#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 0.00 0.92 6.31 2.01 -1.26 -5.17 115.64 118.46 1c3y s THR 2 Ca 0.00 -0.03 -0.12 0.00 0.31 0.00 0.00 61.69 61.85 1c3y s THR 2 Cb 0.00 -0.26 0.14 0.00 0.01 0.00 0.00 72.50 72.39 1c3y s THR 2 CO 0.00 -0.02 1.11 -2.16 -0.69 0.00 0.00 174.62 172.86 1c3y s PRO 3 N 0.04 1.09 -0.07 4.92 0.04 -1.26 -5.00 135.00 134.76 1c3y s PRO 3 Ca -0.01 0.51 0.02 0.00 0.04 0.00 0.00 61.00 61.57 1c3y s PRO 3 Cb -0.01 -1.82 0.08 0.00 0.04 0.00 0.00 34.50 32.79 1c3y s PRO 3 CO 0.00 -2.28 0.64 2.89 0.04 0.00 0.00 177.00 178.29 1c3y n ARG 4 N -3.86 0.26 -4.42 4.56 1.85 -1.26 -5.16 116.66 108.64 1c3y n ARG 4 Ca 0.06 -0.31 -0.20 0.00 -1.00 0.00 0.00 57.85 56.40 1c3y n ARG 4 Cb 0.57 0.22 -0.10 0.00 -1.05 0.00 0.00 32.46 32.10 1c3y n ARG 4 CO 0.00 0.00 0.00 -1.83 -0.01 0.00 0.00 177.63 175.79 1c3y s GLU 5 N 0.02 1.57 -0.31 2.89 -1.05 -1.26 -5.12 118.70 115.44 1c3y s GLU 5 Ca 0.02 -1.84 -0.18 0.00 -0.15 0.00 0.00 54.97 52.81 1c3y s GLU 5 Cb 0.09 -0.82 -0.01 0.00 -0.44 0.00 0.00 34.13 32.94 1c3y s GLU 5 CO -0.02 -0.15 0.52 0.21 0.95 0.00 0.00 175.26 176.77 1c3y s LYS 6 N -3.87 3.85 -0.30 -4.83 2.47 -1.26 -4.98 119.74 110.82 1c3y s LYS 6 Ca 0.34 0.09 -0.14 0.00 -1.56 0.00 0.00 55.97 54.70 1c3y s LYS 6 Cb 0.07 -3.73 0.18 0.00 -1.46 0.00 0.00 37.83 32.89 1c3y s LYS 6 CO 0.14 -0.51 1.12 -1.17 0.16 0.00 0.00 175.35 175.09 1c3y s LEU 7 N 2.38 -0.28 0.59 5.43 0.20 -1.26 -5.15 118.68 120.60 1c3y s LEU 7 Ca 0.20 0.10 0.00 0.00 0.69 0.00 0.00 54.13 55.13 1c3y s LEU 7 Cb -0.15 1.21 0.00 0.00 -0.43 0.00 0.00 46.19 46.81 1c3y s LEU 7 CO 0.11 -0.05 0.00 1.17 -0.29 0.00 0.00 176.35 177.29 1c3y n LYS 8 N 5.29 -3.50 -2.77 1.98 4.81 -1.26 -4.98 118.16 117.72 1c3y n LYS 8 Ca 0.00 2.81 -0.20 0.00 -0.87 0.00 0.00 58.31 60.05 1c3y n LYS 8 Cb 0.56 -3.81 0.08 0.00 0.02 0.00 0.00 35.03 31.89 1c3y n LYS 8 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1c3y n GLN 9 N -3.65 0.35 -2.68 1.64 6.02 -1.26 -5.07 117.38 112.73 1c3y n GLN 9 Ca -0.06 -2.90 -0.05 0.00 -0.01 0.00 0.00 57.00 53.98 1c3y n GLN 9 Cb 0.59 -0.39 0.05 0.00 1.02 0.00 0.00 30.24 31.52 1c3y n GLN 9 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 1c3y n HIS 10 N -2.45 -1.39 -3.05 1.08 -0.00 -1.26 -5.02 115.22 103.12 1c3y n HIS 10 Ca 0.16 -1.29 -0.02 0.00 0.46 0.00 0.00 57.72 57.03 1c3y n HIS 10 Cb 0.58 1.38 0.01 0.00 -0.12 0.00 0.00 29.99 31.84 1c3y n HIS 10 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1c3y n SER 11 N -0.43 -7.58 -4.57 0.26 7.64 -1.26 -4.76 113.62 102.93 1c3y n SER 11 Ca -0.14 -0.14 -0.14 0.00 1.01 0.00 0.00 58.87 59.46 1c3y n SER 11 Cb 0.74 -5.23 -0.09 0.00 -1.01 0.00 0.00 64.21 58.62 1c3y n SER 11 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1c3y s ASP 12 N -3.03 3.60 0.00 6.43 -4.77 -1.26 -2.05 116.67 115.59 1c3y s ASP 12 Ca 0.05 -0.48 0.00 0.00 -3.30 0.00 0.00 52.55 48.83 1c3y s ASP 12 Cb -0.01 -2.58 0.00 0.00 -1.09 0.00 0.00 42.92 39.25 1c3y s ASP 12 CO 0.74 -4.39 0.00 0.00 0.70 0.00 0.00 175.17 172.21 1c3y n ALA 13 N 19.37 0.00 0.64 2.11 0.00 -1.26 -4.95 120.51 136.42 1c3y n ALA 13 Ca 0.44 0.00 0.12 0.00 0.00 0.00 0.00 53.44 54.00 1c3y n ALA 13 Cb 0.45 0.00 0.46 0.00 0.00 0.00 0.00 19.45 20.36 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 0.00 0.00 3.64 -1.88 1.06 116.57 119.39 1c3y h LYS 15 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1c3y h LYS 15 Cb 0.57 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1c3y h LYS 15 CO 0.00 0.13 0.07 0.00 -2.27 0.00 0.00 179.45 177.38 1c3y h ALA 16 N 1.87 1.07 0.00 5.00 0.00 -1.91 -3.39 119.26 121.89 1c3y h ALA 16 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1c3y h ALA 16 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1c3y h ALA 16 CO 0.02 -0.07 0.00 -1.91 0.00 0.00 0.00 179.25 177.29 1c3y n GLU 17 N -2.94 0.00 0.00 0.00 4.07 -1.17 -5.02 120.64 115.58 1c3y n GLU 17 Ca -0.03 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.07 1c3y n GLU 17 Cb 0.13 -0.09 0.00 0.00 -0.06 0.00 0.00 31.44 31.42 1c3y n GLU 17 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1c3y n SER 18 N -1.84 0.00 -2.32 4.31 7.64 0.29 -4.78 113.62 116.92 1c3y n SER 18 Ca 0.00 0.44 -0.08 0.00 1.01 0.00 0.00 58.87 60.24 1c3y n SER 18 Cb 0.00 -0.26 -0.01 0.00 -1.01 0.00 0.00 64.21 62.94 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 1.15 -0.35 3.70 0.23 0.00 0.29 -4.75 105.19 105.47 1c3y n GLY 19 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1c3y n GLY 19 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1c3y n VAL 20 N -2.91 1.94 -1.12 1.61 3.14 -1.26 -4.89 118.33 114.83 1c3y n VAL 20 Ca -0.10 -0.48 -0.26 0.00 -2.96 0.00 0.00 64.34 60.54 1c3y n VAL 20 Cb 0.54 -1.61 0.13 0.00 -1.06 0.00 0.00 33.84 31.85 1c3y n VAL 20 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1c3y n SER 21 N 0.83 5.03 -2.18 6.55 3.41 -1.26 -4.85 113.62 121.15 1c3y n SER 21 Ca 0.05 -3.55 -0.17 0.00 -0.26 0.00 0.00 58.87 54.94 1c3y n SER 21 Cb 0.36 -0.88 -0.03 0.00 -0.26 0.00 0.00 64.21 63.41 1c3y n SER 21 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1c3y n GLU 22 N -0.91 -1.77 -0.07 4.33 1.02 -1.26 -4.87 120.64 117.12 1c3y n GLU 22 Ca 0.56 0.90 -0.10 0.00 -0.02 0.00 0.00 57.16 58.49 1c3y n GLU 22 Cb 1.25 -5.46 -0.10 0.00 -0.02 0.00 0.00 31.44 27.12 1c3y n GLU 22 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1c3y h GLU 23 N 0.00 0.00 -0.09 3.49 5.08 -1.99 -3.25 114.58 117.83 1c3y h GLU 23 Ca -0.40 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 57.84 1c3y h GLU 23 Cb 1.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 1c3y h GLU 23 CO 0.50 0.74 -0.50 0.77 -1.00 0.00 0.00 179.01 179.52 1c3y h SER 24 N -1.00 0.24 0.17 1.42 0.02 -1.99 -2.73 113.55 109.68 1c3y h SER 24 Ca -0.01 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1c3y h SER 24 Cb 0.75 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.22 1c3y h SER 24 CO -0.00 0.70 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.31 1c3y h LEU 25 N 0.18 0.00 0.05 5.07 3.38 -1.96 0.93 115.31 122.97 1c3y h LEU 25 Ca 0.01 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.70 1c3y h LEU 25 Cb 0.94 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 1c3y h LEU 25 CO 0.08 0.01 -1.49 -1.13 0.09 0.00 0.00 178.44 176.00 1c3y h ASN 26 N 0.00 0.17 0.43 -0.43 -1.24 -1.51 -3.35 115.58 109.65 1c3y h ASN 26 Ca -0.00 -0.26 -0.10 0.00 0.71 0.00 0.00 56.30 56.66 1c3y h ASN 26 Cb 0.09 -0.06 -0.02 0.00 0.73 0.00 0.00 38.32 39.07 1c3y h ASN 26 CO 0.00 1.22 -1.65 0.29 -1.29 0.00 0.00 177.43 176.00 1c3y n LYS 27 N -3.30 0.64 -0.26 6.67 5.02 -0.74 -4.26 118.16 121.93 1c3y n LYS 27 Ca -0.13 0.02 -0.05 0.00 -2.02 0.00 0.00 58.31 56.12 1c3y n LYS 27 Cb 1.02 -1.67 0.06 0.00 -0.02 0.00 0.00 35.03 34.42 1c3y n LYS 27 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 1c3y h VAL 28 N 0.00 1.20 -0.58 -0.18 3.04 0.72 -1.86 116.25 118.59 1c3y h VAL 28 Ca -0.12 -0.42 0.17 0.00 -1.01 0.00 0.00 66.70 65.32 1c3y h VAL 28 Cb 1.33 0.17 -0.02 0.00 -2.01 0.00 0.00 31.29 30.75 1c3y h VAL 28 CO 0.02 0.21 0.49 0.08 -1.01 0.00 0.00 177.57 177.35 1c3y h ARG 29 N 0.99 0.00 -7.28 4.17 0.11 -1.74 -3.40 114.38 107.23 1c3y h ARG 29 Ca 0.26 0.00 -0.50 0.00 0.10 0.00 0.00 59.98 59.84 1c3y h ARG 29 Cb -0.06 0.00 0.07 0.00 1.11 0.00 0.00 29.97 31.10 1c3y h ARG 29 CO -0.05 0.00 0.38 1.21 0.10 0.00 0.00 179.97 181.61 1c3y s ASN 30 N -5.62 5.71 -1.24 0.08 3.84 -0.70 -4.61 114.94 112.40 1c3y s ASN 30 Ca -0.05 1.66 -0.20 0.00 0.21 0.00 0.00 52.86 54.49 1c3y s ASN 30 Cb 0.18 -2.51 -0.01 0.00 -0.55 0.00 0.00 41.25 38.37 1c3y s ASN 30 CO 0.66 -1.22 1.84 0.54 -2.79 0.00 0.00 177.10 176.13 1c3y n ARG 31 N -2.58 2.45 0.00 0.43 1.74 -1.26 -3.81 116.66 113.63 1c3y n ARG 31 Ca 0.08 -2.88 0.00 0.00 -0.77 0.00 0.00 57.85 54.28 1c3y n ARG 31 Cb 0.53 -3.58 0.00 0.00 -1.02 0.00 0.00 32.46 28.39 1c3y n ARG 31 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1c3y n GLU 32 N 8.25 0.00 -2.50 5.56 -0.58 -1.26 -5.12 120.64 125.00 1c3y n GLU 32 Ca 0.47 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 57.20 1c3y n GLU 32 Cb 0.46 -0.08 0.00 0.00 -0.57 0.00 0.00 31.44 31.25 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 -2.15 -2.72 0.09 3.49 1.02 -1.25 -4.93 120.64 114.18 1c3y n GLU 33 Ca 0.00 2.29 -0.07 0.00 -0.02 0.00 0.00 57.16 59.37 1c3y n GLU 33 Cb 0.00 -4.60 0.00 0.00 -0.02 0.00 0.00 31.44 26.82 1c3y n GLU 33 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 1c3y h VAL 34 N 2.35 1.54 -4.96 2.62 3.04 -1.90 -3.49 116.25 115.46 1c3y h VAL 34 Ca 0.00 -2.73 0.01 0.00 -1.01 0.00 0.00 66.70 62.97 1c3y h VAL 34 Cb 0.11 2.50 -0.07 0.00 -2.01 0.00 0.00 31.29 31.82 1c3y h VAL 34 CO 0.09 0.79 -1.28 0.47 -1.01 0.00 0.00 177.57 176.63 1c3y n ASP 35 N -3.61 -3.68 -4.35 3.17 9.92 -1.26 -5.06 116.55 111.68 1c3y n ASP 35 Ca -0.02 1.33 -0.23 0.00 -0.53 0.00 0.00 54.79 55.34 1c3y n ASP 35 Cb 0.80 -5.12 -0.11 0.00 -0.64 0.00 0.00 41.12 36.05 1c3y n ASP 35 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1c3y s ASP 36 N -1.05 2.85 -0.04 -2.24 1.01 -1.26 -5.07 116.67 110.87 1c3y s ASP 36 Ca -0.15 -0.85 -0.26 0.00 0.71 0.00 0.00 52.55 52.00 1c3y s ASP 36 Cb 0.01 -0.18 -0.20 0.00 1.01 0.00 0.00 42.92 43.56 1c3y s ASP 36 CO 0.76 0.01 1.15 1.55 0.21 0.00 0.00 175.17 178.85 1c3y h PRO 37 N 3.30 -0.04 -0.53 8.23 0.13 -2.00 -3.05 132.00 138.05 1c3y h PRO 37 Ca -0.44 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.80 1c3y h PRO 37 Cb 1.20 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 1c3y h PRO 37 CO 0.49 0.49 0.36 0.87 -0.23 0.00 0.00 178.00 179.98 1c3y h LYS 38 N -0.61 0.24 -0.40 0.86 1.57 -1.86 -0.96 116.57 115.40 1c3y h LYS 38 Ca -0.00 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 1c3y h LYS 38 Cb 0.56 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1c3y h LYS 38 CO 0.01 0.16 0.01 1.25 -0.57 0.00 0.00 179.45 180.30 1c3y h LEU 39 N 0.25 0.69 -0.00 2.94 6.46 -1.91 0.15 115.31 123.89 1c3y h LEU 39 Ca 0.25 -0.30 -0.00 0.00 -0.12 0.00 0.00 57.88 57.70 1c3y h LEU 39 Cb 0.64 -0.18 -0.00 0.00 -0.73 0.00 0.00 40.66 40.39 1c3y h LEU 39 CO -0.05 0.82 0.00 0.11 -0.62 0.00 0.00 178.44 178.70 1c3y h LYS 40 N 0.54 0.00 -0.33 1.25 1.57 -1.09 -2.23 116.57 116.28 1c3y h LYS 40 Ca 0.11 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1c3y h LYS 40 Cb 0.46 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1c3y h LYS 40 CO 0.02 0.14 0.14 0.93 -0.57 0.00 0.00 179.45 180.11 1c3y h GLU 41 N -0.14 0.49 -0.16 3.15 4.39 -1.34 -3.03 114.58 117.93 1c3y h GLU 41 Ca 0.00 -0.08 0.05 0.00 0.34 0.00 0.00 59.36 59.67 1c3y h GLU 41 Cb 0.14 -0.08 -0.07 0.00 -0.10 0.00 0.00 28.75 28.64 1c3y h GLU 41 CO -0.00 0.47 -0.38 1.25 -1.16 0.00 0.00 179.01 179.19 1c3y h HIS 42 N 0.39 -1.08 -0.93 4.33 2.76 -0.59 -1.57 115.15 118.45 1c3y h HIS 42 Ca 0.11 0.05 0.19 0.00 -2.20 0.00 0.00 60.37 58.51 1c3y h HIS 42 Cb 0.16 0.50 -0.11 0.00 1.55 0.00 0.00 27.41 29.51 1c3y h HIS 42 CO -0.01 -0.45 0.51 0.00 -1.30 0.00 0.00 177.93 176.68 1c3y h ALA 43 N 0.26 1.50 -0.99 5.26 0.00 -1.37 0.17 119.26 124.10 1c3y h ALA 43 Ca 0.09 0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.18 1c3y h ALA 43 Cb 0.60 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.31 1c3y h ALA 43 CO -0.40 -0.14 0.63 0.35 0.00 0.00 0.00 179.25 179.70 1c3y h PHE 44 N 0.63 1.17 -0.01 0.00 3.57 -1.17 0.20 116.94 121.33 1c3y h PHE 44 Ca 0.54 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 62.07 1c3y h PHE 44 Cb 0.87 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 39.23 1c3y h PHE 44 CO -0.06 0.58 -0.00 0.00 -2.23 0.00 0.00 178.31 176.60 1c3y h ILE 46 N -0.32 1.22 -0.16 0.00 5.03 -1.09 0.14 117.51 122.33 1c3y h ILE 46 Ca 0.00 -0.72 0.00 0.00 -0.12 0.00 0.00 64.86 64.03 1c3y h ILE 46 Cb 0.35 0.49 -0.01 0.00 -3.03 0.00 0.00 36.82 34.63 1c3y h ILE 46 CO 0.00 0.28 0.11 0.25 -0.68 0.00 0.00 178.15 178.11 1c3y h LEU 47 N 0.90 0.19 0.08 1.44 6.46 -0.52 0.85 115.31 124.71 1c3y h LEU 47 Ca 0.21 -0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.96 1c3y h LEU 47 Cb 0.19 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 40.08 1c3y h LEU 47 CO -0.02 0.14 -0.04 0.11 -0.62 0.00 0.00 178.44 178.01 1c3y h LYS 48 N 0.22 -0.11 -0.87 1.25 1.57 -1.03 -1.87 116.57 115.73 1c3y h LYS 48 Ca 0.06 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1c3y h LYS 48 Cb -0.02 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1c3y h LYS 48 CO -0.01 0.21 0.55 0.00 -0.57 0.00 0.00 179.45 179.63 1c3y h ARG 49 N -0.44 1.17 -0.04 3.15 2.47 -0.63 -1.32 114.38 118.73 1c3y h ARG 49 Ca -0.01 -0.09 0.01 0.00 -1.26 0.00 0.00 59.98 58.63 1c3y h ARG 49 Cb 0.37 -0.25 -0.00 0.00 -1.65 0.00 0.00 29.97 28.44 1c3y h ARG 49 CO 0.02 0.80 0.03 0.00 0.56 0.00 0.00 179.97 181.38 1c3y h ALA 50 N 1.41 1.79 -0.09 0.04 0.00 0.80 -3.46 119.26 119.76 1c3y h ALA 50 Ca 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1c3y h ALA 50 Cb -0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1c3y h ALA 50 CO -0.06 -0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.54 1c3y n GLY 51 N -1.43 1.37 0.18 0.00 0.00 -0.50 -5.04 105.19 99.76 1c3y n GLY 51 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.46 0.00 -3.10 1.61 3.72 -0.72 -5.01 117.46 112.50 1c3y n PHE 52 Ca 0.00 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.05 1c3y n PHE 52 Cb 0.14 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.62 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 -0.69 4.58 0.51 4.37 2.07 -1.20 -4.48 121.20 126.35 1c3y s ILE 53 Ca 0.00 1.24 -0.01 0.00 -1.41 0.00 0.00 60.65 60.46 1c3y s ILE 53 Cb 0.00 -3.82 0.01 0.00 0.13 0.00 0.00 42.46 38.78 1c3y s ILE 53 CO 0.00 0.13 0.75 1.51 -1.91 0.00 0.00 174.94 175.43 1c3y s ASP 54 N -1.76 5.66 0.58 4.50 -4.77 -1.25 -4.22 116.67 115.41 1c3y s ASP 54 Ca 0.45 0.35 0.28 0.00 -3.30 0.00 0.00 52.55 50.33 1c3y s ASP 54 Cb -0.16 -1.46 1.52 0.00 -1.09 0.00 0.00 42.92 41.73 1c3y s ASP 54 CO 0.20 -0.88 1.84 0.00 0.70 0.00 0.00 175.17 177.03 1c3y h ALA 55 N 0.18 1.24 0.00 2.11 0.00 -1.96 0.65 119.26 121.49 1c3y h ALA 55 Ca -0.45 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.22 1c3y h ALA 55 Cb 1.26 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 1c3y h ALA 55 CO 0.57 -0.24 -1.45 1.03 0.00 0.00 0.00 179.25 179.16 1c3y h SER 56 N 0.00 0.00 0.00 0.00 0.87 -2.04 -3.48 113.55 108.90 1c3y h SER 56 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1c3y h SER 56 Cb 0.53 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.49 1c3y h SER 56 CO 0.00 0.87 0.00 0.61 -0.53 0.00 0.00 176.83 177.78 1c3y n GLY 57 N 1.46 1.43 3.64 5.77 0.00 0.22 -4.91 105.19 112.81 1c3y n GLY 57 Ca -0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 1c3y n GLY 57 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1c3y s GLU 58 N -0.13 4.15 0.27 1.61 2.02 -1.26 -4.70 118.70 120.66 1c3y s GLU 58 Ca 0.00 1.10 -0.30 0.00 0.02 0.00 0.00 54.97 55.80 1c3y s GLU 58 Cb 0.00 -3.68 -0.10 0.00 0.10 0.00 0.00 34.13 30.45 1c3y s GLU 58 CO 0.00 -0.70 1.36 -0.59 0.02 0.00 0.00 175.26 175.36 1c3y s PHE 59 N 3.24 3.09 -0.56 1.61 -0.12 -1.26 -3.83 117.98 120.14 1c3y s PHE 59 Ca 0.41 1.21 0.07 0.00 -0.05 0.00 0.00 56.93 58.57 1c3y s PHE 59 Cb -0.14 -3.72 0.26 0.00 -0.63 0.00 0.00 43.02 38.79 1c3y s PHE 59 CO 0.10 -2.20 0.71 1.04 -0.05 0.00 0.00 175.22 174.83 1c3y n GLN 60 N 1.87 2.10 0.15 1.99 1.13 -1.26 -4.88 117.38 118.47 1c3y n GLN 60 Ca 0.04 -4.29 0.02 0.00 -1.94 0.00 0.00 57.00 50.83 1c3y n GLN 60 Cb 0.41 -1.98 0.18 0.00 0.11 0.00 0.00 30.24 28.97 1c3y n GLN 60 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1c3y h LEU 61 N 3.95 0.00 -1.84 1.08 -0.00 -1.94 -2.75 115.31 113.81 1c3y h LEU 61 Ca 0.16 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 58.06 1c3y h LEU 61 Cb 0.71 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.36 1c3y h LEU 61 CO 0.73 0.55 0.14 0.44 -0.00 0.00 0.00 178.44 180.30 1c3y h ASP 62 N 0.00 0.18 0.57 -0.43 5.19 -2.00 0.16 116.42 120.09 1c3y h ASP 62 Ca -0.01 -0.00 -0.28 0.00 -0.62 0.00 0.00 57.03 56.12 1c3y h ASP 62 Cb 1.14 -0.04 -0.04 0.00 0.18 0.00 0.00 39.33 40.57 1c3y h ASP 62 CO 0.07 0.13 -1.56 -0.74 -3.12 0.00 0.00 179.24 174.02 1c3y h HIS 63 N 0.21 0.09 0.25 4.55 2.76 -1.96 -3.24 115.15 117.81 1c3y h HIS 63 Ca 0.09 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 1c3y h HIS 63 Cb 0.09 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.05 1c3y h HIS 63 CO -0.00 1.10 -0.12 0.82 -1.30 0.00 0.00 177.93 178.43 1c3y h ILE 64 N 0.01 0.79 -0.59 6.26 2.04 -0.99 -1.48 117.51 123.55 1c3y h ILE 64 Ca -0.23 -0.61 0.09 0.00 1.00 0.00 0.00 64.86 65.11 1c3y h ILE 64 Cb 1.96 1.13 -0.07 0.00 -0.74 0.00 0.00 36.82 39.10 1c3y h ILE 64 CO 0.10 0.13 0.22 0.07 0.00 0.00 0.00 178.15 178.66 1c3y h LYS 65 N -0.67 0.38 -0.48 2.37 2.10 -0.89 -0.19 116.57 119.20 1c3y h LYS 65 Ca -0.03 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.57 1c3y h LYS 65 Cb 0.47 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.69 1c3y h LYS 65 CO 0.06 0.25 0.22 1.15 -2.00 0.00 0.00 179.45 179.13 1c3y h THR 66 N 0.39 1.17 0.51 0.07 2.02 -1.57 -0.86 112.91 114.64 1c3y h THR 66 Ca 0.30 -0.48 -0.03 0.00 0.77 0.00 0.00 66.41 66.97 1c3y h THR 66 Cb 0.37 0.56 0.01 0.00 -1.74 0.00 0.00 68.15 67.34 1c3y h THR 66 CO -0.30 0.20 -0.25 0.11 0.37 0.00 0.00 175.52 175.65 1c3y h LYS 67 N 0.67 -0.66 0.00 6.66 1.79 0.05 -2.86 116.57 122.21 1c3y h LYS 67 Ca 0.17 0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.66 1c3y h LYS 67 Cb 0.09 0.15 -0.00 0.00 -1.58 0.00 0.00 32.23 30.88 1c3y h LYS 67 CO -0.02 -0.37 -0.10 0.74 -1.08 0.00 0.00 179.45 178.62 1c3y h PHE 68 N -0.88 0.00 0.00 -1.35 -1.00 -1.22 -1.48 116.94 111.01 1c3y h PHE 68 Ca -0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.71 1c3y h PHE 68 Cb 0.60 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.16 1c3y h PHE 68 CO -0.00 0.10 0.00 1.63 -1.61 0.00 0.00 178.31 178.42 1c3y n LYS 69 N -3.61 0.20 -1.53 1.51 5.02 -0.34 -4.66 118.16 114.74 1c3y n LYS 69 Ca -0.02 0.12 -0.26 0.00 -2.02 0.00 0.00 58.31 56.13 1c3y n LYS 69 Cb 0.22 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.62 1c3y n LYS 69 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1c3y n GLU 70 N -1.35 0.44 0.00 1.97 -0.00 -0.56 -4.24 120.64 116.89 1c3y n GLU 70 Ca 0.08 -0.28 0.00 0.00 -0.00 0.00 0.00 57.16 56.96 1c3y n GLU 70 Cb 0.18 -2.59 0.00 0.00 -0.00 0.00 0.00 31.44 29.03 1c3y n GLU 70 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1c3y n ASN 71 N 13.37 0.00 -1.31 -1.84 3.02 -1.26 -4.91 115.26 122.33 1c3y n ASN 71 Ca 0.53 0.00 0.16 0.00 -0.03 0.00 0.00 54.58 55.24 1c3y n ASN 71 Cb 0.32 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.43 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 1.79 -7.40 0.09 6.41 2.88 -1.26 -4.17 113.62 111.97 1c3y n SER 72 Ca 0.00 0.88 -0.12 0.00 -1.33 0.00 0.00 58.87 58.30 1c3y n SER 72 Cb 0.00 -4.23 -0.10 0.00 -0.75 0.00 0.00 64.21 59.13 1c3y n SER 72 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1c3y h GLU 73 N -1.35 0.22 -1.83 -1.46 5.08 -1.95 -3.41 114.58 109.88 1c3y h GLU 73 Ca -0.07 -0.32 -0.36 0.00 -1.00 0.00 0.00 59.36 57.61 1c3y h GLU 73 Cb 1.32 0.11 -0.29 0.00 0.50 0.00 0.00 28.75 30.39 1c3y h GLU 73 CO 0.04 1.11 -0.69 -1.58 -1.00 0.00 0.00 179.01 176.88 1c3y s HIS 74 N -2.85 -0.33 -1.16 4.33 2.46 -1.26 -5.08 115.29 111.40 1c3y s HIS 74 Ca -0.03 -0.99 -0.22 0.00 0.47 0.00 0.00 55.06 54.29 1c3y s HIS 74 Cb 0.08 -0.35 -0.05 0.00 -0.13 0.00 0.00 32.58 32.13 1c3y s HIS 74 CO 0.86 -1.00 1.89 -1.25 -2.47 0.00 0.00 174.74 172.76 1c3y s PRO 75 N 1.13 2.77 -0.30 2.88 0.04 -1.26 -4.24 135.00 136.03 1c3y s PRO 75 Ca 0.21 -1.17 0.00 0.00 0.04 0.00 0.00 61.00 60.09 1c3y s PRO 75 Cb -0.09 -5.27 0.03 0.00 0.04 0.00 0.00 34.50 29.20 1c3y s PRO 75 CO -0.06 -3.57 1.03 -0.85 0.04 0.00 0.00 177.00 173.59 1c3y n GLU 76 N 8.41 0.04 0.00 4.56 0.28 -1.26 -5.02 120.64 127.65 1c3y n GLU 76 Ca 0.44 -0.55 0.00 0.00 -0.16 0.00 0.00 57.16 56.90 1c3y n GLU 76 Cb 0.47 -0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.33 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 -0.47 0.00 -0.36 3.44 5.02 -1.26 -4.93 118.16 119.61 1c3y n LYS 77 Ca -0.30 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 55.97 1c3y n LYS 77 Cb 0.62 -0.04 0.12 0.00 -0.02 0.00 0.00 35.03 35.71 1c3y n LYS 77 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1c3y h VAL 78 N 0.00 1.25 -0.59 -0.18 2.07 -1.95 -2.29 116.25 114.57 1c3y h VAL 78 Ca 0.00 -0.48 0.12 0.00 0.82 0.00 0.00 66.70 67.16 1c3y h VAL 78 Cb 0.00 -0.17 -0.11 0.00 -1.52 0.00 0.00 31.29 29.49 1c3y h VAL 78 CO 0.00 0.25 -0.08 -2.24 0.02 0.00 0.00 177.57 175.52 1c3y h ASP 79 N 1.33 -0.42 -0.43 0.57 2.03 -1.91 0.89 116.42 118.47 1c3y h ASP 79 Ca 0.36 0.16 -0.14 0.00 -0.73 0.00 0.00 57.03 56.68 1c3y h ASP 79 Cb -0.13 0.32 -0.01 0.00 -0.83 0.00 0.00 39.33 38.68 1c3y h ASP 79 CO -0.07 -0.16 -0.29 0.44 -1.03 0.00 0.00 179.24 178.13 1c3y h ASP 80 N 0.05 1.01 -0.74 4.15 3.32 -1.86 -2.75 116.42 119.59 1c3y h ASP 80 Ca 0.29 -0.41 -0.05 0.00 0.02 0.00 0.00 57.03 56.88 1c3y h ASP 80 Cb 0.46 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 1c3y h ASP 80 CO -0.56 1.21 0.26 -0.07 -1.72 0.00 0.00 179.24 178.35 1c3y h LEU 81 N 0.82 1.06 0.60 1.55 -0.00 -0.49 0.17 115.31 119.01 1c3y h LEU 81 Ca 0.09 -0.19 -0.03 0.00 -0.00 0.00 0.00 57.88 57.76 1c3y h LEU 81 Cb 0.87 -0.28 0.01 0.00 -0.00 0.00 0.00 40.66 41.26 1c3y h LEU 81 CO 0.08 0.97 -0.29 0.58 -0.00 0.00 0.00 178.44 179.78 1c3y h VAL 82 N 1.10 0.00 -0.94 1.22 2.07 0.83 0.70 116.25 121.22 1c3y h VAL 82 Ca 0.24 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.71 1c3y h VAL 82 Cb 0.27 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.00 1c3y h VAL 82 CO -0.01 0.00 0.63 0.00 0.02 0.00 0.00 177.57 178.20 1c3y h ALA 83 N -1.57 1.33 -0.20 1.67 0.00 -1.52 0.98 119.26 119.95 1c3y h ALA 83 Ca -0.08 -0.07 -0.21 0.00 0.00 0.00 0.00 54.91 54.55 1c3y h ALA 83 Cb 0.61 -0.38 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1c3y h ALA 83 CO 0.13 0.63 -0.70 -0.22 0.00 0.00 0.00 179.25 179.09 1c3y h LYS 84 N 1.28 0.82 0.00 0.00 1.63 -0.65 -3.32 116.57 116.32 1c3y h LYS 84 Ca 0.35 -0.61 -0.23 0.00 -0.85 0.00 0.00 60.65 59.30 1c3y h LYS 84 Cb -0.15 0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.55 1c3y h LYS 84 CO -0.07 1.23 -1.47 0.00 -3.45 0.00 0.00 179.45 175.68 1c3y n ALA 86 N -2.46 4.94 -1.78 0.00 0.00 0.34 -4.56 120.51 116.98 1c3y n ALA 86 Ca -0.12 -1.23 -0.41 0.00 0.00 0.00 0.00 53.44 51.69 1c3y n ALA 86 Cb 0.95 -1.38 -0.01 0.00 0.00 0.00 0.00 19.45 19.01 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 -1.29 2.20 -0.16 0.00 -7.23 -1.26 -4.88 120.40 107.78 1c3y s VAL 87 Ca 0.25 0.19 -0.29 0.00 -1.81 0.00 0.00 61.98 60.32 1c3y s VAL 87 Cb 0.18 -3.12 -0.05 0.00 0.56 0.00 0.00 36.38 33.95 1c3y s VAL 87 CO -0.02 0.04 1.85 -1.59 -0.31 0.00 0.00 175.10 175.07 1c3y s LYS 88 N -1.34 3.70 0.45 4.82 -2.85 -1.26 -4.85 119.74 118.42 1c3y s LYS 88 Ca 0.57 1.97 0.06 0.00 -1.00 0.00 0.00 55.97 57.56 1c3y s LYS 88 Cb -0.46 -4.15 0.08 0.00 -2.06 0.00 0.00 37.83 31.24 1c3y s LYS 88 CO 0.55 -1.43 0.63 1.63 0.10 0.00 0.00 175.35 176.82 1c3y n LYS 89 N 7.92 0.59 0.29 1.78 4.76 -1.26 -4.99 118.16 127.25 1c3y n LYS 89 Ca 0.22 -2.29 0.17 0.00 -2.87 0.00 0.00 58.31 53.54 1c3y n LYS 89 Cb 0.44 -0.24 0.82 0.00 -1.84 0.00 0.00 35.03 34.21 1c3y n LYS 89 CO 0.00 0.00 0.00 0.38 -1.37 0.00 0.00 177.40 176.41 1c3y h ASP 90 N -0.02 0.00 -5.11 4.39 3.04 -2.01 -3.44 116.42 113.27 1c3y h ASP 90 Ca -0.21 0.00 -0.11 0.00 -3.24 0.00 0.00 57.03 53.47 1c3y h ASP 90 Cb 0.93 0.00 -0.16 0.00 -1.04 0.00 0.00 39.33 39.06 1c3y h ASP 90 CO 0.29 0.05 -0.47 0.42 -2.04 0.00 0.00 179.24 177.48 1c3y s THR 91 N -3.91 0.14 -0.04 1.15 -4.23 -1.26 -5.08 115.64 102.40 1c3y s THR 91 Ca -0.01 -1.13 -0.25 0.00 -1.18 0.00 0.00 61.69 59.12 1c3y s THR 91 Cb 0.11 -1.06 -0.20 0.00 1.34 0.00 0.00 72.50 72.69 1c3y s THR 91 CO 0.53 -0.62 1.11 1.55 -0.54 0.00 0.00 174.62 176.64 1c3y h PRO 92 N 3.36 -0.06 -0.09 3.99 0.13 -1.86 -3.02 132.00 134.45 1c3y h PRO 92 Ca -0.33 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.83 1c3y h PRO 92 Cb 1.19 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1c3y h PRO 92 CO 0.53 0.48 0.20 -0.56 -0.23 0.00 0.00 178.00 178.41 1c3y h GLN 93 N -0.65 0.00 0.23 0.86 3.07 -1.94 -2.14 115.11 114.55 1c3y h GLN 93 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.72 1c3y h GLN 93 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.13 1c3y h GLN 93 CO 0.01 0.00 -0.11 1.25 0.09 0.00 0.00 178.83 180.07 1c3y h HIS 94 N 0.00 -0.29 -1.22 0.06 2.76 -1.83 -3.25 115.15 111.38 1c3y h HIS 94 Ca 0.04 -0.01 0.35 0.00 -2.20 0.00 0.00 60.37 58.56 1c3y h HIS 94 Cb 0.44 0.09 -0.05 0.00 1.55 0.00 0.00 27.41 29.44 1c3y h HIS 94 CO 0.00 -0.18 0.88 0.66 -1.30 0.00 0.00 177.93 177.99 1c3y h SER 95 N -0.84 0.00 -0.82 3.26 4.64 -1.33 0.49 113.55 118.95 1c3y h SER 95 Ca -0.03 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1c3y h SER 95 Cb 0.24 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.29 1c3y h SER 95 CO 0.05 0.00 0.54 0.28 -0.87 0.00 0.00 176.83 176.83 1c3y h SER 96 N 0.00 0.95 0.88 4.97 0.02 -1.44 0.12 113.55 119.06 1c3y h SER 96 Ca 0.58 -0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 61.46 1c3y h SER 96 Cb 2.33 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 64.63 1c3y h SER 96 CO -0.01 0.70 -0.48 0.00 -1.14 0.00 0.00 176.83 175.90 1c3y h ALA 97 N 1.47 -1.28 -0.37 3.77 0.00 -0.06 -0.84 119.26 121.96 1c3y h ALA 97 Ca 0.30 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1c3y h ALA 97 Cb -0.11 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1c3y h ALA 97 CO -0.06 -1.23 0.25 -0.44 0.00 0.00 0.00 179.25 177.77 1c3y h ASP 98 N -1.25 0.31 -0.07 0.00 3.32 -1.56 0.73 116.42 117.90 1c3y h ASP 98 Ca -0.12 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1c3y h ASP 98 Cb 0.98 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.45 1c3y h ASP 98 CO 0.16 0.21 0.00 0.15 -1.72 0.00 0.00 179.24 178.05 1c3y h PHE 99 N 0.36 0.20 -0.90 4.55 3.57 -0.26 0.45 116.94 124.90 1c3y h PHE 99 Ca 0.15 -0.01 -0.58 0.00 3.53 0.00 0.00 57.97 61.06 1c3y h PHE 99 Cb 0.16 -0.06 -0.30 0.00 2.79 0.00 0.00 35.95 38.53 1c3y h PHE 99 CO -0.00 0.21 0.50 0.34 -2.23 0.00 0.00 178.31 177.13 1c3y n PHE 100 N -4.42 2.94 0.05 0.41 -0.00 0.23 -4.42 117.46 112.26 1c3y n PHE 100 Ca -0.01 -2.56 0.00 0.00 -0.00 0.00 0.00 57.45 54.88 1c3y n PHE 100 Cb 0.15 -1.11 0.00 0.00 -0.00 0.00 0.00 39.48 38.52 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 -0.95 0.00 -0.16 -4.13 4.01 -0.65 -4.88 118.16 111.40 1c3y n LYS 101 Ca 0.57 0.00 -0.03 0.00 -0.51 0.00 0.00 58.31 58.34 1c3y n LYS 101 Cb 0.94 0.00 0.03 0.00 -0.51 0.00 0.00 35.03 35.49 1c3y n LYS 101 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1c3y h VAL 103 N -0.03 0.88 0.17 0.00 -1.51 -1.77 -0.51 116.25 113.47 1c3y h VAL 103 Ca 0.24 0.00 -0.33 0.00 -1.23 0.00 0.00 66.70 65.39 1c3y h VAL 103 Cb 0.40 0.99 0.01 0.00 -2.13 0.00 0.00 31.29 30.56 1c3y h VAL 103 CO -0.54 0.00 -1.61 0.45 -1.23 0.00 0.00 177.57 174.64 1c3y h HIS 104 N 0.00 0.66 -0.24 5.19 -0.00 -0.91 -3.33 115.15 116.53 1c3y h HIS 104 Ca 0.01 -0.48 -0.02 0.00 -0.00 0.00 0.00 60.37 59.88 1c3y h HIS 104 Cb 0.04 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.41 1c3y h HIS 104 CO 0.00 1.63 0.07 -0.44 -0.00 0.00 0.00 177.93 179.19 1c3y h ASP 105 N -0.02 0.30 -3.22 2.45 3.32 0.12 -3.41 116.42 115.96 1c3y h ASP 105 Ca -0.32 -0.03 -0.58 0.00 0.02 0.00 0.00 57.03 56.12 1c3y h ASP 105 Cb 2.00 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 41.41 1c3y h ASP 105 CO 0.15 0.30 -0.11 0.21 -1.72 0.00 0.00 179.24 178.07 1c3y s ASN 106 N -6.83 6.85 0.00 6.45 3.84 -0.24 -4.89 114.94 120.11 1c3y s ASN 106 Ca -0.07 1.01 0.00 0.00 0.21 0.00 0.00 52.86 54.01 1c3y s ASN 106 Cb 0.17 -2.31 0.00 0.00 -0.55 0.00 0.00 41.25 38.56 1c3y s ASN 106 CO 0.72 0.16 0.00 0.54 -2.79 0.00 0.00 177.10 175.73 1c3y n ARG 107 N 2.63 0.00 0.00 0.43 1.74 -1.26 -4.85 116.66 115.34 1c3y n ARG 107 Ca -0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1c3y n ARG 107 Cb 0.52 -0.03 0.00 0.00 -1.02 0.00 0.00 32.46 31.92 1c3y n ARG 107 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56