#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 0.21 -0.02 3.84 2.01 -1.26 -4.96 115.64 115.45 1c3y s THR 2 Ca 0.00 -2.10 -0.24 0.00 0.31 0.00 0.00 61.69 59.66 1c3y s THR 2 Cb 0.00 -1.16 -0.20 0.00 0.01 0.00 0.00 72.50 71.15 1c3y s THR 2 CO 0.00 -1.09 1.18 1.55 -0.69 0.00 0.00 174.62 175.57 1c3y h PRO 3 N 6.42 0.17 0.00 4.92 0.13 -1.98 -3.45 132.00 138.21 1c3y h PRO 3 Ca 0.15 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1c3y h PRO 3 Cb 0.95 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1c3y h PRO 3 CO 0.31 0.75 0.00 0.54 -0.23 0.00 0.00 178.00 179.36 1c3y n ARG 4 N -4.63 0.00 -4.29 0.86 1.74 -1.26 -5.12 116.66 103.96 1c3y n ARG 4 Ca -0.08 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.76 1c3y n ARG 4 Cb 0.39 -0.12 -0.08 0.00 -1.02 0.00 0.00 32.46 31.63 1c3y n ARG 4 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1c3y s GLU 5 N -1.49 2.18 -0.00 5.56 2.12 -1.26 -5.05 118.70 120.75 1c3y s GLU 5 Ca 0.00 -1.58 -0.22 0.00 0.36 0.00 0.00 54.97 53.52 1c3y s GLU 5 Cb 0.00 -2.05 -0.19 0.00 0.26 0.00 0.00 34.13 32.15 1c3y s GLU 5 CO 0.00 0.24 1.18 -0.22 -0.54 0.00 0.00 175.26 175.92 1c3y h LYS 6 N 1.83 0.27 -6.01 4.30 3.64 -1.96 -3.45 116.57 115.20 1c3y h LYS 6 Ca -0.43 -0.21 -0.54 0.00 -1.27 0.00 0.00 60.65 58.20 1c3y h LYS 6 Cb 1.25 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 33.05 1c3y h LYS 6 CO 0.63 0.85 -0.42 -0.48 -2.27 0.00 0.00 179.45 177.76 1c3y s LEU 7 N -8.77 3.17 -0.03 5.20 2.34 -1.26 -4.96 118.68 114.37 1c3y s LEU 7 Ca -0.15 -0.97 -0.03 0.00 0.06 0.00 0.00 54.13 53.05 1c3y s LEU 7 Cb 0.03 -1.66 0.01 0.00 -0.56 0.00 0.00 46.19 44.01 1c3y s LEU 7 CO 0.75 -0.66 0.06 0.29 -1.06 0.00 0.00 176.35 175.73 1c3y n LYS 8 N -1.44 -5.05 -3.41 1.48 5.02 -1.26 -5.08 118.16 108.43 1c3y n LYS 8 Ca 0.01 3.69 -0.11 0.00 -2.02 0.00 0.00 58.31 59.88 1c3y n LYS 8 Cb 0.63 -4.79 -0.02 0.00 -0.02 0.00 0.00 35.03 30.83 1c3y n LYS 8 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1c3y n GLN 9 N 1.79 0.54 0.04 1.97 10.64 -1.26 -4.80 117.38 126.30 1c3y n GLN 9 Ca -0.10 -2.13 0.00 0.00 -1.83 0.00 0.00 57.00 52.94 1c3y n GLN 9 Cb 0.15 2.06 0.00 0.00 -0.86 0.00 0.00 30.24 31.59 1c3y n GLN 9 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 1c3y n HIS 10 N -0.44 -1.12 -1.57 2.61 8.25 -1.26 -4.95 115.22 116.75 1c3y n HIS 10 Ca 0.00 0.18 0.06 0.00 -0.26 0.00 0.00 57.72 57.70 1c3y n HIS 10 Cb 0.45 0.69 0.21 0.00 1.12 0.00 0.00 29.99 32.46 1c3y n HIS 10 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1c3y n SER 11 N -2.76 1.78 -0.25 0.41 2.88 -1.26 -4.71 113.62 109.72 1c3y n SER 11 Ca 0.00 -3.86 -0.06 0.00 -1.33 0.00 0.00 58.87 53.62 1c3y n SER 11 Cb 0.00 -0.53 0.05 0.00 -0.75 0.00 0.00 64.21 62.98 1c3y n SER 11 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 1c3y h ASP 12 N 0.95 0.86 0.27 -3.46 2.03 -1.99 -1.03 116.42 114.05 1c3y h ASP 12 Ca 0.01 -0.09 -0.05 0.00 -0.73 0.00 0.00 57.03 56.17 1c3y h ASP 12 Cb 1.03 -0.22 -0.01 0.00 -0.83 0.00 0.00 39.33 39.30 1c3y h ASP 12 CO 0.02 0.70 -1.78 0.00 -1.03 0.00 0.00 179.24 177.16 1c3y n ALA 13 N -2.34 2.55 0.13 4.15 0.00 -1.26 -4.21 120.51 119.54 1c3y n ALA 13 Ca 0.06 -0.54 -0.02 0.00 0.00 0.00 0.00 53.44 52.94 1c3y n ALA 13 Cb 0.09 -0.79 0.17 0.00 0.00 0.00 0.00 19.45 18.92 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 0.02 0.00 -0.03 0.00 5.09 -1.36 0.82 116.57 121.12 1c3y h LYS 15 Ca -0.01 0.00 0.01 0.00 0.09 0.00 0.00 60.65 60.74 1c3y h LYS 15 Cb 1.08 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.41 1c3y h LYS 15 CO 0.08 0.00 0.14 0.00 -2.09 0.00 0.00 179.45 177.58 1c3y h ALA 16 N 2.28 1.24 0.00 0.07 0.00 -1.68 -3.39 119.26 117.79 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 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1c3y h ALA 16 CO 0.00 -0.15 0.00 -1.91 0.00 0.00 0.00 179.25 177.19 1c3y n GLU 17 N -3.15 0.00 0.00 0.00 4.07 -1.19 -5.04 120.64 115.33 1c3y n GLU 17 Ca -0.02 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.08 1c3y n GLU 17 Cb 0.21 -0.08 0.00 0.00 -0.06 0.00 0.00 31.44 31.50 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 -2.14 0.00 -2.23 4.31 7.64 0.15 -4.81 113.62 116.55 1c3y n SER 18 Ca 0.00 0.08 -0.09 0.00 1.01 0.00 0.00 58.87 59.87 1c3y n SER 18 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 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 1.72 -0.23 3.76 0.23 0.00 -0.43 -4.83 105.19 105.40 1c3y n GLY 19 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1c3y n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c3y s VAL 20 N -2.34 2.06 0.44 1.61 0.11 -1.26 -5.00 120.40 116.01 1c3y s VAL 20 Ca 0.00 0.05 -0.06 0.00 -2.93 0.00 0.00 61.98 59.04 1c3y s VAL 20 Cb 0.00 -3.03 0.10 0.00 -1.53 0.00 0.00 36.38 31.92 1c3y s VAL 20 CO 0.00 0.01 0.60 -1.54 -3.33 0.00 0.00 175.10 170.84 1c3y n SER 21 N 1.72 0.17 -2.85 3.54 3.41 -1.26 -4.94 113.62 113.41 1c3y n SER 21 Ca 0.06 -1.29 -0.32 0.00 -0.26 0.00 0.00 58.87 57.06 1c3y n SER 21 Cb 0.38 -0.45 -0.04 0.00 -0.26 0.00 0.00 64.21 63.84 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 -2.25 3.21 -0.02 4.33 1.02 -1.26 -4.37 120.64 121.30 1c3y n GLU 22 Ca 0.08 -2.76 -0.03 0.00 -0.02 0.00 0.00 57.16 54.43 1c3y n GLU 22 Cb 0.28 -2.32 -0.01 0.00 -0.02 0.00 0.00 31.44 29.37 1c3y n GLU 22 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1c3y n GLU 23 N 1.16 0.19 0.10 3.49 2.13 -1.26 -4.40 120.64 122.06 1c3y n GLU 23 Ca 0.54 0.08 -0.03 0.00 0.66 0.00 0.00 57.16 58.40 1c3y n GLU 23 Cb 0.44 -0.76 0.19 0.00 0.27 0.00 0.00 31.44 31.59 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 -0.36 0.21 -0.93 4.31 0.02 -1.99 -2.91 113.55 111.90 1c3y h SER 24 Ca 0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1c3y h SER 24 Cb 0.36 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.79 1c3y h SER 24 CO 0.00 0.68 0.60 -0.07 -1.14 0.00 0.00 176.83 176.89 1c3y h LEU 25 N 0.16 1.08 -0.72 5.07 -0.00 -1.84 -1.85 115.31 117.21 1c3y h LEU 25 Ca 0.01 -0.04 -0.12 0.00 -0.00 0.00 0.00 57.88 57.73 1c3y h LEU 25 Cb 0.93 -0.27 -0.01 0.00 -0.00 0.00 0.00 40.66 41.31 1c3y h LEU 25 CO 0.07 0.80 -0.28 0.78 -0.00 0.00 0.00 178.44 179.81 1c3y h ASN 26 N 1.27 0.69 0.02 -0.43 2.35 -1.72 -2.68 115.58 115.08 1c3y h ASN 26 Ca 0.34 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 1c3y h ASN 26 Cb -0.12 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.06 1c3y h ASN 26 CO -0.07 0.94 -0.06 0.11 -1.65 0.00 0.00 177.43 176.70 1c3y h LYS 27 N 0.58 0.11 0.00 0.81 1.57 -1.19 -1.41 116.57 117.03 1c3y h LYS 27 Ca 0.07 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1c3y h LYS 27 Cb 0.78 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.07 1c3y h LYS 27 CO 0.06 0.18 -0.02 0.28 -0.57 0.00 0.00 179.45 179.38 1c3y h VAL 28 N 0.11 0.94 -0.40 0.50 2.07 -1.06 -1.39 116.25 117.01 1c3y h VAL 28 Ca 0.03 -0.08 0.09 0.00 0.82 0.00 0.00 66.70 67.55 1c3y h VAL 28 Cb 0.18 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1c3y h VAL 28 CO 0.01 0.02 0.28 0.03 0.02 0.00 0.00 177.57 177.93 1c3y h ARG 29 N 0.00 0.14 -6.14 1.57 2.47 -1.33 -3.42 114.38 107.67 1c3y h ARG 29 Ca -0.00 -0.01 -0.55 0.00 -1.26 0.00 0.00 59.98 58.16 1c3y h ARG 29 Cb 0.04 -0.03 -0.09 0.00 -1.65 0.00 0.00 29.97 28.24 1c3y h ARG 29 CO 0.00 0.09 -0.60 1.21 0.56 0.00 0.00 179.97 181.24 1c3y s ASN 30 N -6.48 4.60 -1.14 7.04 3.84 -0.52 -4.90 114.94 117.38 1c3y s ASN 30 Ca -0.06 -0.72 -0.19 0.00 0.21 0.00 0.00 52.86 52.11 1c3y s ASN 30 Cb 0.19 -0.79 -0.05 0.00 -0.55 0.00 0.00 41.25 40.05 1c3y s ASN 30 CO 0.72 -0.14 2.02 0.54 -2.79 0.00 0.00 177.10 177.45 1c3y n ARG 31 N -1.01 2.22 -0.04 0.43 1.74 -1.26 -4.29 116.66 114.45 1c3y n ARG 31 Ca -0.05 -2.36 -0.02 0.00 -0.77 0.00 0.00 57.85 54.64 1c3y n ARG 31 Cb 0.60 -3.21 -0.08 0.00 -1.02 0.00 0.00 32.46 28.75 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 6.95 1.81 -1.81 5.56 1.02 -1.26 -5.11 120.64 127.80 1c3y n GLU 32 Ca 0.50 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 1c3y n GLU 32 Cb 0.41 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 1c3y n GLU 32 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1c3y n GLU 33 N -2.25 -4.33 -4.36 3.49 2.13 -1.26 -5.06 120.64 108.99 1c3y n GLU 33 Ca -0.13 3.19 -0.20 0.00 0.66 0.00 0.00 57.16 60.69 1c3y n GLU 33 Cb 0.70 -3.46 -0.10 0.00 0.27 0.00 0.00 31.44 28.84 1c3y n GLU 33 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1c3y s VAL 34 N -0.42 1.85 -0.36 6.31 1.01 -1.26 -5.08 120.40 122.44 1c3y s VAL 34 Ca 0.00 -2.21 0.02 0.00 0.00 0.00 0.00 61.98 59.80 1c3y s VAL 34 Cb 0.00 -2.06 0.15 0.00 0.00 0.00 0.00 36.38 34.48 1c3y s VAL 34 CO 0.00 -0.54 0.34 -0.62 0.00 0.00 0.00 175.10 174.29 1c3y s ASP 35 N -3.27 1.47 0.04 3.32 -1.08 -1.26 -5.13 116.67 110.76 1c3y s ASP 35 Ca 0.23 -1.59 0.02 0.00 -0.52 0.00 0.00 52.55 50.68 1c3y s ASP 35 Cb -0.02 0.42 -0.03 0.00 -1.46 0.00 0.00 42.92 41.83 1c3y s ASP 35 CO 0.08 -0.28 -0.06 -1.81 0.52 0.00 0.00 175.17 173.62 1c3y s ASP 36 N 1.47 0.74 -0.04 -0.34 1.11 -1.26 -5.08 116.67 113.27 1c3y s ASP 36 Ca 0.16 -0.61 -0.26 0.00 0.18 0.00 0.00 52.55 52.02 1c3y s ASP 36 Cb -0.16 0.06 -0.21 0.00 1.07 0.00 0.00 42.92 43.68 1c3y s ASP 36 CO -0.06 -0.27 1.19 1.55 1.18 0.00 0.00 175.17 178.76 1c3y h PRO 37 N 4.29 -0.00 -0.51 8.23 0.13 -2.00 -3.05 132.00 139.09 1c3y h PRO 37 Ca -0.35 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.88 1c3y h PRO 37 Cb 1.20 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 1c3y h PRO 37 CO 0.45 0.56 0.35 0.87 -0.23 0.00 0.00 178.00 180.00 1c3y h LYS 38 N -0.57 0.28 0.43 0.86 1.57 -1.88 0.13 116.57 117.40 1c3y h LYS 38 Ca -0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1c3y h LYS 38 Cb 0.56 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1c3y h LYS 38 CO 0.00 0.19 -0.21 1.25 -0.57 0.00 0.00 179.45 180.11 1c3y h LEU 39 N 0.29 -0.49 -0.65 2.94 6.46 -1.92 0.44 115.31 122.38 1c3y h LEU 39 Ca 0.24 -0.08 -0.03 0.00 -0.12 0.00 0.00 57.88 57.88 1c3y h LEU 39 Cb 0.55 0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.57 1c3y h LEU 39 CO -0.05 -0.19 0.30 0.11 -0.62 0.00 0.00 178.44 177.99 1c3y h LYS 40 N -0.79 0.95 0.04 1.25 1.57 -1.32 -2.14 116.57 116.13 1c3y h LYS 40 Ca -0.06 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1c3y h LYS 40 Cb 0.54 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1c3y h LYS 40 CO 0.10 0.77 -0.02 0.93 -0.57 0.00 0.00 179.45 180.66 1c3y h GLU 41 N 0.90 -0.05 -0.74 3.15 5.08 -0.72 -2.89 114.58 119.32 1c3y h GLU 41 Ca 0.22 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.70 1c3y h GLU 41 Cb 0.15 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.32 1c3y h GLU 41 CO -0.03 0.16 0.33 1.25 -1.00 0.00 0.00 179.01 179.73 1c3y h HIS 42 N -0.25 0.58 -0.24 4.33 2.76 0.01 -1.88 115.15 120.47 1c3y h HIS 42 Ca -0.00 0.03 0.04 0.00 -2.20 0.00 0.00 60.37 58.24 1c3y h HIS 42 Cb 0.23 -0.15 -0.04 0.00 1.55 0.00 0.00 27.41 29.00 1c3y h HIS 42 CO -0.01 0.15 -0.03 0.00 -1.30 0.00 0.00 177.93 176.74 1c3y h ALA 43 N 1.49 0.18 -0.13 5.26 0.00 -1.28 -0.74 119.26 124.04 1c3y h ALA 43 Ca 0.39 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.41 1c3y h ALA 43 Cb 0.51 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1c3y h ALA 43 CO -0.34 -0.45 0.10 0.35 0.00 0.00 0.00 179.25 178.91 1c3y h PHE 44 N 0.03 0.00 0.11 0.00 3.57 -1.15 1.00 116.94 120.50 1c3y h PHE 44 Ca 0.11 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 1c3y h PHE 44 Cb 0.16 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.90 1c3y h PHE 44 CO -0.22 0.00 -0.05 0.00 -2.23 0.00 0.00 178.31 175.81 1c3y h ILE 46 N -0.38 1.40 -0.64 0.00 5.03 -1.06 -2.57 117.51 119.28 1c3y h ILE 46 Ca -0.01 -1.93 0.01 0.00 -0.12 0.00 0.00 64.86 62.80 1c3y h ILE 46 Cb 0.31 2.04 -0.03 0.00 -3.03 0.00 0.00 36.82 36.11 1c3y h ILE 46 CO 0.02 0.55 0.42 -0.07 -0.68 0.00 0.00 178.15 178.40 1c3y h LEU 47 N 0.00 0.73 -0.44 1.44 -0.00 -0.66 0.82 115.31 117.21 1c3y h LEU 47 Ca -0.01 -0.02 -0.13 0.00 -0.00 0.00 0.00 57.88 57.73 1c3y h LEU 47 Cb 1.00 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 41.47 1c3y h LEU 47 CO 0.07 0.53 -0.23 0.11 -0.00 0.00 0.00 178.44 178.92 1c3y h LYS 48 N 0.86 0.92 -0.36 1.13 1.57 -1.22 -1.85 116.57 117.64 1c3y h LYS 48 Ca 0.24 -0.41 -0.09 0.00 -1.87 0.00 0.00 60.65 58.52 1c3y h LYS 48 Cb -0.09 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1c3y h LYS 48 CO -0.06 1.07 -0.12 0.00 -0.57 0.00 0.00 179.45 179.77 1c3y h ARG 49 N 0.76 0.72 0.00 3.15 2.47 -1.02 -2.80 114.38 117.65 1c3y h ARG 49 Ca 0.10 -0.29 -0.00 0.00 -1.26 0.00 0.00 59.98 58.52 1c3y h ARG 49 Cb 0.80 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 29.09 1c3y h ARG 49 CO 0.07 0.89 -0.01 0.00 0.56 0.00 0.00 179.97 181.48 1c3y h ALA 50 N 0.81 1.95 -0.54 0.04 0.00 0.71 -3.46 119.26 118.76 1c3y h ALA 50 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1c3y h ALA 50 Cb 0.65 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1c3y h ALA 50 CO 0.04 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.72 1c3y n GLY 51 N -1.49 0.88 0.14 0.00 0.00 -0.91 -5.02 105.19 98.79 1c3y n GLY 51 Ca -0.03 -0.29 -0.12 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 -1.00 0.00 -4.29 1.61 3.72 -0.74 -5.02 117.46 111.74 1c3y n PHE 52 Ca 0.00 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.16 1c3y n PHE 52 Cb 0.23 -0.63 -0.12 0.00 -0.94 0.00 0.00 39.48 38.01 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 -2.33 1.71 0.26 4.37 2.07 -1.22 -3.62 121.20 122.44 1c3y s ILE 53 Ca -0.23 -1.55 -0.05 0.00 -1.41 0.00 0.00 60.65 57.41 1c3y s ILE 53 Cb 0.06 -1.56 -0.05 0.00 0.13 0.00 0.00 42.46 41.04 1c3y s ILE 53 CO 0.37 -0.07 0.52 1.51 -1.91 0.00 0.00 174.94 175.37 1c3y s ASP 54 N -1.92 6.48 0.67 4.50 1.47 -1.25 -4.32 116.67 122.29 1c3y s ASP 54 Ca 0.06 0.71 0.33 0.00 1.18 0.00 0.00 52.55 54.84 1c3y s ASP 54 Cb -0.10 -2.14 1.78 0.00 -0.34 0.00 0.00 42.92 42.12 1c3y s ASP 54 CO 0.04 -0.14 2.01 0.00 0.68 0.00 0.00 175.17 177.76 1c3y h ALA 55 N 1.95 1.28 0.00 2.11 0.00 -1.97 0.14 119.26 122.77 1c3y h ALA 55 Ca -0.47 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1c3y h ALA 55 Cb 1.18 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1c3y h ALA 55 CO 0.67 -0.27 -0.93 0.77 0.00 0.00 0.00 179.25 179.49 1c3y h SER 56 N 0.00 0.00 0.00 0.00 0.02 -2.06 -3.49 113.55 108.02 1c3y h SER 56 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1c3y h SER 56 Cb 0.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.09 1c3y h SER 56 CO -0.00 0.20 0.00 0.61 -1.14 0.00 0.00 176.83 176.50 1c3y n GLY 57 N 1.23 0.42 3.13 -3.77 0.00 0.48 -4.96 105.19 101.72 1c3y n GLY 57 Ca -0.02 -0.75 0.03 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.09 0.55 0.36 1.61 2.56 -1.26 -4.93 118.70 117.51 1c3y s GLU 58 Ca 0.00 0.67 -0.28 0.00 0.00 0.00 0.00 54.97 55.37 1c3y s GLU 58 Cb 0.00 0.31 -0.10 0.00 2.00 0.00 0.00 34.13 36.34 1c3y s GLU 58 CO 0.00 -0.91 1.30 -0.59 -0.56 0.00 0.00 175.26 174.51 1c3y s PHE 59 N 2.82 2.95 -0.47 5.30 -0.12 -1.26 -3.85 117.98 123.35 1c3y s PHE 59 Ca 0.13 1.41 0.06 0.00 -0.05 0.00 0.00 56.93 58.48 1c3y s PHE 59 Cb -0.12 -3.68 0.20 0.00 -0.63 0.00 0.00 43.02 38.80 1c3y s PHE 59 CO -0.24 -1.96 0.46 1.04 -0.05 0.00 0.00 175.22 174.47 1c3y n GLN 60 N 0.51 0.84 0.18 1.99 1.13 -1.24 -4.94 117.38 115.85 1c3y n GLN 60 Ca 0.02 -3.54 0.04 0.00 -1.94 0.00 0.00 57.00 51.57 1c3y n GLN 60 Cb 0.43 -1.68 0.34 0.00 0.11 0.00 0.00 30.24 29.43 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 4.93 0.00 -1.90 1.08 3.38 -1.94 -2.59 115.31 118.27 1c3y h LEU 61 Ca 0.18 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.19 1c3y h LEU 61 Cb 0.85 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1c3y h LEU 61 CO 0.50 0.41 0.14 -0.78 0.09 0.00 0.00 178.44 178.80 1c3y h ASP 62 N 0.00 0.12 0.47 -0.43 1.82 -1.99 0.44 116.42 116.84 1c3y h ASP 62 Ca -0.00 -0.00 -0.30 0.00 -0.39 0.00 0.00 57.03 56.34 1c3y h ASP 62 Cb 0.83 -0.03 -0.03 0.00 0.68 0.00 0.00 39.33 40.78 1c3y h ASP 62 CO 0.05 0.08 -1.65 0.45 -1.61 0.00 0.00 179.24 176.56 1c3y h HIS 63 N 0.14 0.17 0.29 0.28 3.86 -1.91 -3.25 115.15 114.74 1c3y h HIS 63 Ca 0.09 -0.13 -0.01 0.00 -1.16 0.00 0.00 60.37 59.16 1c3y h HIS 63 Cb 0.20 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.66 1c3y h HIS 63 CO -0.00 1.22 -0.14 0.82 0.86 0.00 0.00 177.93 180.69 1c3y h ILE 64 N 0.03 0.65 -0.54 2.45 2.04 -0.92 -1.46 117.51 119.76 1c3y h ILE 64 Ca -0.27 -0.74 0.09 0.00 1.00 0.00 0.00 64.86 64.94 1c3y h ILE 64 Cb 1.99 1.00 -0.07 0.00 -0.74 0.00 0.00 36.82 39.00 1c3y h ILE 64 CO 0.10 0.13 0.15 0.07 0.00 0.00 0.00 178.15 178.61 1c3y h LYS 65 N -0.84 0.30 -0.74 2.37 2.10 -0.35 0.12 116.57 119.52 1c3y h LYS 65 Ca -0.04 -0.02 -0.03 0.00 -2.00 0.00 0.00 60.65 58.56 1c3y h LYS 65 Cb 0.52 -0.07 -0.03 0.00 -0.90 0.00 0.00 32.23 31.74 1c3y h LYS 65 CO 0.07 0.20 0.34 1.15 -2.00 0.00 0.00 179.45 179.20 1c3y h THR 66 N 0.31 1.24 -0.66 0.07 2.02 -1.61 -1.98 112.91 112.29 1c3y h THR 66 Ca 0.27 -0.70 -0.08 0.00 0.77 0.00 0.00 66.41 66.68 1c3y h THR 66 Cb 0.36 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 1c3y h THR 66 CO -0.32 0.29 0.10 0.11 0.37 0.00 0.00 175.52 176.07 1c3y h LYS 67 N 1.06 1.10 -0.33 6.66 1.79 0.02 -2.63 116.57 124.24 1c3y h LYS 67 Ca 0.25 -0.30 -0.11 0.00 -2.18 0.00 0.00 60.65 58.32 1c3y h LYS 67 Cb 0.14 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 1c3y h LYS 67 CO -0.03 1.01 -0.26 0.74 -1.08 0.00 0.00 179.45 179.84 1c3y h PHE 68 N 1.03 0.76 0.00 -1.35 0.04 -0.47 -2.50 116.94 114.45 1c3y h PHE 68 Ca 0.20 -0.18 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1c3y h PHE 68 Cb 0.45 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.42 1c3y h PHE 68 CO 0.03 0.86 0.00 1.63 -0.60 0.00 0.00 178.31 180.23 1c3y n LYS 69 N -4.10 0.83 -0.34 1.51 5.02 -0.78 -3.72 118.16 116.57 1c3y n LYS 69 Ca -0.00 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 1c3y n LYS 69 Cb 0.44 -1.50 0.26 0.00 -0.02 0.00 0.00 35.03 34.21 1c3y n LYS 69 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 1c3y h GLU 70 N 0.00 0.82 0.00 1.97 4.11 -1.08 -3.44 114.58 116.96 1c3y h GLU 70 Ca 0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.38 1c3y h GLU 70 Cb 0.04 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.10 1c3y h GLU 70 CO 0.00 0.54 0.00 0.09 0.07 0.00 0.00 179.01 179.71 1c3y n ASN 71 N -4.72 -3.02 -0.76 3.06 3.02 -1.25 -5.14 115.26 106.45 1c3y n ASN 71 Ca 0.20 0.72 0.10 0.00 -0.03 0.00 0.00 54.58 55.57 1c3y n ASN 71 Cb 0.45 2.93 -0.03 0.00 -0.61 0.00 0.00 39.78 42.52 1c3y n ASN 71 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1c3y n SER 72 N -3.21 -4.34 -0.02 6.41 3.41 -1.24 -4.44 113.62 110.17 1c3y n SER 72 Ca 0.00 0.31 -0.18 0.00 -0.26 0.00 0.00 58.87 58.74 1c3y n SER 72 Cb 0.00 -2.53 -0.13 0.00 -0.26 0.00 0.00 64.21 61.29 1c3y n SER 72 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1c3y h GLU 73 N -0.73 0.14 -1.78 4.33 4.81 -2.02 -3.43 114.58 115.90 1c3y h GLU 73 Ca 0.01 -0.24 -0.40 0.00 -0.13 0.00 0.00 59.36 58.60 1c3y h GLU 73 Cb 1.17 0.09 -0.29 0.00 0.63 0.00 0.00 28.75 30.36 1c3y h GLU 73 CO 0.01 1.12 -0.76 -3.38 -0.73 0.00 0.00 179.01 175.26 1c3y s HIS 74 N -2.35 -0.10 0.27 0.92 -3.43 -1.26 -5.14 115.29 104.20 1c3y s HIS 74 Ca -0.19 -1.52 -0.29 0.00 -0.80 0.00 0.00 55.06 52.26 1c3y s HIS 74 Cb 0.01 -0.38 -0.09 0.00 -1.43 0.00 0.00 32.58 30.68 1c3y s HIS 74 CO 0.74 -1.02 0.98 -1.25 -2.00 0.00 0.00 174.74 172.18 1c3y s PRO 75 N 0.47 4.72 0.00 -0.38 0.04 -1.26 -4.88 135.00 133.71 1c3y s PRO 75 Ca 0.31 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.86 1c3y s PRO 75 Cb 0.01 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.44 1c3y s PRO 75 CO -0.13 0.37 0.00 -0.85 0.04 0.00 0.00 177.00 176.44 1c3y n GLU 76 N 1.14 0.00 -2.74 4.56 0.28 -1.26 -5.00 120.64 117.61 1c3y n GLU 76 Ca -0.01 0.00 -0.04 0.00 -0.16 0.00 0.00 57.16 56.96 1c3y n GLU 76 Cb 0.47 -0.02 0.07 0.00 1.43 0.00 0.00 31.44 33.39 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 -2.29 1.44 -0.26 3.44 5.02 -1.26 -4.92 118.16 119.33 1c3y n LYS 77 Ca 0.00 -2.84 -0.06 0.00 -2.02 0.00 0.00 58.31 53.39 1c3y n LYS 77 Cb 0.00 -0.97 0.05 0.00 -0.02 0.00 0.00 35.03 34.09 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 4.19 1.25 -0.47 -0.18 2.07 -1.94 -0.08 116.25 121.07 1c3y h VAL 78 Ca -0.20 -0.75 0.07 0.00 0.82 0.00 0.00 66.70 66.64 1c3y h VAL 78 Cb 1.25 0.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.37 1c3y h VAL 78 CO 0.17 0.30 0.11 -2.24 0.02 0.00 0.00 177.57 175.94 1c3y h ASP 79 N 1.01 0.04 -0.12 0.57 2.03 -1.91 0.83 116.42 118.88 1c3y h ASP 79 Ca 0.24 0.08 -0.17 0.00 -0.73 0.00 0.00 57.03 56.44 1c3y h ASP 79 Cb 0.19 0.10 -0.00 0.00 -0.83 0.00 0.00 39.33 38.79 1c3y h ASP 79 CO -0.02 0.05 -0.54 -0.78 -1.03 0.00 0.00 179.24 176.92 1c3y h ASP 80 N 0.26 0.78 -0.13 4.15 1.82 -1.90 -2.57 116.42 118.83 1c3y h ASP 80 Ca 0.23 -0.41 -0.01 0.00 -0.39 0.00 0.00 57.03 56.45 1c3y h ASP 80 Cb 0.29 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 40.07 1c3y h ASP 80 CO -0.29 1.16 0.04 0.25 -1.61 0.00 0.00 179.24 178.80 1c3y h LEU 81 N 0.54 0.18 -1.26 2.28 7.12 -0.14 -2.80 115.31 121.23 1c3y h LEU 81 Ca 0.01 -0.20 0.04 0.00 0.13 0.00 0.00 57.88 57.86 1c3y h LEU 81 Cb 1.11 -0.05 -0.05 0.00 -0.53 0.00 0.00 40.66 41.15 1c3y h LEU 81 CO 0.11 0.34 0.52 0.58 -0.13 0.00 0.00 178.44 179.86 1c3y h VAL 82 N 0.02 1.11 0.86 1.05 2.07 0.66 0.25 116.25 122.27 1c3y h VAL 82 Ca 0.04 -0.33 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 1c3y h VAL 82 Cb 0.22 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 1c3y h VAL 82 CO -0.00 0.17 -0.47 0.00 0.02 0.00 0.00 177.57 177.29 1c3y h ALA 83 N 1.55 -1.31 0.00 1.67 0.00 -1.23 0.68 119.26 120.62 1c3y h ALA 83 Ca 0.32 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1c3y h ALA 83 Cb 0.08 0.56 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1c3y h ALA 83 CO -0.10 -1.24 0.00 -0.22 0.00 0.00 0.00 179.25 177.70 1c3y h LYS 84 N -1.23 0.00 0.00 0.00 3.64 -1.36 -3.31 116.57 114.30 1c3y h LYS 84 Ca -0.12 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.14 1c3y h LYS 84 Cb 0.97 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1c3y h LYS 84 CO 0.15 0.00 -0.86 0.00 -2.27 0.00 0.00 179.45 176.47 1c3y n ALA 86 N -3.43 7.46 -1.95 0.00 0.00 0.23 -4.58 120.51 118.24 1c3y n ALA 86 Ca -0.20 -3.56 -0.42 0.00 0.00 0.00 0.00 53.44 49.26 1c3y n ALA 86 Cb 0.49 -3.38 -0.03 0.00 0.00 0.00 0.00 19.45 16.53 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 2.19 2.69 -0.36 0.00 -7.23 -1.26 -4.89 120.40 111.55 1c3y s VAL 87 Ca 0.68 0.50 -0.28 0.00 -1.81 0.00 0.00 61.98 61.08 1c3y s VAL 87 Cb 0.18 -3.32 -0.03 0.00 0.56 0.00 0.00 36.38 33.76 1c3y s VAL 87 CO -0.06 0.04 1.97 -1.59 -0.31 0.00 0.00 175.10 175.15 1c3y s LYS 88 N 1.01 3.06 0.64 4.82 -2.85 -1.26 -4.82 119.74 120.34 1c3y s LYS 88 Ca 0.69 1.46 0.04 0.00 -1.00 0.00 0.00 55.97 57.15 1c3y s LYS 88 Cb -0.43 -4.31 0.10 0.00 -2.06 0.00 0.00 37.83 31.14 1c3y s LYS 88 CO 0.32 -2.19 0.88 0.15 0.10 0.00 0.00 175.35 174.61 1c3y s LYS 89 N 6.29 2.03 0.05 1.78 -0.14 -1.26 -5.03 119.74 123.47 1c3y s LYS 89 Ca 0.85 -1.34 -0.21 0.00 -1.36 0.00 0.00 55.97 53.91 1c3y s LYS 89 Cb -0.23 -2.50 -0.13 0.00 -1.68 0.00 0.00 37.83 33.30 1c3y s LYS 89 CO 0.31 -1.11 1.44 0.38 -0.76 0.00 0.00 175.35 175.62 1c3y h ASP 90 N -0.15 0.29 -2.80 2.83 2.03 -2.02 -3.44 116.42 113.17 1c3y h ASP 90 Ca -0.34 -0.36 -0.64 0.00 -0.73 0.00 0.00 57.03 54.96 1c3y h ASP 90 Cb 1.28 -0.08 -0.06 0.00 -0.83 0.00 0.00 39.33 39.64 1c3y h ASP 90 CO 0.41 0.58 -0.50 0.42 -1.03 0.00 0.00 179.24 179.13 1c3y s THR 91 N -4.78 5.41 -0.00 1.15 -4.23 -1.26 -5.03 115.64 106.90 1c3y s THR 91 Ca -0.14 -0.13 -0.23 0.00 -1.18 0.00 0.00 61.69 60.01 1c3y s THR 91 Cb 0.06 -3.51 -0.19 0.00 1.34 0.00 0.00 72.50 70.20 1c3y s THR 91 CO 0.73 0.36 1.24 1.55 -0.54 0.00 0.00 174.62 177.96 1c3y h PRO 92 N 3.96 0.19 0.00 3.99 0.13 -1.93 -3.06 132.00 135.28 1c3y h PRO 92 Ca -0.50 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 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 0.67 0.69 0.00 -0.56 -0.23 0.00 0.00 178.00 178.58 1c3y h GLN 93 N -0.30 0.00 0.42 0.86 -0.00 -1.95 -2.91 115.11 111.22 1c3y h GLN 93 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.63 1c3y h GLN 93 Cb 0.68 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.17 1c3y h GLN 93 CO 0.03 0.00 -0.20 1.25 -0.00 0.00 0.00 178.83 179.90 1c3y h HIS 94 N 0.00 -0.52 -0.95 0.06 2.76 -1.85 -3.22 115.15 111.43 1c3y h HIS 94 Ca 0.00 -0.01 0.27 0.00 -2.20 0.00 0.00 60.37 58.43 1c3y h HIS 94 Cb 0.06 0.17 -0.04 0.00 1.55 0.00 0.00 27.41 29.16 1c3y h HIS 94 CO 0.00 -0.32 0.81 0.66 -1.30 0.00 0.00 177.93 177.78 1c3y h SER 95 N -1.11 0.00 -0.93 3.26 4.64 -1.51 0.76 113.55 118.67 1c3y h SER 95 Ca -0.06 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.33 1c3y h SER 95 Cb 0.43 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.46 1c3y h SER 95 CO 0.09 0.00 0.59 0.77 -0.87 0.00 0.00 176.83 177.41 1c3y h SER 96 N 0.00 0.93 0.31 4.97 4.64 -1.55 0.42 113.55 123.27 1c3y h SER 96 Ca 0.45 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.77 1c3y h SER 96 Cb 2.07 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 63.98 1c3y h SER 96 CO -0.00 0.59 -0.19 0.00 -0.87 0.00 0.00 176.83 176.36 1c3y h ALA 97 N 1.43 -1.04 -0.29 5.18 0.00 -0.97 0.84 119.26 124.41 1c3y h ALA 97 Ca 0.40 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.24 1c3y h ALA 97 Cb 0.17 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1c3y h ALA 97 CO -0.17 -1.03 0.20 -0.44 0.00 0.00 0.00 179.25 177.81 1c3y h ASP 98 N -0.47 0.25 -0.05 0.00 3.32 -1.66 0.12 116.42 117.94 1c3y h ASP 98 Ca -0.04 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 1c3y h ASP 98 Cb 0.38 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1c3y h ASP 98 CO 0.04 0.18 -0.04 0.15 -1.72 0.00 0.00 179.24 177.85 1c3y h PHE 99 N 0.30 0.23 -0.87 4.55 3.57 0.14 0.40 116.94 125.26 1c3y h PHE 99 Ca 0.12 -0.01 -0.54 0.00 3.53 0.00 0.00 57.97 61.06 1c3y h PHE 99 Cb 0.11 -0.07 -0.29 0.00 2.79 0.00 0.00 35.95 38.49 1c3y h PHE 99 CO -0.00 0.28 0.45 0.34 -2.23 0.00 0.00 178.31 177.15 1c3y n PHE 100 N -4.36 2.81 0.00 0.41 7.35 0.26 -4.42 117.46 119.52 1c3y n PHE 100 Ca -0.01 -2.40 0.00 0.00 -0.76 0.00 0.00 57.45 54.29 1c3y n PHE 100 Cb 0.20 -1.03 0.00 0.00 0.35 0.00 0.00 39.48 39.00 1c3y n PHE 100 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1c3y n LYS 101 N -0.99 0.00 -0.04 -4.13 5.02 -0.81 -4.88 118.16 112.33 1c3y n LYS 101 Ca 0.55 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.76 1c3y n LYS 101 Cb 1.03 -0.06 -0.02 0.00 -0.02 0.00 0.00 35.03 35.97 1c3y n LYS 101 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1c3y h VAL 103 N -0.13 0.73 0.00 0.00 -1.51 -1.77 -2.85 116.25 110.73 1c3y h VAL 103 Ca 0.12 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 65.52 1c3y h VAL 103 Cb 0.31 0.92 -0.01 0.00 -2.13 0.00 0.00 31.29 30.39 1c3y h VAL 103 CO -0.30 0.00 -0.45 0.45 -1.23 0.00 0.00 177.57 176.04 1c3y h HIS 104 N 0.00 0.00 0.00 5.19 -0.00 -1.34 -3.39 115.15 115.62 1c3y h HIS 104 Ca 0.06 0.00 -0.66 0.00 -0.00 0.00 0.00 60.37 59.77 1c3y h HIS 104 Cb 0.26 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 27.68 1c3y h HIS 104 CO 0.00 0.83 2.73 -3.47 -0.00 0.00 0.00 177.93 178.02 1c3y n ASP 105 N -4.59 3.52 -4.86 2.45 -0.08 0.28 -4.91 116.55 108.36 1c3y n ASP 105 Ca -0.15 -2.71 -0.34 0.00 -1.51 0.00 0.00 54.79 50.09 1c3y n ASP 105 Cb 0.42 -1.35 -0.05 0.00 2.34 0.00 0.00 41.12 42.48 1c3y n ASP 105 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 1c3y s ASN 106 N 4.04 6.68 -0.11 1.67 3.84 -1.25 -4.84 114.94 124.97 1c3y s ASN 106 Ca 0.53 0.92 -0.03 0.00 0.21 0.00 0.00 52.86 54.49 1c3y s ASN 106 Cb 0.14 -2.23 -0.03 0.00 -0.55 0.00 0.00 41.25 38.58 1c3y s ASN 106 CO 0.02 0.04 0.01 -0.13 -2.79 0.00 0.00 177.10 174.25 1c3y s ARG 107 N -2.35 3.22 0.00 0.43 0.52 -1.26 -5.12 118.95 114.40 1c3y s ARG 107 Ca 0.41 -0.39 0.00 0.00 -0.52 0.00 0.00 55.73 55.23 1c3y s ARG 107 Cb -0.13 -2.89 0.00 0.00 0.52 0.00 0.00 34.95 32.45 1c3y s ARG 107 CO 0.20 0.60 0.00 0.43 0.02 0.00 0.00 175.30 176.55