#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s2x n ASP 1 N 0.00 3.65 -0.19 -1.34 5.75 -1.26 -3.70 116.55 119.47 1s2x n ASP 1 Ca 0.00 -3.00 0.09 0.00 -0.01 0.00 0.00 54.79 51.87 1s2x n ASP 1 Cb 0.00 -0.71 0.15 0.00 -1.03 0.00 0.00 41.12 39.53 1s2x n ASP 1 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1s2x n GLU 2 N -0.41 1.39 -3.99 0.11 -0.58 -1.26 -5.03 120.64 110.87 1s2x n GLU 2 Ca 0.36 -2.70 -0.22 0.00 -0.42 0.00 0.00 57.16 54.19 1s2x n GLU 2 Cb 1.22 -1.53 -0.05 0.00 -0.57 0.00 0.00 31.44 30.51 1s2x n GLU 2 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1s2x s LEU 3 N -2.93 3.57 0.00 -4.62 1.43 -1.24 -4.73 118.68 110.16 1s2x s LEU 3 Ca 0.33 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 1s2x s LEU 3 Cb 0.30 -2.13 0.00 0.00 0.03 0.00 0.00 46.19 44.39 1s2x s LEU 3 CO 0.02 -0.22 0.00 0.61 0.23 0.00 0.00 176.35 176.99 1s2x n GLY 4 N -1.24 0.76 3.84 -3.19 0.00 -1.26 -4.43 105.19 99.67 1s2x n GLY 4 Ca -0.04 -0.43 -0.34 0.00 0.00 0.00 0.00 46.02 45.20 1s2x n GLY 4 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1s2x n PHE 5 N -2.39 -1.80 -0.96 1.61 7.35 -1.26 -4.40 117.46 115.61 1s2x n PHE 5 Ca 0.00 0.44 -0.34 0.00 -0.76 0.00 0.00 57.45 56.79 1s2x n PHE 5 Cb 0.00 -3.01 0.09 0.00 0.35 0.00 0.00 39.48 36.91 1s2x n PHE 5 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 1s2x n ASN 6 N -2.39 -2.68 -0.08 -2.13 3.02 -1.26 -4.64 115.26 105.10 1s2x n ASN 6 Ca -0.16 0.37 0.08 0.00 -0.03 0.00 0.00 54.58 54.84 1s2x n ASN 6 Cb 0.60 -1.11 0.44 0.00 -0.61 0.00 0.00 39.78 39.10 1s2x n ASN 6 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 1s2x h GLU 7 N -1.12 0.52 -0.13 3.52 9.09 -1.98 0.23 114.58 124.71 1s2x h GLU 7 Ca -0.44 -0.03 -0.16 0.00 0.05 0.00 0.00 59.36 58.78 1s2x h GLU 7 Cb 1.31 -0.12 -0.01 0.00 -1.65 0.00 0.00 28.75 28.28 1s2x h GLU 7 CO 0.34 0.35 -0.61 0.00 0.05 0.00 0.00 179.01 179.14 1s2x h ALA 8 N 1.69 0.71 -0.11 1.06 0.00 -1.99 -0.28 119.26 120.34 1s2x h ALA 8 Ca 0.25 -0.54 -0.17 0.00 0.00 0.00 0.00 54.91 54.44 1s2x h ALA 8 Cb 0.29 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1s2x h ALA 8 CO -0.07 0.71 -0.66 1.49 0.00 0.00 0.00 179.25 180.72 1s2x h GLU 9 N 0.33 0.46 -0.50 0.00 4.57 -1.70 -2.37 114.58 115.36 1s2x h GLU 9 Ca -0.01 -0.34 -0.06 0.00 -1.18 0.00 0.00 59.36 57.78 1s2x h GLU 9 Cb 1.15 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.78 1s2x h GLU 9 CO 0.11 0.96 0.07 0.00 -1.18 0.00 0.00 179.01 178.97 1s2x h ARG 10 N 0.33 0.83 0.00 1.92 3.08 -0.82 -2.83 114.38 116.89 1s2x h ARG 10 Ca -0.02 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 59.76 1s2x h ARG 10 Cb 1.22 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 1s2x h ARG 10 CO 0.12 0.83 -0.22 0.37 -1.07 0.00 0.00 179.97 180.00 1s2x h GLN 11 N 0.70 0.00 -0.23 0.04 5.75 -0.93 -2.03 115.11 118.41 1s2x h GLN 11 Ca 0.15 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.48 1s2x h GLN 11 Cb 0.41 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.96 1s2x h GLN 11 CO 0.01 0.22 -0.55 0.87 -2.65 0.00 0.00 178.83 176.73 1s2x h LYS 12 N 0.00 0.70 -0.02 1.69 1.79 -1.19 -2.00 116.57 117.54 1s2x h LYS 12 Ca -0.00 -0.45 -0.14 0.00 -2.18 0.00 0.00 60.65 57.88 1s2x h LYS 12 Cb 0.50 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.19 1s2x h LYS 12 CO 0.03 1.07 -0.62 0.82 -1.08 0.00 0.00 179.45 179.66 1s2x h ILE 13 N 0.54 1.43 0.55 1.86 2.04 -1.27 0.32 117.51 122.98 1s2x h ILE 13 Ca 0.01 -2.09 -0.03 0.00 1.00 0.00 0.00 64.86 63.75 1s2x h ILE 13 Cb 1.12 2.11 0.01 0.00 -0.74 0.00 0.00 36.82 39.32 1s2x h ILE 13 CO 0.11 0.61 -0.26 -0.07 0.00 0.00 0.00 178.15 178.53 1s2x h LEU 14 N 0.07 -0.63 -1.10 1.44 3.38 -1.19 -2.77 115.31 114.51 1s2x h LEU 14 Ca -0.01 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.92 1s2x h LEU 14 Cb 1.12 0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.98 1s2x h LEU 14 CO 0.09 -0.29 0.61 0.44 0.09 0.00 0.00 178.44 179.38 1s2x h ASP 15 N -0.99 1.05 -0.84 -0.43 3.32 -1.39 -0.62 116.42 116.53 1s2x h ASP 15 Ca -0.08 -0.03 0.04 0.00 0.02 0.00 0.00 57.03 56.98 1s2x h ASP 15 Cb 0.64 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.88 1s2x h ASP 15 CO 0.12 0.76 0.55 -1.28 -1.72 0.00 0.00 179.24 177.68 1s2x h SER 16 N 1.24 0.90 -0.51 6.45 0.87 -0.97 -2.88 113.55 118.64 1s2x h SER 16 Ca 0.34 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 1s2x h SER 16 Cb -0.14 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.61 1s2x h SER 16 CO -0.07 0.62 0.00 0.59 -0.53 0.00 0.00 176.83 177.43 1s2x n ASN 17 N -4.45 3.63 0.00 6.23 3.02 -0.89 -4.65 115.26 118.15 1s2x n ASN 17 Ca 0.11 -2.15 0.13 0.00 -0.03 0.00 0.00 54.58 52.64 1s2x n ASN 17 Cb 0.11 -0.39 0.69 0.00 -0.61 0.00 0.00 39.78 39.58 1s2x n ASN 17 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1s2x n SER 18 N 0.90 0.00 -0.05 6.41 3.41 -0.29 -3.79 113.62 120.21 1s2x n SER 18 Ca 0.19 -0.26 -0.15 0.00 -0.26 0.00 0.00 58.87 58.39 1s2x n SER 18 Cb 0.60 -0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 1s2x n SER 18 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1s2x h SER 19 N 0.00 0.91 0.00 4.04 0.87 -1.82 -2.75 113.55 114.80 1s2x h SER 19 Ca 0.00 -0.52 0.00 0.00 -1.23 0.00 0.00 61.79 60.04 1s2x h SER 19 Cb 0.19 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 1s2x h SER 19 CO 0.00 1.31 0.00 0.18 -0.53 0.00 0.00 176.83 177.79 1s2x n LEU 20 N -3.97 0.60 -0.67 2.23 4.77 -1.25 -4.92 117.00 113.78 1s2x n LEU 20 Ca -0.05 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 1s2x n LEU 20 Cb 0.66 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 1s2x n LEU 20 CO 0.51 0.11 -0.06 0.54 -1.33 0.00 0.00 177.39 177.15 1s2x n ARG 22 N 1.34 -0.76 -1.16 3.23 1.74 -1.04 -4.90 116.66 115.11 1s2x n ARG 22 Ca 0.00 0.93 -0.06 0.00 -0.77 0.00 0.00 57.85 57.96 1s2x n ARG 22 Cb 0.08 -0.58 -0.02 0.00 -1.02 0.00 0.00 32.46 30.91 1s2x n ARG 22 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1s2x n ASN 23 N 0.21 -4.27 -0.20 0.55 5.03 -1.26 -4.92 115.26 110.39 1s2x n ASN 23 Ca 0.00 0.14 -0.00 0.00 0.87 0.00 0.00 54.58 55.59 1s2x n ASN 23 Cb 0.00 -2.27 0.10 0.00 -1.02 0.00 0.00 39.78 36.59 1s2x n ASN 23 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1s2x h ALA 24 N 0.00 0.78 -0.36 5.41 0.00 -1.98 0.25 119.26 123.35 1s2x h ALA 24 Ca -0.12 0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1s2x h ALA 24 Cb 0.57 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1s2x h ALA 24 CO 0.17 -0.18 -0.26 -0.91 0.00 0.00 0.00 179.25 178.07 1s2x h ASN 25 N 0.42 0.77 0.17 0.00 4.21 -2.00 -1.66 115.58 117.49 1s2x h ASN 25 Ca 0.30 -0.29 -0.11 0.00 1.21 0.00 0.00 56.30 57.41 1s2x h ASN 25 Cb 0.36 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.33 1s2x h ASN 25 CO -0.29 0.99 -0.41 -0.33 -1.29 0.00 0.00 177.43 176.10 1s2x h GLU 26 N 0.64 0.32 -0.31 0.81 3.07 -1.76 -0.30 114.58 117.06 1s2x h GLU 26 Ca 0.08 -0.15 -0.05 0.00 -0.50 0.00 0.00 59.36 58.74 1s2x h GLU 26 Cb 0.78 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.67 1s2x h GLU 26 CO 0.06 0.68 0.01 0.28 -1.40 0.00 0.00 179.01 178.64 1s2x h VAL 27 N 0.26 1.25 -0.05 3.13 2.07 -0.85 -1.15 116.25 120.91 1s2x h VAL 27 Ca 0.02 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.63 1s2x h VAL 27 Cb 0.84 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.85 1s2x h VAL 27 CO 0.07 0.30 0.03 -0.09 0.02 0.00 0.00 177.57 177.89 1s2x h ARG 28 N 0.33 0.07 -0.42 1.57 1.12 -1.09 0.05 114.38 116.01 1s2x h ARG 28 Ca 0.09 -0.01 0.03 0.00 -1.11 0.00 0.00 59.98 58.98 1s2x h ARG 28 Cb 0.41 -0.01 -0.03 0.00 -0.01 0.00 0.00 29.97 30.33 1s2x h ARG 28 CO 0.01 0.10 0.22 -0.44 -3.11 0.00 0.00 179.97 176.75 1s2x h ASP 29 N 0.02 0.32 -0.41 -3.80 3.45 -1.00 0.12 116.42 115.12 1s2x h ASP 29 Ca 0.02 0.02 -0.15 0.00 0.43 0.00 0.00 57.03 57.35 1s2x h ASP 29 Cb 0.05 -0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 38.77 1s2x h ASP 29 CO -0.00 0.23 -0.32 0.50 -1.57 0.00 0.00 179.24 178.08 1s2x h LYS 30 N 0.44 0.95 -0.34 3.56 3.64 -1.09 -1.07 116.57 122.66 1s2x h LYS 30 Ca 0.18 -0.47 -0.01 0.00 -1.27 0.00 0.00 60.65 59.08 1s2x h LYS 30 Cb 0.08 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 1s2x h LYS 30 CO -0.12 1.13 0.16 0.35 -2.27 0.00 0.00 179.45 178.70 1s2x h PHE 31 N 0.78 0.49 -0.00 1.91 3.04 -0.58 -1.27 116.94 121.31 1s2x h PHE 31 Ca 0.08 -0.03 0.01 0.00 3.98 0.00 0.00 57.97 62.02 1s2x h PHE 31 Cb 0.91 -0.15 -0.02 0.00 2.56 0.00 0.00 35.95 39.25 1s2x h PHE 31 CO 0.06 0.43 -0.08 0.82 -2.02 0.00 0.00 178.31 177.52 1s2x h ILE 32 N 0.41 0.80 -0.64 1.41 1.08 -0.59 0.46 117.51 120.43 1s2x h ILE 32 Ca 0.12 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.67 1s2x h ILE 32 Cb 0.12 0.80 -0.04 0.00 -3.07 0.00 0.00 36.82 34.63 1s2x h ILE 32 CO -0.01 0.00 0.42 1.56 -0.69 0.00 0.00 178.15 179.43 1s2x h GLN 33 N -0.13 0.54 0.00 2.37 1.08 -1.08 0.13 115.11 118.01 1s2x h GLN 33 Ca 0.03 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1s2x h GLN 33 Cb 0.18 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.48 1s2x h GLN 33 CO -0.08 0.36 -0.91 0.09 -0.95 0.00 0.00 178.83 177.33 1s2x n ASN 34 N -4.48 0.66 0.00 1.46 5.03 -0.49 -4.54 115.26 112.91 1s2x n ASN 34 Ca 0.10 0.01 0.00 0.00 0.87 0.00 0.00 54.58 55.56 1s2x n ASN 34 Cb 0.30 0.54 0.00 0.00 -1.02 0.00 0.00 39.78 39.60 1s2x n ASN 34 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1s2x n TYR 35 N -2.15 0.00 0.18 3.10 4.01 0.08 -4.88 117.16 117.50 1s2x n TYR 35 Ca 0.02 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.78 1s2x n TYR 35 Cb 0.46 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.50 1s2x n TYR 35 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1s2x n ALA 36 N -0.51 2.49 0.08 -0.72 0.00 0.42 -4.58 120.51 117.69 1s2x n ALA 36 Ca 0.00 -0.43 0.01 0.00 0.00 0.00 0.00 53.44 53.02 1s2x n ALA 36 Cb 0.00 -0.14 0.34 0.00 0.00 0.00 0.00 19.45 19.65 1s2x n ALA 36 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1s2x h THR 37 N 0.64 1.20 0.00 0.00 1.35 -1.77 -2.82 112.91 111.50 1s2x h THR 37 Ca 0.00 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 1s2x h THR 37 Cb 0.16 1.17 0.00 0.00 -1.73 0.00 0.00 68.15 67.75 1s2x h THR 37 CO 0.00 0.27 0.00 0.77 -0.25 0.00 0.00 175.52 176.31 1s2x h SER 38 N 0.32 0.00 -0.90 5.36 4.64 -1.92 -2.41 113.55 118.64 1s2x h SER 38 Ca 0.06 0.00 0.21 0.00 -0.47 0.00 0.00 61.79 61.59 1s2x h SER 38 Cb 0.40 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.43 1s2x h SER 38 CO 0.02 0.00 0.60 -0.07 -0.87 0.00 0.00 176.83 176.51 1s2x h LEU 39 N 0.00 0.38 -1.86 5.97 3.38 -1.70 0.14 115.31 121.62 1s2x h LEU 39 Ca 0.00 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1s2x h LEU 39 Cb 0.14 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1s2x h LEU 39 CO 0.00 0.15 -0.12 0.50 0.09 0.00 0.00 178.44 179.06 1s2x h LYS 40 N 0.38 0.00 -0.74 1.13 3.64 0.15 -1.33 116.57 119.80 1s2x h LYS 40 Ca 0.46 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.79 1s2x h LYS 40 Cb 1.20 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.99 1s2x h LYS 40 CO -0.17 0.12 0.06 -0.25 -2.27 0.00 0.00 179.45 176.95 1s2x n ASP 41 N -4.09 4.35 -4.77 4.20 10.43 0.48 -4.54 116.55 122.62 1s2x n ASP 41 Ca -0.02 -2.74 -0.41 0.00 2.57 0.00 0.00 54.79 54.18 1s2x n ASP 41 Cb 0.21 -0.65 -0.01 0.00 1.84 0.00 0.00 41.12 42.51 1s2x n ASP 41 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 1s2x s SER 42 N -0.58 6.32 0.22 -2.24 0.01 -0.50 -4.91 113.70 112.03 1s2x s SER 42 Ca 0.40 3.04 0.04 0.00 1.31 0.00 0.00 55.95 60.74 1s2x s SER 42 Cb 0.31 -2.65 0.19 0.00 0.21 0.00 0.00 66.02 64.08 1s2x s SER 42 CO 0.11 -0.92 1.52 0.78 0.41 0.00 0.00 173.24 175.14 1s2x h ASN 43 N 3.80 0.26 -5.04 2.44 -0.26 -1.91 -3.47 115.58 111.39 1s2x h ASN 43 Ca -0.49 -0.16 0.12 0.00 -0.56 0.00 0.00 56.30 55.21 1s2x h ASN 43 Cb 1.23 -0.08 -0.10 0.00 -1.06 0.00 0.00 38.32 38.31 1s2x h ASN 43 CO 0.71 0.85 0.42 1.51 -1.06 0.00 0.00 177.43 179.86 1s2x s ASP 44 N -6.90 -0.29 0.28 5.81 -4.77 -1.26 -5.01 116.67 104.52 1s2x s ASP 44 Ca -0.04 -0.26 -0.01 0.00 -3.30 0.00 0.00 52.55 48.94 1s2x s ASP 44 Cb 0.12 0.50 0.64 0.00 -1.09 0.00 0.00 42.92 43.08 1s2x s ASP 44 CO 0.80 -0.88 1.62 -0.65 0.70 0.00 0.00 175.17 176.77 1s2x h PRO 45 N 2.00 0.12 0.00 2.11 0.11 -1.93 0.58 132.00 135.00 1s2x h PRO 45 Ca -0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1s2x h PRO 45 Cb 1.25 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1s2x h PRO 45 CO 0.28 0.08 -0.46 1.04 -0.21 0.00 0.00 178.00 178.74 1s2x n GLN 46 N -5.33 0.26 0.08 1.05 1.13 -1.26 -2.14 117.38 111.18 1s2x n GLN 46 Ca 0.19 0.11 -0.09 0.00 -1.94 0.00 0.00 57.00 55.27 1s2x n GLN 46 Cb 0.64 -1.70 -0.01 0.00 0.11 0.00 0.00 30.24 29.28 1s2x n GLN 46 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 1s2x h ASP 47 N 0.00 0.29 -0.00 1.08 3.58 -1.40 -0.60 116.42 119.37 1s2x h ASP 47 Ca 0.00 -0.23 0.02 0.00 0.42 0.00 0.00 57.03 57.23 1s2x h ASP 47 Cb 0.72 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.67 1s2x h ASP 47 CO 0.00 1.03 -0.09 0.15 -2.88 0.00 0.00 179.24 177.45 1s2x h PHE 48 N 0.12 -0.23 -0.15 0.28 3.04 -0.86 -0.70 116.94 118.44 1s2x h PHE 48 Ca -0.05 0.01 -0.10 0.00 3.98 0.00 0.00 57.97 61.81 1s2x h PHE 48 Cb 1.51 0.10 -0.01 0.00 2.56 0.00 0.00 35.95 40.11 1s2x h PHE 48 CO 0.03 -0.14 -0.33 -0.07 -2.02 0.00 0.00 178.31 175.78 1s2x h LEU 49 N -0.16 0.32 -0.84 0.59 3.38 -1.31 0.44 115.31 117.73 1s2x h LEU 49 Ca 0.04 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1s2x h LEU 49 Cb 0.20 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1s2x h LEU 49 CO -0.10 0.64 0.38 -0.09 0.09 0.00 0.00 178.44 179.36 1s2x h ARG 50 N 0.27 1.22 0.00 1.13 9.65 -0.96 0.49 114.38 126.18 1s2x h ARG 50 Ca 0.03 -0.19 -0.11 0.00 -1.10 0.00 0.00 59.98 58.61 1s2x h ARG 50 Cb 0.72 -0.21 -0.02 0.00 -1.39 0.00 0.00 29.97 29.07 1s2x h ARG 50 CO 0.05 0.95 -0.53 0.00 2.80 0.00 0.00 179.97 183.25 1s2x h ARG 51 N 1.20 0.00 -0.20 0.20 3.08 0.40 -2.27 114.38 116.80 1s2x h ARG 51 Ca 0.28 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.21 1s2x h ARG 51 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1s2x h ARG 51 CO -0.03 0.53 -0.36 0.28 -1.07 0.00 0.00 179.97 179.32 1s2x h VAL 52 N 0.00 1.33 -0.48 2.04 2.07 0.32 -0.97 116.25 120.56 1s2x h VAL 52 Ca -0.01 -1.58 0.10 0.00 0.82 0.00 0.00 66.70 66.03 1s2x h VAL 52 Cb 1.09 1.86 -0.09 0.00 -1.52 0.00 0.00 31.29 32.63 1s2x h VAL 52 CO 0.07 0.49 -0.15 1.56 0.02 0.00 0.00 177.57 179.56 1s2x h GLN 53 N 0.26 -0.03 -0.43 1.57 4.20 -0.83 -0.86 115.11 118.98 1s2x h GLN 53 Ca 0.01 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1s2x h GLN 53 Cb 0.95 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.72 1s2x h GLN 53 CO 0.08 -0.02 0.19 1.49 -0.67 0.00 0.00 178.83 179.90 1s2x h GLU 54 N -0.03 0.61 -0.64 1.46 4.57 -1.31 0.16 114.58 119.41 1s2x h GLU 54 Ca 0.23 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.32 1s2x h GLU 54 Cb 0.39 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 1s2x h GLU 54 CO -0.51 0.49 0.35 1.25 -1.18 0.00 0.00 179.01 179.41 1s2x h LEU 55 N 0.61 0.80 -0.84 1.64 5.85 -0.57 0.22 115.31 123.01 1s2x h LEU 55 Ca 0.15 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 1s2x h LEU 55 Cb 0.10 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1s2x h LEU 55 CO -0.02 0.66 0.11 -0.09 -0.34 0.00 0.00 178.44 178.76 1s2x h ARG 56 N 0.87 0.97 -0.55 1.25 9.65 -0.26 -2.54 114.38 123.78 1s2x h ARG 56 Ca 0.22 -0.24 -0.11 0.00 -1.10 0.00 0.00 59.98 58.76 1s2x h ARG 56 Cb 0.04 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.48 1s2x h ARG 56 CO -0.04 0.89 -0.07 0.82 2.80 0.00 0.00 179.97 184.37 1s2x h ILE 57 N 0.92 1.27 0.00 1.20 2.04 -0.57 -0.90 117.51 121.47 1s2x h ILE 57 Ca 0.19 -1.22 0.00 0.00 1.00 0.00 0.00 64.86 64.83 1s2x h ILE 57 Cb 0.39 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1s2x h ILE 57 CO 0.01 0.43 0.00 0.59 0.00 0.00 0.00 178.15 179.18 1s2x n ASN 58 N -4.19 1.23 0.00 1.72 3.02 0.74 -1.33 115.26 116.46 1s2x n ASN 58 Ca 0.02 -1.03 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 1s2x n ASN 58 Cb 0.38 -0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.31 1s2x n ASN 58 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s2x n GLN 60 N 1.41 0.00 0.30 3.52 1.13 -0.34 -1.80 117.38 121.59 1s2x n GLN 60 Ca 0.00 0.00 0.17 0.00 -1.94 0.00 0.00 57.00 55.23 1s2x n GLN 60 Cb 0.14 0.00 0.94 0.00 0.11 0.00 0.00 30.24 31.44 1s2x n GLN 60 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1s2x h LYS 61 N 0.00 0.00 -0.64 -1.09 1.57 -1.47 -1.79 116.57 113.15 1s2x h LYS 61 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1s2x h LYS 61 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1s2x h LYS 61 CO 0.00 0.03 0.00 0.09 -0.57 0.00 0.00 179.45 179.00 1s2x n ASN 62 N -3.48 4.32 -3.47 0.86 4.13 -0.75 -4.95 115.26 111.93 1s2x n ASN 62 Ca -0.02 -2.28 -0.25 0.00 1.68 0.00 0.00 54.58 53.71 1s2x n ASN 62 Cb 0.14 -0.52 0.00 0.00 -1.54 0.00 0.00 39.78 37.86 1s2x n ASN 62 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1s2x n PHE 63 N 1.21 -1.89 -2.18 3.10 3.72 -0.67 -4.95 117.46 115.80 1s2x n PHE 63 Ca 0.24 0.57 -0.41 0.00 -0.05 0.00 0.00 57.45 57.80 1s2x n PHE 63 Cb 0.76 -3.29 -0.03 0.00 -0.94 0.00 0.00 39.48 35.99 1s2x n PHE 63 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 1s2x s ILE 64 N -3.04 2.90 -0.14 4.37 -1.16 -1.26 -5.00 121.20 117.87 1s2x s ILE 64 Ca 0.46 0.87 -0.06 0.00 -0.51 0.00 0.00 60.65 61.41 1s2x s ILE 64 Cb -0.24 -3.55 0.06 0.00 0.61 0.00 0.00 42.46 39.34 1s2x s ILE 64 CO 0.56 0.19 0.31 -0.55 -2.81 0.00 0.00 174.94 172.64 1s2x s SER 65 N -0.35 -0.04 0.21 4.50 0.15 -1.26 -4.74 113.70 112.17 1s2x s SER 65 Ca 0.50 0.69 0.17 0.00 0.70 0.00 0.00 55.95 58.02 1s2x s SER 65 Cb -0.38 0.75 0.02 0.00 -1.71 0.00 0.00 66.02 64.70 1s2x s SER 65 CO 0.48 -0.21 1.20 -0.26 1.20 0.00 0.00 173.24 175.65 1s2x h PHE 66 N 7.82 0.00 -1.04 3.44 0.04 -1.96 -3.30 116.94 121.93 1s2x h PHE 66 Ca -0.25 0.00 0.28 0.00 2.80 0.00 0.00 57.97 60.80 1s2x h PHE 66 Cb 1.13 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 39.17 1s2x h PHE 66 CO 0.33 0.41 0.64 -0.44 -0.60 0.00 0.00 178.31 178.66 1s2x h ASP 67 N 0.00 0.53 -0.56 2.17 3.45 -1.99 0.16 116.42 120.17 1s2x h ASP 67 Ca -0.06 0.12 0.00 0.00 0.43 0.00 0.00 57.03 57.53 1s2x h ASP 67 Cb 1.36 0.04 -0.03 0.00 -0.56 0.00 0.00 39.33 40.15 1s2x h ASP 67 CO 0.04 0.04 0.35 0.00 -1.57 0.00 0.00 179.24 178.11 1s2x h ALA 68 N 1.69 0.72 0.00 3.45 0.00 -2.00 -1.20 119.26 121.92 1s2x h ALA 68 Ca 0.65 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.47 1s2x h ALA 68 Cb 1.51 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1s2x h ALA 68 CO -0.41 0.18 -0.17 1.88 0.00 0.00 0.00 179.25 180.73 1s2x h TYR 69 N 0.76 0.00 -0.35 0.00 0.99 -0.91 0.50 116.97 117.97 1s2x h TYR 69 Ca 0.20 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.94 1s2x h TYR 69 Cb -0.05 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 37.66 1s2x h TYR 69 CO -0.03 0.17 0.22 -0.92 -0.00 0.00 0.00 178.16 177.61 1s2x h TYR 70 N 0.00 0.42 -0.23 4.88 3.20 -0.60 -1.77 116.97 122.88 1s2x h TYR 70 Ca -0.00 0.01 -0.20 0.00 3.14 0.00 0.00 58.73 61.68 1s2x h TYR 70 Cb 0.33 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.46 1s2x h TYR 70 CO 0.00 0.26 -0.62 -0.91 -1.64 0.00 0.00 178.16 175.25 1s2x h ASN 71 N 0.46 0.95 -0.17 -2.11 2.35 -0.41 -2.06 115.58 114.60 1s2x h ASN 71 Ca 0.13 -0.57 0.05 0.00 -0.55 0.00 0.00 56.30 55.36 1s2x h ASN 71 Cb -0.04 -0.28 -0.06 0.00 0.05 0.00 0.00 38.32 38.00 1s2x h ASN 71 CO -0.04 1.35 -0.19 0.22 -1.65 0.00 0.00 177.43 177.12 1s2x h TYR 72 N 0.60 -0.49 -0.71 1.19 3.20 -0.78 0.67 116.97 120.64 1s2x h TYR 72 Ca -0.01 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1s2x h TYR 72 Cb 1.24 0.24 -0.03 0.00 1.54 0.00 0.00 36.73 39.72 1s2x h TYR 72 CO 0.08 -0.27 0.36 -0.07 -1.64 0.00 0.00 178.16 176.63 1s2x h LEU 73 N -0.22 0.90 -0.24 2.82 3.38 -1.28 -0.57 115.31 120.11 1s2x h LEU 73 Ca 0.11 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1s2x h LEU 73 Cb 0.39 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1s2x h LEU 73 CO -0.30 0.76 0.15 -1.13 0.09 0.00 0.00 178.44 178.02 1s2x h ASN 74 N 0.98 0.28 -0.31 -0.43 -1.24 -0.88 0.11 115.58 114.09 1s2x h ASN 74 Ca 0.25 -0.02 0.03 0.00 0.71 0.00 0.00 56.30 57.27 1s2x h ASN 74 Cb 0.08 -0.07 -0.03 0.00 0.73 0.00 0.00 38.32 39.03 1s2x h ASN 74 CO -0.04 0.22 0.10 0.78 -1.29 0.00 0.00 177.43 177.21 1s2x h ASN 75 N 0.31 0.11 -0.15 1.15 2.35 -0.60 -0.50 115.58 118.24 1s2x h ASN 75 Ca 0.09 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1s2x h ASN 75 Cb -0.02 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1s2x h ASN 75 CO -0.02 0.10 0.09 0.25 -1.65 0.00 0.00 177.43 176.20 1s2x h LEU 76 N 0.24 0.16 -0.67 1.61 5.85 -0.89 -0.50 115.31 121.10 1s2x h LEU 76 Ca 0.14 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1s2x h LEU 76 Cb 0.11 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1s2x h LEU 76 CO -0.15 0.12 0.40 0.58 -0.34 0.00 0.00 178.44 179.05 1s2x h VAL 77 N 0.19 1.20 0.07 1.05 2.07 -0.55 -1.03 116.25 119.24 1s2x h VAL 77 Ca 0.06 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 1s2x h VAL 77 Cb -0.01 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1s2x h VAL 77 CO -0.02 0.20 -0.03 0.25 0.02 0.00 0.00 177.57 177.99 1s2x h LEU 78 N 0.92 -0.08 -1.43 2.57 5.85 -0.92 -1.13 115.31 121.10 1s2x h LEU 78 Ca 0.24 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1s2x h LEU 78 Cb -0.02 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 1s2x h LEU 78 CO -0.04 0.08 0.38 0.00 -0.34 0.00 0.00 178.44 178.51 1s2x h ALA 79 N 0.69 1.58 -0.32 1.25 0.00 -0.90 0.49 119.26 122.05 1s2x h ALA 79 Ca -0.01 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1s2x h ALA 79 Cb 0.20 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1s2x h ALA 79 CO 0.02 0.38 -0.32 0.77 0.00 0.00 0.00 179.25 180.10 1s2x h SER 80 N 0.78 0.84 -0.46 0.00 0.02 -1.07 -2.37 113.55 111.30 1s2x h SER 80 Ca 0.21 -0.47 -0.03 0.00 -0.84 0.00 0.00 61.79 60.66 1s2x h SER 80 Cb -0.08 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.20 1s2x h SER 80 CO -0.04 1.14 0.16 0.22 -1.14 0.00 0.00 176.83 177.17 1s2x h TYR 81 N 0.56 0.72 -0.56 3.45 5.03 -0.26 -1.14 116.97 124.77 1s2x h TYR 81 Ca 0.05 -0.06 -0.07 0.00 2.58 0.00 0.00 58.73 61.23 1s2x h TYR 81 Cb 0.90 -0.21 -0.02 0.00 1.55 0.00 0.00 36.73 38.94 1s2x h TYR 81 CO 0.07 0.63 0.06 -0.91 -1.32 0.00 0.00 178.16 176.69 1s2x h ASN 82 N 0.60 0.88 -0.01 -2.11 -0.26 -0.94 0.55 115.58 114.28 1s2x h ASN 82 Ca 0.15 -0.20 -0.01 0.00 -0.56 0.00 0.00 56.30 55.68 1s2x h ASN 82 Cb 0.23 -0.23 -0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1s2x h ASN 82 CO -0.01 0.90 -0.01 -0.09 -1.06 0.00 0.00 177.43 177.16 1s2x h ARG 83 N 0.86 0.03 -0.19 0.81 9.65 -1.29 -3.09 114.38 121.18 1s2x h ARG 83 Ca 0.17 -0.02 -0.06 0.00 -1.10 0.00 0.00 59.98 58.98 1s2x h ARG 83 Cb 0.42 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.99 1s2x h ARG 83 CO 0.01 0.50 -0.14 0.00 2.80 0.00 0.00 179.97 183.15 1s2x h LYS 85 N 0.28 0.97 -0.11 0.00 3.64 -0.94 0.34 116.57 120.76 1s2x h LYS 85 Ca 0.06 -0.37 -0.01 0.00 -1.27 0.00 0.00 60.65 59.05 1s2x h LYS 85 Cb 0.42 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1s2x h LYS 85 CO 0.02 1.04 0.02 0.37 -2.27 0.00 0.00 179.45 178.63 1s2x h GLN 86 N 0.83 0.18 0.02 1.90 4.15 -1.43 -0.11 115.11 120.64 1s2x h GLN 86 Ca 0.13 -0.05 0.02 0.00 0.77 0.00 0.00 58.65 59.52 1s2x h GLN 86 Cb 0.68 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.32 1s2x h GLN 86 CO 0.05 0.38 -0.16 0.93 -1.93 0.00 0.00 178.83 178.10 1s2x h GLU 87 N -0.06 -0.26 -0.79 1.69 5.08 -1.05 -1.17 114.58 118.01 1s2x h GLU 87 Ca 0.03 0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.56 1s2x h GLU 87 Cb 0.29 0.06 -0.10 0.00 0.50 0.00 0.00 28.75 29.51 1s2x h GLU 87 CO 0.00 -0.18 0.35 -0.22 -1.00 0.00 0.00 179.01 177.97 1s2x h LYS 88 N -0.27 0.49 0.14 2.33 3.64 -0.12 0.54 116.57 123.31 1s2x h LYS 88 Ca 0.05 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1s2x h LYS 88 Cb 0.33 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1s2x h LYS 88 CO -0.14 0.32 -0.07 1.15 -2.27 0.00 0.00 179.45 178.45 1s2x h THR 89 N 0.50 1.01 -0.16 1.00 2.02 -0.48 -2.55 112.91 114.25 1s2x h THR 89 Ca 0.44 -0.68 0.05 0.00 0.77 0.00 0.00 66.41 66.98 1s2x h THR 89 Cb 0.65 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 1s2x h THR 89 CO -0.39 0.16 0.14 0.15 0.37 0.00 0.00 175.52 175.95 1s2x h PHE 90 N -0.51 0.00 -0.08 3.16 3.57 -0.58 0.25 116.94 122.74 1s2x h PHE 90 Ca -0.02 0.00 -0.24 0.00 3.53 0.00 0.00 57.97 61.24 1s2x h PHE 90 Cb 0.40 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.16 1s2x h PHE 90 CO 0.03 0.00 -0.88 0.00 -2.23 0.00 0.00 178.31 175.23 1s2x h ALA 91 N 1.87 0.27 0.00 2.41 0.00 -0.74 -2.20 119.26 120.87 1s2x h ALA 91 Ca 0.08 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1s2x h ALA 91 Cb 0.36 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1s2x h ALA 91 CO -0.00 0.70 0.00 0.39 0.00 0.00 0.00 179.25 180.34 1s2x n GLU 92 N -3.89 0.13 0.01 0.00 1.02 -0.32 -0.30 120.64 117.30 1s2x n GLU 92 Ca -0.08 0.26 0.11 0.00 -0.02 0.00 0.00 57.16 57.42 1s2x n GLU 92 Cb 0.80 -1.71 -0.02 0.00 -0.02 0.00 0.00 31.44 30.49 1s2x n GLU 92 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1s2x n SER 93 N -1.95 0.69 0.00 1.62 7.64 -0.08 -4.56 113.62 116.99 1s2x n SER 93 Ca 0.04 -0.52 0.00 0.00 1.01 0.00 0.00 58.87 59.40 1s2x n SER 93 Cb 0.29 0.93 0.00 0.00 -1.01 0.00 0.00 64.21 64.41 1s2x n SER 93 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1s2x n THR 94 N -1.73 0.00 -4.05 0.44 -1.04 -0.82 -5.01 114.28 102.06 1s2x n THR 94 Ca 0.03 -0.14 -0.32 0.00 -2.04 0.00 0.00 64.05 61.58 1s2x n THR 94 Cb 0.39 0.62 -0.15 0.00 -1.82 0.00 0.00 70.33 69.38 1s2x n THR 94 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1s2x s ILE 95 N -1.60 2.28 0.05 12.58 1.01 0.59 -4.99 121.20 131.12 1s2x s ILE 95 Ca 0.00 -1.59 -0.11 0.00 0.00 0.00 0.00 60.65 58.95 1s2x s ILE 95 Cb 0.00 -2.33 -0.32 0.00 0.01 0.00 0.00 42.46 39.82 1s2x s ILE 95 CO 0.00 -0.03 1.07 0.11 0.00 0.00 0.00 174.94 176.09 1s2x h LYS 96 N 7.81 0.45 -6.30 2.79 6.56 -1.94 -3.43 116.57 122.50 1s2x h LYS 96 Ca -0.20 -0.74 -0.57 0.00 -1.06 0.00 0.00 60.65 58.08 1s2x h LYS 96 Cb 1.05 0.27 -0.04 0.00 -0.57 0.00 0.00 32.23 32.94 1s2x h LYS 96 CO 0.47 1.35 1.04 1.21 -2.06 0.00 0.00 179.45 181.47 1s2x s ASN 97 N -7.40 6.55 0.32 0.86 3.84 -1.26 -4.87 114.94 112.98 1s2x s ASN 97 Ca -0.07 1.46 0.03 0.00 0.21 0.00 0.00 52.86 54.49 1s2x s ASN 97 Cb 0.05 -2.54 0.62 0.00 -0.55 0.00 0.00 41.25 38.84 1s2x s ASN 97 CO 0.92 -1.14 1.89 -0.33 -2.79 0.00 0.00 177.10 175.66 1s2x h GLU 98 N 9.89 0.89 -0.19 0.43 5.08 -1.99 0.15 114.58 128.85 1s2x h GLU 98 Ca -0.30 -0.05 -0.21 0.00 -1.00 0.00 0.00 59.36 57.79 1s2x h GLU 98 Cb 1.13 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 30.18 1s2x h GLU 98 CO 1.01 0.59 -0.71 -0.07 -1.00 0.00 0.00 179.01 178.83 1s2x h LEU 99 N 0.92 0.95 -1.94 1.33 4.07 -1.98 -1.99 115.31 116.68 1s2x h LEU 99 Ca 0.41 -0.60 -0.02 0.00 0.08 0.00 0.00 57.88 57.75 1s2x h LEU 99 Cb 0.37 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 41.83 1s2x h LEU 99 CO -0.17 1.40 -0.08 0.74 -1.08 0.00 0.00 178.44 179.24 1s2x h THR 100 N 0.57 0.91 0.00 0.22 2.02 -1.80 -1.91 112.91 112.93 1s2x h THR 100 Ca -0.04 -0.29 -0.20 0.00 0.77 0.00 0.00 66.41 66.66 1s2x h THR 100 Cb 1.34 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 1s2x h THR 100 CO 0.15 0.08 -0.87 0.25 0.37 0.00 0.00 175.52 175.50 1s2x h LEU 101 N 0.00 0.25 -0.91 2.58 5.85 -0.61 -2.47 115.31 120.00 1s2x h LEU 101 Ca -0.00 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.53 1s2x h LEU 101 Cb 0.16 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 1s2x h LEU 101 CO 0.01 1.00 0.60 1.23 -0.34 0.00 0.00 178.44 180.95 1s2x h GLY 102 N 1.86 1.30 0.10 3.75 0.00 -0.68 -0.03 103.07 109.37 1s2x h GLY 102 Ca -0.04 -0.47 0.13 0.00 0.00 0.00 0.00 47.33 46.95 1s2x h GLY 102 CO 0.13 0.44 0.20 0.83 0.00 0.00 0.00 176.54 178.14 1s2x h GLU 103 N 1.21 0.31 0.15 4.80 4.39 -0.89 0.58 114.58 125.13 1s2x h GLU 103 Ca 0.34 -0.02 -0.29 0.00 0.34 0.00 0.00 59.36 59.73 1s2x h GLU 103 Cb -0.09 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 28.50 1s2x h GLU 103 CO -0.09 0.21 -1.35 0.74 -1.16 0.00 0.00 179.01 177.36 1s2x h PHE 104 N 0.32 0.59 -0.44 4.33 0.04 -1.32 -2.13 116.94 118.33 1s2x h PHE 104 Ca 0.37 -0.43 -0.14 0.00 2.80 0.00 0.00 57.97 60.57 1s2x h PHE 104 Cb 0.58 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 1s2x h PHE 104 CO -0.23 1.36 -0.29 0.28 -0.60 0.00 0.00 178.31 178.84 1s2x h VAL 105 N 0.09 1.27 -0.50 -0.55 2.07 -0.68 -1.06 116.25 116.90 1s2x h VAL 105 Ca -0.18 -1.46 -0.10 0.00 0.82 0.00 0.00 66.70 65.78 1s2x h VAL 105 Cb 2.02 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 33.01 1s2x h VAL 105 CO 0.21 0.49 -0.09 0.00 0.02 0.00 0.00 177.57 178.21 1s2x h ALA 106 N 0.85 0.68 -0.40 1.67 0.00 -0.94 -2.47 119.26 118.65 1s2x h ALA 106 Ca 0.09 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1s2x h ALA 106 Cb 0.87 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1s2x h ALA 106 CO 0.08 0.57 0.12 1.49 0.00 0.00 0.00 179.25 181.51 1s2x h GLU 107 N 0.79 0.63 -0.33 0.00 4.57 -1.25 -1.81 114.58 117.18 1s2x h GLU 107 Ca 0.13 -0.14 -0.02 0.00 -1.18 0.00 0.00 59.36 58.15 1s2x h GLU 107 Cb 0.64 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.12 1s2x h GLU 107 CO 0.04 0.64 0.13 0.82 -1.18 0.00 0.00 179.01 179.46 1s2x h ILE 108 N 0.51 1.18 0.02 2.32 2.04 -1.18 -1.20 117.51 121.20 1s2x h ILE 108 Ca 0.13 -0.57 -0.22 0.00 1.00 0.00 0.00 64.86 65.20 1s2x h ILE 108 Cb 0.27 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1s2x h ILE 108 CO -0.00 0.20 -0.95 0.77 0.00 0.00 0.00 178.15 178.16 1s2x h SER 109 N 0.39 0.43 -0.02 1.72 4.64 -1.45 -2.23 113.55 117.03 1s2x h SER 109 Ca 0.11 -0.36 -0.07 0.00 -0.47 0.00 0.00 61.79 61.01 1s2x h SER 109 Cb 0.19 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1s2x h SER 109 CO -0.01 1.17 -0.17 0.44 -0.87 0.00 0.00 176.83 177.39 1s2x h ASP 110 N 0.17 0.34 1.32 4.97 3.32 -1.26 0.16 116.42 125.45 1s2x h ASP 110 Ca -0.07 -0.09 -0.13 0.00 0.02 0.00 0.00 57.03 56.76 1s2x h ASP 110 Cb 1.60 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 41.04 1s2x h ASP 110 CO 0.16 0.53 -0.69 0.78 -1.72 0.00 0.00 179.24 178.30 1s2x h ASN 111 N 0.32 0.00 -0.06 6.45 2.35 -1.16 -2.50 115.58 120.98 1s2x h ASN 111 Ca 0.06 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1s2x h ASN 111 Cb 0.49 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.86 1s2x h ASN 111 CO 0.03 0.61 -0.01 0.15 -1.65 0.00 0.00 177.43 176.55 1s2x h PHE 112 N 0.00 0.13 -0.86 1.19 3.04 -0.91 -0.19 116.94 119.34 1s2x h PHE 112 Ca -0.02 -0.03 0.03 0.00 3.98 0.00 0.00 57.97 61.93 1s2x h PHE 112 Cb 1.48 -0.03 -0.05 0.00 2.56 0.00 0.00 35.95 39.91 1s2x h PHE 112 CO 0.00 0.44 0.56 -0.97 -2.02 0.00 0.00 178.31 176.32 1s2x h ASN 113 N -0.22 0.93 0.30 0.41 -1.24 -0.68 -2.16 115.58 112.93 1s2x h ASN 113 Ca 0.02 -0.01 -0.33 0.00 0.71 0.00 0.00 56.30 56.68 1s2x h ASN 113 Cb 0.40 -0.21 0.04 0.00 0.73 0.00 0.00 38.32 39.27 1s2x h ASN 113 CO 0.01 0.65 -1.47 0.78 -1.29 0.00 0.00 177.43 176.10 1s2x h ASN 114 N 1.09 0.81 -0.44 1.15 -0.26 -1.44 -2.18 115.58 114.31 1s2x h ASN 114 Ca 0.34 -0.87 -0.12 0.00 -0.56 0.00 0.00 56.30 55.09 1s2x h ASN 114 Cb -0.02 -0.26 -0.01 0.00 -1.06 0.00 0.00 38.32 36.97 1s2x h ASN 114 CO -0.11 1.68 -0.20 0.15 -1.06 0.00 0.00 177.43 177.89 1s2x h PHE 115 N 0.14 1.05 -0.05 1.19 3.04 -0.99 -1.72 116.94 119.61 1s2x h PHE 115 Ca -0.25 -0.26 -0.09 0.00 3.98 0.00 0.00 57.97 61.35 1s2x h PHE 115 Cb 2.16 -0.24 0.01 0.00 2.56 0.00 0.00 35.95 40.43 1s2x h PHE 115 CO 0.12 1.05 -0.34 1.79 -2.02 0.00 0.00 178.31 178.91 1s2x h THR 116 N 0.74 1.45 -0.34 4.41 1.35 -1.48 -2.51 112.91 116.53 1s2x h THR 116 Ca 0.10 -1.81 -0.02 0.00 -0.55 0.00 0.00 66.41 64.13 1s2x h THR 116 Cb 0.77 2.45 -0.02 0.00 -1.73 0.00 0.00 68.15 69.63 1s2x h THR 116 CO 0.06 0.52 0.14 0.00 -0.25 0.00 0.00 175.52 175.99 1s2x h ASP 118 N 0.48 0.36 0.33 0.00 3.32 -1.32 -2.32 116.42 117.27 1s2x h ASP 118 Ca 0.12 -0.23 -0.17 0.00 0.02 0.00 0.00 57.03 56.77 1s2x h ASP 118 Cb 0.10 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1s2x h ASP 118 CO -0.01 0.93 -0.71 -0.33 -1.72 0.00 0.00 179.24 177.40 1s2x h GLU 119 N 0.22 0.33 -0.73 3.56 4.39 -0.80 -1.60 114.58 119.95 1s2x h GLU 119 Ca -0.02 -0.27 -0.04 0.00 0.34 0.00 0.00 59.36 59.37 1s2x h GLU 119 Cb 1.22 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.89 1s2x h GLU 119 CO 0.11 0.91 0.29 0.28 -1.16 0.00 0.00 179.01 179.43 1s2x h VAL 120 N 0.23 1.25 -0.27 3.13 2.07 -1.18 -1.76 116.25 119.72 1s2x h VAL 120 Ca -0.02 -0.78 -0.10 0.00 0.82 0.00 0.00 66.70 66.61 1s2x h VAL 120 Cb 1.27 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1s2x h VAL 120 CO 0.12 0.31 -0.27 0.00 0.02 0.00 0.00 177.57 177.75 1s2x h ALA 121 N 1.26 1.04 -0.25 1.67 0.00 -1.25 0.32 119.26 122.04 1s2x h ALA 121 Ca 0.24 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1s2x h ALA 121 Cb 0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1s2x h ALA 121 CO -0.02 0.58 -0.01 -0.09 0.00 0.00 0.00 179.25 179.71 1s2x h ARG 122 N 0.46 0.45 -0.50 0.00 2.43 -1.03 0.01 114.38 116.21 1s2x h ARG 122 Ca 0.06 -0.15 -0.11 0.00 -0.81 0.00 0.00 59.98 58.98 1s2x h ARG 122 Cb 0.71 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 1s2x h ARG 122 CO 0.05 0.63 -0.11 0.82 -1.51 0.00 0.00 179.97 179.85 1s2x h ILE 123 N 0.23 1.26 -0.43 1.20 5.03 -1.20 -1.09 117.51 122.51 1s2x h ILE 123 Ca 0.07 -1.24 -0.00 0.00 -0.12 0.00 0.00 64.86 63.57 1s2x h ILE 123 Cb 0.44 1.00 -0.02 0.00 -3.03 0.00 0.00 36.82 35.21 1s2x h ILE 123 CO 0.02 0.43 0.27 -1.28 -0.68 0.00 0.00 178.15 176.90 1s2x h SER 124 N 0.83 0.51 -0.73 1.72 0.87 -0.17 -1.06 113.55 115.52 1s2x h SER 124 Ca 0.13 -0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.66 1s2x h SER 124 Cb 0.65 -0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 62.44 1s2x h SER 124 CO 0.05 0.41 0.48 0.44 -0.53 0.00 0.00 176.83 177.67 1s2x h ASP 125 N 0.57 0.82 -0.65 6.23 3.45 -0.78 -1.60 116.42 124.46 1s2x h ASP 125 Ca 0.16 -0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.56 1s2x h ASP 125 Cb -0.02 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 38.53 1s2x h ASP 125 CO -0.03 0.58 0.27 0.25 -1.57 0.00 0.00 179.24 178.75 1s2x h LEU 126 N 0.97 0.89 -0.56 1.55 5.85 -0.83 -1.90 115.31 121.29 1s2x h LEU 126 Ca 0.27 -0.16 -0.14 0.00 0.84 0.00 0.00 57.88 58.69 1s2x h LEU 126 Cb -0.08 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.71 1s2x h LEU 126 CO -0.07 0.81 -0.38 0.58 -0.34 0.00 0.00 178.44 179.04 1s2x h VAL 127 N 0.92 1.29 -0.33 1.05 2.07 -0.91 -2.25 116.25 118.09 1s2x h VAL 127 Ca 0.22 -1.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 1s2x h VAL 127 Cb 0.19 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1s2x h VAL 127 CO -0.02 0.50 0.15 0.00 0.02 0.00 0.00 177.57 178.23 1s2x h ALA 128 N 0.96 1.66 0.00 1.67 0.00 -1.17 -2.43 119.26 119.95 1s2x h ALA 128 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1s2x h ALA 128 Cb 0.93 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1s2x h ALA 128 CO 0.08 0.28 0.00 -1.13 0.00 0.00 0.00 179.25 178.49 1s2x n SER 129 N -4.43 0.00 0.00 0.00 3.41 -0.72 -2.47 113.62 109.41 1s2x n SER 129 Ca 0.02 -0.22 0.10 0.00 -0.26 0.00 0.00 58.87 58.51 1s2x n SER 129 Cb 0.12 -0.14 0.46 0.00 -0.26 0.00 0.00 64.21 64.39 1s2x n SER 129 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1s2x n TYR 130 N -1.14 0.00 -3.44 7.33 4.01 -0.91 -3.45 117.16 119.55 1s2x n TYR 130 Ca 0.09 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.40 1s2x n TYR 130 Cb 0.09 -0.42 -0.05 0.00 -0.31 0.00 0.00 39.34 38.65 1s2x n TYR 130 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1s2x s LEU 131 N -2.84 6.25 -0.21 7.72 2.96 -1.03 -5.05 118.68 126.48 1s2x s LEU 131 Ca 0.13 -2.62 -0.29 0.00 -0.22 0.00 0.00 54.13 51.13 1s2x s LEU 131 Cb 0.13 -2.10 -0.01 0.00 0.50 0.00 0.00 46.19 44.71 1s2x s LEU 131 CO 0.35 -0.55 1.28 -2.16 -1.32 0.00 0.00 176.35 173.95 1s2x s PRO 132 N 0.29 4.11 0.52 0.98 0.04 -1.22 -4.86 135.00 134.85 1s2x s PRO 132 Ca 0.16 1.51 0.20 0.00 0.04 0.00 0.00 61.00 62.91 1s2x s PRO 132 Cb -0.15 -3.81 1.30 0.00 0.04 0.00 0.00 34.50 31.88 1s2x s PRO 132 CO -0.06 -0.87 2.07 -0.09 0.04 0.00 0.00 177.00 178.09 1s2x h ARG 133 N 8.64 0.03 0.00 4.56 1.12 -1.92 -2.26 114.38 124.56 1s2x h ARG 133 Ca -0.26 -0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.60 1s2x h ARG 133 Cb 1.10 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 31.05 1s2x h ARG 133 CO 0.99 0.02 0.00 -0.85 -3.11 0.00 0.00 179.97 177.03 1s2x n GLU 134 N -4.46 0.41 -0.09 0.20 0.00 -1.26 -3.00 120.64 112.43 1s2x n GLU 134 Ca 0.03 0.03 0.04 0.00 0.00 0.00 0.00 57.16 57.26 1s2x n GLU 134 Cb 0.33 -1.50 0.08 0.00 0.00 0.00 0.00 31.44 30.36 1s2x n GLU 134 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1s2x n TYR 135 N -1.27 0.21 -2.64 -1.84 4.01 -0.85 -5.01 117.16 109.77 1s2x n TYR 135 Ca 0.13 -0.59 -0.42 0.00 -0.16 0.00 0.00 57.90 56.86 1s2x n TYR 135 Cb 0.21 -0.07 -0.03 0.00 -0.31 0.00 0.00 39.34 39.14 1s2x n TYR 135 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1s2x s LEU 136 N -1.36 4.27 0.65 7.72 1.02 -1.16 0.04 118.68 129.86 1s2x s LEU 136 Ca 0.14 1.61 -0.18 0.00 0.02 0.00 0.00 54.13 55.72 1s2x s LEU 136 Cb 0.09 -3.56 -0.02 0.00 0.02 0.00 0.00 46.19 42.72 1s2x s LEU 136 CO 0.06 -0.46 1.08 -2.65 0.02 0.00 0.00 176.35 174.40 1s2x n PRO 137 N 4.93 0.87 0.19 1.29 -0.02 -1.26 -4.87 135.00 136.14 1s2x n PRO 137 Ca 0.09 0.35 0.14 0.00 -2.02 0.00 0.00 63.50 62.06 1s2x n PRO 137 Cb 0.48 -2.30 0.62 0.00 -0.02 0.00 0.00 33.50 32.28 1s2x n PRO 137 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1s2x h PRO 138 N 0.32 0.00 -0.54 0.52 0.13 -1.95 -1.96 132.00 128.52 1s2x h PRO 138 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1s2x h PRO 138 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 1s2x h PRO 138 CO 0.51 0.00 0.00 1.97 -0.23 0.00 0.00 178.00 180.25 1s2x n PHE 139 N -2.54 0.77 -3.36 1.56 -1.74 -1.26 -4.92 117.46 105.97 1s2x n PHE 139 Ca 0.01 -0.36 -0.38 0.00 -0.56 0.00 0.00 57.45 56.16 1s2x n PHE 139 Cb 0.21 -0.05 -0.06 0.00 1.52 0.00 0.00 39.48 41.10 1s2x n PHE 139 CO 0.00 0.00 0.00 0.42 -0.56 0.00 0.00 176.76 176.62 1s2x s ILE 140 N -1.42 5.15 0.53 1.97 -1.09 -0.74 -4.95 121.20 120.65 1s2x s ILE 140 Ca 0.35 0.91 0.09 0.00 -2.23 0.00 0.00 60.65 59.76 1s2x s ILE 140 Cb 0.19 -3.79 0.06 0.00 -1.58 0.00 0.00 42.46 37.34 1s2x s ILE 140 CO 0.22 0.39 0.67 1.51 -1.23 0.00 0.00 174.94 176.49 1s2x s ASP 141 N 0.23 5.15 0.60 3.58 3.84 -1.26 -4.98 116.67 123.83 1s2x s ASP 141 Ca 0.25 -0.81 0.30 0.00 -0.00 0.00 0.00 52.55 52.29 1s2x s ASP 141 Cb -0.15 0.06 1.71 0.00 -1.38 0.00 0.00 42.92 43.16 1s2x s ASP 141 CO 0.11 -1.14 2.11 1.23 -0.00 0.00 0.00 175.17 177.47 1s2x h GLY 142 N 0.41 0.00 -7.00 2.12 0.00 -2.04 -3.42 103.07 93.14 1s2x h GLY 142 Ca -0.34 0.00 -0.70 0.00 0.00 0.00 0.00 47.33 46.30 1s2x h GLY 142 CO 0.45 0.00 2.55 -2.01 0.00 0.00 0.00 176.54 177.53 1s2x n ASN 143 N -3.70 4.51 0.00 0.19 5.15 -1.26 -4.75 115.26 115.40 1s2x n ASN 143 Ca 0.01 -2.90 0.00 0.00 -0.60 0.00 0.00 54.58 51.09 1s2x n ASN 143 Cb 0.30 -1.69 0.00 0.00 -0.53 0.00 0.00 39.78 37.86 1s2x n ASN 143 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1s2x n GLY 146 N 4.66 2.17 0.33 8.20 0.00 -1.26 -4.71 105.19 114.57 1s2x n GLY 146 Ca 0.49 -0.36 -0.05 0.00 0.00 0.00 0.00 46.02 46.11 1s2x n GLY 146 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1s2x h VAL 147 N 0.00 1.24 -0.73 1.61 2.07 -1.96 -1.23 116.25 117.25 1s2x h VAL 147 Ca 0.00 -0.62 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 1s2x h VAL 147 Cb 0.00 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 29.90 1s2x h VAL 147 CO 0.00 0.27 0.35 0.00 0.02 0.00 0.00 177.57 178.22 1s2x h ALA 148 N 1.23 0.94 -0.89 1.67 0.00 -1.98 0.38 119.26 120.62 1s2x h ALA 148 Ca 0.29 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1s2x h ALA 148 Cb 0.04 -0.29 -0.06 0.00 0.00 0.00 0.00 17.79 17.49 1s2x h ALA 148 CO -0.04 0.50 0.58 0.74 0.00 0.00 0.00 179.25 181.03 1s2x h PHE 149 N 1.02 1.03 -0.08 0.00 0.05 -1.82 0.35 116.94 117.50 1s2x h PHE 149 Ca 0.25 0.03 -0.15 0.00 3.82 0.00 0.00 57.97 61.92 1s2x h PHE 149 Cb 0.11 -0.34 0.01 0.00 2.00 0.00 0.00 35.95 37.73 1s2x h PHE 149 CO 0.01 0.55 -0.54 1.96 -0.18 0.00 0.00 178.31 180.10 1s2x h GLN 150 N 1.02 0.51 0.00 1.51 4.20 0.03 -0.75 115.11 121.63 1s2x h GLN 150 Ca 0.38 -0.44 -0.08 0.00 0.06 0.00 0.00 58.65 58.57 1s2x h GLN 150 Cb 0.18 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1s2x h GLN 150 CO -0.14 1.07 -0.36 0.82 -0.67 0.00 0.00 178.83 179.56 1s2x h ILE 151 N 0.10 1.26 -0.00 2.54 2.04 0.17 -2.49 117.51 121.12 1s2x h ILE 151 Ca -0.04 -1.24 0.00 0.00 1.00 0.00 0.00 64.86 64.58 1s2x h ILE 151 Cb 1.20 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.94 1s2x h ILE 151 CO 0.11 0.35 -0.01 0.18 0.00 0.00 0.00 178.15 178.79 1s2x n LEU 152 N -4.11 0.37 0.00 1.44 4.77 0.07 -4.83 117.00 114.71 1s2x n LEU 152 Ca -0.02 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 1s2x n LEU 152 Cb 0.40 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1s2x n LEU 152 CO 0.39 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1s2x n GLY 153 N 1.07 0.84 0.15 -0.72 0.00 -0.94 -4.92 105.19 100.67 1s2x n GLY 153 Ca 0.22 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.05 1s2x n GLY 153 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1s2x h ILE 154 N 0.00 1.40 -0.68 -0.61 2.04 -1.40 -2.38 117.51 115.88 1s2x h ILE 154 Ca 0.00 -2.17 0.09 0.00 1.00 0.00 0.00 64.86 63.77 1s2x h ILE 154 Cb 0.00 2.63 -0.07 0.00 -0.74 0.00 0.00 36.82 38.64 1s2x h ILE 154 CO 0.00 0.64 0.33 -0.78 0.00 0.00 0.00 178.15 178.34 1s2x h ASP 155 N -0.03 0.44 0.36 1.72 3.58 -1.62 -0.04 116.42 120.82 1s2x h ASP 155 Ca -0.10 0.06 -0.11 0.00 0.42 0.00 0.00 57.03 57.30 1s2x h ASP 155 Cb 1.44 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 42.47 1s2x h ASP 155 CO 0.14 0.26 -0.47 -0.78 -2.88 0.00 0.00 179.24 175.51 1s2x h ASP 156 N 0.58 0.14 -0.51 2.28 3.58 -1.82 -2.28 116.42 118.39 1s2x h ASP 156 Ca 0.33 -0.06 -0.11 0.00 0.42 0.00 0.00 57.03 57.61 1s2x h ASP 156 Cb 0.34 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.33 1s2x h ASP 156 CO -0.26 0.59 -0.11 0.15 -2.88 0.00 0.00 179.24 176.73 1s2x h PHE 157 N 0.11 1.10 -0.23 0.28 3.04 -0.72 -2.57 116.94 117.96 1s2x h PHE 157 Ca 0.01 -0.23 0.05 0.00 3.98 0.00 0.00 57.97 61.77 1s2x h PHE 157 Cb 0.87 -0.27 -0.05 0.00 2.56 0.00 0.00 35.95 39.06 1s2x h PHE 157 CO 0.01 1.04 -0.11 0.78 -2.02 0.00 0.00 178.31 178.01 1s2x h GLY 158 N 0.85 0.09 0.01 2.40 0.00 -0.50 0.35 103.07 106.27 1s2x h GLY 158 Ca 0.13 0.13 0.09 0.00 0.00 0.00 0.00 47.33 47.68 1s2x h GLY 158 CO 0.05 -0.13 -0.19 0.50 0.00 0.00 0.00 176.54 176.77 1s2x h LYS 159 N -0.08 -0.11 -0.18 4.80 1.57 -1.38 0.32 116.57 121.51 1s2x h LYS 159 Ca 0.12 0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.86 1s2x h LYS 159 Cb 0.26 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1s2x h LYS 159 CO -0.28 -0.08 -0.10 0.87 -0.57 0.00 0.00 179.45 179.30 1s2x h LYS 160 N -0.12 0.29 -0.18 3.15 1.57 -0.77 -0.70 116.57 119.80 1s2x h LYS 160 Ca 0.20 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.80 1s2x h LYS 160 Cb 0.42 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1s2x h LYS 160 CO -0.48 0.40 -0.38 1.25 -0.57 0.00 0.00 179.45 179.67 1s2x h LEU 161 N 0.27 0.42 -0.90 2.94 5.85 0.16 -2.90 115.31 121.16 1s2x h LEU 161 Ca 0.06 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 1s2x h LEU 161 Cb 0.36 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1s2x h LEU 161 CO 0.02 0.77 0.49 0.78 -0.34 0.00 0.00 178.44 180.15 1s2x h ASN 162 N 0.34 1.13 -0.67 1.25 2.35 0.11 -1.23 115.58 118.85 1s2x h ASN 162 Ca 0.03 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 1s2x h ASN 162 Cb 0.83 -0.29 -0.03 0.00 0.05 0.00 0.00 38.32 38.88 1s2x h ASN 162 CO 0.07 0.91 0.33 -0.33 -1.65 0.00 0.00 177.43 176.76 1s2x h GLU 163 N 1.26 0.98 -0.26 0.81 5.08 -1.22 -1.45 114.58 119.79 1s2x h GLU 163 Ca 0.32 -0.13 -0.05 0.00 -1.00 0.00 0.00 59.36 58.50 1s2x h GLU 163 Cb 0.04 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 1s2x h GLU 163 CO -0.05 0.76 -0.02 0.82 -1.00 0.00 0.00 179.01 179.52 1s2x h ILE 164 N 0.98 1.26 -0.13 3.13 2.04 -1.23 -1.05 117.51 122.51 1s2x h ILE 164 Ca 0.24 -0.96 0.02 0.00 1.00 0.00 0.00 64.86 65.16 1s2x h ILE 164 Cb 0.10 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1s2x h ILE 164 CO -0.03 0.30 0.09 0.58 0.00 0.00 0.00 178.15 179.09 1s2x h VAL 165 N 0.23 0.99 -0.22 1.67 2.07 -1.04 -0.63 116.25 119.31 1s2x h VAL 165 Ca 0.07 -0.03 -0.17 0.00 0.82 0.00 0.00 66.70 67.39 1s2x h VAL 165 Cb 0.45 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1s2x h VAL 165 CO 0.02 0.02 -0.54 1.56 0.02 0.00 0.00 177.57 178.64 1s2x h GLN 166 N 0.10 0.65 -0.04 1.57 4.20 -0.80 -2.21 115.11 118.58 1s2x h GLN 166 Ca 0.06 -0.41 -0.17 0.00 0.06 0.00 0.00 58.65 58.18 1s2x h GLN 166 Cb 0.11 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1s2x h GLN 166 CO -0.01 1.03 -0.73 0.22 -0.67 0.00 0.00 178.83 178.67 1s2x h ASP 167 N 0.50 0.31 -0.65 1.46 1.82 -0.21 -2.32 116.42 117.34 1s2x h ASP 167 Ca 0.01 -0.21 0.04 0.00 -0.39 0.00 0.00 57.03 56.48 1s2x h ASP 167 Cb 1.10 -0.09 -0.04 0.00 0.68 0.00 0.00 39.33 40.98 1s2x h ASP 167 CO 0.11 0.93 0.39 0.40 -1.61 0.00 0.00 179.24 179.46 1s2x h ILE 168 N 0.17 1.05 -0.94 2.25 2.04 -1.04 0.22 117.51 121.25 1s2x h ILE 168 Ca -0.02 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1s2x h ILE 168 Cb 1.29 0.23 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 1s2x h ILE 168 CO 0.11 0.14 0.60 1.23 0.00 0.00 0.00 178.15 180.23 1s2x h GLY 169 N 0.76 1.35 1.93 5.37 0.00 -1.28 0.45 103.07 111.66 1s2x h GLY 169 Ca 0.27 -0.53 -0.15 0.00 0.00 0.00 0.00 47.33 46.91 1s2x h GLY 169 CO -0.12 0.52 -0.69 -0.84 0.00 0.00 0.00 176.54 175.40 1s2x h THR 170 N 1.29 1.48 0.00 4.70 2.02 -0.90 -2.03 112.91 119.48 1s2x h THR 170 Ca 0.34 -2.32 -0.19 0.00 0.77 0.00 0.00 66.41 65.02 1s2x h THR 170 Cb -0.10 2.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.53 1s2x h THR 170 CO -0.07 0.67 -0.88 0.11 0.37 0.00 0.00 175.52 175.72 1s2x h LYS 171 N 0.04 0.04 -0.37 6.66 1.57 0.04 -2.44 116.57 122.11 1s2x h LYS 171 Ca -0.01 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1s2x h LYS 171 Cb 1.23 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.54 1s2x h LYS 171 CO 0.10 0.89 0.16 -0.92 -0.57 0.00 0.00 179.45 179.10 1s2x h TYR 172 N 0.02 0.55 -0.08 -1.35 5.03 -0.06 -0.06 116.97 121.02 1s2x h TYR 172 Ca -0.02 -0.04 0.03 0.00 2.58 0.00 0.00 58.73 61.29 1s2x h TYR 172 Cb 1.54 -0.17 -0.06 0.00 1.55 0.00 0.00 36.73 39.59 1s2x h TYR 172 CO 0.01 0.49 -0.50 0.82 -1.32 0.00 0.00 178.16 177.66 1s2x h ILE 173 N 0.45 0.05 -0.00 1.81 1.08 -1.25 -0.25 117.51 119.40 1s2x h ILE 173 Ca 0.12 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.63 1s2x h ILE 173 Cb 0.16 0.05 -0.05 0.00 -3.07 0.00 0.00 36.82 33.91 1s2x h ILE 173 CO -0.01 0.00 -0.36 0.40 -0.69 0.00 0.00 178.15 177.49 1s2x h ILE 174 N -0.59 0.24 0.00 -0.67 2.04 -1.24 -2.40 117.51 114.89 1s2x h ILE 174 Ca 0.04 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 1s2x h ILE 174 Cb 0.68 0.24 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1s2x h ILE 174 CO -0.40 0.00 -0.12 -0.07 0.00 0.00 0.00 178.15 177.57 1s2x h LEU 175 N -0.52 0.00 -1.22 1.44 3.38 -0.75 -2.85 115.31 114.80 1s2x h LEU 175 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1s2x h LEU 175 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1s2x h LEU 175 CO -0.29 0.12 -0.10 -1.54 0.09 0.00 0.00 178.44 176.71 1s2x n SER 176 N -3.60 2.00 -4.22 -0.43 3.41 -0.13 -4.72 113.62 105.93 1s2x n SER 176 Ca -0.02 -1.57 -0.47 0.00 -0.26 0.00 0.00 58.87 56.55 1s2x n SER 176 Cb 0.24 0.09 -0.13 0.00 -0.26 0.00 0.00 64.21 64.15 1s2x n SER 176 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1s2x n LYS 177 N 0.41 0.00 -0.98 4.33 3.00 -1.08 -4.84 118.16 119.00 1s2x n LYS 177 Ca 0.15 0.00 -0.37 0.00 -0.00 0.00 0.00 58.31 58.09 1s2x n LYS 177 Cb 0.45 -1.44 0.03 0.00 0.00 0.00 0.00 35.03 34.07 1s2x n LYS 177 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1s2x n ASN 178 N 8.86 -4.33 -0.89 3.14 3.02 -1.26 -5.11 115.26 118.69 1s2x n ASN 178 Ca 0.59 0.08 0.12 0.00 -0.03 0.00 0.00 54.58 55.34 1s2x n ASN 178 Cb -0.00 -0.61 0.16 0.00 -0.61 0.00 0.00 39.78 38.72 1s2x n ASN 178 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93