#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 4.03 -0.78 6.31 -1.32 -1.26 -5.05 115.64 117.57 1c3y s THR 2 Ca 0.00 -0.75 -0.25 0.00 -1.21 0.00 0.00 61.69 59.47 1c3y s THR 2 Cb 0.00 -2.83 -0.03 0.00 -1.51 0.00 0.00 72.50 68.13 1c3y s THR 2 CO 0.00 0.30 1.85 -2.16 -2.21 0.00 0.00 174.62 172.39 1c3y s PRO 3 N -1.77 2.68 -0.28 7.08 0.04 -1.26 -4.89 135.00 136.60 1c3y s PRO 3 Ca 0.21 0.03 -0.23 0.00 0.04 0.00 0.00 61.00 61.05 1c3y s PRO 3 Cb -0.11 -4.76 0.09 0.00 0.04 0.00 0.00 34.50 29.76 1c3y s PRO 3 CO 0.12 -2.98 0.81 0.50 0.04 0.00 0.00 177.00 175.50 1c3y s ARG 4 N 6.83 0.71 -0.31 4.56 3.52 -1.26 -5.13 118.95 127.87 1c3y s ARG 4 Ca 0.66 0.90 -0.10 0.00 -0.13 0.00 0.00 55.73 57.06 1c3y s ARG 4 Cb -0.09 0.31 0.19 0.00 -1.56 0.00 0.00 34.95 33.80 1c3y s ARG 4 CO 0.08 -0.09 1.05 -2.00 -0.81 0.00 0.00 175.30 173.53 1c3y s GLU 5 N 0.55 0.16 0.37 5.12 2.56 -1.26 -5.16 118.70 121.05 1c3y s GLU 5 Ca -0.01 0.03 -0.08 0.00 0.00 0.00 0.00 54.97 54.91 1c3y s GLU 5 Cb -0.05 0.04 0.03 0.00 2.00 0.00 0.00 34.13 36.15 1c3y s GLU 5 CO -0.04 -0.26 0.63 0.15 -0.56 0.00 0.00 175.26 175.18 1c3y s LYS 6 N 2.44 2.11 -0.37 4.30 1.02 -1.26 -5.09 119.74 122.89 1c3y s LYS 6 Ca 0.21 -1.65 0.11 0.00 0.02 0.00 0.00 55.97 54.66 1c3y s LYS 6 Cb 0.01 0.53 0.40 0.00 -0.52 0.00 0.00 37.83 38.25 1c3y s LYS 6 CO -0.19 -0.93 1.43 1.47 -0.92 0.00 0.00 175.35 176.21 1c3y n LEU 7 N -0.57 -1.63 0.08 3.17 -0.00 -1.26 -5.00 117.00 111.79 1c3y n LEU 7 Ca -0.04 -3.36 0.00 0.00 -0.00 0.00 0.00 56.01 52.62 1c3y n LEU 7 Cb 0.61 0.06 0.00 0.00 -0.00 0.00 0.00 43.42 44.09 1c3y n LEU 7 CO 0.29 1.81 0.00 1.17 -0.00 0.00 0.00 177.39 180.66 1c3y n LYS 8 N -0.99 0.00 -1.57 1.47 3.00 -1.26 -5.02 118.16 113.80 1c3y n LYS 8 Ca -0.09 0.00 -0.19 0.00 -0.00 0.00 0.00 58.31 58.03 1c3y n LYS 8 Cb 0.86 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 35.81 1c3y n LYS 8 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1c3y n GLN 9 N -2.87 -1.49 -2.49 1.64 6.02 -1.26 -2.01 117.38 114.92 1c3y n GLN 9 Ca 0.00 1.19 -0.15 0.00 -0.01 0.00 0.00 57.00 58.03 1c3y n GLN 9 Cb 0.00 -5.58 -0.01 0.00 1.02 0.00 0.00 30.24 25.68 1c3y n GLN 9 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1c3y n HIS 10 N -2.37 -1.35 -0.04 1.08 8.25 -1.26 -4.81 115.22 114.72 1c3y n HIS 10 Ca -0.19 0.04 -0.03 0.00 -0.26 0.00 0.00 57.72 57.27 1c3y n HIS 10 Cb 0.67 -3.11 -0.08 0.00 1.12 0.00 0.00 29.99 28.59 1c3y n HIS 10 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1c3y n SER 11 N -1.90 2.50 -0.01 0.41 3.41 -0.85 -4.53 113.62 112.66 1c3y n SER 11 Ca -0.16 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.56 1c3y n SER 11 Cb 0.63 0.91 0.54 0.00 -0.26 0.00 0.00 64.21 66.03 1c3y n SER 11 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1c3y h ASP 12 N 0.00 0.26 0.43 4.04 2.03 -1.87 0.44 116.42 121.75 1c3y h ASP 12 Ca -0.22 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.07 1c3y h ASP 12 Cb 1.38 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 39.83 1c3y h ASP 12 CO 0.01 0.17 -0.21 0.00 -1.03 0.00 0.00 179.24 178.18 1c3y h ALA 13 N 1.75 -0.58 0.00 4.15 0.00 -1.92 -2.31 119.26 120.36 1c3y h ALA 13 Ca 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1c3y h ALA 13 Cb 0.47 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1c3y h ALA 13 CO -0.05 -0.76 0.00 0.00 0.00 0.00 0.00 179.25 178.44 1c3y h LYS 15 N 0.00 0.00 -0.07 0.00 1.63 0.11 0.88 116.57 119.11 1c3y h LYS 15 Ca 0.00 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.82 1c3y h LYS 15 Cb 0.64 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.26 1c3y h LYS 15 CO 0.00 0.45 0.18 0.00 -3.45 0.00 0.00 179.45 176.62 1c3y h ALA 16 N 1.55 1.42 0.00 5.00 0.00 -1.29 -3.39 119.26 122.55 1c3y h ALA 16 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1c3y h ALA 16 Cb 1.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1c3y h ALA 16 CO 0.06 -0.21 0.00 -1.91 0.00 0.00 0.00 179.25 177.18 1c3y n GLU 17 N -3.31 0.00 -1.02 0.00 4.07 -1.18 -4.96 120.64 114.23 1c3y n GLU 17 Ca -0.01 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.75 1c3y n GLU 17 Cb 0.26 -0.08 -0.04 0.00 -0.06 0.00 0.00 31.44 31.52 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 3.66 -2.36 4.31 7.64 0.30 -4.54 113.62 120.50 1c3y n SER 18 Ca 0.00 -2.54 -0.30 0.00 1.01 0.00 0.00 58.87 57.03 1c3y n SER 18 Cb 0.00 -1.14 0.04 0.00 -1.01 0.00 0.00 64.21 62.09 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 4.18 6.03 0.34 0.23 0.00 -1.25 -4.38 105.19 110.33 1c3y n GLY 19 Ca 0.48 -2.56 0.14 0.00 0.00 0.00 0.00 46.02 44.09 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 1.90 0.86 -1.55 1.61 3.04 -1.80 -3.48 116.25 116.83 1c3y h VAL 20 Ca 0.46 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 66.11 1c3y h VAL 20 Cb 0.95 0.76 0.00 0.00 -2.01 0.00 0.00 31.29 30.98 1c3y h VAL 20 CO 1.13 0.02 0.00 -1.54 -1.01 0.00 0.00 177.57 176.17 1c3y n SER 21 N -4.45 -4.66 -3.37 3.17 3.41 -1.26 -3.44 113.62 103.01 1c3y n SER 21 Ca 0.06 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.27 1c3y n SER 21 Cb 0.38 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 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 -1.49 4.05 0.02 4.33 2.13 -1.26 -4.23 120.64 124.18 1c3y n GLU 22 Ca 0.00 -2.68 0.00 0.00 0.66 0.00 0.00 57.16 55.14 1c3y n GLU 22 Cb 0.00 -2.74 0.00 0.00 0.27 0.00 0.00 31.44 28.97 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 2.87 0.00 0.09 5.31 2.13 -1.22 -4.64 120.64 125.18 1c3y n GLU 23 Ca 0.73 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 58.51 1c3y n GLU 23 Cb 0.24 -0.13 0.16 0.00 0.27 0.00 0.00 31.44 31.98 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 0.00 0.23 -0.40 4.31 0.02 -1.74 -2.89 113.55 113.09 1c3y h SER 24 Ca 0.00 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 1c3y h SER 24 Cb 0.00 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 1c3y h SER 24 CO 0.00 0.73 0.23 -0.07 -1.14 0.00 0.00 176.83 176.58 1c3y h LEU 25 N 0.16 0.51 -0.64 5.07 3.38 -1.88 -1.90 115.31 120.02 1c3y h LEU 25 Ca 0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1c3y h LEU 25 Cb 1.01 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 1c3y h LEU 25 CO 0.08 0.41 0.25 -1.13 0.09 0.00 0.00 178.44 178.14 1c3y h ASN 26 N 0.58 0.89 0.06 -0.43 -0.73 -1.77 -2.01 115.58 112.17 1c3y h ASN 26 Ca 0.15 -0.18 -0.01 0.00 1.87 0.00 0.00 56.30 58.13 1c3y h ASN 26 Cb 0.02 -0.23 -0.00 0.00 0.27 0.00 0.00 38.32 38.37 1c3y h ASN 26 CO -0.03 0.82 -0.06 0.11 -0.37 0.00 0.00 177.43 177.91 1c3y h LYS 27 N 0.90 0.00 0.00 6.67 1.57 -1.37 -0.84 116.57 123.50 1c3y h LYS 27 Ca 0.21 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.98 1c3y h LYS 27 Cb 0.22 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 1c3y h LYS 27 CO -0.02 0.06 -0.04 0.28 -0.57 0.00 0.00 179.45 179.16 1c3y h VAL 28 N 0.00 0.81 -0.45 0.50 2.07 -1.06 -1.49 116.25 116.64 1c3y h VAL 28 Ca -0.00 -0.15 0.10 0.00 0.82 0.00 0.00 66.70 67.47 1c3y h VAL 28 Cb 0.10 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1c3y h VAL 28 CO 0.01 0.04 0.31 0.03 0.02 0.00 0.00 177.57 177.98 1c3y h ARG 29 N 0.00 0.14 -5.90 1.57 2.47 -1.16 -3.40 114.38 108.09 1c3y h ARG 29 Ca -0.00 -0.01 -0.58 0.00 -1.26 0.00 0.00 59.98 58.13 1c3y h ARG 29 Cb 0.09 -0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 28.31 1c3y h ARG 29 CO 0.01 0.09 -0.13 -0.80 0.56 0.00 0.00 179.97 179.70 1c3y s ASN 30 N -6.40 6.79 -1.20 7.04 -0.87 -0.56 -4.99 114.94 114.76 1c3y s ASN 30 Ca -0.06 0.95 -0.21 0.00 -1.57 0.00 0.00 52.86 51.97 1c3y s ASN 30 Cb 0.19 -2.30 -0.00 0.00 -0.02 0.00 0.00 41.25 39.12 1c3y s ASN 30 CO 0.72 0.12 1.80 -0.13 -2.57 0.00 0.00 177.10 177.05 1c3y s ARG 31 N -0.08 3.28 0.00 -0.60 0.52 -1.26 -4.52 118.95 116.29 1c3y s ARG 31 Ca 0.26 -1.47 0.00 0.00 -0.52 0.00 0.00 55.73 54.00 1c3y s ARG 31 Cb -0.16 -5.37 0.00 0.00 0.52 0.00 0.00 34.95 29.93 1c3y s ARG 31 CO 0.13 -2.99 0.00 0.39 0.02 0.00 0.00 175.30 172.85 1c3y n GLU 32 N 8.44 0.00 0.00 3.54 1.02 -1.26 -5.12 120.64 127.25 1c3y n GLU 32 Ca 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.59 1c3y n GLU 32 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.89 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 -1.11 0.00 -1.17 3.49 2.13 -1.26 -5.17 120.64 117.55 1c3y n GLU 33 Ca 0.00 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.90 1c3y n GLU 33 Cb 0.00 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.66 1c3y n GLU 33 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 1c3y n VAL 34 N 0.00 -0.90 -3.27 6.31 3.14 -1.26 -4.99 118.33 117.36 1c3y n VAL 34 Ca 0.00 0.68 -0.05 0.00 -2.96 0.00 0.00 64.34 62.01 1c3y n VAL 34 Cb 0.00 -1.06 -0.05 0.00 -1.06 0.00 0.00 33.84 31.67 1c3y n VAL 34 CO 0.00 0.00 0.00 1.51 -6.46 0.00 0.00 176.83 171.88 1c3y s ASP 35 N -6.08 -0.25 -0.02 6.55 -4.77 -1.26 -5.15 116.67 105.70 1c3y s ASP 35 Ca 0.00 0.08 0.01 0.00 -3.30 0.00 0.00 52.55 49.34 1c3y s ASP 35 Cb 0.00 1.42 0.01 0.00 -1.09 0.00 0.00 42.92 43.26 1c3y s ASP 35 CO 0.00 -0.32 -0.02 -1.81 0.70 0.00 0.00 175.17 173.72 1c3y s ASP 36 N 2.64 0.49 -0.06 2.11 1.11 -1.26 -5.07 116.67 116.63 1c3y s ASP 36 Ca 0.12 -0.06 -0.25 0.00 0.18 0.00 0.00 52.55 52.55 1c3y s ASP 36 Cb -0.13 -0.17 -0.20 0.00 1.07 0.00 0.00 42.92 43.49 1c3y s ASP 36 CO -0.24 -0.03 1.02 1.55 1.18 0.00 0.00 175.17 178.65 1c3y h PRO 37 N 6.70 -0.07 -0.44 8.23 0.13 -2.01 -3.23 132.00 141.32 1c3y h PRO 37 Ca -0.35 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.91 1c3y h PRO 37 Cb 1.16 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1c3y h PRO 37 CO 0.49 0.51 0.35 0.87 -0.23 0.00 0.00 178.00 179.99 1c3y h LYS 38 N -0.73 0.00 -0.21 0.86 1.57 -1.97 -0.97 116.57 115.12 1c3y h LYS 38 Ca -0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1c3y h LYS 38 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1c3y h LYS 38 CO 0.01 0.00 0.09 1.25 -0.57 0.00 0.00 179.45 180.24 1c3y h LEU 39 N 0.00 0.28 -0.22 2.94 6.46 -1.94 0.37 115.31 123.20 1c3y h LEU 39 Ca 0.21 -0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 57.81 1c3y h LEU 39 Cb 0.90 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.75 1c3y h LEU 39 CO -0.00 0.35 0.08 0.11 -0.62 0.00 0.00 178.44 178.36 1c3y h LYS 40 N 0.20 0.33 -0.38 1.25 1.57 -1.24 -2.32 116.57 115.98 1c3y h LYS 40 Ca 0.07 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1c3y h LYS 40 Cb 0.14 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1c3y h LYS 40 CO -0.01 0.39 0.14 0.93 -0.57 0.00 0.00 179.45 180.34 1c3y h GLU 41 N 0.20 0.58 -0.28 3.15 4.39 -1.34 -2.74 114.58 118.54 1c3y h GLU 41 Ca 0.07 -0.11 0.06 0.00 0.34 0.00 0.00 59.36 59.72 1c3y h GLU 41 Cb 0.19 -0.09 -0.06 0.00 -0.10 0.00 0.00 28.75 28.69 1c3y h GLU 41 CO -0.01 0.56 -0.10 1.25 -1.16 0.00 0.00 179.01 179.56 1c3y h HIS 42 N 0.47 -0.22 -0.45 4.33 2.76 -0.16 -1.53 115.15 120.35 1c3y h HIS 42 Ca 0.13 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.38 1c3y h HIS 42 Cb 0.21 0.14 -0.05 0.00 1.55 0.00 0.00 27.41 29.26 1c3y h HIS 42 CO 0.00 -0.15 0.16 0.00 -1.30 0.00 0.00 177.93 176.64 1c3y h ALA 43 N 1.22 0.54 -0.05 5.26 0.00 -1.33 -0.36 119.26 124.54 1c3y h ALA 43 Ca 0.14 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1c3y h ALA 43 Cb 0.25 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1c3y h ALA 43 CO -0.31 -0.23 0.04 0.35 0.00 0.00 0.00 179.25 179.11 1c3y h PHE 44 N 0.34 0.00 -0.11 0.00 3.57 -1.09 0.35 116.94 119.99 1c3y h PHE 44 Ca 0.21 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.65 1c3y h PHE 44 Cb 0.20 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1c3y h PHE 44 CO -0.15 0.00 -0.21 0.00 -2.23 0.00 0.00 178.31 175.72 1c3y n ILE 46 N -4.22 1.47 -0.33 0.00 -0.00 -0.20 -3.68 119.36 112.40 1c3y n ILE 46 Ca -0.01 -0.82 -0.02 0.00 -0.00 0.00 0.00 62.75 61.90 1c3y n ILE 46 Cb 0.31 -0.73 0.13 0.00 -0.00 0.00 0.00 39.64 39.35 1c3y n ILE 46 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 1c3y h LEU 47 N 0.00 1.08 -0.47 1.39 -0.00 -0.21 0.85 115.31 117.95 1c3y h LEU 47 Ca -0.41 -0.05 -0.16 0.00 -0.00 0.00 0.00 57.88 57.27 1c3y h LEU 47 Cb 2.10 -0.27 -0.01 0.00 -0.00 0.00 0.00 40.66 42.48 1c3y h LEU 47 CO 0.05 0.82 -0.44 0.11 -0.00 0.00 0.00 178.44 178.97 1c3y h LYS 48 N 1.26 0.77 -0.19 1.13 1.57 -1.54 -2.44 116.57 117.12 1c3y h LYS 48 Ca 0.33 -0.43 -0.21 0.00 -1.87 0.00 0.00 60.65 58.47 1c3y h LYS 48 Cb -0.09 0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.26 1c3y h LYS 48 CO -0.07 1.05 -0.71 0.00 -0.57 0.00 0.00 179.45 179.16 1c3y h ARG 49 N 0.62 0.79 -0.06 3.15 3.08 -1.44 -3.08 114.38 117.43 1c3y h ARG 49 Ca 0.04 -0.60 0.02 0.00 0.07 0.00 0.00 59.98 59.51 1c3y h ARG 49 Cb 1.01 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 31.17 1c3y h ARG 49 CO 0.10 1.21 0.04 0.00 -1.07 0.00 0.00 179.97 180.25 1c3y h ALA 50 N 0.63 2.04 -0.08 0.04 0.00 0.74 -3.46 119.26 119.17 1c3y h ALA 50 Ca -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1c3y h ALA 50 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1c3y h ALA 50 CO 0.15 -0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.73 1c3y n GLY 51 N -1.54 1.34 0.13 0.00 0.00 -1.09 -5.00 105.19 99.03 1c3y n GLY 51 Ca -0.02 -0.29 -0.19 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.77 0.03 -4.49 1.61 3.72 -0.94 -4.98 117.46 110.63 1c3y n PHE 52 Ca 0.00 0.01 -0.23 0.00 -0.05 0.00 0.00 57.45 57.18 1c3y n PHE 52 Cb 0.17 -1.00 -0.14 0.00 -0.94 0.00 0.00 39.48 37.57 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 -2.52 1.38 0.34 4.37 2.07 -1.19 -3.53 121.20 122.12 1c3y s ILE 53 Ca -0.35 -1.09 -0.06 0.00 -1.41 0.00 0.00 60.65 57.74 1c3y s ILE 53 Cb 0.10 -1.22 -0.05 0.00 0.13 0.00 0.00 42.46 41.41 1c3y s ILE 53 CO 0.59 0.10 0.63 1.51 -1.91 0.00 0.00 174.94 175.86 1c3y s ASP 54 N -1.15 6.44 0.64 4.50 1.47 -1.24 -4.23 116.67 123.10 1c3y s ASP 54 Ca 0.05 0.82 0.32 0.00 1.18 0.00 0.00 52.55 54.91 1c3y s ASP 54 Cb -0.08 -2.19 1.72 0.00 -0.34 0.00 0.00 42.92 42.03 1c3y s ASP 54 CO 0.02 -0.28 2.00 0.00 0.68 0.00 0.00 175.17 177.58 1c3y h ALA 55 N 1.40 1.49 -0.31 2.11 0.00 -1.96 0.88 119.26 122.86 1c3y h ALA 55 Ca -0.48 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1c3y h ALA 55 Cb 1.19 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1c3y h ALA 55 CO 0.65 -0.34 0.01 0.43 0.00 0.00 0.00 179.25 180.00 1c3y n SER 56 N -3.18 3.52 -2.73 0.00 7.64 -1.26 -4.96 113.62 112.65 1c3y n SER 56 Ca -0.00 -2.51 -0.02 0.00 1.01 0.00 0.00 58.87 57.35 1c3y n SER 56 Cb 0.37 -0.60 -0.02 0.00 -1.01 0.00 0.00 64.21 62.95 1c3y n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c3y n GLY 57 N 0.31 -4.14 3.15 0.23 0.00 0.30 -5.05 105.19 99.99 1c3y n GLY 57 Ca 0.15 0.92 0.04 0.00 0.00 0.00 0.00 46.02 47.13 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 -1.15 0.56 0.31 1.61 -6.30 -1.25 -4.95 118.70 107.54 1c3y s GLU 58 Ca -0.11 0.70 -0.29 0.00 -2.50 0.00 0.00 54.97 52.77 1c3y s GLU 58 Cb 0.01 0.35 -0.10 0.00 0.00 0.00 0.00 34.13 34.39 1c3y s GLU 58 CO 0.69 -0.91 1.31 -0.59 0.02 0.00 0.00 175.26 175.78 1c3y s PHE 59 N 2.84 3.08 -0.59 5.30 -0.12 -1.26 -3.72 117.98 123.51 1c3y s PHE 59 Ca 0.14 1.38 0.04 0.00 -0.05 0.00 0.00 56.93 58.44 1c3y s PHE 59 Cb -0.12 -3.67 0.16 0.00 -0.63 0.00 0.00 43.02 38.77 1c3y s PHE 59 CO -0.24 -1.88 0.41 -0.65 -0.05 0.00 0.00 175.22 172.81 1c3y s GLN 60 N -1.53 1.91 0.41 1.99 -0.21 -1.23 -4.93 119.66 116.07 1c3y s GLN 60 Ca 0.50 -2.85 0.20 0.00 0.02 0.00 0.00 55.36 53.24 1c3y s GLN 60 Cb -0.39 -2.78 0.85 0.00 1.00 0.00 0.00 33.01 31.68 1c3y s GLN 60 CO 0.50 -1.29 1.82 -0.07 -2.12 0.00 0.00 175.29 174.14 1c3y h LEU 61 N 5.67 0.00 -2.18 2.90 3.38 -1.94 -2.84 115.31 120.30 1c3y h LEU 61 Ca 0.15 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.13 1c3y h LEU 61 Cb 0.82 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1c3y h LEU 61 CO 0.60 0.31 0.05 0.44 0.09 0.00 0.00 178.44 179.93 1c3y h ASP 62 N 0.00 0.00 0.27 -0.43 3.32 -1.99 0.16 116.42 117.74 1c3y h ASP 62 Ca -0.00 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.72 1c3y h ASP 62 Cb 0.74 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.24 1c3y h ASP 62 CO 0.04 0.00 -1.99 1.57 -1.72 0.00 0.00 179.24 177.14 1c3y n HIS 63 N -4.23 0.73 0.04 4.55 -0.00 -1.09 -3.93 115.22 111.29 1c3y n HIS 63 Ca -0.02 0.23 -0.13 0.00 0.46 0.00 0.00 57.72 58.27 1c3y n HIS 63 Cb 0.15 -1.12 -0.09 0.00 -0.12 0.00 0.00 29.99 28.81 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 1.11 -0.76 3.57 2.04 -1.17 -2.88 117.51 119.44 1c3y h ILE 64 Ca -0.40 -0.93 0.12 0.00 1.00 0.00 0.00 64.86 64.66 1c3y h ILE 64 Cb 2.07 1.69 -0.09 0.00 -0.74 0.00 0.00 36.82 39.75 1c3y h ILE 64 CO 0.06 0.22 0.35 0.07 0.00 0.00 0.00 178.15 178.85 1c3y h LYS 65 N -0.58 0.53 -0.80 2.37 2.10 -0.92 -0.55 116.57 118.72 1c3y h LYS 65 Ca -0.01 -0.03 0.02 0.00 -2.00 0.00 0.00 60.65 58.62 1c3y h LYS 65 Cb 0.47 -0.12 -0.04 0.00 -0.90 0.00 0.00 32.23 31.63 1c3y h LYS 65 CO 0.02 0.35 0.52 1.15 -2.00 0.00 0.00 179.45 179.49 1c3y h THR 66 N 0.54 1.17 -0.02 0.07 2.02 -1.67 0.37 112.91 115.39 1c3y h THR 66 Ca 0.40 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 1c3y h THR 66 Cb 0.53 0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1c3y h THR 66 CO -0.34 0.19 0.00 0.11 0.37 0.00 0.00 175.52 175.85 1c3y h LYS 67 N 1.04 0.03 0.00 6.66 1.79 -0.95 -0.64 116.57 124.49 1c3y h LYS 67 Ca 0.30 -0.01 -0.05 0.00 -2.18 0.00 0.00 60.65 58.71 1c3y h LYS 67 Cb -0.07 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.57 1c3y h LYS 67 CO -0.09 0.28 -0.26 0.74 -1.08 0.00 0.00 179.45 179.05 1c3y h PHE 68 N -0.23 0.00 0.07 -1.35 -1.00 -0.94 -3.17 116.94 110.31 1c3y h PHE 68 Ca 0.00 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 1c3y h PHE 68 Cb 0.27 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.83 1c3y h PHE 68 CO 0.02 0.26 -0.03 -0.22 -1.61 0.00 0.00 178.31 176.72 1c3y h LYS 69 N 0.00 -0.09 -6.71 1.51 3.64 -0.06 -3.46 116.57 111.41 1c3y h LYS 69 Ca -0.00 0.01 -0.58 0.00 -1.27 0.00 0.00 60.65 58.81 1c3y h LYS 69 Cb 0.59 0.02 0.16 0.00 -0.41 0.00 0.00 32.23 32.59 1c3y h LYS 69 CO 0.03 0.49 -0.02 -0.85 -2.27 0.00 0.00 179.45 176.83 1c3y n GLU 70 N -4.82 0.86 -2.88 1.90 0.28 -0.27 -3.83 120.64 111.88 1c3y n GLU 70 Ca -0.08 0.33 -0.02 0.00 -0.16 0.00 0.00 57.16 57.23 1c3y n GLU 70 Cb 0.30 -2.01 0.00 0.00 1.43 0.00 0.00 31.44 31.17 1c3y n GLU 70 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1c3y n ASN 71 N -0.19 -7.35 -0.97 -1.84 5.15 -1.26 -4.97 115.26 103.83 1c3y n ASN 71 Ca 0.12 0.07 0.00 0.00 -0.60 0.00 0.00 54.58 54.18 1c3y n ASN 71 Cb 0.46 -4.97 0.00 0.00 -0.53 0.00 0.00 39.78 34.74 1c3y n ASN 71 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1c3y n SER 72 N -1.37 0.00 -0.69 1.20 2.88 -1.25 -5.07 113.62 109.33 1c3y n SER 72 Ca 0.03 -0.97 -0.01 0.00 -1.33 0.00 0.00 58.87 56.59 1c3y n SER 72 Cb 0.48 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.93 1c3y n SER 72 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1c3y n GLU 73 N 0.00 0.00 -2.73 -1.46 1.02 -1.26 -4.93 120.64 111.28 1c3y n GLU 73 Ca 0.00 -0.63 -0.08 0.00 -0.02 0.00 0.00 57.16 56.43 1c3y n GLU 73 Cb 0.00 -0.03 0.10 0.00 -0.02 0.00 0.00 31.44 31.48 1c3y n GLU 73 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1c3y n HIS 74 N 0.05 -2.04 -1.99 -0.32 8.25 -1.26 -5.08 115.22 112.83 1c3y n HIS 74 Ca -0.05 -2.16 -0.25 0.00 -0.26 0.00 0.00 57.72 55.00 1c3y n HIS 74 Cb 0.65 1.30 -0.06 0.00 1.12 0.00 0.00 29.99 33.00 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 -0.28 2.36 -0.20 -0.41 0.04 -1.26 -4.23 135.00 131.02 1c3y s PRO 75 Ca 0.23 -0.61 0.01 0.00 0.04 0.00 0.00 61.00 60.67 1c3y s PRO 75 Cb 0.38 -5.11 0.04 0.00 0.04 0.00 0.00 34.50 29.84 1c3y s PRO 75 CO -0.06 -3.86 0.86 -0.85 0.04 0.00 0.00 177.00 173.12 1c3y n GLU 76 N 8.56 0.12 0.00 4.56 0.00 -1.26 -5.01 120.64 127.61 1c3y n GLU 76 Ca 0.43 -0.42 0.00 0.00 0.00 0.00 0.00 57.16 57.17 1c3y n GLU 76 Cb 0.46 0.01 0.00 0.00 0.00 0.00 0.00 31.44 31.92 1c3y n GLU 76 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1c3y n LYS 77 N -0.36 0.00 -0.22 3.44 5.02 -1.26 -4.92 118.16 119.86 1c3y n LYS 77 Ca -0.18 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.18 1c3y n LYS 77 Cb 0.59 -0.06 0.34 0.00 -0.02 0.00 0.00 35.03 35.88 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 1.00 -0.07 -0.18 2.07 -1.95 -0.46 116.25 116.66 1c3y h VAL 78 Ca 0.00 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 67.28 1c3y h VAL 78 Cb 0.00 0.14 -0.06 0.00 -1.52 0.00 0.00 31.29 29.84 1c3y h VAL 78 CO 0.00 0.15 -0.48 -2.24 0.02 0.00 0.00 177.57 175.02 1c3y h ASP 79 N 0.80 -1.50 0.53 0.57 2.03 -1.91 0.67 116.42 117.60 1c3y h ASP 79 Ca 0.35 0.18 -0.14 0.00 -0.73 0.00 0.00 57.03 56.69 1c3y h ASP 79 Cb 0.31 0.59 -0.02 0.00 -0.83 0.00 0.00 39.33 39.38 1c3y h ASP 79 CO -0.12 -0.47 -0.61 0.44 -1.03 0.00 0.00 179.24 177.44 1c3y h ASP 80 N -0.58 0.09 -0.45 4.15 3.32 -1.89 -3.18 116.42 117.88 1c3y h ASP 80 Ca 0.05 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1c3y h ASP 80 Cb 0.67 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 1c3y h ASP 80 CO -0.38 0.68 0.15 0.25 -1.72 0.00 0.00 179.24 178.22 1c3y h LEU 81 N 0.06 0.65 0.35 1.55 5.85 -0.17 -1.19 115.31 122.41 1c3y h LEU 81 Ca -0.01 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 1c3y h LEU 81 Cb 1.10 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 1c3y h LEU 81 CO 0.08 0.67 -0.21 0.58 -0.34 0.00 0.00 178.44 179.23 1c3y h VAL 82 N 0.59 0.56 -0.71 1.05 2.07 0.32 0.86 116.25 121.00 1c3y h VAL 82 Ca 0.15 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.67 1c3y h VAL 82 Cb 0.24 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 1c3y h VAL 82 CO -0.01 0.00 0.47 0.00 0.02 0.00 0.00 177.57 178.05 1c3y h ALA 83 N 0.10 0.90 0.00 1.67 0.00 -1.55 0.89 119.26 121.28 1c3y h ALA 83 Ca -0.04 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1c3y h ALA 83 Cb 0.44 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1c3y h ALA 83 CO 0.04 0.33 -0.33 -0.22 0.00 0.00 0.00 179.25 179.07 1c3y h LYS 84 N 0.96 0.00 0.09 0.00 3.64 -1.02 -3.29 116.57 116.95 1c3y h LYS 84 Ca 0.26 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.29 1c3y h LYS 84 Cb -0.11 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.69 1c3y h LYS 84 CO -0.06 0.33 -1.94 0.00 -2.27 0.00 0.00 179.45 175.52 1c3y n ALA 86 N -2.88 6.73 -1.91 0.00 0.00 0.30 -4.44 120.51 118.31 1c3y n ALA 86 Ca -0.28 -3.08 -0.42 0.00 0.00 0.00 0.00 53.44 49.65 1c3y n ALA 86 Cb 1.05 -2.57 -0.03 0.00 0.00 0.00 0.00 19.45 17.91 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 -0.37 3.30 -0.19 0.00 -7.23 -1.26 -4.90 120.40 109.75 1c3y s VAL 87 Ca 0.62 0.50 -0.29 0.00 -1.81 0.00 0.00 61.98 61.00 1c3y s VAL 87 Cb 0.28 -3.32 -0.04 0.00 0.56 0.00 0.00 36.38 33.86 1c3y s VAL 87 CO -0.11 -0.03 1.87 -1.59 -0.31 0.00 0.00 175.10 174.93 1c3y s LYS 88 N 3.70 3.61 0.35 4.82 0.00 -1.26 -4.80 119.74 126.16 1c3y s LYS 88 Ca 0.77 1.89 0.04 0.00 0.00 0.00 0.00 55.97 58.66 1c3y s LYS 88 Cb -0.37 -4.17 0.06 0.00 0.00 0.00 0.00 37.83 33.35 1c3y s LYS 88 CO 0.33 -1.54 0.48 1.63 0.00 0.00 0.00 175.35 176.25 1c3y n LYS 89 N 8.05 0.60 0.31 1.78 4.76 -1.26 -4.98 118.16 127.42 1c3y n LYS 89 Ca 0.23 -1.66 0.20 0.00 -2.87 0.00 0.00 58.31 54.21 1c3y n LYS 89 Cb 0.45 -0.21 0.95 0.00 -1.84 0.00 0.00 35.03 34.38 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 -0.07 0.00 -5.06 4.39 3.04 -2.01 -3.43 116.42 113.28 1c3y h ASP 90 Ca -0.16 0.00 -0.15 0.00 -3.24 0.00 0.00 57.03 53.48 1c3y h ASP 90 Cb 0.69 0.00 -0.19 0.00 -1.04 0.00 0.00 39.33 38.78 1c3y h ASP 90 CO 0.21 0.00 -0.65 0.42 -2.04 0.00 0.00 179.24 177.18 1c3y s THR 91 N -3.90 0.14 -0.02 1.15 -4.23 -1.26 -5.07 115.64 102.44 1c3y s THR 91 Ca -0.02 -1.12 -0.25 0.00 -1.18 0.00 0.00 61.69 59.12 1c3y s THR 91 Cb 0.11 -0.66 -0.20 0.00 1.34 0.00 0.00 72.50 73.09 1c3y s THR 91 CO 0.47 -0.62 1.21 1.55 -0.54 0.00 0.00 174.62 176.70 1c3y h PRO 92 N 4.11 0.10 -0.04 3.99 0.13 -1.94 -3.10 132.00 135.26 1c3y h PRO 92 Ca -0.32 -0.07 0.01 0.00 -0.87 0.00 0.00 66.00 64.75 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 0.48 0.64 0.09 -0.56 -0.23 0.00 0.00 178.00 178.43 1c3y h GLN 93 N -0.42 0.00 0.23 0.86 3.07 -1.96 -2.50 115.11 114.38 1c3y h GLN 93 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 1c3y h GLN 93 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.20 1c3y h GLN 93 CO 0.01 0.00 -0.11 1.25 0.09 0.00 0.00 178.83 180.08 1c3y h HIS 94 N 0.00 -0.28 -1.02 0.06 2.76 -1.84 -3.23 115.15 111.61 1c3y h HIS 94 Ca 0.02 -0.01 0.30 0.00 -2.20 0.00 0.00 60.37 58.48 1c3y h HIS 94 Cb 0.21 0.09 -0.04 0.00 1.55 0.00 0.00 27.41 29.22 1c3y h HIS 94 CO 0.00 0.04 0.83 0.66 -1.30 0.00 0.00 177.93 178.16 1c3y h SER 95 N -0.98 0.00 -0.95 3.26 4.64 -1.39 0.12 113.55 118.25 1c3y h SER 95 Ca -0.03 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.40 1c3y h SER 95 Cb 0.44 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.46 1c3y h SER 95 CO 0.05 0.00 0.61 0.77 -0.87 0.00 0.00 176.83 177.39 1c3y h SER 96 N 0.00 0.86 0.35 4.97 4.64 -1.54 0.62 113.55 123.45 1c3y h SER 96 Ca 0.48 0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.82 1c3y h SER 96 Cb 2.14 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 64.08 1c3y h SER 96 CO -0.01 0.49 -0.19 0.00 -0.87 0.00 0.00 176.83 176.26 1c3y h ALA 97 N 1.54 -1.10 -0.30 5.18 0.00 -0.91 0.44 119.26 124.11 1c3y h ALA 97 Ca 0.45 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.27 1c3y h ALA 97 Cb 0.44 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1c3y h ALA 97 CO -0.21 -1.07 0.20 -0.44 0.00 0.00 0.00 179.25 177.73 1c3y h ASP 98 N -0.49 0.31 -0.03 0.00 3.32 -1.65 0.16 116.42 118.04 1c3y h ASP 98 Ca -0.05 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1c3y h ASP 98 Cb 0.38 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1c3y h ASP 98 CO 0.07 0.22 -0.02 0.15 -1.72 0.00 0.00 179.24 177.94 1c3y h PHE 99 N 0.36 0.15 -0.77 4.55 3.57 0.47 0.65 116.94 125.92 1c3y h PHE 99 Ca 0.12 -0.00 -0.42 0.00 3.53 0.00 0.00 57.97 61.20 1c3y h PHE 99 Cb 0.02 -0.05 -0.24 0.00 2.79 0.00 0.00 35.95 38.47 1c3y h PHE 99 CO -0.00 0.18 0.39 1.19 -2.23 0.00 0.00 178.31 177.84 1c3y n PHE 100 N -4.42 2.40 0.01 0.41 3.72 0.13 -4.43 117.46 115.28 1c3y n PHE 100 Ca -0.01 -1.86 0.00 0.00 -0.05 0.00 0.00 57.45 55.53 1c3y n PHE 100 Cb 0.16 -0.82 0.00 0.00 -0.94 0.00 0.00 39.48 37.88 1c3y n PHE 100 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1c3y n LYS 101 N -1.12 0.00 -0.02 -1.08 5.02 -0.53 -4.82 118.16 115.61 1c3y n LYS 101 Ca 0.51 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.69 1c3y n LYS 101 Cb 1.38 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 36.34 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 -0.41 0.16 0.00 0.00 -1.51 -1.77 -0.57 116.25 112.14 1c3y h VAL 103 Ca 0.10 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.56 1c3y h VAL 103 Cb 0.58 1.01 0.00 0.00 -2.13 0.00 0.00 31.29 30.75 1c3y h VAL 103 CO -0.41 0.00 -0.08 0.45 -1.23 0.00 0.00 177.57 176.30 1c3y h HIS 104 N 0.00 0.00 -0.25 5.19 -0.00 -0.84 -3.40 115.15 115.85 1c3y h HIS 104 Ca -0.00 0.00 0.05 0.00 -0.00 0.00 0.00 60.37 60.42 1c3y h HIS 104 Cb 0.01 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 27.37 1c3y h HIS 104 CO 0.00 0.00 -0.05 0.38 -0.00 0.00 0.00 177.93 178.26 1c3y h ASP 105 N -0.29 -0.20 -1.63 2.45 3.04 -0.19 -3.48 116.42 116.12 1c3y h ASP 105 Ca 0.00 0.07 0.12 0.00 -3.24 0.00 0.00 57.03 53.98 1c3y h ASP 105 Cb 0.08 0.14 -0.03 0.00 -1.04 0.00 0.00 39.33 38.48 1c3y h ASP 105 CO 0.00 -0.07 -0.16 -3.20 -2.04 0.00 0.00 179.24 173.78 1c3y n ASN 106 N -5.21 -6.58 -3.82 4.15 5.15 -0.23 -4.83 115.26 103.90 1c3y n ASN 106 Ca -0.01 0.47 -0.21 0.00 -0.60 0.00 0.00 54.58 54.22 1c3y n ASN 106 Cb 0.15 -1.31 -0.17 0.00 -0.53 0.00 0.00 39.78 37.91 1c3y n ASN 106 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1c3y s ARG 107 N -0.67 0.66 0.00 1.20 1.70 -1.26 -5.08 118.95 115.49 1c3y s ARG 107 Ca 0.00 0.03 0.30 0.00 -0.47 0.00 0.00 55.73 55.59 1c3y s ARG 107 Cb 0.00 -0.88 1.51 0.00 -0.57 0.00 0.00 34.95 35.01 1c3y s ARG 107 CO 0.00 -0.21 2.00 0.43 -1.08 0.00 0.00 175.30 176.44