO 0.01 0.57 -0.16 0.54 -1.00 0.00 0.00 179.01 178.97 1wpb n ARG 44 N -4.63 0.66 -3.47 2.33 1.74 -0.05 -4.95 116.66 108.28 1wpb n ARG 44 Ca 0.02 -0.27 -0.20 0.00 -0.77 0.00 0.00 57.85 56.63 1wpb n ARG 44 Cb 0.11 -1.49 0.08 0.00 -1.02 0.00 0.00 32.46 30.14 1wpb n ARG 44 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wpb n GLY 45 N 1.31 -0.42 3.57 -0.13 0.00 -0.46 -4.89 105.19 104.18 1wpb n GLY 45 Ca 0.13 0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.90 1wpb n GLY 45 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wpb s TYR 46 N -3.33 1.93 0.30 1.61 2.02 -0.69 -4.87 117.35 114.31 1wpb s TYR 46 Ca 0.26 0.59 0.02 0.00 -0.37 0.00 0.00 57.07 57.57 1wpb s TYR 46 Cb -0.11 -4.24 0.47 0.00 -0.40 0.00 0.00 41.96 37.68 1wpb s TYR 46 CO 0.71 -2.28 1.81 0.78 -1.57 0.00 0.00 175.55 175.00 1wpb h GLY 47 N 14.66 0.66 0.91 0.71 0.00 -1.90 -1.02 103.07 117.10 1wpb h GLY 47 Ca -0.28 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.62 1wpb h GLY 47 CO 1.18 0.40 -0.09 -2.00 0.00 0.00 0.00 176.54 176.03 1wpb h LEU 48 N 0.57 -0.22 -1.33 3.11 5.85 -2.00 -1.70 115.31 119.59 1wpb h LEU 48 Ca 0.11 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 1wpb h LEU 48 Cb 0.43 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 1wpb h LEU 48 CO 0.02 -0.08 0.01 1.56 -0.34 0.00 0.00 178.44 179.61 1wpb h GLN 49 N -0.35 0.46 -0.92 1.25 7.50 -1.93 -1.78 115.11 119.33 1wpb h GLN 49 Ca -0.03 -0.09 -0.00 0.00 0.50 0.00 0.00 58.65 59.04 1wpb h GLN 49 Cb 0.27 -0.07 -0.05 0.00 0.05 0.00 0.00 27.48 27.68 1wpb h GLN 49 CO 0.04 0.48 0.58 0.52 -1.50 0.00 0.00 178.83 178.95 1wpb h MET 50 N 0.44 1.24 -0.60 1.46 2.86 -1.05 -0.97 114.93 118.32 1wpb h MET 50 Ca 0.10 -0.10 0.03 0.00 -2.06 0.00 0.00 59.70 57.67 1wpb h MET 50 Cb 0.27 -0.27 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 1wpb h MET 50 CO 0.01 0.85 0.37 -0.09 1.06 0.00 0.00 176.91 179.11 1wpb h ARG 51 N 1.27 0.70 -0.66 1.72 2.43 -0.89 -1.52 114.38 117.42 1wpb h ARG 51 Ca 0.33 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.47 1wpb h ARG 51 Cb -0.09 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.27 1wpb h ARG 51 CO -0.07 0.46 0.44 0.93 -1.51 0.00 0.00 179.97 180.23 1wpb h GLU 52 N 0.72 0.86 -0.60 0.20 5.08 -0.67 -1.38 114.58 118.79 1wpb h GLU 52 Ca 0.24 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.59 1wpb h GLU 52 Cb 0.03 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.04 1wpb h GLU 52 CO -0.10 0.57 0.35 -0.07 -1.00 0.00 0.00 179.01 178.76 1wpb h LEU 53 N 0.88 0.56 -1.25 1.33 3.38 -0.49 -2.27 115.31 117.45 1wpb h LEU 53 Ca 0.25 0.01 0.19 0.00 0.09 0.00 0.00 57.88 58.42 1wpb h LEU 53 Cb -0.08 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 40.48 1wpb h LEU 53 CO -0.06 0.38 0.61 0.44 0.09 0.00 0.00 178.44 179.90 1wpb h ASP 54 N 0.68 0.62 1.01 -0.43 3.32 -0.28 -1.57 116.42 119.79 1wpb h ASP 54 Ca 0.25 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.37 1wpb h ASP 54 Cb 0.07 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1wpb h ASP 54 CO -0.12 0.25 0.00 0.54 -1.72 0.00 0.00 179.24 178.18 1wpb n ARG 55 N -4.63 0.18 0.09 3.56 5.12 -0.86 -1.67 116.66 118.46 1wpb n ARG 55 Ca 0.21 0.28 0.11 0.00 -1.93 0.00 0.00 57.85 56.53 1wpb n ARG 55 Cb 0.61 -1.77 0.45 0.00 -1.16 0.00 0.00 32.46 30.59 1wpb n ARG 55 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1wpb n GLU 56 N -2.10 0.15 -4.11 5.56 1.02 -0.59 -4.75 120.64 115.83 1wpb n GLU 56 Ca 0.04 0.30 -0.35 0.00 -0.02 0.00 0.00 57.16 57.13 1wpb n GLU 56 Cb 0.31 -1.75 -0.13 0.00 -0.02 0.00 0.00 31.44 29.85 1wpb n GLU 56 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1wpb s PHE 57 N -3.17 3.00 0.14 -0.32 0.08 -0.67 -5.11 117.98 111.93 1wpb s PHE 57 Ca 0.07 -0.58 0.02 0.00 0.12 0.00 0.00 56.93 56.56 1wpb s PHE 57 Cb 0.11 -2.06 0.02 0.00 -0.57 0.00 0.00 43.02 40.51 1wpb s PHE 57 CO 0.43 -0.30 0.13 0.41 -0.10 0.00 0.00 175.22 175.78 1wpb n GLY 58 N 4.29 2.67 3.24 4.36 0.00 -1.26 -5.03 105.19 113.46 1wpb n GLY 58 Ca -0.17 -2.19 -0.13 0.00 0.00 0.00 0.00 46.02 43.53 1wpb n GLY 58 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wpb s GLU 59 N -2.59 0.43 -0.23 1.61 4.04 -1.26 -5.09 118.70 115.62 1wpb s GLU 59 Ca 0.10 0.44 -0.04 0.00 0.04 0.00 0.00 54.97 55.51 1wpb s GLU 59 Cb -0.01 0.21 0.08 0.00 0.02 0.00 0.00 34.13 34.44 1wpb s GLU 59 CO 0.06 -0.06 0.14 -1.17 -1.84 0.00 0.00 175.26 172.39 1wpb s LEU 60 N 0.07 0.32 0.56 1.83 2.96 -1.26 -5.12 118.68 118.04 1wpb s LEU 60 Ca -0.01 -0.83 -0.21 0.00 -0.22 0.00 0.00 54.13 52.86 1wpb s LEU 60 Cb -0.03 -0.15 -0.04 0.00 0.50 0.00 0.00 46.19 46.47 1wpb s LEU 60 CO 0.01 -0.38 1.35 -0.54 -1.32 0.00 0.00 176.35 175.46 1wpb s LYS 61 N 2.16 3.05 0.28 1.98 1.02 -1.26 -4.71 119.74 122.27 1wpb s LYS 61 Ca 0.06 2.21 0.02 0.00 0.02 0.00 0.00 55.97 58.28 1wpb s LYS 61 Cb -0.16 -2.19 0.65 0.00 -0.52 0.00 0.00 37.83 35.60 1wpb s LYS 61 CO -0.22 -1.25 1.73 1.49 -0.92 0.00 0.00 175.35 176.18 1wpb h GLU 62 N 1.32 0.52 -0.42 1.68 4.81 -2.00 -1.13 114.58 119.36 1wpb h GLU 62 Ca -0.51 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 58.60 1wpb h GLU 62 Cb 1.31 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 1wpb h GLU 62 CO 0.57 0.34 -0.09 0.93 -0.73 0.00 0.00 179.01 180.03 1wpb h GLU 63 N 0.54 0.73 -0.39 1.92 4.39 -1.99 -1.11 114.58 118.67 1wpb h GLU 63 Ca 0.52 -0.23 -0.07 0.00 0.34 0.00 0.00 59.36 59.92 1wpb h GLU 63 Cb 0.87 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.44 1wpb h GLU 63 CO -0.44 0.81 -0.04 1.15 -1.16 0.00 0.00 179.01 179.33 1wpb h THR 64 N 0.67 1.27 -0.47 1.13 2.02 -1.60 -0.54 112.91 115.40 1wpb h THR 64 Ca 0.12 -1.08 0.09 0.00 0.77 0.00 0.00 66.41 66.31 1wpb h THR 64 Cb 0.54 1.19 -0.08 0.00 -1.74 0.00 0.00 68.15 68.06 1wpb h THR 64 CO 0.03 0.36 -0.03 0.00 0.37 0.00 0.00 175.52 176.25 1wpb h ARG 66 N 0.08 0.67 -0.44 0.00 3.08 -1.01 -1.88 114.38 114.87 1wpb h ARG 66 Ca 0.23 -0.15 -0.09 0.00 0.07 0.00 0.00 59.98 60.04 1wpb h ARG 66 Cb 0.35 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1wpb h ARG 66 CO -0.41 0.67 -0.09 1.15 -1.07 0.00 0.00 179.97 180.21 1wpb h THR 67 N 0.63 1.27 -0.25 2.04 2.02 -0.69 0.90 112.91 118.84 1wpb h THR 67 Ca 0.13 -1.19 0.00 0.00 0.77 0.00 0.00 66.41 66.12 1wpb h THR 67 Cb 0.36 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 1wpb h THR 67 CO 0.01 0.41 0.16 0.40 0.37 0.00 0.00 175.52 176.87 1wpb h ILE 68 N 0.68 1.08 -0.55 3.11 2.04 -1.15 -0.64 117.51 122.07 1wpb h ILE 68 Ca 0.11 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 65.82 1wpb h ILE 68 Cb 0.62 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 1wpb h ILE 68 CO 0.04 0.08 0.34 0.40 0.00 0.00 0.00 178.15 179.01 1wpb h ILE 69 N 0.33 1.08 -0.87 -0.67 2.04 -1.15 -2.29 117.51 115.98 1wpb h ILE 69 Ca 0.09 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.77 1wpb h ILE 69 Cb -0.01 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.35 1wpb h ILE 69 CO -0.02 0.13 0.57 -0.78 0.00 0.00 0.00 178.15 178.05 1wpb h ASP 70 N 0.69 0.89 -0.47 1.72 3.58 -0.45 0.12 116.42 122.50 1wpb h ASP 70 Ca 0.22 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.63 1wpb h ASP 70 Cb -0.01 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 40.83 1wpb h ASP 70 CO -0.08 0.59 0.13 0.40 -2.88 0.00 0.00 179.24 177.39 1wpb h ILE 71 N 1.02 1.23 -0.39 2.25 2.04 -0.82 0.40 117.51 123.24 1wpb h ILE 71 Ca 0.37 -0.78 -0.04 0.00 1.00 0.00 0.00 64.86 65.40 1wpb h ILE 71 Cb 0.14 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1wpb h ILE 71 CO -0.13 0.28 0.09 0.24 0.00 0.00 0.00 178.15 178.63 1wpb h MET 72 N 0.62 0.62 -0.76 2.37 2.86 -0.87 -1.91 114.93 117.86 1wpb h MET 72 Ca 0.15 -0.15 0.03 0.00 -2.06 0.00 0.00 59.70 57.67 1wpb h MET 72 Cb 0.29 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.83 1wpb h MET 72 CO -0.00 0.66 0.50 1.49 1.06 0.00 0.00 176.91 180.62 1wpb h GLU 73 N 0.48 0.91 -0.46 1.72 4.57 -0.54 -0.67 114.58 120.59 1wpb h GLU 73 Ca 0.12 -0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.27 1wpb h GLU 73 Cb 0.32 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 28.68 1wpb h GLU 73 CO 0.00 0.60 0.27 1.98 -1.18 0.00 0.00 179.01 180.69 1wpb h MET 74 N 0.94 0.53 -0.10 1.92 4.05 0.18 -0.28 114.93 122.17 1wpb h MET 74 Ca 0.30 -0.03 -0.11 0.00 -0.28 0.00 0.00 59.70 59.58 1wpb h MET 74 Cb 0.03 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 30.70 1wpb h MET 74 CO -0.08 0.35 -0.44 1.88 0.23 0.00 0.00 176.91 178.85 1wpb h TYR 75 N 0.54 0.29 0.14 1.39 0.05 -0.57 0.25 116.97 119.06 1wpb h TYR 75 Ca 0.18 -0.08 0.01 0.00 0.05 0.00 0.00 58.73 58.89 1wpb h TYR 75 Cb 0.01 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 37.68 1wpb h TYR 75 CO -0.07 0.64 -0.16 1.25 -1.05 0.00 0.00 178.16 178.77 1wpb h HIS 76 N 0.20 -0.42 -0.26 4.88 -0.00 -0.75 0.88 115.15 119.67 1wpb h HIS 76 Ca 0.02 0.00 0.06 0.00 -0.00 0.00 0.00 60.37 60.45 1wpb h HIS 76 Cb 0.86 0.17 -0.06 0.00 -0.00 0.00 0.00 27.41 28.37 1wpb h HIS 76 CO 0.02 -0.24 -0.15 0.00 -0.00 0.00 0.00 177.93 177.55 1wpb h ALA 77 N 0.48 0.05 0.58 5.26 0.00 -0.54 -0.76 119.26 124.33 1wpb h ALA 77 Ca 0.01 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1wpb h ALA 77 Cb 0.33 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1wpb h ALA 77 CO -0.06 -0.56 -0.30 -0.07 0.00 0.00 0.00 179.25 178.27 1wpb h LEU 78 N -0.12 -0.71 -0.42 0.00 3.38 -0.38 -1.37 115.31 115.68 1wpb h LEU 78 Ca 0.14 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.18 1wpb h LEU 78 Cb 0.34 0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 1wpb h LEU 78 CO -0.34 -0.49 0.18 -0.74 0.09 0.00 0.00 178.44 177.14 1wpb h HIS 79 N -0.80 0.33 -0.68 1.13 2.76 -0.72 0.10 115.15 117.27 1wpb h HIS 79 Ca -0.08 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.06 1wpb h HIS 79 Cb 0.63 -0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.47 1wpb h HIS 79 CO -0.05 0.15 0.22 0.28 -1.30 0.00 0.00 177.93 177.23 1wpb h VAL 80 N 0.37 1.25 -0.41 5.26 2.07 -1.10 0.13 116.25 123.83 1wpb h VAL 80 Ca 0.19 -0.87 0.01 0.00 0.82 0.00 0.00 66.70 66.86 1wpb h VAL 80 Cb 0.14 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 1wpb h VAL 80 CO -0.16 0.34 0.25 0.28 0.02 0.00 0.00 177.57 178.30 1wpb h SER 81 N 0.99 0.42 -0.51 0.57 0.02 -0.98 -1.82 113.55 112.24 1wpb h SER 81 Ca 0.22 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.12 1wpb h SER 81 Cb 0.29 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 1wpb h SER 81 CO -0.01 0.30 0.13 -0.25 -1.14 0.00 0.00 176.83 175.86 1wpb h TRP 82 N 0.51 0.85 0.00 3.45 7.01 -0.65 -2.14 115.95 124.98 1wpb h TRP 82 Ca 0.16 -0.10 -0.01 0.00 2.11 0.00 0.00 58.89 61.05 1wpb h TRP 82 Cb -0.01 -0.24 -0.00 0.00 -2.10 0.00 0.00 29.16 26.80 1wpb h TRP 82 CO -0.06 0.75 -0.06 0.66 -2.79 0.00 0.00 178.44 176.94 1wpb h SER 83 N 0.70 0.00 -0.04 2.65 4.64 -0.56 -1.45 113.55 119.51 1wpb h SER 83 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1wpb h SER 83 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1wpb h SER 83 CO 0.00 0.06 0.00 0.59 -0.87 0.00 0.00 176.83 176.61 1wpb n ASN 84 N -3.48 2.12 -4.71 4.97 3.02 -0.70 -4.90 115.26 111.57 1wpb n ASN 84 Ca -0.02 -1.71 -0.42 0.00 -0.03 0.00 0.00 54.58 52.41 1wpb n ASN 84 Cb 0.18 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.31 1wpb n ASN 84 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wpb s LEU 85 N -1.97 4.38 -0.16 3.41 1.43 -0.55 -4.96 118.68 120.27 1wpb s LEU 85 Ca 0.34 1.63 -0.24 0.00 -1.03 0.00 0.00 54.13 54.83 1wpb s LEU 85 Cb 0.21 -3.52 -0.24 0.00 0.03 0.00 0.00 46.19 42.67 1wpb s LEU 85 CO 0.32 -0.21 0.52 0.06 0.23 0.00 0.00 176.35 177.26 1wpb h GLN 86 N 6.60 0.05 -5.36 1.70 3.07 -1.90 -3.38 115.11 115.89 1wpb h GLN 86 Ca -0.41 -0.08 -0.65 0.00 0.09 0.00 0.00 58.65 57.59 1wpb h GLN 86 Cb 1.22 0.03 -0.15 0.00 0.08 0.00 0.00 27.48 28.65 1wpb h GLN 86 CO 0.74 1.04 0.29 0.34 0.09 0.00 0.00 178.83 181.34 1wpb s ASP 87 N -6.63 6.27 -0.02 0.06 3.68 -1.26 -4.88 116.67 113.89 1wpb s ASP 87 Ca -0.23 -0.70 0.08 0.00 2.13 0.00 0.00 52.55 53.84 1wpb s ASP 87 Cb 0.02 -2.36 0.27 0.00 -1.45 0.00 0.00 42.92 39.40 1wpb s ASP 87 CO 0.67 -1.07 1.18 0.00 0.13 0.00 0.00 175.17 176.08 1wpb n GLN 88 N 6.80 1.84 -3.27 4.34 6.02 -1.26 -4.85 117.38 127.00 1wpb n GLN 88 Ca -0.03 -1.09 -0.20 0.00 -0.01 0.00 0.00 57.00 55.67 1wpb n GLN 88 Cb 0.46 -1.33 -0.02 0.00 1.02 0.00 0.00 30.24 30.37 1wpb n GLN 88 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1wpb n GLN 89 N 0.34 -2.75 0.00 -1.09 3.00 -1.26 0.25 117.38 115.87 1wpb n GLN 89 Ca 0.10 0.33 0.00 0.00 -0.01 0.00 0.00 57.00 57.42 1wpb n GLN 89 Cb 0.32 -4.96 0.00 0.00 0.00 0.00 0.00 30.24 25.59 1wpb n GLN 89 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1wpb n SER 90 N -2.09 0.00 -4.70 1.08 7.64 -1.26 -4.88 113.62 109.41 1wpb n SER 90 Ca -0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1wpb n SER 90 Cb 0.53 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.70 1wpb n SER 90 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1wpb s ILE 91 N 0.00 2.57 0.13 0.44 1.01 0.70 -4.98 121.20 121.07 1wpb s ILE 91 Ca 0.00 0.14 -0.31 0.00 0.00 0.00 0.00 60.65 60.48 1wpb s ILE 91 Cb 0.00 -3.09 -0.10 0.00 0.01 0.00 0.00 42.46 39.27 1wpb s ILE 91 CO 0.00 0.00 1.83 -0.62 0.00 0.00 0.00 174.94 176.15 1wpb s ASP 92 N 2.42 6.42 0.26 3.58 -1.08 -1.26 -4.92 116.67 122.08 1wpb s ASP 92 Ca 0.78 2.77 -0.02 0.00 -0.52 0.00 0.00 52.55 55.57 1wpb s ASP 92 Cb -0.45 -2.57 0.44 0.00 -1.46 0.00 0.00 42.92 38.88 1wpb s ASP 92 CO 0.35 -1.01 1.84 -0.08 0.52 0.00 0.00 175.17 176.79 1wpb h GLU 93 N 8.53 0.94 -0.99 4.34 4.81 -1.96 -1.64 114.58 128.60 1wpb h GLU 93 Ca -0.46 -0.06 0.26 0.00 -0.13 0.00 0.00 59.36 58.97 1wpb h GLU 93 Cb 1.22 -0.21 -0.07 0.00 0.63 0.00 0.00 28.75 30.32 1wpb h GLU 93 CO 0.95 0.62 0.67 -0.09 -0.73 0.00 0.00 179.01 180.43 1wpb h ARG 94 N 0.96 0.25 0.00 1.92 2.43 -1.93 0.69 114.38 118.70 1wpb h ARG 94 Ca 0.44 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.59 1wpb h ARG 94 Cb 0.34 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1wpb h ARG 94 CO -0.23 0.16 0.00 0.00 -1.51 0.00 0.00 179.97 178.40 1wpb h ARG 95 N 0.26 0.00 -0.18 0.20 2.47 -1.68 -2.90 114.38 112.54 1wpb h ARG 95 Ca 0.51 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 59.17 1wpb h ARG 95 Cb 1.55 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.84 1wpb h ARG 95 CO -0.15 0.00 -0.12 0.28 0.56 0.00 0.00 179.97 180.53 1wpb n VAL 96 N -2.90 2.27 -5.19 2.04 0.31 0.19 -4.90 118.33 110.15 1wpb n VAL 96 Ca 0.01 -2.53 -0.31 0.00 -0.01 0.00 0.00 64.34 61.50 1wpb n VAL 96 Cb 0.32 -0.27 -0.17 0.00 -0.91 0.00 0.00 33.84 32.81 1wpb n VAL 96 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1wpb s THR 97 N -3.06 2.00 -0.04 2.52 2.01 -0.91 -4.12 115.64 114.04 1wpb s THR 97 Ca 0.40 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.10 1wpb s THR 97 Cb 0.35 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 1wpb s THR 97 CO 0.01 0.55 1.24 0.12 -0.69 0.00 0.00 174.62 175.86 1wpb s PHE 98 N 0.23 3.12 -0.43 4.92 5.36 -1.26 -4.89 117.98 125.03 1wpb s PHE 98 Ca -0.15 1.13 0.18 0.00 -0.96 0.00 0.00 56.93 57.13 1wpb s PHE 98 Cb -0.17 -3.47 -0.24 0.00 -0.34 0.00 0.00 43.02 38.80 1wpb s PHE 98 CO 0.07 -1.56 0.57 1.28 -1.46 0.00 0.00 175.22 174.13 1wpb n LEU 99 N 5.20 0.42 0.00 6.12 4.77 -1.26 -4.87 117.00 127.38 1wpb n LEU 99 Ca 0.11 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1wpb n LEU 99 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1wpb n LEU 99 CO 0.56 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.33 1wpb n GLY 100 N 1.44 0.26 3.29 -0.72 0.00 -1.26 -3.58 105.19 104.62 1wpb n GLY 100 Ca -0.00 -1.74 -0.15 0.00 0.00 0.00 0.00 46.02 44.13 1wpb n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wpb s PHE 101 N 0.00 1.39 -0.37 1.61 0.08 -0.13 -4.62 117.98 115.93 1wpb s PHE 101 Ca 0.00 -0.99 -0.27 0.00 0.12 0.00 0.00 56.93 55.79 1wpb s PHE 101 Cb 0.00 -0.80 0.02 0.00 -0.57 0.00 0.00 43.02 41.67 1wpb s PHE 101 CO 0.00 -0.15 1.00 0.34 -0.10 0.00 0.00 175.22 176.31 1wpb s ASP 102 N -3.24 6.74 0.24 1.36 2.15 -1.25 0.15 116.67 122.83 1wpb s ASP 102 Ca 0.27 0.69 -0.05 0.00 0.43 0.00 0.00 52.55 53.90 1wpb s ASP 102 Cb 0.06 -2.50 0.45 0.00 -0.30 0.00 0.00 42.92 40.64 1wpb s ASP 102 CO 0.07 -0.92 1.71 0.00 -0.17 0.00 0.00 175.17 175.85 1wpb h ALA 103 N 8.48 1.00 -0.19 3.66 0.00 -1.91 0.67 119.26 130.97 1wpb h ALA 103 Ca -0.22 0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1wpb h ALA 103 Cb 1.07 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1wpb h ALA 103 CO 1.02 -0.28 -0.33 0.00 0.00 0.00 0.00 179.25 179.67 1wpb h ALA 104 N 1.57 0.29 -0.00 0.00 0.00 -1.96 -3.31 119.26 115.85 1wpb h ALA 104 Ca 0.41 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wpb h ALA 104 Cb 0.66 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1wpb h ALA 104 CO -0.45 0.33 -0.09 0.25 0.00 0.00 0.00 179.25 179.30 1wpb n THR 105 N -4.32 0.00 -2.43 0.00 -2.24 -1.17 -4.70 114.28 99.42 1wpb n THR 105 Ca -0.06 -0.46 -0.14 0.00 -2.27 0.00 0.00 64.05 61.13 1wpb n THR 105 Cb 0.49 1.04 0.03 0.00 -2.10 0.00 0.00 70.33 69.79 1wpb n THR 105 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1wpb n GLU 106 N -0.48 2.67 -0.09 -0.78 1.02 0.23 -4.90 120.64 118.32 1wpb n GLU 106 Ca 0.01 -3.87 -0.03 0.00 -0.02 0.00 0.00 57.16 53.25 1wpb n GLU 106 Cb 0.07 -1.94 0.19 0.00 -0.02 0.00 0.00 31.44 29.75 1wpb n GLU 106 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wpb h ALA 107 N 2.44 1.17 -0.27 0.62 0.00 -1.64 -0.08 119.26 121.51 1wpb h ALA 107 Ca 0.13 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1wpb h ALA 107 Cb 1.36 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1wpb h ALA 107 CO 0.52 0.54 -0.02 0.00 0.00 0.00 0.00 179.25 180.29 1wpb h ARG 108 N 0.70 0.40 0.01 0.00 3.08 -1.91 -0.99 114.38 115.68 1wpb h ARG 108 Ca 0.14 -0.08 -0.17 0.00 0.07 0.00 0.00 59.98 59.94 1wpb h ARG 108 Cb 0.41 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.41 1wpb h ARG 108 CO 0.02 0.45 -0.67 1.88 -1.07 0.00 0.00 179.97 180.57 1wpb h TYR 109 N 0.39 0.66 -0.77 3.04 0.05 -1.46 -2.58 116.97 116.30 1wpb h TYR 109 Ca 0.09 -0.36 -0.05 0.00 0.05 0.00 0.00 58.73 58.45 1wpb h TYR 109 Cb 0.29 -0.07 -0.03 0.00 1.01 0.00 0.00 36.73 37.93 1wpb h TYR 109 CO 0.01 1.19 0.27 1.25 -1.05 0.00 0.00 178.16 179.83 1wpb h LEU 110 N -0.06 1.09 -1.42 3.88 5.85 -1.04 -2.06 115.31 121.54 1wpb h LEU 110 Ca -0.09 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.45 1wpb h LEU 110 Cb 1.38 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 1wpb h LEU 110 CO 0.13 0.99 0.40 1.23 -0.34 0.00 0.00 178.44 180.84 1wpb h GLY 111 N 1.13 0.83 1.12 3.75 0.00 -1.13 -2.25 103.07 106.51 1wpb h GLY 111 Ca 0.25 -0.31 -0.22 0.00 0.00 0.00 0.00 47.33 47.06 1wpb h GLY 111 CO -0.01 0.29 -0.78 -1.82 0.00 0.00 0.00 176.54 174.22 1wpb h TYR 112 N 0.79 1.00 -0.25 5.60 3.20 -1.02 -0.68 116.97 125.60 1wpb h TYR 112 Ca 0.22 -0.46 0.06 0.00 3.14 0.00 0.00 58.73 61.69 1wpb h TYR 112 Cb -0.06 -0.15 -0.07 0.00 1.54 0.00 0.00 36.73 37.99 1wpb h TYR 112 CO -0.00 1.29 -0.27 0.28 -1.64 0.00 0.00 178.16 177.82 1wpb h VAL 113 N 0.43 0.35 -0.99 1.81 2.07 -1.24 0.18 116.25 118.84 1wpb h VAL 113 Ca -0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.49 1wpb h VAL 113 Cb 1.42 0.35 -0.06 0.00 -1.52 0.00 0.00 31.29 31.47 1wpb h VAL 113 CO 0.16 0.00 0.65 0.03 0.02 0.00 0.00 177.57 178.43 1wpb h ARG 114 N -0.27 1.21 -0.28 1.57 3.08 -1.33 -0.99 114.38 117.37 1wpb h ARG 114 Ca 0.14 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 1wpb h ARG 114 Cb 0.49 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1wpb h ARG 114 CO -0.41 0.80 0.07 0.35 -1.07 0.00 0.00 179.97 179.72 1wpb h PHE 115 N 1.25 0.46 -0.43 3.04 3.57 -0.55 0.17 116.94 124.44 1wpb h PHE 115 Ca 0.40 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.77 1wpb h PHE 115 Cb 0.01 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 1wpb h PHE 115 CO -0.00 0.51 -0.05 0.52 -2.23 0.00 0.00 178.31 177.06 1wpb h MET 116 N 0.28 0.73 0.00 1.11 2.86 0.01 -0.07 114.93 119.85 1wpb h MET 116 Ca 0.09 -0.21 -0.03 0.00 -2.06 0.00 0.00 59.70 57.49 1wpb h MET 116 Cb 0.27 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 1wpb h MET 116 CO -0.00 0.78 -0.17 0.28 1.06 0.00 0.00 176.91 178.85 1wpb h VAL 117 N 0.68 1.18 0.00 -2.22 2.07 -1.09 -0.89 116.25 115.98 1wpb h VAL 117 Ca 0.13 -1.95 -0.15 0.00 0.82 0.00 0.00 66.70 65.55 1wpb h VAL 117 Cb 0.49 2.29 -0.02 0.00 -1.52 0.00 0.00 31.29 32.53 1wpb h VAL 117 CO 0.03 0.40 -0.88 0.78 0.02 0.00 0.00 177.57 177.91 1wpb h ASN 118 N -1.00 0.00 0.00 0.57 2.35 -0.71 -2.47 115.58 114.32 1wpb h ASN 118 Ca -0.04 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1wpb h ASN 118 Cb 0.78 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.14 1wpb h ASN 118 CO -0.03 0.67 -1.05 0.52 -1.65 0.00 0.00 177.43 175.90 1wpb n VAL 119 N -3.17 1.50 0.25 2.81 0.31 -0.09 -4.62 118.33 115.31 1wpb n VAL 119 Ca -0.02 0.12 0.13 0.00 -0.01 0.00 0.00 64.34 64.56 1wpb n VAL 119 Cb 0.83 -2.33 0.57 0.00 -0.91 0.00 0.00 33.84 32.00 1wpb n VAL 119 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1wpb h GLU 120 N -1.00 0.00 0.00 5.55 4.39 -1.41 -3.47 114.58 118.65 1wpb h GLU 120 Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1wpb h GLU 120 Cb 1.02 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.67 1wpb h GLU 120 CO -0.01 0.13 0.00 0.41 -1.16 0.00 0.00 179.01 178.38 1wpb n GLY 121 N 0.02 0.49 3.83 -3.84 0.00 -0.80 -4.99 105.19 99.91 1wpb n GLY 121 Ca 0.00 -0.65 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 1wpb n GLY 121 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wpb s ARG 122 N -1.21 4.12 -1.50 1.61 3.52 -0.41 -4.18 118.95 120.90 1wpb s ARG 122 Ca 0.00 0.74 -0.04 0.00 -0.13 0.00 0.00 55.73 56.30 1wpb s ARG 122 Cb 0.00 -2.70 0.02 0.00 -1.56 0.00 0.00 34.95 30.71 1wpb s ARG 122 CO 0.00 0.30 0.43 0.66 -0.81 0.00 0.00 175.30 175.88 1wpb n TYR 123 N 0.27 -1.73 0.30 5.12 4.01 -1.26 -3.96 117.16 119.92 1wpb n TYR 123 Ca -0.00 0.38 0.18 0.00 -0.16 0.00 0.00 57.90 58.29 1wpb n TYR 123 Cb 0.52 -3.96 0.80 0.00 -0.31 0.00 0.00 39.34 36.39 1wpb n TYR 123 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 1wpb h THR 124 N -0.95 0.00 -0.00 -0.72 1.35 -1.88 -2.14 112.91 108.57 1wpb h THR 124 Ca -0.48 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 1wpb h THR 124 Cb 1.34 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 1wpb h THR 124 CO 0.55 0.00 -0.20 1.41 -0.25 0.00 0.00 175.52 177.02 1wpb n HIS 125 N -2.88 0.00 -1.88 4.73 8.25 -1.26 -4.87 115.22 117.30 1wpb n HIS 125 Ca -0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 1wpb n HIS 125 Cb 0.20 -0.28 -0.01 0.00 1.12 0.00 0.00 29.99 31.03 1wpb n HIS 125 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1wpb s PHE 126 N -2.76 2.69 -0.35 4.41 0.40 -0.81 -4.98 117.98 116.59 1wpb s PHE 126 Ca 0.20 1.23 -0.29 0.00 -0.60 0.00 0.00 56.93 57.47 1wpb s PHE 126 Cb 0.19 -3.94 0.00 0.00 0.51 0.00 0.00 43.02 39.78 1wpb s PHE 126 CO 0.56 -2.72 1.45 0.34 0.70 0.00 0.00 175.22 175.54 1wpb s ASP 127 N -0.24 6.39 0.00 1.36 -1.08 -1.26 -4.89 116.67 116.94 1wpb s ASP 127 Ca 0.52 1.07 0.27 0.00 -0.52 0.00 0.00 52.55 53.90 1wpb s ASP 127 Cb -0.45 -2.54 1.18 0.00 -1.46 0.00 0.00 42.92 39.66 1wpb s ASP 127 CO 0.61 -1.35 1.88 0.00 0.52 0.00 0.00 175.17 176.83 1wpb n ALA 128 N 8.60 2.25 -4.05 3.66 0.00 -1.26 -4.83 120.51 124.89 1wpb n ALA 128 Ca 0.17 -0.10 -0.33 0.00 0.00 0.00 0.00 53.44 53.19 1wpb n ALA 128 Cb 0.47 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 1wpb n ALA 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wpb n GLY 129 N 1.27 -0.44 3.77 0.00 0.00 -1.26 -1.39 105.19 107.13 1wpb n GLY 129 Ca 0.07 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.34 1wpb n GLY 129 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wpb n THR 130 N -4.57 0.00 -2.16 2.61 -2.24 -1.26 -4.59 114.28 102.07 1wpb n THR 130 Ca -0.24 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.57 1wpb n THR 130 Cb 0.65 0.00 0.09 0.00 -2.10 0.00 0.00 70.33 68.97 1wpb n THR 130 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1wpb n HIS 131 N -1.32 0.23 -3.59 4.78 8.25 -1.26 -5.03 115.22 117.29 1wpb n HIS 131 Ca 0.00 -1.08 -0.22 0.00 -0.26 0.00 0.00 57.72 56.16 1wpb n HIS 131 Cb 0.00 -0.20 0.05 0.00 1.12 0.00 0.00 29.99 30.95 1wpb n HIS 131 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wpb n GLY 132 N -0.25 -0.62 2.37 -1.41 0.00 -1.05 -1.64 105.19 102.58 1wpb n GLY 132 Ca 0.13 0.29 -0.06 0.00 0.00 0.00 0.00 46.02 46.38 1wpb n GLY 132 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wpb n PHE 133 N -4.04 0.00 -2.64 1.61 3.72 -0.49 -4.92 117.46 110.71 1wpb n PHE 133 Ca -0.21 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.76 1wpb n PHE 133 Cb 0.65 -1.49 -0.02 0.00 -0.94 0.00 0.00 39.48 37.68 1wpb n PHE 133 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1wpb s ASN 134 N -2.50 6.67 0.39 4.37 2.47 -0.65 -0.96 114.94 124.72 1wpb s ASN 134 Ca 0.00 0.54 0.21 0.00 0.42 0.00 0.00 52.86 54.03 1wpb s ASN 134 Cb 0.00 -2.54 0.56 0.00 -1.45 0.00 0.00 41.25 37.83 1wpb s ASN 134 CO 0.00 -1.16 1.67 0.00 -3.72 0.00 0.00 177.10 173.90 1wpb h ALA 135 N 8.99 0.90 0.00 1.71 0.00 0.14 -3.44 119.26 127.55 1wpb h ALA 135 Ca -0.23 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1wpb h ALA 135 Cb 1.06 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1wpb h ALA 135 CO 1.10 0.35 0.00 1.04 0.00 0.00 0.00 179.25 181.74 1wpb n GLN 136 N -3.29 -0.48 -3.76 0.00 6.02 -1.25 -4.92 117.38 109.70 1wpb n GLN 136 Ca 0.01 0.12 -0.13 0.00 -0.01 0.00 0.00 57.00 56.99 1wpb n GLN 136 Cb 0.54 -3.77 -0.09 0.00 1.02 0.00 0.00 30.24 27.95 1wpb n GLN 136 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1wpb s THR 137 N -2.00 0.06 0.25 5.09 -1.32 -1.26 -4.97 115.64 111.48 1wpb s THR 137 Ca 0.00 -0.47 -0.30 0.00 -1.21 0.00 0.00 61.69 59.71 1wpb s THR 137 Cb 0.00 -0.61 -0.10 0.00 -1.51 0.00 0.00 72.50 70.28 1wpb s THR 137 CO 0.00 -0.26 1.40 -2.84 -2.21 0.00 0.00 174.62 170.71 1wpb s PRO 138 N -1.32 4.30 0.00 7.08 0.02 -1.26 -3.80 135.00 140.01 1wpb s PRO 138 Ca -0.14 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.13 1wpb s PRO 138 Cb -0.05 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.35 1wpb s PRO 138 CO 0.04 -0.37 0.00 -1.33 -0.33 0.00 0.00 177.00 175.01 1wpb n MET 139 N 2.26 5.08 0.02 5.54 2.81 -1.26 -4.84 117.12 126.73 1wpb n MET 139 Ca 0.06 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.83 1wpb n MET 139 Cb 0.41 -0.50 -0.06 0.00 -0.71 0.00 0.00 33.22 32.36 1wpb n MET 139 CO 0.00 0.00 0.00 2.35 1.51 0.00 0.00 175.97 179.83 1wpb h TRP 140 N 0.00 -1.13 -0.40 2.03 2.91 -1.91 -0.51 115.95 116.94 1wpb h TRP 140 Ca 0.00 0.04 0.04 0.00 1.13 0.00 0.00 58.89 60.10 1wpb h TRP 140 Cb 0.00 0.51 -0.04 0.00 -0.51 0.00 0.00 29.16 29.12 1wpb h TRP 140 CO 0.00 -0.47 0.17 0.93 -1.03 0.00 0.00 178.44 178.04 1wpb h GLU 141 N -0.50 0.34 -0.52 2.65 5.08 -2.00 -1.53 114.58 118.10 1wpb h GLU 141 Ca 0.07 -0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.49 1wpb h GLU 141 Cb 0.62 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.73 1wpb h GLU 141 CO -0.36 0.22 0.14 -0.22 -1.00 0.00 0.00 179.01 177.80 1wpb h LYS 142 N 0.35 0.28 -0.23 2.33 1.63 -1.80 -2.11 116.57 117.02 1wpb h LYS 142 Ca 0.18 -0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 59.89 1wpb h LYS 142 Cb 0.12 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.68 1wpb h LYS 142 CO -0.15 0.18 -0.15 1.88 -3.45 0.00 0.00 179.45 177.76 1wpb h TYR 143 N 0.29 0.41 -0.60 1.91 0.05 -0.49 -1.37 116.97 117.17 1wpb h TYR 143 Ca 0.26 -0.06 0.01 0.00 0.05 0.00 0.00 58.73 58.98 1wpb h TYR 143 Cb 0.33 -0.11 -0.03 0.00 1.01 0.00 0.00 36.73 37.93 1wpb h TYR 143 CO -0.21 0.53 0.40 1.96 -1.05 0.00 0.00 178.16 179.79 1wpb h GLN 144 N 0.36 0.79 -0.45 4.88 1.08 -0.70 -0.07 115.11 121.00 1wpb h GLN 144 Ca 0.07 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.19 1wpb h GLN 144 Cb 0.48 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.71 1wpb h GLN 144 CO 0.03 0.52 0.18 0.00 -0.95 0.00 0.00 178.83 178.62 1wpb h ARG 145 N 0.81 0.68 -0.51 1.46 3.08 -0.69 -2.01 114.38 117.20 1wpb h ARG 145 Ca 0.22 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 1wpb h ARG 145 Cb -0.09 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 1wpb h ARG 145 CO -0.05 0.62 0.24 0.52 -1.07 0.00 0.00 179.97 180.23 1wpb h MET 146 N 0.59 0.74 -0.92 0.04 2.86 -1.09 -2.42 114.93 114.72 1wpb h MET 146 Ca 0.15 -0.11 0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1wpb h MET 146 Cb 0.19 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 31.67 1wpb h MET 146 CO -0.01 0.62 0.60 -0.07 1.06 0.00 0.00 176.91 179.11 1wpb h LEU 147 N 0.68 1.00 -0.81 1.22 3.38 -0.91 -0.14 115.31 119.73 1wpb h LEU 147 Ca 0.17 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.14 1wpb h LEU 147 Cb 0.13 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1wpb h LEU 147 CO -0.02 0.69 0.53 -1.13 0.09 0.00 0.00 178.44 178.59 1wpb h ASN 148 N 1.16 0.94 -0.06 -0.43 -1.24 -0.87 -1.17 115.58 113.90 1wpb h ASN 148 Ca 0.36 -0.03 -0.14 0.00 0.71 0.00 0.00 56.30 57.20 1wpb h ASN 148 Cb 0.00 -0.23 0.01 0.00 0.73 0.00 0.00 38.32 38.83 1wpb h ASN 148 CO -0.11 0.69 -0.51 0.58 -1.29 0.00 0.00 177.43 176.79 1wpb h VAL 149 N 1.10 1.40 -0.11 2.57 2.07 -1.16 -3.08 116.25 119.04 1wpb h VAL 149 Ca 0.29 -1.90 0.02 0.00 0.82 0.00 0.00 66.70 65.94 1wpb h VAL 149 Cb -0.11 2.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 1wpb h VAL 149 CO -0.06 0.56 -0.04 -0.25 0.02 0.00 0.00 177.57 177.79 1wpb h TRP 150 N 0.00 -0.10 0.00 1.57 7.01 -0.85 -1.85 115.95 121.74 1wpb h TRP 150 Ca -0.05 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.96 1wpb h TRP 150 Cb 1.18 0.06 0.00 0.00 -2.10 0.00 0.00 29.16 28.30 1wpb h TRP 150 CO 0.13 -0.07 0.00 0.72 -2.79 0.00 0.00 178.44 176.42 1wpb n HIS 151 N -5.17 0.59 1.04 2.65 8.25 -0.46 -1.75 115.22 120.38 1wpb n HIS 151 Ca -0.04 0.24 0.13 0.00 -0.26 0.00 0.00 57.72 57.78 1wpb n HIS 151 Cb 0.10 -0.88 0.39 0.00 1.12 0.00 0.00 29.99 30.73 1wpb n HIS 151 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1wpb n ALA 152 N -1.70 3.10 -2.40 -1.41 0.00 -0.72 -4.85 120.51 112.53 1wpb n ALA 152 Ca 0.02 -0.27 -0.42 0.00 0.00 0.00 0.00 53.44 52.77 1wpb n ALA 152 Cb 0.21 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.38 1wpb n ALA 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wpb h PRO 154 N 6.46 0.31 -6.09 0.00 0.13 -1.88 -3.35 132.00 127.57 1wpb h PRO 154 Ca -0.42 -0.04 -0.60 0.00 -0.87 0.00 0.00 66.00 64.07 1wpb h PRO 154 Cb 1.21 -0.06 -0.28 0.00 0.13 0.00 0.00 31.00 32.01 1wpb h PRO 154 CO 0.78 0.32 -0.85 0.50 -0.23 0.00 0.00 178.00 178.52 1wpb s ARG 155 N -5.04 1.54 0.01 0.86 3.52 -1.26 -5.05 118.95 113.54 1wpb s ARG 155 Ca -0.06 -0.86 0.22 0.00 -0.13 0.00 0.00 55.73 54.90 1wpb s ARG 155 Cb 0.16 -1.58 -0.25 0.00 -1.56 0.00 0.00 34.95 31.72 1wpb s ARG 155 CO 0.72 0.42 0.64 1.04 -0.81 0.00 0.00 175.30 177.32 1wpb n GLN 156 N 2.18 0.56 -4.39 5.12 6.02 -1.26 -4.89 117.38 120.73 1wpb n GLN 156 Ca -0.16 -0.12 -0.24 0.00 -0.01 0.00 0.00 57.00 56.47 1wpb n GLN 156 Cb 0.53 -1.57 -0.09 0.00 1.02 0.00 0.00 30.24 30.13 1wpb n GLN 156 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1wpb s TYR 157 N -3.43 2.49 -1.20 1.08 2.02 -1.26 -4.66 117.35 112.39 1wpb s TYR 157 Ca -0.05 -0.34 -0.05 0.00 -0.37 0.00 0.00 57.07 56.26 1wpb s TYR 157 Cb 0.14 -1.23 -0.02 0.00 -0.40 0.00 0.00 41.96 40.45 1wpb s TYR 157 CO 0.88 0.61 0.83 0.72 -1.57 0.00 0.00 175.55 177.02 1wpb n HIS 158 N -0.81 -2.10 -2.53 2.71 8.25 -1.26 -4.94 115.22 114.54 1wpb n HIS 158 Ca -0.05 0.80 -0.36 0.00 -0.26 0.00 0.00 57.72 57.85 1wpb n HIS 158 Cb 0.61 -4.31 -0.04 0.00 1.12 0.00 0.00 29.99 27.37 1wpb n HIS 158 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1wpb s LEU 159 N -6.27 4.12 0.82 2.41 1.43 -1.26 -5.05 118.68 114.87 1wpb s LEU 159 Ca 0.19 2.04 -0.12 0.00 -1.03 0.00 0.00 54.13 55.21 1wpb s LEU 159 Cb -0.04 -4.21 0.09 0.00 0.03 0.00 0.00 46.19 42.06 1wpb s LEU 159 CO 0.79 -0.53 1.13 -0.94 0.23 0.00 0.00 176.35 177.03 1wpb s SER 160 N -1.58 4.32 0.27 2.29 1.04 -1.26 -4.81 113.70 113.98 1wpb s SER 160 Ca 0.59 1.01 -0.02 0.00 0.48 0.00 0.00 55.95 58.00 1wpb s SER 160 Cb -0.22 -1.63 0.37 0.00 0.10 0.00 0.00 66.02 64.64 1wpb s SER 160 CO 0.27 -2.05 1.84 0.00 0.98 0.00 0.00 173.24 174.28 1wpb h ALA 161 N -1.15 1.21 -0.54 5.32 0.00 -1.95 -1.71 119.26 120.44 1wpb h ALA 161 Ca -0.48 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.20 1wpb h ALA 161 Cb 1.31 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1wpb h ALA 161 CO 0.63 0.56 0.13 -0.91 0.00 0.00 0.00 179.25 179.66 1wpb h ASN 162 N 0.89 0.82 -0.08 0.00 -0.26 -1.99 -2.45 115.58 112.52 1wpb h ASN 162 Ca 0.20 -0.23 0.00 0.00 -0.56 0.00 0.00 56.30 55.71 1wpb h ASN 162 Cb 0.23 -0.22 -0.00 0.00 -1.06 0.00 0.00 38.32 37.27 1wpb h ASN 162 CO -0.01 0.84 0.05 -0.33 -1.06 0.00 0.00 177.43 176.92 1wpb h GLU 163 N 0.77 0.11 -0.75 0.81 5.08 -1.81 -1.81 114.58 116.98 1wpb h GLU 163 Ca 0.17 -0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.68 1wpb h GLU 163 Cb 0.34 -0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.46 1wpb h GLU 163 CO 0.00 0.09 0.25 0.82 -1.00 0.00 0.00 179.01 179.17 1wpb h ILE 164 N 0.09 0.58 -0.41 3.13 2.04 -1.23 -1.13 117.51 120.59 1wpb h ILE 164 Ca 0.03 -0.12 -0.10 0.00 1.00 0.00 0.00 64.86 65.67 1wpb h ILE 164 Cb 0.01 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 1wpb h ILE 164 CO -0.01 0.06 -0.13 0.78 0.00 0.00 0.00 178.15 178.86 1wpb h ASN 165 N 0.36 0.82 -0.84 1.72 2.35 -1.16 -0.50 115.58 118.33 1wpb h ASN 165 Ca 0.42 -0.38 0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1wpb h ASN 165 Cb 0.69 -0.22 -0.05 0.00 0.05 0.00 0.00 38.32 38.78 1wpb h ASN 165 CO -0.46 1.01 0.54 1.56 -1.65 0.00 0.00 177.43 178.43 1wpb h GLN 166 N 0.62 1.02 0.53 0.81 4.20 -0.65 -1.46 115.11 120.18 1wpb h GLN 166 Ca 0.10 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1wpb h GLN 166 Cb 0.67 -0.23 0.01 0.00 0.30 0.00 0.00 27.48 28.22 1wpb h GLN 166 CO 0.05 0.67 -0.25 0.82 -0.67 0.00 0.00 178.83 179.45 1wpb h ILE 167 N 1.05 0.18 -0.24 2.54 2.04 -0.63 -2.52 117.51 119.93 1wpb h ILE 167 Ca 0.34 -0.48 0.06 0.00 1.00 0.00 0.00 64.86 65.78 1wpb h ILE 167 Cb 0.01 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.35 1wpb h ILE 167 CO -0.12 0.03 0.17 0.16 0.00 0.00 0.00 178.15 178.39 1wpb h ILE 168 N -1.11 0.89 0.00 -0.67 3.07 -1.14 -2.05 117.51 116.51 1wpb h ILE 168 Ca -0.07 -0.01 0.00 0.00 1.55 0.00 0.00 64.86 66.33 1wpb h ILE 168 Cb 0.60 0.87 0.00 0.00 -0.27 0.00 0.00 36.82 38.01 1wpb h ILE 168 CO 0.12 0.00 -0.17 0.59 -1.05 0.00 0.00 178.15 177.65 1wpb n ASN 169 N -4.47 0.60 0.00 2.16 3.02 -0.55 -5.04 115.26 110.97 1wpb n ASN 169 Ca 0.03 0.40 0.00 0.00 -0.03 0.00 0.00 54.58 54.98 1wpb n ASN 169 Cb 0.30 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 1wpb n ASN 169 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64