#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c3y s THR 2 N 0.00 5.31 -0.40 6.31 2.01 -1.26 -5.05 115.64 122.57 1c3y s THR 2 Ca 0.00 0.14 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 1c3y s THR 2 Cb 0.00 -3.33 -0.00 0.00 0.01 0.00 0.00 72.50 69.17 1c3y s THR 2 CO 0.00 0.57 1.62 -2.16 -0.69 0.00 0.00 174.62 173.96 1c3y s PRO 3 N -0.65 3.39 0.15 4.92 0.04 -1.26 -4.99 135.00 136.60 1c3y s PRO 3 Ca 0.13 1.11 -0.27 0.00 0.04 0.00 0.00 61.00 62.01 1c3y s PRO 3 Cb -0.12 -4.13 -0.07 0.00 0.04 0.00 0.00 34.50 30.22 1c3y s PRO 3 CO 0.02 -1.79 0.83 1.03 0.04 0.00 0.00 177.00 177.13 1c3y s ARG 4 N 5.43 4.63 0.26 4.56 0.52 -1.26 -4.96 118.95 128.13 1c3y s ARG 4 Ca 0.70 1.25 -0.04 0.00 -0.52 0.00 0.00 55.73 57.12 1c3y s ARG 4 Cb -0.17 -3.30 0.31 0.00 0.52 0.00 0.00 34.95 32.31 1c3y s ARG 4 CO 0.32 0.45 1.83 1.49 0.02 0.00 0.00 175.30 179.41 1c3y h GLU 5 N 4.75 1.02 -7.07 3.54 4.81 -1.95 -3.41 114.58 116.26 1c3y h GLU 5 Ca -0.45 -0.17 -0.40 0.00 -0.13 0.00 0.00 59.36 58.21 1c3y h GLU 5 Cb 1.21 -0.17 0.21 0.00 0.63 0.00 0.00 28.75 30.63 1c3y h GLU 5 CO 0.68 0.83 -0.08 0.15 -0.73 0.00 0.00 179.01 179.86 1c3y s LYS 6 N -5.46 -2.48 0.00 1.92 1.02 -1.26 -4.07 119.74 109.41 1c3y s LYS 6 Ca -0.11 0.27 0.00 0.00 0.02 0.00 0.00 55.97 56.15 1c3y s LYS 6 Cb 0.16 -1.42 0.00 0.00 -0.52 0.00 0.00 37.83 36.05 1c3y s LYS 6 CO 0.82 -4.61 0.00 1.28 -0.92 0.00 0.00 175.35 171.91 1c3y n LEU 7 N -5.46 0.00 0.00 3.17 7.99 -1.26 -4.72 117.00 116.72 1c3y n LEU 7 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.10 1c3y n LEU 7 Cb 0.59 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.90 1c3y n LEU 7 CO 0.46 0.00 0.00 1.17 -1.51 0.00 0.00 177.39 177.51 1c3y n LYS 8 N 0.00 -0.52 -1.10 3.23 4.81 -1.26 -4.90 118.16 118.43 1c3y n LYS 8 Ca 0.00 0.00 0.14 0.00 -0.87 0.00 0.00 58.31 57.58 1c3y n LYS 8 Cb 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.00 1c3y n LYS 8 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1c3y n GLN 9 N -1.03 -2.34 -2.74 1.64 7.27 -1.26 -4.93 117.38 114.00 1c3y n GLN 9 Ca 0.00 1.68 -0.14 0.00 0.07 0.00 0.00 57.00 58.62 1c3y n GLN 9 Cb 0.00 -2.81 -0.00 0.00 2.41 0.00 0.00 30.24 29.84 1c3y n GLN 9 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1c3y n HIS 10 N -3.75 -0.92 -1.77 3.69 8.25 -1.26 -4.69 115.22 114.78 1c3y n HIS 10 Ca -0.02 -1.20 -0.15 0.00 -0.26 0.00 0.00 57.72 56.09 1c3y n HIS 10 Cb 0.51 -0.23 -0.04 0.00 1.12 0.00 0.00 29.99 31.35 1c3y n HIS 10 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1c3y n SER 11 N -1.86 -4.77 -0.22 0.41 7.64 -1.26 -4.89 113.62 108.66 1c3y n SER 11 Ca -0.02 0.23 -0.06 0.00 1.01 0.00 0.00 58.87 60.04 1c3y n SER 11 Cb 0.32 -3.73 0.04 0.00 -1.01 0.00 0.00 64.21 59.84 1c3y n SER 11 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 1c3y h ASP 12 N 0.00 0.73 0.31 6.43 2.03 -1.92 -2.46 116.42 121.55 1c3y h ASP 12 Ca -0.33 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 55.95 1c3y h ASP 12 Cb 1.10 -0.18 0.00 0.00 -0.83 0.00 0.00 39.33 39.42 1c3y h ASP 12 CO 0.45 0.53 -0.51 0.00 -1.03 0.00 0.00 179.24 178.67 1c3y n ALA 13 N -2.27 3.62 0.22 4.15 0.00 -1.26 -3.96 120.51 121.00 1c3y n ALA 13 Ca 0.05 -0.42 0.11 0.00 0.00 0.00 0.00 53.44 53.17 1c3y n ALA 13 Cb 0.02 -1.04 0.33 0.00 0.00 0.00 0.00 19.45 18.75 1c3y n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1c3y h LYS 15 N 0.00 0.00 0.25 0.00 2.10 -1.66 -1.50 116.57 115.76 1c3y h LYS 15 Ca -0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 1c3y h LYS 15 Cb 0.91 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.24 1c3y h LYS 15 CO 0.02 0.16 -0.15 0.00 -2.00 0.00 0.00 179.45 177.48 1c3y h ALA 16 N 1.84 -1.01 0.00 0.07 0.00 -1.75 -3.23 119.26 115.18 1c3y h ALA 16 Ca -0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1c3y h ALA 16 Cb 0.96 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1c3y h ALA 16 CO 0.02 -1.00 -0.14 1.49 0.00 0.00 0.00 179.25 179.62 1c3y h GLU 17 N -0.37 0.00 -3.80 0.00 4.57 -1.73 -3.37 114.58 109.87 1c3y h GLU 17 Ca -0.03 0.00 -0.61 0.00 -1.18 0.00 0.00 59.36 57.54 1c3y h GLU 17 Cb 0.30 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1c3y h GLU 17 CO 0.03 0.67 2.94 0.43 -1.18 0.00 0.00 179.01 181.90 1c3y n SER 18 N -4.64 4.73 -2.35 1.04 7.64 -0.57 -4.65 113.62 114.82 1c3y n SER 18 Ca -0.09 -2.62 -0.29 0.00 1.01 0.00 0.00 58.87 56.87 1c3y n SER 18 Cb 0.35 -1.36 0.04 0.00 -1.01 0.00 0.00 64.21 62.23 1c3y n SER 18 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c3y n GLY 19 N 4.04 5.06 0.34 0.23 0.00 -1.22 -4.33 105.19 109.30 1c3y n GLY 19 Ca 0.55 -1.93 0.16 0.00 0.00 0.00 0.00 46.02 44.80 1c3y n GLY 19 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1c3y h VAL 20 N 1.36 0.75 -3.56 1.61 3.04 -1.83 -3.45 116.25 114.17 1c3y h VAL 20 Ca 0.48 0.00 -0.31 0.00 -1.01 0.00 0.00 66.70 65.85 1c3y h VAL 20 Cb 0.68 0.84 -0.01 0.00 -2.01 0.00 0.00 31.29 30.78 1c3y h VAL 20 CO 1.21 0.00 -0.41 -1.54 -1.01 0.00 0.00 177.57 175.83 1c3y n SER 21 N -4.28 -4.69 -2.38 3.17 3.41 -1.26 -0.66 113.62 106.92 1c3y n SER 21 Ca 0.04 0.10 -0.19 0.00 -0.26 0.00 0.00 58.87 58.56 1c3y n SER 21 Cb 0.39 -3.95 -0.01 0.00 -0.26 0.00 0.00 64.21 60.38 1c3y n SER 21 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1c3y n GLU 22 N -2.92 -1.79 -0.08 4.33 2.13 -1.26 -4.88 120.64 116.17 1c3y n GLU 22 Ca -0.18 0.93 -0.10 0.00 0.66 0.00 0.00 57.16 58.47 1c3y n GLU 22 Cb 0.64 -5.57 -0.04 0.00 0.27 0.00 0.00 31.44 26.73 1c3y n GLU 22 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1c3y n GLU 23 N -2.95 0.49 0.10 5.31 2.13 0.16 -3.79 120.64 122.10 1c3y n GLU 23 Ca -0.22 0.52 -0.03 0.00 0.66 0.00 0.00 57.16 58.09 1c3y n GLU 23 Cb 0.67 -1.69 0.19 0.00 0.27 0.00 0.00 31.44 30.88 1c3y n GLU 23 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 1c3y h SER 24 N -1.00 0.21 -0.63 4.31 0.02 -1.90 -2.94 113.55 111.61 1c3y h SER 24 Ca -0.11 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1c3y h SER 24 Cb 0.76 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.21 1c3y h SER 24 CO -0.07 0.68 0.40 -0.07 -1.14 0.00 0.00 176.83 176.64 1c3y h LEU 25 N 0.16 0.75 -0.37 5.07 3.38 -1.89 -2.37 115.31 120.04 1c3y h LEU 25 Ca 0.01 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1c3y h LEU 25 Cb 0.94 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1c3y h LEU 25 CO 0.08 0.56 0.20 -1.13 0.09 0.00 0.00 178.44 178.24 1c3y h ASN 26 N 0.88 0.46 0.01 -0.43 -0.73 -1.61 -1.83 115.58 112.32 1c3y h ASN 26 Ca 0.23 -0.09 -0.00 0.00 1.87 0.00 0.00 56.30 58.31 1c3y h ASN 26 Cb -0.06 -0.12 -0.00 0.00 0.27 0.00 0.00 38.32 38.41 1c3y h ASN 26 CO -0.05 0.42 -0.00 0.11 -0.37 0.00 0.00 177.43 177.54 1c3y h LYS 27 N 0.47 0.00 -0.18 6.67 1.57 -1.47 -0.80 116.57 122.83 1c3y h LYS 27 Ca 0.13 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1c3y h LYS 27 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1c3y h LYS 27 CO -0.02 0.00 0.06 0.28 -0.57 0.00 0.00 179.45 179.20 1c3y h VAL 28 N 0.00 1.08 -0.44 0.50 2.07 -1.09 -1.44 116.25 116.93 1c3y h VAL 28 Ca -0.00 -0.26 0.05 0.00 0.82 0.00 0.00 66.70 67.31 1c3y h VAL 28 Cb 0.01 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1c3y h VAL 28 CO 0.00 0.10 0.30 0.03 0.02 0.00 0.00 177.57 178.01 1c3y h ARG 29 N 0.25 0.37 -6.00 1.57 2.47 -1.20 -3.41 114.38 108.43 1c3y h ARG 29 Ca 0.06 -0.02 -0.57 0.00 -1.26 0.00 0.00 59.98 58.19 1c3y h ARG 29 Cb 0.07 -0.08 -0.06 0.00 -1.65 0.00 0.00 29.97 28.25 1c3y h ARG 29 CO -0.01 0.25 -0.06 0.54 0.56 0.00 0.00 179.97 181.25 1c3y s ASN 30 N -6.52 6.90 -1.23 7.04 2.20 -0.54 -4.99 114.94 117.79 1c3y s ASN 30 Ca -0.07 1.07 -0.20 0.00 -0.94 0.00 0.00 52.86 52.72 1c3y s ASN 30 Cb 0.18 -2.33 0.04 0.00 -2.00 0.00 0.00 41.25 37.14 1c3y s ASN 30 CO 0.73 0.11 1.72 -0.13 -2.94 0.00 0.00 177.10 176.59 1c3y s ARG 31 N -0.14 3.70 0.00 3.55 0.52 -1.26 -4.45 118.95 120.87 1c3y s ARG 31 Ca 0.29 -1.71 0.00 0.00 -0.52 0.00 0.00 55.73 53.79 1c3y s ARG 31 Cb -0.17 -5.46 0.00 0.00 0.52 0.00 0.00 34.95 29.84 1c3y s ARG 31 CO 0.15 -2.50 0.00 0.39 0.02 0.00 0.00 175.30 173.37 1c3y n GLU 32 N 8.48 0.00 0.00 3.54 -0.58 -1.26 -5.17 120.64 125.65 1c3y n GLU 32 Ca 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.20 1c3y n GLU 32 Cb 0.47 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.34 1c3y n GLU 32 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1c3y n GLU 33 N -1.51 0.00 -3.72 3.49 -0.58 -1.26 -5.18 120.64 111.87 1c3y n GLU 33 Ca 0.00 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.62 1c3y n GLU 33 Cb 0.00 0.00 -0.11 0.00 -0.57 0.00 0.00 31.44 30.76 1c3y n GLU 33 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1c3y s VAL 34 N -1.12 -0.01 -0.43 2.62 1.01 -1.26 -4.95 120.40 116.25 1c3y s VAL 34 Ca 0.00 0.04 0.08 0.00 0.00 0.00 0.00 61.98 62.10 1c3y s VAL 34 Cb 0.00 -0.55 0.29 0.00 0.00 0.00 0.00 36.38 36.12 1c3y s VAL 34 CO 0.00 0.02 0.82 -0.90 0.00 0.00 0.00 175.10 175.04 1c3y n ASP 35 N 3.46 -1.16 -4.74 3.32 5.75 -1.26 -5.13 116.55 116.79 1c3y n ASP 35 Ca -0.18 -3.20 -0.35 0.00 -0.01 0.00 0.00 54.79 51.06 1c3y n ASP 35 Cb 0.56 0.70 -0.08 0.00 -1.03 0.00 0.00 41.12 41.27 1c3y n ASP 35 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1c3y s ASP 36 N -1.63 5.56 -0.03 -1.12 2.15 -1.26 -5.04 116.67 115.29 1c3y s ASP 36 Ca 0.32 0.20 -0.26 0.00 0.43 0.00 0.00 52.55 53.24 1c3y s ASP 36 Cb 0.26 -1.62 -0.21 0.00 -0.30 0.00 0.00 42.92 41.05 1c3y s ASP 36 CO -0.12 0.36 1.21 1.55 -0.17 0.00 0.00 175.17 177.99 1c3y h PRO 37 N 4.85 0.02 -0.56 4.34 0.13 -2.00 -3.16 132.00 135.62 1c3y h PRO 37 Ca -0.51 -0.01 0.16 0.00 -0.87 0.00 0.00 66.00 64.77 1c3y h PRO 37 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1c3y h PRO 37 CO 0.57 0.57 0.45 0.87 -0.23 0.00 0.00 178.00 180.23 1c3y h LYS 38 N -0.53 0.00 0.67 0.86 1.57 -1.95 0.11 116.57 117.31 1c3y h LYS 38 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1c3y h LYS 38 Cb 0.57 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.88 1c3y h LYS 38 CO 0.00 0.00 -0.32 1.25 -0.57 0.00 0.00 179.45 179.81 1c3y h LEU 39 N 0.00 -0.76 -1.07 2.94 6.46 -1.93 0.20 115.31 121.14 1c3y h LEU 39 Ca 0.27 -0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.98 1c3y h LEU 39 Cb 1.17 0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 41.27 1c3y h LEU 39 CO -0.00 -0.40 0.20 0.11 -0.62 0.00 0.00 178.44 177.72 1c3y h LYS 40 N -1.16 0.86 0.85 1.25 1.57 -1.41 -1.58 116.57 116.95 1c3y h LYS 40 Ca -0.09 -0.15 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 1c3y h LYS 40 Cb 0.72 -0.14 0.01 0.00 0.08 0.00 0.00 32.23 32.89 1c3y h LYS 40 CO 0.15 0.73 -0.41 0.93 -0.57 0.00 0.00 179.45 180.28 1c3y h GLU 41 N 0.84 -1.10 -0.70 3.15 3.07 -0.78 -2.46 114.58 116.60 1c3y h GLU 41 Ca 0.19 0.08 0.13 0.00 -0.50 0.00 0.00 59.36 59.26 1c3y h GLU 41 Cb 0.22 0.25 -0.09 0.00 -0.84 0.00 0.00 28.75 28.29 1c3y h GLU 41 CO -0.01 -0.73 0.24 1.25 -1.40 0.00 0.00 179.01 178.35 1c3y h HIS 42 N -1.28 0.40 -0.50 4.33 2.76 -0.54 -1.45 115.15 118.86 1c3y h HIS 42 Ca -0.12 0.04 0.08 0.00 -2.20 0.00 0.00 60.37 58.17 1c3y h HIS 42 Cb 0.88 -0.07 -0.07 0.00 1.55 0.00 0.00 27.41 29.70 1c3y h HIS 42 CO 0.01 0.03 0.11 0.00 -1.30 0.00 0.00 177.93 176.78 1c3y h ALA 43 N 1.52 0.57 -0.59 5.26 0.00 -1.25 0.11 119.26 124.89 1c3y h ALA 43 Ca 0.38 0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.49 1c3y h ALA 43 Cb 0.57 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 1c3y h ALA 43 CO -0.40 -0.29 0.40 0.35 0.00 0.00 0.00 179.25 179.30 1c3y h PHE 44 N 0.26 0.40 0.00 0.00 3.57 -0.78 0.30 116.94 120.69 1c3y h PHE 44 Ca 0.25 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.71 1c3y h PHE 44 Cb 0.33 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1c3y h PHE 44 CO -0.22 0.19 -0.26 0.00 -2.23 0.00 0.00 178.31 175.80 1c3y h ILE 46 N 0.00 1.04 -0.75 0.00 1.08 -0.23 -3.25 117.51 115.40 1c3y h ILE 46 Ca -0.00 -2.79 0.02 0.00 -0.39 0.00 0.00 64.86 61.71 1c3y h ILE 46 Cb 0.49 2.60 -0.04 0.00 -3.07 0.00 0.00 36.82 36.80 1c3y h ILE 46 CO 0.03 0.72 0.48 -0.07 -0.69 0.00 0.00 178.15 178.62 1c3y h LEU 47 N 0.03 0.80 0.25 1.44 -0.00 -0.58 0.64 115.31 117.88 1c3y h LEU 47 Ca -0.25 -0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.61 1c3y h LEU 47 Cb 1.98 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 42.46 1c3y h LEU 47 CO 0.11 0.56 -0.12 0.11 -0.00 0.00 0.00 178.44 179.11 1c3y h LYS 48 N 0.95 -0.32 -0.55 1.13 1.57 -1.61 -2.31 116.57 115.42 1c3y h LYS 48 Ca 0.29 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.08 1c3y h LYS 48 Cb -0.02 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1c3y h LYS 48 CO -0.10 -0.03 0.26 0.00 -0.57 0.00 0.00 179.45 179.02 1c3y h ARG 49 N -0.61 0.78 -0.03 3.15 2.47 -1.55 -1.58 114.38 117.01 1c3y h ARG 49 Ca -0.03 -0.10 0.01 0.00 -1.26 0.00 0.00 59.98 58.60 1c3y h ARG 49 Cb 0.44 -0.15 -0.00 0.00 -1.65 0.00 0.00 29.97 28.61 1c3y h ARG 49 CO 0.06 0.61 0.02 0.00 0.56 0.00 0.00 179.97 181.21 1c3y h ALA 50 N 1.51 1.96 -0.15 0.04 0.00 0.38 -3.46 119.26 119.55 1c3y h ALA 50 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1c3y h ALA 50 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1c3y h ALA 50 CO -0.03 -0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.60 1c3y n GLY 51 N -1.51 1.15 0.09 0.00 0.00 -0.59 -5.02 105.19 99.30 1c3y n GLY 51 Ca -0.02 -0.39 -0.04 0.00 0.00 0.00 0.00 46.02 45.57 1c3y n GLY 51 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1c3y n PHE 52 N -2.01 0.00 -4.05 1.61 3.72 -0.90 -4.99 117.46 110.83 1c3y n PHE 52 Ca 0.00 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.08 1c3y n PHE 52 Cb 0.24 -0.23 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 1c3y n PHE 52 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 1c3y s ILE 53 N -1.90 4.72 0.28 4.37 2.07 -1.23 -4.02 121.20 125.49 1c3y s ILE 53 Ca -0.13 -0.57 -0.05 0.00 -1.41 0.00 0.00 60.65 58.49 1c3y s ILE 53 Cb 0.02 -3.23 -0.05 0.00 0.13 0.00 0.00 42.46 39.33 1c3y s ILE 53 CO 0.20 0.22 0.54 1.51 -1.91 0.00 0.00 174.94 175.50 1c3y s ASP 54 N -2.13 6.44 0.64 4.50 1.47 -1.22 -4.26 116.67 122.11 1c3y s ASP 54 Ca 0.27 0.69 0.30 0.00 1.18 0.00 0.00 52.55 54.98 1c3y s ASP 54 Cb -0.12 -2.13 1.59 0.00 -0.34 0.00 0.00 42.92 41.92 1c3y s ASP 54 CO 0.19 -0.17 1.93 0.00 0.68 0.00 0.00 175.17 177.79 1c3y h ALA 55 N 1.74 1.58 -0.35 2.11 0.00 -1.96 0.10 119.26 122.49 1c3y h ALA 55 Ca -0.48 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1c3y h ALA 55 Cb 1.19 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1c3y h ALA 55 CO 0.66 -0.43 0.06 -1.13 0.00 0.00 0.00 179.25 178.41 1c3y n SER 56 N -3.17 3.54 -2.77 0.00 3.41 -1.26 -4.96 113.62 108.41 1c3y n SER 56 Ca 0.01 -2.56 -0.01 0.00 -0.26 0.00 0.00 58.87 56.05 1c3y n SER 56 Cb 0.45 -0.62 -0.01 0.00 -0.26 0.00 0.00 64.21 63.78 1c3y n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c3y n GLY 57 N 0.22 -3.82 3.14 5.00 0.00 0.35 -5.05 105.19 105.03 1c3y n GLY 57 Ca 0.18 0.58 0.04 0.00 0.00 0.00 0.00 46.02 46.82 1c3y n GLY 57 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1c3y s GLU 58 N -1.39 0.56 0.49 1.61 2.56 -1.25 -4.95 118.70 116.33 1c3y s GLU 58 Ca -0.04 0.97 -0.22 0.00 0.00 0.00 0.00 54.97 55.68 1c3y s GLU 58 Cb 0.00 0.52 -0.07 0.00 2.00 0.00 0.00 34.13 36.58 1c3y s GLU 58 CO 0.67 -0.64 1.18 -0.59 -0.56 0.00 0.00 175.26 175.32 1c3y s PHE 59 N 2.85 2.75 -0.39 5.30 -0.12 -1.26 -3.44 117.98 123.68 1c3y s PHE 59 Ca 0.20 1.52 0.02 0.00 -0.05 0.00 0.00 56.93 58.62 1c3y s PHE 59 Cb -0.15 -3.42 0.15 0.00 -0.63 0.00 0.00 43.02 38.97 1c3y s PHE 59 CO -0.21 -1.71 0.26 -0.65 -0.05 0.00 0.00 175.22 172.86 1c3y s GLN 60 N -2.84 0.77 0.43 1.99 -1.52 -1.26 -4.97 119.66 112.26 1c3y s GLN 60 Ca 0.67 -1.69 0.23 0.00 -1.95 0.00 0.00 55.36 52.62 1c3y s GLN 60 Cb -0.29 -1.47 0.79 0.00 -0.22 0.00 0.00 33.01 31.82 1c3y s GLN 60 CO 0.35 -1.27 1.77 -0.07 -0.25 0.00 0.00 175.29 175.82 1c3y h LEU 61 N 6.50 0.00 -2.05 2.90 3.38 -1.95 -2.83 115.31 121.25 1c3y h LEU 61 Ca 0.13 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1c3y h LEU 61 Cb 0.94 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 1c3y h LEU 61 CO 0.33 0.23 0.02 -0.78 0.09 0.00 0.00 178.44 178.33 1c3y h ASP 62 N 0.00 0.00 0.27 -0.43 1.82 -1.99 0.14 116.42 116.23 1c3y h ASP 62 Ca -0.00 0.00 -0.33 0.00 -0.39 0.00 0.00 57.03 56.31 1c3y h ASP 62 Cb 0.84 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 40.79 1c3y h ASP 62 CO 0.03 0.00 -2.01 1.57 -1.61 0.00 0.00 179.24 177.22 1c3y n HIS 63 N -4.45 0.64 0.03 0.28 -0.00 -1.15 -3.88 115.22 106.69 1c3y n HIS 63 Ca -0.02 0.21 -0.13 0.00 0.46 0.00 0.00 57.72 58.24 1c3y n HIS 63 Cb 0.12 -1.11 -0.09 0.00 -0.12 0.00 0.00 29.99 28.79 1c3y n HIS 63 CO 0.00 0.00 0.00 0.82 0.46 0.00 0.00 176.34 177.62 1c3y h ILE 64 N 0.01 1.16 -0.63 3.57 2.04 -1.17 -2.10 117.51 120.38 1c3y h ILE 64 Ca -0.40 -0.74 0.10 0.00 1.00 0.00 0.00 64.86 64.82 1c3y h ILE 64 Cb 2.09 1.64 -0.07 0.00 -0.74 0.00 0.00 36.82 39.73 1c3y h ILE 64 CO 0.05 0.18 0.25 0.07 0.00 0.00 0.00 178.15 178.71 1c3y h LYS 65 N -0.41 0.42 -0.29 2.37 2.10 -0.95 0.11 116.57 119.93 1c3y h LYS 65 Ca -0.01 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.61 1c3y h LYS 65 Cb 0.36 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 31.58 1c3y h LYS 65 CO 0.01 0.28 0.18 1.15 -2.00 0.00 0.00 179.45 179.07 1c3y h THR 66 N 0.44 1.10 -0.23 0.07 2.02 -1.66 -0.22 112.91 114.44 1c3y h THR 66 Ca 0.32 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.24 1c3y h THR 66 Cb 0.39 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1c3y h THR 66 CO -0.31 0.10 0.09 0.11 0.37 0.00 0.00 175.52 175.89 1c3y h LYS 67 N 0.37 0.35 0.00 6.66 1.79 -0.65 -2.28 116.57 122.81 1c3y h LYS 67 Ca 0.11 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.50 1c3y h LYS 67 Cb 0.01 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.60 1c3y h LYS 67 CO -0.02 0.40 -0.07 0.74 -1.08 0.00 0.00 179.45 179.42 1c3y h PHE 68 N 0.22 0.00 0.07 -1.35 0.04 -0.67 -3.24 116.94 112.01 1c3y h PHE 68 Ca 0.08 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.84 1c3y h PHE 68 Cb 0.18 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.33 1c3y h PHE 68 CO -0.01 0.07 -0.03 -0.22 -0.60 0.00 0.00 178.31 177.52 1c3y h LYS 69 N 0.00 -0.09 -6.56 1.51 3.64 -0.49 -3.43 116.57 111.15 1c3y h LYS 69 Ca -0.00 0.01 -0.59 0.00 -1.27 0.00 0.00 60.65 58.79 1c3y h LYS 69 Cb 0.35 0.02 0.08 0.00 -0.41 0.00 0.00 32.23 32.28 1c3y h LYS 69 CO 0.01 -0.06 0.55 -0.85 -2.27 0.00 0.00 179.45 176.83 1c3y n GLU 70 N -2.55 1.91 -2.77 1.90 0.28 -0.94 -3.71 120.64 114.75 1c3y n GLU 70 Ca -0.01 0.68 -0.05 0.00 -0.16 0.00 0.00 57.16 57.62 1c3y n GLU 70 Cb 0.04 -2.30 0.01 0.00 1.43 0.00 0.00 31.44 30.61 1c3y n GLU 70 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1c3y n ASN 71 N 2.05 -7.86 0.00 -1.84 3.02 -1.26 -4.92 115.26 104.44 1c3y n ASN 71 Ca 0.12 0.87 0.00 0.00 -0.03 0.00 0.00 54.58 55.53 1c3y n ASN 71 Cb 0.31 -5.29 0.00 0.00 -0.61 0.00 0.00 39.78 34.19 1c3y n ASN 71 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1c3y n SER 72 N 0.08 0.00 0.00 6.41 2.88 -1.24 -4.97 113.62 116.77 1c3y n SER 72 Ca 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 1c3y n SER 72 Cb 0.28 0.10 0.00 0.00 -0.75 0.00 0.00 64.21 63.83 1c3y n SER 72 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1c3y n GLU 73 N -1.64 -0.39 -2.72 -1.46 4.07 -1.26 -4.86 120.64 112.39 1c3y n GLU 73 Ca 0.00 0.10 -0.09 0.00 -0.06 0.00 0.00 57.16 57.11 1c3y n GLU 73 Cb 0.00 -3.38 0.07 0.00 -0.06 0.00 0.00 31.44 28.07 1c3y n GLU 73 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 1c3y n HIS 74 N -2.62 -0.88 -2.31 4.31 8.25 -1.26 -5.10 115.22 115.61 1c3y n HIS 74 Ca 0.00 -2.42 -0.41 0.00 -0.26 0.00 0.00 57.72 54.63 1c3y n HIS 74 Cb 0.10 0.68 -0.03 0.00 1.12 0.00 0.00 29.99 31.86 1c3y n HIS 74 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1c3y s PRO 75 N -1.30 3.26 0.00 -0.41 0.04 -1.26 -4.07 135.00 131.26 1c3y s PRO 75 Ca 0.25 0.61 0.00 0.00 0.04 0.00 0.00 61.00 61.90 1c3y s PRO 75 Cb 0.41 -4.15 0.00 0.00 0.04 0.00 0.00 34.50 30.80 1c3y s PRO 75 CO -0.03 -1.98 0.00 -0.85 0.04 0.00 0.00 177.00 174.17 1c3y n GLU 76 N 8.64 0.00 0.02 4.56 0.28 -1.26 -4.95 120.64 127.93 1c3y n GLU 76 Ca 0.15 0.00 0.11 0.00 -0.16 0.00 0.00 57.16 57.26 1c3y n GLU 76 Cb 0.49 0.00 0.05 0.00 1.43 0.00 0.00 31.44 33.41 1c3y n GLU 76 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1c3y n LYS 77 N 0.00 0.23 0.06 3.44 4.76 -1.26 -4.32 118.16 121.07 1c3y n LYS 77 Ca 0.00 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.32 1c3y n LYS 77 Cb 0.00 -1.58 -0.06 0.00 -1.84 0.00 0.00 35.03 31.55 1c3y n LYS 77 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1c3y h VAL 78 N 0.00 0.86 -0.53 -0.18 2.07 -1.93 0.17 116.25 116.72 1c3y h VAL 78 Ca 0.00 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.62 1c3y h VAL 78 Cb 0.68 0.86 -0.11 0.00 -1.52 0.00 0.00 31.29 31.21 1c3y h VAL 78 CO 0.00 0.00 -0.22 -2.24 0.02 0.00 0.00 177.57 175.13 1c3y h ASP 79 N -0.12 -0.75 -0.39 0.57 2.03 -1.92 0.92 116.42 116.76 1c3y h ASP 79 Ca 0.01 0.18 -0.16 0.00 -0.73 0.00 0.00 57.03 56.34 1c3y h ASP 79 Cb 0.13 0.42 -0.01 0.00 -0.83 0.00 0.00 39.33 39.04 1c3y h ASP 79 CO -0.03 -0.24 -0.37 0.44 -1.03 0.00 0.00 179.24 178.00 1c3y h ASP 80 N -0.09 1.00 -0.53 4.15 3.32 -1.77 -2.92 116.42 119.58 1c3y h ASP 80 Ca 0.24 -0.45 -0.05 0.00 0.02 0.00 0.00 57.03 56.79 1c3y h ASP 80 Cb 0.47 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 1c3y h ASP 80 CO -0.59 1.25 0.16 -0.07 -1.72 0.00 0.00 179.24 178.27 1c3y h LEU 81 N 0.77 0.82 0.53 1.55 -0.00 0.72 0.19 115.31 119.89 1c3y h LEU 81 Ca 0.07 -0.14 -0.03 0.00 -0.00 0.00 0.00 57.88 57.78 1c3y h LEU 81 Cb 0.96 -0.21 0.01 0.00 -0.00 0.00 0.00 40.66 41.41 1c3y h LEU 81 CO 0.09 0.79 -0.26 0.58 -0.00 0.00 0.00 178.44 179.65 1c3y h VAL 82 N 0.85 0.00 -0.79 1.22 2.07 0.90 0.82 116.25 121.32 1c3y h VAL 82 Ca 0.19 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.66 1c3y h VAL 82 Cb 0.28 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.01 1c3y h VAL 82 CO -0.00 0.00 0.52 0.00 0.02 0.00 0.00 177.57 178.11 1c3y h ALA 83 N -1.61 1.46 -0.23 1.67 0.00 -1.53 0.90 119.26 119.93 1c3y h ALA 83 Ca -0.07 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.59 1c3y h ALA 83 Cb 0.55 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1c3y h ALA 83 CO 0.12 0.49 -0.64 -0.22 0.00 0.00 0.00 179.25 179.00 1c3y h LYS 84 N 1.05 0.84 0.00 0.00 3.64 -0.59 -3.26 116.57 118.24 1c3y h LYS 84 Ca 0.30 -0.60 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1c3y h LYS 84 Cb -0.08 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1c3y h LYS 84 CO -0.07 1.22 -0.76 0.00 -2.27 0.00 0.00 179.45 177.57 1c3y n ALA 86 N -1.91 5.90 -1.80 0.00 0.00 0.31 -4.53 120.51 118.47 1c3y n ALA 86 Ca 0.02 -1.93 -0.43 0.00 0.00 0.00 0.00 53.44 51.11 1c3y n ALA 86 Cb 0.46 -1.95 -0.03 0.00 0.00 0.00 0.00 19.45 17.94 1c3y n ALA 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1c3y s VAL 87 N -0.61 3.24 -0.21 0.00 -7.23 -1.26 -4.89 120.40 109.43 1c3y s VAL 87 Ca 0.50 0.27 -0.29 0.00 -1.81 0.00 0.00 61.98 60.65 1c3y s VAL 87 Cb 0.28 -3.24 -0.04 0.00 0.56 0.00 0.00 36.38 33.94 1c3y s VAL 87 CO -0.07 -0.10 1.90 -1.59 -0.31 0.00 0.00 175.10 174.93 1c3y s LYS 88 N 5.14 3.52 0.51 4.82 -2.85 -1.26 -4.76 119.74 124.86 1c3y s LYS 88 Ca 0.87 1.84 0.05 0.00 -1.00 0.00 0.00 55.97 57.74 1c3y s LYS 88 Cb -0.34 -4.20 0.09 0.00 -2.06 0.00 0.00 37.83 31.33 1c3y s LYS 88 CO 0.35 -1.64 0.71 1.63 0.10 0.00 0.00 175.35 176.50 1c3y n LYS 89 N 8.18 0.47 0.20 1.78 5.02 -1.26 -4.98 118.16 127.57 1c3y n LYS 89 Ca 0.23 -2.46 0.15 0.00 -2.02 0.00 0.00 58.31 54.21 1c3y n LYS 89 Cb 0.45 -0.31 0.65 0.00 -0.02 0.00 0.00 35.03 35.80 1c3y n LYS 89 CO 0.00 0.00 0.00 0.38 -0.52 0.00 0.00 177.40 177.26 1c3y h ASP 90 N -0.10 0.00 -5.05 4.39 2.03 -2.02 -3.44 116.42 112.23 1c3y h ASP 90 Ca -0.24 0.00 -0.13 0.00 -0.73 0.00 0.00 57.03 55.93 1c3y h ASP 90 Cb 1.02 0.00 -0.19 0.00 -0.83 0.00 0.00 39.33 39.33 1c3y h ASP 90 CO 0.31 0.00 -0.53 0.42 -1.03 0.00 0.00 179.24 178.41 1c3y s THR 91 N -3.55 0.12 -0.00 1.15 -4.23 -1.26 -5.07 115.64 102.79 1c3y s THR 91 Ca 0.01 -0.98 -0.23 0.00 -1.18 0.00 0.00 61.69 59.31 1c3y s THR 91 Cb 0.09 -0.73 -0.18 0.00 1.34 0.00 0.00 72.50 73.02 1c3y s THR 91 CO 0.41 -0.54 1.26 1.55 -0.54 0.00 0.00 174.62 176.76 1c3y h PRO 92 N 3.89 0.18 -0.10 3.99 0.13 -1.94 -2.97 132.00 135.17 1c3y h PRO 92 Ca -0.32 -0.11 0.03 0.00 -0.87 0.00 0.00 66.00 64.73 1c3y h PRO 92 Cb 1.19 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1c3y h PRO 92 CO 0.47 0.66 0.19 -0.56 -0.23 0.00 0.00 178.00 178.54 1c3y h GLN 93 N -0.29 0.00 0.06 0.86 -0.00 -1.95 0.17 115.11 113.96 1c3y h GLN 93 Ca 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1c3y h GLN 93 Cb 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.13 1c3y h GLN 93 CO 0.02 0.00 -0.03 1.25 -0.00 0.00 0.00 178.83 180.07 1c3y h HIS 94 N 0.00 -0.07 -0.72 0.06 2.76 -1.85 -3.30 115.15 112.02 1c3y h HIS 94 Ca 0.05 -0.00 0.21 0.00 -2.20 0.00 0.00 60.37 58.43 1c3y h HIS 94 Cb 0.43 0.02 -0.03 0.00 1.55 0.00 0.00 27.41 29.39 1c3y h HIS 94 CO 0.00 -0.05 0.66 0.66 -1.30 0.00 0.00 177.93 177.90 1c3y h SER 95 N -0.34 0.00 -0.01 3.26 4.64 -1.34 -1.27 113.55 118.49 1c3y h SER 95 Ca -0.01 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.34 1c3y h SER 95 Cb 0.06 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.11 1c3y h SER 95 CO 0.01 0.00 -0.20 0.77 -0.87 0.00 0.00 176.83 176.55 1c3y h SER 96 N 0.00 -0.58 -0.63 4.97 4.64 -1.04 -1.55 113.55 119.35 1c3y h SER 96 Ca 0.34 0.08 0.03 0.00 -0.47 0.00 0.00 61.79 61.78 1c3y h SER 96 Cb 1.66 0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 63.96 1c3y h SER 96 CO -0.00 -0.26 0.42 0.00 -0.87 0.00 0.00 176.83 176.11 1c3y h ALA 97 N 0.60 1.63 -0.39 5.18 0.00 -1.31 -1.26 119.26 123.71 1c3y h ALA 97 Ca 0.06 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1c3y h ALA 97 Cb 0.39 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1c3y h ALA 97 CO -0.19 0.31 0.24 -0.44 0.00 0.00 0.00 179.25 179.17 1c3y h ASP 98 N 0.77 0.46 0.38 0.00 5.19 -1.28 -1.61 116.42 120.32 1c3y h ASP 98 Ca 0.25 -0.02 -0.16 0.00 -0.62 0.00 0.00 57.03 56.48 1c3y h ASP 98 Cb 0.04 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.43 1c3y h ASP 98 CO -0.07 0.35 -0.68 -0.26 -3.12 0.00 0.00 179.24 175.46 1c3y h PHE 99 N 0.53 0.37 -0.99 4.55 0.04 -0.60 -0.56 116.94 120.28 1c3y h PHE 99 Ca 0.14 -0.16 -0.55 0.00 2.80 0.00 0.00 57.97 60.21 1c3y h PHE 99 Cb -0.03 -0.06 -0.30 0.00 2.20 0.00 0.00 35.95 37.76 1c3y h PHE 99 CO 0.00 0.87 0.70 0.34 -0.60 0.00 0.00 178.31 179.62 1c3y n PHE 100 N -3.82 3.07 0.09 -0.55 -0.00 -0.68 -4.19 117.46 111.38 1c3y n PHE 100 Ca -0.03 -2.09 0.00 0.00 -0.00 0.00 0.00 57.45 55.33 1c3y n PHE 100 Cb 0.67 -1.05 0.00 0.00 -0.00 0.00 0.00 39.48 39.10 1c3y n PHE 100 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 1c3y n LYS 101 N -1.07 0.00 -0.27 -4.13 4.76 -0.78 -4.90 118.16 111.77 1c3y n LYS 101 Ca 0.60 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 56.10 1c3y n LYS 101 Cb 1.44 0.00 0.21 0.00 -1.84 0.00 0.00 35.03 34.84 1c3y n LYS 101 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1c3y n VAL 103 N -5.00 4.20 0.06 0.00 0.24 -1.26 -3.93 118.33 112.64 1c3y n VAL 103 Ca 0.16 -3.23 0.00 0.00 -2.04 0.00 0.00 64.34 59.22 1c3y n VAL 103 Cb 0.45 -2.01 0.00 0.00 -1.47 0.00 0.00 33.84 30.81 1c3y n VAL 103 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1c3y n HIS 104 N 1.89 -2.63 -1.72 6.34 -0.00 -0.83 -4.94 115.22 113.34 1c3y n HIS 104 Ca 0.58 0.38 -0.38 0.00 -0.00 0.00 0.00 57.72 58.31 1c3y n HIS 104 Cb 0.43 1.29 0.05 0.00 -0.00 0.00 0.00 29.99 31.76 1c3y n HIS 104 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 1c3y n ASP 105 N -2.76 7.58 -3.74 0.41 -0.08 -1.18 -4.82 116.55 111.96 1c3y n ASP 105 Ca 0.00 -3.81 -0.42 0.00 -1.51 0.00 0.00 54.79 49.05 1c3y n ASP 105 Cb 0.00 -1.04 0.00 0.00 2.34 0.00 0.00 41.12 42.42 1c3y n ASP 105 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1c3y n ASN 106 N -0.65 6.16 0.00 1.67 5.15 -1.26 -4.25 115.26 122.09 1c3y n ASN 106 Ca 0.57 -3.15 0.00 0.00 -0.60 0.00 0.00 54.58 51.40 1c3y n ASN 106 Cb 0.38 -1.42 0.00 0.00 -0.53 0.00 0.00 39.78 38.20 1c3y n ASN 106 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1c3y n ARG 107 N 2.95 0.00 0.00 1.20 0.63 -1.26 -5.17 116.66 115.01 1c3y n ARG 107 Ca 0.46 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 57.55 1c3y n ARG 107 Cb 0.32 -0.49 0.78 0.00 0.45 0.00 0.00 32.46 33.52 1c3y n ARG 107 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99