#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 2.03 -0.22 2.62 2.01 -1.26 -5.09 115.64 115.74 1c3y s THR 2 Ca 0.00 -2.91 -0.29 0.00 0.31 0.00 0.00 61.69 58.80 1c3y s THR 2 Cb 0.00 -2.42 -0.02 0.00 0.01 0.00 0.00 72.50 70.07 1c3y s THR 2 CO 0.00 -0.83 1.45 -2.16 -0.69 0.00 0.00 174.62 172.39 1c3y s PRO 3 N 0.08 3.96 -0.49 4.92 0.04 -1.26 -4.90 135.00 137.36 1c3y s PRO 3 Ca 0.17 1.59 0.03 0.00 0.04 0.00 0.00 61.00 62.83 1c3y s PRO 3 Cb -0.25 -3.93 0.56 0.00 0.04 0.00 0.00 34.50 30.93 1c3y s PRO 3 CO -0.01 -1.07 1.84 -2.13 0.04 0.00 0.00 177.00 175.67 1c3y n ARG 4 N 7.28 2.41 -3.45 4.56 0.63 -1.26 -4.73 116.66 122.11 1c3y n ARG 4 Ca 0.16 -3.20 -0.28 0.00 -0.92 0.00 0.00 57.85 53.61 1c3y n ARG 4 Cb 0.45 -2.17 -0.11 0.00 0.45 0.00 0.00 32.46 31.09 1c3y n ARG 4 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 1c3y s GLU 5 N -3.48 0.79 -0.15 -0.14 0.41 -1.26 -5.07 118.70 109.81 1c3y s GLU 5 Ca 0.57 -1.79 -0.08 0.00 -0.41 0.00 0.00 54.97 53.27 1c3y s GLU 5 Cb 0.47 -1.44 0.05 0.00 -1.78 0.00 0.00 34.13 31.44 1c3y s GLU 5 CO 0.05 -1.30 0.36 0.21 -0.49 0.00 0.00 175.26 174.09 1c3y s LYS 6 N 0.49 0.33 0.00 1.61 2.47 -1.26 -4.98 119.74 118.40 1c3y s LYS 6 Ca 0.26 0.70 0.00 0.00 -1.56 0.00 0.00 55.97 55.37 1c3y s LYS 6 Cb -0.09 -0.05 0.00 0.00 -1.46 0.00 0.00 37.83 36.23 1c3y s LYS 6 CO -0.10 -0.16 0.00 1.28 0.16 0.00 0.00 175.35 176.53 1c3y n LEU 7 N 4.22 0.00 -2.65 5.43 4.77 -1.26 -4.77 117.00 122.75 1c3y n LEU 7 Ca -0.24 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.72 1c3y n LEU 7 Cb 0.55 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.61 1c3y n LEU 7 CO 0.10 0.00 -0.58 1.17 -1.33 0.00 0.00 177.39 176.75 1c3y n LYS 8 N 0.00 -4.00 -3.64 3.23 4.81 -1.26 -5.05 118.16 112.25 1c3y n LYS 8 Ca 0.00 3.10 -0.22 0.00 -0.87 0.00 0.00 58.31 60.32 1c3y n LYS 8 Cb 0.00 -5.23 -0.03 0.00 0.02 0.00 0.00 35.03 29.79 1c3y n LYS 8 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 1c3y s GLN 9 N -1.19 2.46 0.35 1.64 0.00 -1.26 -5.03 119.66 116.63 1c3y s GLN 9 Ca -0.13 -1.62 0.00 0.00 -0.00 0.00 0.00 55.36 53.60 1c3y s GLN 9 Cb 0.01 -2.31 0.00 0.00 0.00 0.00 0.00 33.01 30.71 1c3y s GLN 9 CO 0.79 -0.25 0.00 0.72 0.00 0.00 0.00 175.29 176.55 1c3y n HIS 10 N -1.55 -3.66 -0.91 9.60 8.25 -1.26 -4.34 115.22 121.34 1c3y n HIS 10 Ca 0.03 1.83 0.08 0.00 -0.26 0.00 0.00 57.72 59.39 1c3y n HIS 10 Cb 0.62 -3.32 0.34 0.00 1.12 0.00 0.00 29.99 28.75 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 -4.30 4.93 -4.55 0.41 2.88 -1.26 -4.89 113.62 106.84 1c3y n SER 11 Ca 0.01 -2.92 -0.20 0.00 -1.33 0.00 0.00 58.87 54.42 1c3y n SER 11 Cb 0.67 -0.62 -0.10 0.00 -0.75 0.00 0.00 64.21 63.41 1c3y n SER 11 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1c3y n ASP 12 N 0.21 1.95 0.00 -3.46 5.75 -1.26 -1.74 116.55 118.00 1c3y n ASP 12 Ca 0.25 -2.57 0.00 0.00 -0.01 0.00 0.00 54.79 52.46 1c3y n ASP 12 Cb 1.05 -1.71 0.00 0.00 -1.03 0.00 0.00 41.12 39.43 1c3y n ASP 12 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1c3y n ALA 13 N 17.75 0.00 0.23 2.12 0.00 -1.26 -4.96 120.51 134.40 1c3y n ALA 13 Ca 0.43 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.99 1c3y n ALA 13 Cb 0.47 0.00 0.31 0.00 0.00 0.00 0.00 19.45 20.23 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 0.06 0.00 3.64 -1.73 -1.40 116.57 117.14 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 0.89 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1c3y h LYS 15 CO 0.01 0.43 -0.04 0.00 -2.27 0.00 0.00 179.45 177.58 1c3y h ALA 16 N 1.57 -0.93 0.00 5.00 0.00 -1.89 -3.25 119.26 119.77 1c3y h ALA 16 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1c3y h ALA 16 Cb 1.14 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1c3y h ALA 16 CO 0.06 -0.92 -0.11 1.49 0.00 0.00 0.00 179.25 179.76 1c3y h GLU 17 N -0.10 0.00 -3.87 0.00 4.81 -1.72 -3.38 114.58 110.32 1c3y h GLU 17 Ca -0.01 0.00 -0.60 0.00 -0.13 0.00 0.00 59.36 58.63 1c3y h GLU 17 Cb 0.08 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.47 1c3y h GLU 17 CO 0.01 0.07 2.81 0.43 -0.73 0.00 0.00 179.01 181.60 1c3y n SER 18 N -4.74 4.40 -2.50 1.04 7.64 -0.53 -4.65 113.62 114.28 1c3y n SER 18 Ca -0.02 -2.61 -0.32 0.00 1.01 0.00 0.00 58.87 56.93 1c3y n SER 18 Cb 0.09 -1.30 0.03 0.00 -1.01 0.00 0.00 64.21 62.01 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 4.08 5.19 0.34 0.23 0.00 -1.23 -4.21 105.19 109.59 1c3y n GLY 19 Ca 0.53 -2.11 0.11 0.00 0.00 0.00 0.00 46.02 44.56 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 1.55 0.92 -1.59 1.61 3.04 -1.83 -3.48 116.25 116.48 1c3y h VAL 20 Ca 0.51 -0.12 0.02 0.00 -1.01 0.00 0.00 66.70 66.10 1c3y h VAL 20 Cb 0.53 0.55 -0.00 0.00 -2.01 0.00 0.00 31.29 30.36 1c3y h VAL 20 CO 1.28 0.06 -0.02 -1.54 -1.01 0.00 0.00 177.57 176.34 1c3y n SER 21 N -4.47 -4.72 -3.29 3.17 3.41 -1.26 -3.44 113.62 103.02 1c3y n SER 21 Ca 0.07 0.07 -0.38 0.00 -0.26 0.00 0.00 58.87 58.37 1c3y n SER 21 Cb 0.32 -0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 64.05 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 -1.64 3.97 0.03 4.33 1.02 -1.26 -4.17 120.64 122.92 1c3y n GLU 22 Ca 0.00 -2.69 0.00 0.00 -0.02 0.00 0.00 57.16 54.45 1c3y n GLU 22 Cb 0.03 -2.66 0.00 0.00 -0.02 0.00 0.00 31.44 28.78 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 2.62 0.00 0.08 3.49 4.07 -1.22 -4.66 120.64 125.02 1c3y n GLU 23 Ca 0.69 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.75 1c3y n GLU 23 Cb 0.28 -0.14 0.16 0.00 -0.06 0.00 0.00 31.44 31.69 1c3y n GLU 23 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1c3y h SER 24 N 0.00 0.27 -0.72 4.31 0.02 -1.73 -2.83 113.55 112.88 1c3y h SER 24 Ca 0.00 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 1c3y h SER 24 Cb 0.00 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.43 1c3y h SER 24 CO 0.00 0.74 0.45 -0.07 -1.14 0.00 0.00 176.83 176.82 1c3y h LEU 25 N 0.20 0.85 -0.87 5.07 3.38 -1.85 -2.03 115.31 120.06 1c3y h LEU 25 Ca 0.01 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1c3y h LEU 25 Cb 0.98 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1c3y h LEU 25 CO 0.08 0.64 -0.04 0.78 0.09 0.00 0.00 178.44 179.99 1c3y h ASN 26 N 0.98 0.77 0.02 -0.43 -0.26 -1.80 -2.14 115.58 112.72 1c3y h ASN 26 Ca 0.26 -0.20 -0.00 0.00 -0.56 0.00 0.00 56.30 55.80 1c3y h ASN 26 Cb -0.07 -0.21 -0.00 0.00 -1.06 0.00 0.00 38.32 36.99 1c3y h ASN 26 CO -0.05 0.86 -0.01 0.11 -1.06 0.00 0.00 177.43 177.28 1c3y h LYS 27 N 0.73 0.00 0.00 0.81 1.57 -1.13 -0.89 116.57 117.65 1c3y h LYS 27 Ca 0.14 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1c3y h LYS 27 Cb 0.50 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 1c3y h LYS 27 CO 0.03 0.01 -0.04 0.28 -0.57 0.00 0.00 179.45 179.16 1c3y h VAL 28 N 0.00 1.01 -0.44 0.50 2.07 -0.98 -1.38 116.25 117.03 1c3y h VAL 28 Ca -0.00 -0.14 0.10 0.00 0.82 0.00 0.00 66.70 67.48 1c3y h VAL 28 Cb 0.02 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1c3y h VAL 28 CO 0.00 0.04 0.30 0.03 0.02 0.00 0.00 177.57 177.96 1c3y h ARG 29 N 0.00 0.16 -5.71 1.57 2.47 -1.27 -3.39 114.38 108.21 1c3y h ARG 29 Ca -0.00 -0.01 -0.59 0.00 -1.26 0.00 0.00 59.98 58.12 1c3y h ARG 29 Cb 0.07 -0.04 -0.09 0.00 -1.65 0.00 0.00 29.97 28.27 1c3y h ARG 29 CO 0.01 0.11 0.07 -0.80 0.56 0.00 0.00 179.97 179.91 1c3y s ASN 30 N -6.43 6.71 -1.20 7.04 0.01 -0.52 -4.98 114.94 115.58 1c3y s ASN 30 Ca -0.06 0.86 -0.21 0.00 -0.71 0.00 0.00 52.86 52.74 1c3y s ASN 30 Cb 0.19 -2.34 0.00 0.00 0.41 0.00 0.00 41.25 39.51 1c3y s ASN 30 CO 0.72 -0.21 1.79 -0.60 -1.51 0.00 0.00 177.10 177.30 1c3y s ARG 31 N 1.59 3.31 0.00 -0.60 3.52 -1.26 -4.42 118.95 121.09 1c3y s ARG 31 Ca 0.29 -1.49 0.00 0.00 -0.13 0.00 0.00 55.73 54.40 1c3y s ARG 31 Cb -0.16 -5.38 0.00 0.00 -1.56 0.00 0.00 34.95 27.85 1c3y s ARG 31 CO 0.11 -2.96 0.00 0.39 -0.81 0.00 0.00 175.30 172.03 1c3y n GLU 32 N 8.44 0.00 0.00 5.12 1.02 -1.26 -5.18 120.64 128.78 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 -1.52 0.00 -3.73 3.49 2.13 -1.26 -5.18 120.64 114.57 1c3y n GLU 33 Ca 0.00 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.68 1c3y n GLU 33 Cb 0.00 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 31.62 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 -2.00 0.04 -0.45 6.31 1.01 -1.26 -4.96 120.40 119.10 1c3y s VAL 34 Ca 0.00 -0.33 0.07 0.00 0.00 0.00 0.00 61.98 61.72 1c3y s VAL 34 Cb 0.00 -0.64 0.24 0.00 0.00 0.00 0.00 36.38 35.97 1c3y s VAL 34 CO 0.00 -0.18 0.69 -0.90 0.00 0.00 0.00 175.10 174.71 1c3y n ASP 35 N 1.56 -1.57 -3.92 3.32 5.75 -1.26 -5.12 116.55 115.32 1c3y n ASP 35 Ca -0.20 -2.97 -0.19 0.00 -0.01 0.00 0.00 54.79 51.42 1c3y n ASP 35 Cb 0.56 0.69 -0.16 0.00 -1.03 0.00 0.00 41.12 41.18 1c3y n ASP 35 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1c3y s ASP 36 N -1.19 0.86 0.06 -1.12 1.11 -1.26 -5.05 116.67 110.09 1c3y s ASP 36 Ca 0.33 -0.12 -0.16 0.00 0.18 0.00 0.00 52.55 52.77 1c3y s ASP 36 Cb 0.18 -0.33 -0.16 0.00 1.07 0.00 0.00 42.92 43.68 1c3y s ASP 36 CO -0.18 -0.01 1.28 1.55 1.18 0.00 0.00 175.17 178.99 1c3y h PRO 37 N 6.79 0.60 -0.88 8.23 0.13 -2.00 -3.20 132.00 141.67 1c3y h PRO 37 Ca -0.36 -0.45 0.17 0.00 -0.87 0.00 0.00 66.00 64.49 1c3y h PRO 37 Cb 1.16 0.08 -0.07 0.00 0.13 0.00 0.00 31.00 32.30 1c3y h PRO 37 CO 0.48 1.07 0.57 0.87 -0.23 0.00 0.00 178.00 180.77 1c3y h LYS 38 N 0.25 0.55 0.17 0.86 1.57 -1.93 0.41 116.57 118.46 1c3y h LYS 38 Ca -0.02 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1c3y h LYS 38 Cb 1.13 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.32 1c3y h LYS 38 CO 0.11 0.36 -0.08 1.25 -0.57 0.00 0.00 179.45 180.51 1c3y h LEU 39 N 0.56 -0.20 -0.69 2.94 6.46 -1.91 0.21 115.31 122.69 1c3y h LEU 39 Ca 0.45 -0.19 -0.05 0.00 -0.12 0.00 0.00 57.88 57.97 1c3y h LEU 39 Cb 0.90 0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.85 1c3y h LEU 39 CO -0.20 0.09 0.23 0.11 -0.62 0.00 0.00 178.44 178.04 1c3y h LYS 40 N -0.49 1.06 -0.02 1.25 1.57 -1.33 -2.59 116.57 116.03 1c3y h LYS 40 Ca -0.02 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1c3y h LYS 40 Cb 0.38 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 1c3y h LYS 40 CO 0.04 0.91 0.01 0.93 -0.57 0.00 0.00 179.45 180.77 1c3y h GLU 41 N 1.00 0.02 -0.51 3.15 5.08 -0.15 -2.73 114.58 120.45 1c3y h GLU 41 Ca 0.22 -0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.68 1c3y h GLU 41 Cb 0.29 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.45 1c3y h GLU 41 CO -0.01 0.18 0.01 1.25 -1.00 0.00 0.00 179.01 179.44 1c3y h HIS 42 N -0.13 -0.01 -0.06 4.33 2.76 -0.45 -1.42 115.15 120.15 1c3y h HIS 42 Ca 0.01 0.04 0.03 0.00 -2.20 0.00 0.00 60.37 58.25 1c3y h HIS 42 Cb 0.16 0.08 -0.04 0.00 1.55 0.00 0.00 27.41 29.17 1c3y h HIS 42 CO -0.02 -0.11 -0.16 0.00 -1.30 0.00 0.00 177.93 176.34 1c3y h ALA 43 N 1.45 -0.14 -0.29 5.26 0.00 -1.38 -1.52 119.26 122.64 1c3y h ALA 43 Ca 0.26 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.26 1c3y h ALA 43 Cb 0.39 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1c3y h ALA 43 CO -0.42 -0.63 0.20 0.35 0.00 0.00 0.00 179.25 178.75 1c3y h PHE 44 N -0.23 0.06 -0.23 0.00 3.57 -1.08 0.65 116.94 119.68 1c3y h PHE 44 Ca 0.07 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 1c3y h PHE 44 Cb 0.33 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1c3y h PHE 44 CO -0.24 0.03 -0.05 0.00 -2.23 0.00 0.00 178.31 175.82 1c3y n ILE 46 N -4.30 1.52 -0.07 0.00 -0.00 -0.18 -3.49 119.36 112.84 1c3y n ILE 46 Ca 0.00 -0.79 -0.10 0.00 -0.00 0.00 0.00 62.75 61.87 1c3y n ILE 46 Cb 0.24 -0.89 -0.03 0.00 -0.00 0.00 0.00 39.64 38.96 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 0.01 0.29 -0.68 1.39 -0.00 0.42 0.85 115.31 117.58 1c3y h LEU 47 Ca -0.43 -0.02 -0.10 0.00 -0.00 0.00 0.00 57.88 57.32 1c3y h LEU 47 Cb 2.10 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 42.67 1c3y h LEU 47 CO 0.04 0.23 -0.07 0.50 -0.00 0.00 0.00 178.44 179.14 1c3y h LYS 48 N 0.34 0.95 -0.38 1.13 3.64 -1.27 -2.67 116.57 118.31 1c3y h LYS 48 Ca 0.09 -0.32 -0.14 0.00 -1.27 0.00 0.00 60.65 59.02 1c3y h LYS 48 Cb -0.02 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 1c3y h LYS 48 CO -0.02 0.98 -0.30 0.00 -2.27 0.00 0.00 179.45 177.84 1c3y h ARG 49 N 0.86 0.87 -0.01 1.90 2.47 -1.49 -2.84 114.38 116.13 1c3y h ARG 49 Ca 0.15 -0.43 0.00 0.00 -1.26 0.00 0.00 59.98 58.44 1c3y h ARG 49 Cb 0.60 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.92 1c3y h ARG 49 CO 0.04 1.08 0.01 0.00 0.56 0.00 0.00 179.97 181.66 1c3y h ALA 50 N 0.77 1.70 0.00 0.04 0.00 0.87 -3.46 119.26 119.19 1c3y h ALA 50 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1c3y h ALA 50 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1c3y h ALA 50 CO 0.08 -0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.72 1c3y n GLY 51 N -1.40 0.57 0.37 0.00 0.00 -1.03 -4.95 105.19 98.75 1c3y n GLY 51 Ca -0.03 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.04 1c3y n GLY 51 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1c3y h PHE 52 N 0.00 1.10 -4.18 1.61 0.04 -1.76 -3.41 116.94 110.34 1c3y h PHE 52 Ca 0.00 0.03 -0.53 0.00 2.80 0.00 0.00 57.97 60.27 1c3y h PHE 52 Cb 0.00 -0.36 -0.30 0.00 2.20 0.00 0.00 35.95 37.49 1c3y h PHE 52 CO 0.00 0.53 -0.83 -1.50 -0.60 0.00 0.00 178.31 175.91 1c3y s ILE 53 N -5.94 1.29 0.48 -0.55 2.07 -1.18 -3.34 121.20 114.04 1c3y s ILE 53 Ca -0.12 -0.69 0.01 0.00 -1.41 0.00 0.00 60.65 58.44 1c3y s ILE 53 Cb 0.21 -1.09 0.01 0.00 0.13 0.00 0.00 42.46 41.72 1c3y s ILE 53 CO 0.81 0.37 0.70 1.51 -1.91 0.00 0.00 174.94 176.42 1c3y s ASP 54 N -0.27 5.67 0.65 4.50 -4.77 -1.24 -4.18 116.67 117.03 1c3y s ASP 54 Ca 0.04 0.20 0.31 0.00 -3.30 0.00 0.00 52.55 49.80 1c3y s ASP 54 Cb -0.07 -1.34 1.66 0.00 -1.09 0.00 0.00 42.92 42.07 1c3y s ASP 54 CO -0.00 -0.83 1.96 0.00 0.70 0.00 0.00 175.17 177.00 1c3y h ALA 55 N 0.30 1.50 -0.31 2.11 0.00 -1.94 0.89 119.26 121.80 1c3y h ALA 55 Ca -0.45 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1c3y h ALA 55 Cb 1.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1c3y h ALA 55 CO 0.56 -0.37 0.02 0.45 0.00 0.00 0.00 179.25 179.90 1c3y n SER 56 N -3.12 3.46 -1.73 0.00 2.88 -1.26 -4.87 113.62 108.99 1c3y n SER 56 Ca -0.00 -2.50 -0.16 0.00 -1.33 0.00 0.00 58.87 54.88 1c3y n SER 56 Cb 0.41 -0.60 -0.05 0.00 -0.75 0.00 0.00 64.21 63.21 1c3y n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1c3y n GLY 57 N 0.29 0.98 3.56 0.46 0.00 0.31 -4.89 105.19 105.90 1c3y n GLY 57 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.82 3.41 0.38 1.61 2.56 -1.25 -4.82 118.70 116.76 1c3y s GLU 58 Ca 0.00 0.02 -0.27 0.00 0.00 0.00 0.00 54.97 54.73 1c3y s GLU 58 Cb 0.00 -4.06 -0.09 0.00 2.00 0.00 0.00 34.13 31.98 1c3y s GLU 58 CO 0.00 -1.73 1.26 -0.59 -0.56 0.00 0.00 175.26 173.64 1c3y s PHE 59 N 4.87 2.98 -0.54 5.30 -0.12 -1.26 -3.60 117.98 125.60 1c3y s PHE 59 Ca 0.38 1.46 0.04 0.00 -0.05 0.00 0.00 56.93 58.76 1c3y s PHE 59 Cb -0.09 -3.59 0.15 0.00 -0.63 0.00 0.00 43.02 38.86 1c3y s PHE 59 CO 0.22 -1.77 0.35 -0.65 -0.05 0.00 0.00 175.22 173.31 1c3y s GLN 60 N -2.09 1.71 0.13 1.99 -1.52 -1.21 -4.94 119.66 113.73 1c3y s GLN 60 Ca 0.54 -2.57 -0.07 0.00 -1.95 0.00 0.00 55.36 51.31 1c3y s GLN 60 Cb -0.36 -2.68 -0.09 0.00 -0.22 0.00 0.00 33.01 29.66 1c3y s GLN 60 CO 0.47 -1.24 1.32 -0.07 -0.25 0.00 0.00 175.29 175.53 1c3y h LEU 61 N 6.05 0.68 -1.94 2.90 3.38 -1.94 -3.07 115.31 121.37 1c3y h LEU 61 Ca 0.08 -0.49 0.22 0.00 0.09 0.00 0.00 57.88 57.79 1c3y h LEU 61 Cb 0.86 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 1c3y h LEU 61 CO 0.57 1.28 0.63 -0.78 0.09 0.00 0.00 178.44 180.23 1c3y h ASP 62 N 0.35 0.00 0.41 -0.43 3.58 -1.99 0.56 116.42 118.89 1c3y h ASP 62 Ca -0.07 0.00 -0.31 0.00 0.42 0.00 0.00 57.03 57.07 1c3y h ASP 62 Cb 1.48 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.50 1c3y h ASP 62 CO 0.16 0.00 -1.69 0.45 -2.88 0.00 0.00 179.24 175.27 1c3y h HIS 63 N 0.00 0.27 0.36 0.28 3.86 -1.96 -3.25 115.15 114.70 1c3y h HIS 63 Ca 0.37 -0.20 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 1c3y h HIS 63 Cb 1.63 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 30.09 1c3y h HIS 63 CO 0.00 1.33 -0.17 0.82 0.86 0.00 0.00 177.93 180.77 1c3y h ILE 64 N 0.04 0.44 -0.74 2.45 2.04 -0.28 -2.82 117.51 118.65 1c3y h ILE 64 Ca -0.30 -0.69 0.14 0.00 1.00 0.00 0.00 64.86 65.01 1c3y h ILE 64 Cb 2.01 0.68 -0.09 0.00 -0.74 0.00 0.00 36.82 38.68 1c3y h ILE 64 CO 0.11 0.09 0.28 0.07 0.00 0.00 0.00 178.15 178.71 1c3y h LYS 65 N -0.97 0.42 -0.90 2.37 2.10 -0.30 0.61 116.57 119.90 1c3y h LYS 65 Ca -0.05 -0.03 0.04 0.00 -2.00 0.00 0.00 60.65 58.62 1c3y h LYS 65 Cb 0.52 -0.09 -0.05 0.00 -0.90 0.00 0.00 32.23 31.71 1c3y h LYS 65 CO 0.08 0.28 0.59 1.15 -2.00 0.00 0.00 179.45 179.55 1c3y h THR 66 N 0.43 1.13 0.11 0.07 2.02 -1.62 0.25 112.91 115.31 1c3y h THR 66 Ca 0.40 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 1c3y h THR 66 Cb 0.60 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1c3y h THR 66 CO -0.40 0.20 -0.05 0.11 0.37 0.00 0.00 175.52 175.75 1c3y h LYS 67 N 1.11 -0.14 0.00 6.66 1.79 -0.65 -1.35 116.57 123.99 1c3y h LYS 67 Ca 0.36 0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.82 1c3y h LYS 67 Cb 0.06 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1c3y h LYS 67 CO -0.12 0.13 -0.13 0.74 -1.08 0.00 0.00 179.45 179.00 1c3y h PHE 68 N -0.40 0.00 0.10 -1.35 -1.00 -0.88 -3.26 116.94 110.16 1c3y h PHE 68 Ca -0.01 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.76 1c3y h PHE 68 Cb 0.33 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.89 1c3y h PHE 68 CO 0.01 0.13 -0.05 0.87 -1.61 0.00 0.00 178.31 177.66 1c3y h LYS 69 N 0.00 -0.13 -5.38 1.51 1.79 -0.23 -3.39 116.57 110.74 1c3y h LYS 69 Ca -0.00 0.01 -0.48 0.00 -2.18 0.00 0.00 60.65 58.00 1c3y h LYS 69 Cb 0.41 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 31.06 1c3y h LYS 69 CO 0.02 -0.09 1.68 -0.85 -1.08 0.00 0.00 179.45 179.13 1c3y n GLU 70 N -2.96 0.63 -2.44 3.15 -0.00 -0.53 -3.89 120.64 114.59 1c3y n GLU 70 Ca -0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 57.16 57.13 1c3y n GLU 70 Cb 0.05 -2.66 -0.02 0.00 -0.00 0.00 0.00 31.44 28.82 1c3y n GLU 70 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1c3y n ASN 71 N 13.63 -5.92 -2.50 -1.84 5.15 -1.26 -4.94 115.26 117.58 1c3y n ASN 71 Ca 0.49 1.63 -0.02 0.00 -0.60 0.00 0.00 54.58 56.07 1c3y n ASN 71 Cb 0.33 -4.87 0.11 0.00 -0.53 0.00 0.00 39.78 34.82 1c3y n ASN 71 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1c3y n SER 72 N 1.86 -1.28 0.00 1.20 7.64 -1.25 -4.90 113.62 116.88 1c3y n SER 72 Ca -0.14 -2.05 0.00 0.00 1.01 0.00 0.00 58.87 57.69 1c3y n SER 72 Cb 0.21 0.62 0.00 0.00 -1.01 0.00 0.00 64.21 64.03 1c3y n SER 72 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1c3y n GLU 73 N -1.23 0.00 -2.98 1.43 1.02 -1.26 -3.62 120.64 113.99 1c3y n GLU 73 Ca -0.14 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.86 1c3y n GLU 73 Cb 0.82 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 32.26 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 0.00 -1.16 -2.61 -0.32 8.25 -1.26 -5.13 115.22 113.00 1c3y n HIS 74 Ca 0.00 -3.07 -0.41 0.00 -0.26 0.00 0.00 57.72 53.99 1c3y n HIS 74 Cb 0.00 0.49 -0.05 0.00 1.12 0.00 0.00 29.99 31.55 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 -1.25 4.70 0.00 -0.41 0.04 -1.24 -4.71 135.00 132.13 1c3y s PRO 75 Ca 0.32 1.63 0.00 0.00 0.04 0.00 0.00 61.00 62.99 1c3y s PRO 75 Cb 0.32 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.59 1c3y s PRO 75 CO -0.07 0.26 0.00 -0.85 0.04 0.00 0.00 177.00 176.38 1c3y n GLU 76 N 1.88 0.00 -0.16 4.56 0.28 -1.26 -4.96 120.64 120.98 1c3y n GLU 76 Ca 0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.16 57.11 1c3y n GLU 76 Cb 0.46 0.00 0.19 0.00 1.43 0.00 0.00 31.44 33.52 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 -0.39 2.34 0.22 3.44 5.02 -1.26 -4.40 118.16 123.14 1c3y n LYS 77 Ca 0.00 -2.15 0.06 0.00 -2.02 0.00 0.00 58.31 54.20 1c3y n LYS 77 Cb 0.00 -1.46 0.56 0.00 -0.02 0.00 0.00 35.03 34.11 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 4.04 1.07 0.10 -0.18 2.07 -1.93 -1.91 116.25 119.50 1c3y h VAL 78 Ca 0.00 -0.30 0.02 0.00 0.82 0.00 0.00 66.70 67.24 1c3y h VAL 78 Cb 0.91 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.74 1c3y h VAL 78 CO 0.00 0.09 -0.50 -2.24 0.02 0.00 0.00 177.57 174.94 1c3y h ASP 79 N 0.05 -1.52 0.37 0.57 2.03 -1.92 0.89 116.42 116.90 1c3y h ASP 79 Ca 0.01 0.16 -0.11 0.00 -0.73 0.00 0.00 57.03 56.37 1c3y h ASP 79 Cb 0.14 0.57 -0.01 0.00 -0.83 0.00 0.00 39.33 39.20 1c3y h ASP 79 CO 0.01 -0.54 -0.46 -0.78 -1.03 0.00 0.00 179.24 176.44 1c3y h ASP 80 N -0.72 0.12 -0.24 4.15 3.58 -1.86 -2.93 116.42 118.52 1c3y h ASP 80 Ca 0.01 -0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.39 1c3y h ASP 80 Cb 0.74 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.75 1c3y h ASP 80 CO -0.29 0.57 0.10 0.25 -2.88 0.00 0.00 179.24 176.99 1c3y h LEU 81 N 0.09 0.32 -1.03 2.28 6.46 -0.48 -2.13 115.31 120.82 1c3y h LEU 81 Ca 0.00 -0.15 -0.00 0.00 -0.12 0.00 0.00 57.88 57.62 1c3y h LEU 81 Cb 0.85 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.66 1c3y h LEU 81 CO 0.07 0.38 0.55 0.58 -0.62 0.00 0.00 178.44 179.39 1c3y h VAL 82 N 0.24 1.24 0.73 1.05 2.07 0.86 0.41 116.25 122.86 1c3y h VAL 82 Ca 0.08 -0.52 -0.04 0.00 0.82 0.00 0.00 66.70 67.05 1c3y h VAL 82 Cb 0.15 -0.03 0.01 0.00 -1.52 0.00 0.00 31.29 29.90 1c3y h VAL 82 CO -0.01 0.25 -0.35 0.00 0.02 0.00 0.00 177.57 177.48 1c3y h ALA 83 N 1.37 -0.98 0.00 1.67 0.00 -1.32 0.88 119.26 120.88 1c3y h ALA 83 Ca 0.32 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1c3y h ALA 83 Cb -0.07 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1c3y h ALA 83 CO -0.06 -1.03 -0.09 -0.22 0.00 0.00 0.00 179.25 177.85 1c3y h LYS 84 N -1.02 0.00 0.00 0.00 3.64 -1.27 -3.06 116.57 114.86 1c3y h LYS 84 Ca -0.10 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.08 1c3y h LYS 84 Cb 0.76 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.55 1c3y h LYS 84 CO 0.16 0.09 -1.08 0.00 -2.27 0.00 0.00 179.45 176.36 1c3y n ALA 86 N -3.30 4.24 -1.76 0.00 0.00 0.30 -4.43 120.51 115.56 1c3y n ALA 86 Ca -0.29 -1.10 -0.39 0.00 0.00 0.00 0.00 53.44 51.66 1c3y n ALA 86 Cb 0.65 -1.22 0.03 0.00 0.00 0.00 0.00 19.45 18.91 1c3y n ALA 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1c3y s VAL 87 N -1.42 2.05 0.06 0.00 0.11 -1.16 -4.92 120.40 115.13 1c3y s VAL 87 Ca 0.21 0.04 -0.31 0.00 -2.93 0.00 0.00 61.98 59.00 1c3y s VAL 87 Cb 0.17 -3.02 -0.07 0.00 -1.53 0.00 0.00 36.38 31.93 1c3y s VAL 87 CO 0.02 0.00 1.35 -1.59 -3.33 0.00 0.00 175.10 171.55 1c3y s LYS 88 N -2.62 4.33 0.32 1.54 -2.85 -1.26 -4.86 119.74 114.35 1c3y s LYS 88 Ca 0.65 1.97 0.03 0.00 -1.00 0.00 0.00 55.97 57.62 1c3y s LYS 88 Cb -0.43 -3.38 0.03 0.00 -2.06 0.00 0.00 37.83 31.98 1c3y s LYS 88 CO 0.54 -0.45 0.21 1.63 0.10 0.00 0.00 175.35 177.38 1c3y n LYS 89 N 4.45 1.05 0.31 1.78 4.01 -1.26 -5.00 118.16 123.49 1c3y n LYS 89 Ca 0.12 -2.05 0.20 0.00 -0.51 0.00 0.00 58.31 56.06 1c3y n LYS 89 Cb 0.44 0.27 0.97 0.00 -0.51 0.00 0.00 35.03 36.19 1c3y n LYS 89 CO 0.00 0.00 0.00 0.38 -1.11 0.00 0.00 177.40 176.67 1c3y h ASP 90 N 0.43 0.00 -5.02 4.39 3.04 -2.02 -3.43 116.42 113.81 1c3y h ASP 90 Ca -0.21 0.00 -0.13 0.00 -3.24 0.00 0.00 57.03 53.44 1c3y h ASP 90 Cb 0.75 0.00 -0.19 0.00 -1.04 0.00 0.00 39.33 38.85 1c3y h ASP 90 CO 0.34 0.01 -0.49 0.42 -2.04 0.00 0.00 179.24 177.48 1c3y s THR 91 N -3.97 0.10 0.00 1.15 -4.23 -1.26 -5.07 115.64 102.36 1c3y s THR 91 Ca -0.02 -0.83 -0.23 0.00 -1.18 0.00 0.00 61.69 59.42 1c3y s THR 91 Cb 0.11 -0.62 -0.18 0.00 1.34 0.00 0.00 72.50 73.15 1c3y s THR 91 CO 0.48 -0.46 1.26 1.55 -0.54 0.00 0.00 174.62 176.91 1c3y h PRO 92 N 3.99 0.20 -0.05 3.99 0.13 -1.88 -3.08 132.00 135.31 1c3y h PRO 92 Ca -0.31 -0.12 0.01 0.00 -0.87 0.00 0.00 66.00 64.71 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 0.44 0.68 0.14 -0.56 -0.23 0.00 0.00 178.00 178.48 1c3y h GLN 93 N -0.27 0.00 0.22 0.86 3.07 -1.96 -2.39 115.11 114.63 1c3y h GLN 93 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.74 1c3y h GLN 93 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.23 1c3y h GLN 93 CO 0.02 0.00 -0.11 1.25 0.09 0.00 0.00 178.83 180.09 1c3y h HIS 94 N 0.00 -0.28 -1.00 0.06 2.76 -1.84 -3.23 115.15 111.62 1c3y h HIS 94 Ca 0.02 -0.01 0.29 0.00 -2.20 0.00 0.00 60.37 58.48 1c3y h HIS 94 Cb 0.30 0.09 -0.04 0.00 1.55 0.00 0.00 27.41 29.31 1c3y h HIS 94 CO 0.00 0.03 0.82 0.66 -1.30 0.00 0.00 177.93 178.14 1c3y h SER 95 N -0.99 0.00 -1.00 3.26 4.64 -1.40 0.11 113.55 118.16 1c3y h SER 95 Ca -0.03 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.41 1c3y h SER 95 Cb 0.43 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.43 1c3y h SER 95 CO 0.05 0.00 0.63 -1.28 -0.87 0.00 0.00 176.83 175.36 1c3y h SER 96 N 0.00 0.94 0.33 4.97 0.87 -1.53 0.63 113.55 119.76 1c3y h SER 96 Ca 0.48 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 61.07 1c3y h SER 96 Cb 2.11 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 63.93 1c3y h SER 96 CO -0.01 0.51 -0.20 0.00 -0.53 0.00 0.00 176.83 176.60 1c3y h ALA 97 N 1.53 -1.06 -0.14 6.23 0.00 -0.93 0.22 119.26 125.11 1c3y h ALA 97 Ca 0.49 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.30 1c3y h ALA 97 Cb 0.46 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1c3y h ALA 97 CO -0.26 -1.04 0.08 -0.44 0.00 0.00 0.00 179.25 177.60 1c3y h ASP 98 N -0.50 0.16 0.05 0.00 3.32 -1.65 -0.41 116.42 117.40 1c3y h ASP 98 Ca -0.04 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.94 1c3y h ASP 98 Cb 0.40 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 1c3y h ASP 98 CO 0.04 0.13 -0.17 0.15 -1.72 0.00 0.00 179.24 177.67 1c3y h PHE 99 N 0.19 0.25 -0.81 4.55 3.57 0.58 0.84 116.94 126.11 1c3y h PHE 99 Ca 0.05 -0.03 -0.50 0.00 3.53 0.00 0.00 57.97 61.02 1c3y h PHE 99 Cb -0.01 -0.07 -0.27 0.00 2.79 0.00 0.00 35.95 38.40 1c3y h PHE 99 CO 0.00 0.40 0.35 0.34 -2.23 0.00 0.00 178.31 177.17 1c3y n PHE 100 N -4.24 2.61 0.01 0.41 7.35 0.73 -4.45 117.46 119.88 1c3y n PHE 100 Ca -0.01 -2.23 0.00 0.00 -0.76 0.00 0.00 57.45 54.45 1c3y n PHE 100 Cb 0.30 -0.93 0.00 0.00 0.35 0.00 0.00 39.48 39.20 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 -1.01 0.00 -0.24 -4.13 5.02 -0.95 -4.89 118.16 111.96 1c3y n LYS 101 Ca 0.52 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.85 1c3y n LYS 101 Cb 1.10 0.00 0.14 0.00 -0.02 0.00 0.00 35.03 36.25 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 0.74 0.00 0.00 -1.51 -1.78 -3.25 116.25 110.59 1c3y h VAL 103 Ca 0.38 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 65.70 1c3y h VAL 103 Cb 0.66 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 30.91 1c3y h VAL 103 CO -0.59 0.04 -0.06 0.45 -1.23 0.00 0.00 177.57 176.18 1c3y h HIS 104 N 0.00 0.00 -0.81 5.19 -0.00 0.17 -3.41 115.15 116.29 1c3y h HIS 104 Ca -0.00 0.00 -0.60 0.00 -0.00 0.00 0.00 60.37 59.77 1c3y h HIS 104 Cb 0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 27.42 1c3y h HIS 104 CO 0.00 0.00 1.90 0.16 -0.00 0.00 0.00 177.93 179.99 1c3y s ASP 105 N -3.80 6.45 0.41 2.45 -4.77 0.13 -4.95 116.67 112.58 1c3y s ASP 105 Ca -0.02 -2.17 -0.02 0.00 -3.30 0.00 0.00 52.55 47.05 1c3y s ASP 105 Cb 0.00 -2.58 -0.03 0.00 -1.09 0.00 0.00 42.92 39.22 1c3y s ASP 105 CO 0.02 -1.58 0.64 0.20 0.70 0.00 0.00 175.17 175.16 1c3y s ASN 106 N 4.79 6.23 -0.23 2.11 0.02 -1.24 -4.72 114.94 121.90 1c3y s ASN 106 Ca 0.56 0.60 -0.01 0.00 -1.02 0.00 0.00 52.86 52.99 1c3y s ASN 106 Cb 0.03 -2.06 0.02 0.00 0.02 0.00 0.00 41.25 39.26 1c3y s ASN 106 CO 0.07 -0.44 -0.09 -0.13 0.02 0.00 0.00 177.10 176.53 1c3y s ARG 107 N -4.49 2.95 0.00 -0.60 0.52 -1.26 -5.17 118.95 110.90 1c3y s ARG 107 Ca 0.43 -0.89 0.30 0.00 -0.52 0.00 0.00 55.73 55.06 1c3y s ARG 107 Cb -0.10 -2.89 1.58 0.00 0.52 0.00 0.00 34.95 34.05 1c3y s ARG 107 CO 0.39 -0.32 2.04 0.43 0.02 0.00 0.00 175.30 177.86