#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c3y n THR 2 N 0.00 -6.79 -0.03 6.31 -2.24 -1.26 -4.93 114.28 105.34 1c3y n THR 2 Ca 0.00 0.27 -0.16 0.00 -2.27 0.00 0.00 64.05 61.89 1c3y n THR 2 Cb 0.00 -5.01 -0.08 0.00 -2.10 0.00 0.00 70.33 63.14 1c3y n THR 2 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1c3y h PRO 3 N 1.44 0.51 -0.01 -0.78 0.13 -2.04 -3.33 132.00 127.92 1c3y h PRO 3 Ca -0.34 -0.40 -0.01 0.00 -0.87 0.00 0.00 66.00 64.38 1c3y h PRO 3 Cb 1.24 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1c3y h PRO 3 CO 0.25 1.03 -0.03 -0.09 -0.23 0.00 0.00 178.00 178.93 1c3y h ARG 4 N 0.12 0.04 -3.51 0.86 2.43 -1.99 -3.49 114.38 108.84 1c3y h ARG 4 Ca -0.03 -0.03 0.34 0.00 -0.81 0.00 0.00 59.98 59.46 1c3y h ARG 4 Cb 1.10 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 30.46 1c3y h ARG 4 CO 0.10 0.61 -1.28 -1.91 -1.51 0.00 0.00 179.97 175.98 1c3y n GLU 5 N -4.77 -3.36 -0.04 0.20 2.13 -1.25 -4.75 120.64 108.79 1c3y n GLU 5 Ca -0.09 2.76 -0.12 0.00 0.66 0.00 0.00 57.16 60.37 1c3y n GLU 5 Cb 0.31 -3.91 -0.10 0.00 0.27 0.00 0.00 31.44 28.01 1c3y n GLU 5 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1c3y h LYS 6 N -1.38 -0.03 -6.62 5.31 1.57 -1.96 -3.45 116.57 110.01 1c3y h LYS 6 Ca -0.20 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.07 1c3y h LYS 6 Cb 1.37 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.68 1c3y h LYS 6 CO 0.08 0.70 0.42 -1.17 -0.57 0.00 0.00 179.45 178.91 1c3y s LEU 7 N -8.51 4.50 -0.72 2.94 1.98 -1.26 -4.95 118.68 112.66 1c3y s LEU 7 Ca -0.15 1.95 -0.26 0.00 -2.89 0.00 0.00 54.13 52.78 1c3y s LEU 7 Cb -0.02 -3.60 -0.01 0.00 0.66 0.00 0.00 46.19 43.23 1c3y s LEU 7 CO 0.58 -0.14 1.73 -0.54 -1.89 0.00 0.00 176.35 176.09 1c3y s LYS 8 N -0.22 2.79 -0.30 1.98 -0.14 -1.26 -4.85 119.74 117.74 1c3y s LYS 8 Ca 0.48 0.16 -0.17 0.00 -1.36 0.00 0.00 55.97 55.08 1c3y s LYS 8 Cb -0.27 -4.53 0.19 0.00 -1.68 0.00 0.00 37.83 31.55 1c3y s LYS 8 CO 0.32 -2.70 1.22 1.14 -0.76 0.00 0.00 175.35 174.58 1c3y s GLN 9 N 6.63 0.10 -0.30 1.68 -2.07 -1.26 -5.14 119.66 119.30 1c3y s GLN 9 Ca 0.60 0.21 -0.14 0.00 -1.82 0.00 0.00 55.36 54.21 1c3y s GLN 9 Cb -0.10 0.08 0.18 0.00 -1.09 0.00 0.00 33.01 32.09 1c3y s GLN 9 CO 0.14 -0.03 1.13 -1.58 -1.32 0.00 0.00 175.29 173.63 1c3y s HIS 10 N 1.68 -0.19 0.00 9.60 2.46 -1.26 -5.02 115.29 122.56 1c3y s HIS 10 Ca -0.04 0.10 0.04 0.00 0.47 0.00 0.00 55.06 55.63 1c3y s HIS 10 Cb -0.02 0.03 0.06 0.00 -0.13 0.00 0.00 32.58 32.52 1c3y s HIS 10 CO -0.14 -0.12 0.87 0.45 -2.47 0.00 0.00 174.74 173.33 1c3y n SER 11 N 4.77 0.04 -0.22 9.88 2.88 -1.26 -4.92 113.62 124.80 1c3y n SER 11 Ca 0.09 -1.69 -0.05 0.00 -1.33 0.00 0.00 58.87 55.89 1c3y n SER 11 Cb 0.60 -0.10 0.05 0.00 -0.75 0.00 0.00 64.21 64.01 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 0.14 0.65 1.18 -3.46 2.03 -2.01 -1.14 116.42 113.81 1c3y h ASP 12 Ca -0.09 -0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.20 1c3y h ASP 12 Cb 1.35 -0.15 -0.00 0.00 -0.83 0.00 0.00 39.33 39.70 1c3y h ASP 12 CO -0.01 0.46 -0.04 0.00 -1.03 0.00 0.00 179.24 178.62 1c3y h ALA 13 N 1.25 1.00 0.00 4.15 0.00 -2.02 -2.80 119.26 120.84 1c3y h ALA 13 Ca 0.24 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1c3y h ALA 13 Cb -0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1c3y h ALA 13 CO -0.08 0.05 -0.14 0.00 0.00 0.00 0.00 179.25 179.07 1c3y h LYS 15 N 0.00 0.00 -0.02 0.00 3.64 -1.19 0.29 116.57 119.28 1c3y h LYS 15 Ca -0.00 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1c3y h LYS 15 Cb 0.86 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.68 1c3y h LYS 15 CO 0.02 0.00 0.13 0.00 -2.27 0.00 0.00 179.45 177.33 1c3y h ALA 16 N 2.21 1.24 0.00 5.00 0.00 -1.64 -3.39 119.26 122.67 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 0.73 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1c3y h ALA 16 CO 0.00 -0.14 0.00 -1.91 0.00 0.00 0.00 179.25 177.20 1c3y n GLU 17 N -3.15 0.00 -1.28 0.00 2.13 -1.20 -4.98 120.64 112.16 1c3y n GLU 17 Ca -0.02 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.41 1c3y n GLU 17 Cb 0.20 -0.05 -0.03 0.00 0.27 0.00 0.00 31.44 31.83 1c3y n GLU 17 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1c3y n SER 18 N -2.04 3.79 -2.19 4.31 7.64 0.10 -4.60 113.62 120.63 1c3y n SER 18 Ca 0.00 -2.67 -0.27 0.00 1.01 0.00 0.00 58.87 56.95 1c3y n SER 18 Cb 0.00 -1.31 0.12 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 4.21 4.91 0.34 0.23 0.00 -1.26 -4.33 105.19 109.29 1c3y n GLY 19 Ca 0.52 -1.52 0.17 0.00 0.00 0.00 0.00 46.02 45.18 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 0.96 0.70 -4.24 1.61 3.04 -1.81 -3.46 116.25 113.04 1c3y h VAL 20 Ca 0.57 0.00 -0.40 0.00 -1.01 0.00 0.00 66.70 65.86 1c3y h VAL 20 Cb 1.83 0.82 0.04 0.00 -2.01 0.00 0.00 31.29 31.97 1c3y h VAL 20 CO 1.23 0.00 -0.59 -1.54 -1.01 0.00 0.00 177.57 175.66 1c3y n SER 21 N -4.21 -5.92 -1.95 3.17 3.41 -1.26 -1.32 113.62 105.53 1c3y n SER 21 Ca 0.04 -0.23 -0.17 0.00 -0.26 0.00 0.00 58.87 58.26 1c3y n SER 21 Cb 0.41 -4.82 -0.04 0.00 -0.26 0.00 0.00 64.21 59.50 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 -3.80 -1.66 -0.03 4.33 2.13 -1.26 -4.86 120.64 115.49 1c3y n GLU 22 Ca -0.14 0.89 -0.10 0.00 0.66 0.00 0.00 57.16 58.47 1c3y n GLU 22 Cb 0.63 -5.36 -0.09 0.00 0.27 0.00 0.00 31.44 26.89 1c3y n GLU 22 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1c3y h GLU 23 N 0.00 -0.06 -0.20 5.31 4.81 -1.58 -2.81 114.58 120.06 1c3y h GLU 23 Ca -0.37 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 58.73 1c3y h GLU 23 Cb 1.19 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 1c3y h GLU 23 CO 0.48 0.54 -0.44 0.77 -0.73 0.00 0.00 179.01 179.63 1c3y h SER 24 N -0.93 0.52 -0.14 1.04 0.02 -1.89 -2.77 113.55 109.40 1c3y h SER 24 Ca -0.01 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 60.69 1c3y h SER 24 Cb 0.63 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1c3y h SER 24 CO 0.01 0.89 0.06 -0.07 -1.14 0.00 0.00 176.83 176.58 1c3y h LEU 25 N 0.39 0.24 -0.55 5.07 3.38 -1.92 -2.06 115.31 119.86 1c3y h LEU 25 Ca 0.03 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1c3y h LEU 25 Cb 0.93 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 1c3y h LEU 25 CO 0.08 0.24 0.36 0.78 0.09 0.00 0.00 178.44 179.98 1c3y h ASN 26 N 0.27 0.64 0.16 -0.43 -0.26 -1.21 -2.01 115.58 112.74 1c3y h ASN 26 Ca 0.07 -0.03 -0.10 0.00 -0.56 0.00 0.00 56.30 55.68 1c3y h ASN 26 Cb 0.09 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.17 1c3y h ASN 26 CO -0.01 0.48 -0.35 0.11 -1.06 0.00 0.00 177.43 176.61 1c3y h LYS 27 N 0.75 0.27 0.00 0.81 1.57 -1.44 -2.45 116.57 116.08 1c3y h LYS 27 Ca 0.20 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1c3y h LYS 27 Cb -0.07 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 1c3y h LYS 27 CO -0.04 0.59 -0.05 0.28 -0.57 0.00 0.00 179.45 179.66 1c3y h VAL 28 N 0.24 0.67 -0.50 0.50 2.07 -0.79 -1.77 116.25 116.67 1c3y h VAL 28 Ca 0.03 -0.22 0.12 0.00 0.82 0.00 0.00 66.70 67.45 1c3y h VAL 28 Cb 0.73 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1c3y h VAL 28 CO 0.06 0.05 0.35 0.03 0.02 0.00 0.00 177.57 178.08 1c3y h ARG 29 N 0.00 0.14 0.00 1.57 2.47 -1.07 -3.43 114.38 114.06 1c3y h ARG 29 Ca -0.00 -0.01 -0.45 0.00 -1.26 0.00 0.00 59.98 58.26 1c3y h ARG 29 Cb 0.13 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.40 1c3y h ARG 29 CO 0.01 0.09 -0.17 0.09 0.56 0.00 0.00 179.97 180.55 1c3y n ASN 30 N -4.43 2.20 -4.29 7.04 4.13 -0.66 -5.00 115.26 114.25 1c3y n ASN 30 Ca 0.09 -2.46 -0.39 0.00 1.68 0.00 0.00 54.58 53.50 1c3y n ASN 30 Cb 0.47 -0.14 -0.03 0.00 -1.54 0.00 0.00 39.78 38.55 1c3y n ASN 30 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1c3y n ARG 31 N -1.72 2.44 -3.39 3.52 1.74 -1.26 -4.76 116.66 113.22 1c3y n ARG 31 Ca 0.03 -2.72 -0.17 0.00 -0.77 0.00 0.00 57.85 54.22 1c3y n ARG 31 Cb 0.51 -3.45 -0.09 0.00 -1.02 0.00 0.00 32.46 28.41 1c3y n ARG 31 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1c3y s GLU 32 N 4.80 0.41 0.02 5.56 0.41 -1.26 -5.12 118.70 123.52 1c3y s GLU 32 Ca 0.57 -0.31 -0.30 0.00 -0.41 0.00 0.00 54.97 54.52 1c3y s GLU 32 Cb 0.06 -0.66 -0.07 0.00 -1.78 0.00 0.00 34.13 31.67 1c3y s GLU 32 CO 0.07 -1.07 1.70 -1.21 -0.49 0.00 0.00 175.26 174.26 1c3y s GLU 33 N 2.14 4.18 -0.08 1.61 8.01 -1.26 -4.37 118.70 128.93 1c3y s GLU 33 Ca 0.11 2.33 -0.03 0.00 0.01 0.00 0.00 54.97 57.39 1c3y s GLU 33 Cb -0.14 -3.81 0.04 0.00 -4.31 0.00 0.00 34.13 25.91 1c3y s GLU 33 CO -0.25 -0.80 0.16 0.08 0.01 0.00 0.00 175.26 174.45 1c3y s VAL 34 N 3.37 -0.12 0.00 2.63 1.01 -1.26 -5.09 120.40 120.94 1c3y s VAL 34 Ca 0.76 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.97 1c3y s VAL 34 Cb -0.38 -0.27 0.00 0.00 0.00 0.00 0.00 36.38 35.73 1c3y s VAL 34 CO 0.33 0.10 0.00 0.47 0.00 0.00 0.00 175.10 175.99 1c3y n ASP 35 N 4.57 0.00 -1.46 3.32 9.92 -1.26 -5.02 116.55 126.62 1c3y n ASP 35 Ca -0.20 0.05 0.00 0.00 -0.53 0.00 0.00 54.79 54.12 1c3y n ASP 35 Cb 0.51 -0.10 0.00 0.00 -0.64 0.00 0.00 41.12 40.89 1c3y n ASP 35 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1c3y n ASP 36 N -1.22 -7.89 0.07 -2.24 9.92 -1.26 -4.21 116.55 109.73 1c3y n ASP 36 Ca 0.00 1.56 -0.11 0.00 -0.53 0.00 0.00 54.79 55.71 1c3y n ASP 36 Cb 0.00 -4.55 -0.07 0.00 -0.64 0.00 0.00 41.12 35.86 1c3y n ASP 36 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1c3y h PRO 37 N 0.57 -0.24 -0.42 -0.24 0.13 -2.00 -3.15 132.00 126.65 1c3y h PRO 37 Ca 0.00 0.02 0.12 0.00 -0.87 0.00 0.00 66.00 65.27 1c3y h PRO 37 Cb 0.62 0.06 -0.02 0.00 0.13 0.00 0.00 31.00 31.79 1c3y h PRO 37 CO 0.00 0.15 0.33 0.87 -0.23 0.00 0.00 178.00 179.12 1c3y h LYS 38 N -0.88 0.00 0.10 0.86 1.57 -1.88 -1.16 116.57 115.18 1c3y h LYS 38 Ca -0.03 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1c3y h LYS 38 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1c3y h LYS 38 CO 0.04 0.00 -0.05 1.25 -0.57 0.00 0.00 179.45 180.13 1c3y h LEU 39 N 0.00 -0.11 -0.51 2.94 6.46 -1.74 0.50 115.31 122.85 1c3y h LEU 39 Ca 0.20 -0.22 -0.02 0.00 -0.12 0.00 0.00 57.88 57.71 1c3y h LEU 39 Cb 0.85 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.78 1c3y h LEU 39 CO -0.00 0.17 0.23 0.11 -0.62 0.00 0.00 178.44 178.32 1c3y h LYS 40 N -0.39 0.74 0.76 1.25 1.57 -1.27 0.15 116.57 119.39 1c3y h LYS 40 Ca -0.01 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.61 1c3y h LYS 40 Cb 0.33 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 32.52 1c3y h LYS 40 CO 0.02 0.63 -0.37 0.93 -0.57 0.00 0.00 179.45 180.10 1c3y h GLU 41 N 0.67 -0.99 -0.41 3.15 4.39 -1.20 -1.91 114.58 118.29 1c3y h GLU 41 Ca 0.17 0.07 0.08 0.00 0.34 0.00 0.00 59.36 60.02 1c3y h GLU 41 Cb 0.15 0.22 -0.07 0.00 -0.10 0.00 0.00 28.75 28.95 1c3y h GLU 41 CO -0.02 -0.64 -0.07 1.25 -1.16 0.00 0.00 179.01 178.37 1c3y h HIS 42 N -1.18 -0.15 -0.25 4.33 2.76 0.05 -1.65 115.15 119.05 1c3y h HIS 42 Ca -0.10 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.16 1c3y h HIS 42 Cb 0.80 0.13 -0.06 0.00 1.55 0.00 0.00 27.41 29.83 1c3y h HIS 42 CO -0.00 -0.15 -0.17 0.00 -1.30 0.00 0.00 177.93 176.31 1c3y h ALA 43 N 1.39 0.01 -0.45 5.26 0.00 -0.68 0.79 119.26 125.58 1c3y h ALA 43 Ca 0.20 0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.30 1c3y h ALA 43 Cb 0.30 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1c3y h ALA 43 CO -0.39 -0.58 0.31 0.35 0.00 0.00 0.00 179.25 178.94 1c3y h PHE 44 N -0.15 0.18 0.00 0.00 3.57 -0.74 0.35 116.94 120.15 1c3y h PHE 44 Ca 0.14 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 1c3y h PHE 44 Cb 0.36 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1c3y h PHE 44 CO -0.34 0.09 -0.20 0.00 -2.23 0.00 0.00 178.31 175.63 1c3y n ILE 46 N -4.00 1.66 -0.24 0.00 2.08 0.99 -3.62 119.36 116.22 1c3y n ILE 46 Ca -0.02 -0.75 -0.05 0.00 0.56 0.00 0.00 62.75 62.50 1c3y n ILE 46 Cb 0.28 -1.26 0.06 0.00 -0.75 0.00 0.00 39.64 37.96 1c3y n ILE 46 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1c3y h LEU 47 N 0.03 0.76 0.55 1.39 -0.00 -0.63 0.87 115.31 118.26 1c3y h LEU 47 Ca -0.35 -0.01 -0.03 0.00 -0.00 0.00 0.00 57.88 57.49 1c3y h LEU 47 Cb 2.03 -0.18 0.01 0.00 -0.00 0.00 0.00 40.66 42.52 1c3y h LEU 47 CO 0.08 0.54 -0.26 0.11 -0.00 0.00 0.00 178.44 178.90 1c3y h LYS 48 N 0.90 -0.71 -0.09 1.13 1.57 -1.60 -2.54 116.57 115.22 1c3y h LYS 48 Ca 0.26 0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 59.06 1c3y h LYS 48 Cb -0.06 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1c3y h LYS 48 CO -0.07 -0.40 -0.06 0.00 -0.57 0.00 0.00 179.45 178.35 1c3y h ARG 49 N -1.01 0.13 -0.12 3.15 -0.00 -1.60 -1.73 114.38 113.21 1c3y h ARG 49 Ca -0.08 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.39 1c3y h ARG 49 Cb 0.64 -0.02 -0.01 0.00 0.00 0.00 0.00 29.97 30.58 1c3y h ARG 49 CO 0.12 0.20 0.07 0.00 0.00 0.00 0.00 179.97 180.37 1c3y h ALA 50 N 1.82 1.91 -0.03 0.04 0.00 0.85 -3.46 119.26 120.39 1c3y h ALA 50 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1c3y h ALA 50 Cb 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1c3y h ALA 50 CO 0.01 0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.75 1c3y n GLY 51 N -1.51 1.49 0.07 0.00 0.00 -0.65 -5.04 105.19 99.55 1c3y n GLY 51 Ca -0.01 -0.24 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 -1.69 0.00 -1.17 1.61 3.72 -0.98 -4.94 117.46 114.02 1c3y n PHE 52 Ca 0.00 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.09 1c3y n PHE 52 Cb 0.14 0.00 0.11 0.00 -0.94 0.00 0.00 39.48 38.79 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 -0.29 3.06 0.24 4.37 2.07 -1.23 -4.62 121.20 124.81 1c3y s ILE 53 Ca 0.00 0.34 -0.08 0.00 -1.41 0.00 0.00 60.65 59.50 1c3y s ILE 53 Cb 0.00 -2.77 -0.07 0.00 0.13 0.00 0.00 42.46 39.76 1c3y s ILE 53 CO 0.00 -0.45 0.54 1.51 -1.91 0.00 0.00 174.94 174.63 1c3y s ASP 54 N -3.30 6.57 0.62 4.50 -4.77 -1.26 -4.69 116.67 114.34 1c3y s ASP 54 Ca 0.62 0.84 0.28 0.00 -3.30 0.00 0.00 52.55 50.99 1c3y s ASP 54 Cb -0.18 -2.19 1.46 0.00 -1.09 0.00 0.00 42.92 40.91 1c3y s ASP 54 CO 0.57 -0.10 1.85 0.00 0.70 0.00 0.00 175.17 178.18 1c3y h ALA 55 N 2.33 1.85 0.00 2.11 0.00 -1.95 0.33 119.26 123.93 1c3y h ALA 55 Ca -0.47 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.27 1c3y h ALA 55 Cb 1.17 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1c3y h ALA 55 CO 0.69 -0.60 -1.32 0.77 0.00 0.00 0.00 179.25 178.78 1c3y h SER 56 N 0.00 0.00 -0.38 0.00 0.02 -2.04 -3.50 113.55 107.66 1c3y h SER 56 Ca 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1c3y h SER 56 Cb 1.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1c3y h SER 56 CO -0.00 0.57 0.00 0.61 -1.14 0.00 0.00 176.83 176.87 1c3y n GLY 57 N 1.38 -0.37 2.68 -3.77 0.00 0.12 -4.94 105.19 100.28 1c3y n GLY 57 Ca -0.08 -0.73 -0.02 0.00 0.00 0.00 0.00 46.02 45.19 1c3y n GLY 57 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1c3y n GLU 58 N 0.43 1.38 0.00 1.61 2.13 -1.26 -4.83 120.64 120.11 1c3y n GLU 58 Ca 0.00 -1.30 0.00 0.00 0.66 0.00 0.00 57.16 56.52 1c3y n GLU 58 Cb 0.00 0.35 0.00 0.00 0.27 0.00 0.00 31.44 32.06 1c3y n GLU 58 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1c3y n PHE 59 N -1.52 0.00 -2.62 4.31 -1.74 -1.26 -4.65 117.46 109.98 1c3y n PHE 59 Ca -0.17 0.00 -0.01 0.00 -0.56 0.00 0.00 57.45 56.71 1c3y n PHE 59 Cb 0.88 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.88 1c3y n PHE 59 CO 0.00 0.00 0.00 1.04 -0.56 0.00 0.00 176.76 177.24 1c3y n GLN 60 N 0.00 -1.17 0.10 3.97 1.13 -1.26 -3.53 117.38 116.62 1c3y n GLN 60 Ca 0.00 1.35 -0.04 0.00 -1.94 0.00 0.00 57.00 56.38 1c3y n GLN 60 Cb 0.00 -4.65 -0.00 0.00 0.11 0.00 0.00 30.24 25.70 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 0.62 0.00 -1.82 1.08 3.38 -1.89 -3.21 115.31 113.46 1c3y h LEU 61 Ca 0.00 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.09 1c3y h LEU 61 Cb 0.94 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 1c3y h LEU 61 CO 0.20 0.81 0.38 -0.78 0.09 0.00 0.00 178.44 179.15 1c3y h ASP 62 N 0.00 0.18 0.76 -0.43 3.58 -1.95 0.19 116.42 118.75 1c3y h ASP 62 Ca -0.01 0.01 -0.25 0.00 0.42 0.00 0.00 57.03 57.20 1c3y h ASP 62 Cb 1.50 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 42.50 1c3y h ASP 62 CO 0.11 0.10 -1.21 0.45 -2.88 0.00 0.00 179.24 175.80 1c3y h HIS 63 N 0.19 0.21 0.45 0.28 3.86 -1.87 -3.12 115.15 115.15 1c3y h HIS 63 Ca 0.26 -0.16 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 1c3y h HIS 63 Cb 0.76 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.23 1c3y h HIS 63 CO -0.00 1.14 -0.21 0.82 0.86 0.00 0.00 177.93 180.54 1c3y h ILE 64 N 0.03 0.24 -0.73 2.45 2.04 -0.94 -2.91 117.51 117.69 1c3y h ILE 64 Ca -0.11 -0.58 0.13 0.00 1.00 0.00 0.00 64.86 65.30 1c3y h ILE 64 Cb 1.89 0.38 -0.09 0.00 -0.74 0.00 0.00 36.82 38.26 1c3y h ILE 64 CO 0.15 0.05 0.30 0.07 0.00 0.00 0.00 178.15 178.72 1c3y h LYS 65 N -1.07 0.45 -0.01 2.37 2.10 -0.89 0.36 116.57 119.88 1c3y h LYS 65 Ca -0.06 -0.03 0.02 0.00 -2.00 0.00 0.00 60.65 58.58 1c3y h LYS 65 Cb 0.54 -0.10 -0.03 0.00 -0.90 0.00 0.00 32.23 31.74 1c3y h LYS 65 CO 0.10 0.30 -0.13 1.15 -2.00 0.00 0.00 179.45 178.86 1c3y h THR 66 N 0.46 0.66 -0.56 0.07 2.02 -1.61 0.60 112.91 114.56 1c3y h THR 66 Ca 0.39 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.53 1c3y h THR 66 Cb 0.55 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 1c3y h THR 66 CO -0.37 0.00 0.20 0.11 0.37 0.00 0.00 175.52 175.83 1c3y h LYS 67 N -0.22 0.85 -0.04 6.66 6.56 -1.20 -0.53 116.57 128.65 1c3y h LYS 67 Ca 0.05 -0.17 -0.08 0.00 -1.06 0.00 0.00 60.65 59.40 1c3y h LYS 67 Cb 0.29 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 31.80 1c3y h LYS 67 CO -0.14 0.75 -0.33 0.35 -2.06 0.00 0.00 179.45 178.02 1c3y h PHE 68 N 0.77 0.07 0.00 -1.35 3.04 -0.61 -3.32 116.94 115.54 1c3y h PHE 68 Ca 0.18 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.12 1c3y h PHE 68 Cb 0.23 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.73 1c3y h PHE 68 CO 0.01 0.39 0.00 1.63 -2.02 0.00 0.00 178.31 178.32 1c3y n LYS 69 N -4.13 0.00 -1.67 1.11 4.76 0.21 -4.60 118.16 113.84 1c3y n LYS 69 Ca -0.02 0.37 -0.51 0.00 -2.87 0.00 0.00 58.31 55.28 1c3y n LYS 69 Cb 0.39 -1.03 -0.05 0.00 -1.84 0.00 0.00 35.03 32.49 1c3y n LYS 69 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1c3y n GLU 70 N -1.60 1.74 -2.68 1.97 -0.00 -0.25 -3.79 120.64 116.03 1c3y n GLU 70 Ca 0.00 0.63 -0.02 0.00 -0.00 0.00 0.00 57.16 57.77 1c3y n GLU 70 Cb 0.00 -2.39 -0.02 0.00 -0.00 0.00 0.00 31.44 29.04 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 4.84 -5.39 -3.06 -1.84 2.85 -1.26 -4.83 115.26 106.56 1c3y n ASN 71 Ca 0.21 1.41 -0.07 0.00 -0.11 0.00 0.00 54.58 56.02 1c3y n ASN 71 Cb 0.23 -5.32 0.02 0.00 1.24 0.00 0.00 39.78 35.96 1c3y n ASN 71 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1c3y s SER 72 N -1.30 -0.00 -0.12 1.20 0.01 -1.25 -4.91 113.70 107.33 1c3y s SER 72 Ca -0.10 -1.01 -0.26 0.00 1.31 0.00 0.00 55.95 55.89 1c3y s SER 72 Cb 0.01 0.76 -0.23 0.00 0.21 0.00 0.00 66.02 66.77 1c3y s SER 72 CO 0.79 -1.51 0.76 -0.33 0.41 0.00 0.00 173.24 173.36 1c3y h GLU 73 N 2.00 -0.01 -1.10 12.44 5.08 -1.92 -3.42 114.58 127.65 1c3y h GLU 73 Ca -0.31 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.66 1c3y h GLU 73 Cb 1.24 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 30.21 1c3y h GLU 73 CO 0.39 0.81 -0.84 0.72 -1.00 0.00 0.00 179.01 179.09 1c3y n HIS 74 N -4.67 -1.48 -2.29 4.33 8.25 -1.26 -5.12 115.22 112.98 1c3y n HIS 74 Ca -0.09 -2.89 -0.43 0.00 -0.26 0.00 0.00 57.72 54.06 1c3y n HIS 74 Cb 0.40 0.51 -0.02 0.00 1.12 0.00 0.00 29.99 32.00 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 -0.74 4.13 0.00 -0.41 0.04 -1.26 -4.42 135.00 132.34 1c3y s PRO 75 Ca 0.33 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1c3y s PRO 75 Cb 0.26 -3.86 0.00 0.00 0.04 0.00 0.00 34.50 30.93 1c3y s PRO 75 CO -0.12 -0.86 0.00 -0.85 0.04 0.00 0.00 177.00 175.21 1c3y n GLU 76 N 6.94 0.00 -0.22 4.56 0.28 -1.26 -4.95 120.64 126.00 1c3y n GLU 76 Ca 0.15 0.00 0.12 0.00 -0.16 0.00 0.00 57.16 57.27 1c3y n GLU 76 Cb 0.45 0.00 0.24 0.00 1.43 0.00 0.00 31.44 33.55 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 -0.54 2.53 -0.20 3.44 5.02 -1.26 -4.38 118.16 122.77 1c3y n LYS 77 Ca 0.00 -2.33 -0.01 0.00 -2.02 0.00 0.00 58.31 53.95 1c3y n LYS 77 Cb 0.00 -1.52 0.21 0.00 -0.02 0.00 0.00 35.03 33.70 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 4.44 1.21 -0.69 -0.18 2.07 -1.92 -2.70 116.25 118.48 1c3y h VAL 78 Ca 0.00 -0.53 0.15 0.00 0.82 0.00 0.00 66.70 67.14 1c3y h VAL 78 Cb 0.98 0.27 -0.11 0.00 -1.52 0.00 0.00 31.29 30.92 1c3y h VAL 78 CO 0.00 0.23 0.09 -2.24 0.02 0.00 0.00 177.57 175.68 1c3y h ASP 79 N 0.97 -0.13 -0.30 0.57 2.03 -1.95 0.90 116.42 118.52 1c3y h ASP 79 Ca 0.25 0.15 -0.08 0.00 -0.73 0.00 0.00 57.03 56.62 1c3y h ASP 79 Cb 0.03 0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 38.76 1c3y h ASP 79 CO -0.04 -0.08 -0.11 -0.78 -1.03 0.00 0.00 179.24 177.20 1c3y h ASP 80 N 0.20 0.61 -0.62 4.15 1.82 -1.81 -2.20 116.42 118.57 1c3y h ASP 80 Ca 0.38 -0.39 -0.05 0.00 -0.39 0.00 0.00 57.03 56.58 1c3y h ASP 80 Cb 0.64 -0.17 -0.03 0.00 0.68 0.00 0.00 39.33 40.45 1c3y h ASP 80 CO -0.53 0.86 0.17 -0.07 -1.61 0.00 0.00 179.24 178.07 1c3y h LEU 81 N 0.36 0.92 0.82 2.28 -0.00 -0.95 0.14 115.31 118.88 1c3y h LEU 81 Ca 0.07 -0.22 -0.04 0.00 -0.00 0.00 0.00 57.88 57.69 1c3y h LEU 81 Cb 0.61 -0.24 0.01 0.00 -0.00 0.00 0.00 40.66 41.04 1c3y h LEU 81 CO 0.04 0.89 -0.39 0.58 -0.00 0.00 0.00 178.44 179.56 1c3y h VAL 82 N 0.89 0.00 -0.90 1.22 2.07 0.81 0.58 116.25 120.92 1c3y h VAL 82 Ca 0.20 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.62 1c3y h VAL 82 Cb 0.32 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.04 1c3y h VAL 82 CO -0.00 0.00 0.56 0.00 0.02 0.00 0.00 177.57 178.15 1c3y h ALA 83 N -1.40 1.30 -0.18 1.67 0.00 -1.43 1.04 119.26 120.26 1c3y h ALA 83 Ca -0.11 -0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.51 1c3y h ALA 83 Cb 0.84 -0.36 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1c3y h ALA 83 CO 0.18 0.62 -0.70 -0.22 0.00 0.00 0.00 179.25 179.13 1c3y h LYS 84 N 1.23 0.76 0.03 0.00 3.64 -0.68 -3.33 116.57 118.22 1c3y h LYS 84 Ca 0.33 -0.57 -0.30 0.00 -1.27 0.00 0.00 60.65 58.83 1c3y h LYS 84 Cb -0.09 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 1c3y h LYS 84 CO -0.07 1.19 -1.71 0.00 -2.27 0.00 0.00 179.45 176.59 1c3y n ALA 86 N -2.63 5.89 -1.84 0.00 0.00 0.36 -4.36 120.51 117.92 1c3y n ALA 86 Ca -0.19 -1.89 -0.42 0.00 0.00 0.00 0.00 53.44 50.94 1c3y n ALA 86 Cb 1.04 -1.95 -0.02 0.00 0.00 0.00 0.00 19.45 18.52 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 -0.51 2.40 0.00 0.00 -7.23 -1.26 -4.88 120.40 108.92 1c3y s VAL 87 Ca 0.50 0.32 -0.30 0.00 -1.81 0.00 0.00 61.98 60.69 1c3y s VAL 87 Cb 0.28 -3.20 -0.06 0.00 0.56 0.00 0.00 36.38 33.96 1c3y s VAL 87 CO -0.07 0.04 1.46 -1.59 -0.31 0.00 0.00 175.10 174.64 1c3y s LYS 88 N 0.18 4.26 0.44 4.82 -2.85 -1.26 -4.80 119.74 120.52 1c3y s LYS 88 Ca 0.65 2.04 0.07 0.00 -1.00 0.00 0.00 55.97 57.73 1c3y s LYS 88 Cb -0.45 -3.61 0.07 0.00 -2.06 0.00 0.00 37.83 31.77 1c3y s LYS 88 CO 0.40 -0.63 0.54 1.63 0.10 0.00 0.00 175.35 177.39 1c3y n LYS 89 N 5.58 0.74 0.17 1.78 4.01 -1.26 -4.99 118.16 124.20 1c3y n LYS 89 Ca 0.14 -2.46 0.13 0.00 -0.51 0.00 0.00 58.31 55.62 1c3y n LYS 89 Cb 0.43 -0.07 0.59 0.00 -0.51 0.00 0.00 35.03 35.47 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 0.18 0.00 -5.11 4.39 2.03 -2.01 -3.44 116.42 112.46 1c3y h ASP 90 Ca -0.22 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 55.96 1c3y h ASP 90 Cb 0.96 0.00 -0.17 0.00 -0.83 0.00 0.00 39.33 39.29 1c3y h ASP 90 CO 0.33 0.00 -0.52 0.42 -1.03 0.00 0.00 179.24 178.44 1c3y s THR 91 N -3.48 0.14 0.01 1.15 -4.23 -1.26 -5.07 115.64 102.90 1c3y s THR 91 Ca 0.02 -1.17 -0.21 0.00 -1.18 0.00 0.00 61.69 59.14 1c3y s THR 91 Cb 0.09 -1.01 -0.18 0.00 1.34 0.00 0.00 72.50 72.74 1c3y s THR 91 CO 0.37 -0.65 1.24 1.55 -0.54 0.00 0.00 174.62 176.59 1c3y h PRO 92 N 3.50 0.32 -0.13 3.99 0.13 -1.88 -3.04 132.00 134.89 1c3y h PRO 92 Ca -0.33 -0.22 0.04 0.00 -0.87 0.00 0.00 66.00 64.62 1c3y h PRO 92 Cb 1.18 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1c3y h PRO 92 CO 0.53 0.82 0.17 -0.56 -0.23 0.00 0.00 178.00 178.73 1c3y h GLN 93 N -0.14 0.00 0.12 0.86 3.07 -1.96 -1.78 115.11 115.28 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 0.83 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.39 1c3y h GLN 93 CO 0.05 0.00 -0.06 1.25 0.09 0.00 0.00 178.83 180.16 1c3y h HIS 94 N 0.00 -0.15 -0.72 0.06 2.76 -1.84 -3.17 115.15 112.09 1c3y h HIS 94 Ca 0.06 -0.00 0.21 0.00 -2.20 0.00 0.00 60.37 58.44 1c3y h HIS 94 Cb 0.41 0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.39 1c3y h HIS 94 CO 0.00 0.31 0.67 0.66 -1.30 0.00 0.00 177.93 178.27 1c3y h SER 95 N -0.89 0.00 0.21 3.26 4.64 -1.23 -2.08 113.55 117.45 1c3y h SER 95 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1c3y h SER 95 Cb 0.53 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.59 1c3y h SER 95 CO 0.03 0.00 -0.40 0.28 -0.87 0.00 0.00 176.83 175.87 1c3y h SER 96 N 0.00 -1.16 -0.24 4.97 0.02 -1.37 -0.51 113.55 115.26 1c3y h SER 96 Ca 0.34 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 1c3y h SER 96 Cb 1.68 0.41 -0.01 0.00 0.14 0.00 0.00 62.40 64.62 1c3y h SER 96 CO -0.00 -0.46 0.16 0.00 -1.14 0.00 0.00 176.83 175.38 1c3y h ALA 97 N -0.91 1.84 -0.89 3.77 0.00 -1.51 -1.82 119.26 119.73 1c3y h ALA 97 Ca -0.02 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1c3y h ALA 97 Cb 0.62 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1c3y h ALA 97 CO -0.15 0.15 0.58 -0.44 0.00 0.00 0.00 179.25 179.39 1c3y h ASP 98 N 0.32 1.03 0.98 0.00 5.19 -1.14 -3.07 116.42 119.71 1c3y h ASP 98 Ca 0.09 -0.03 -0.05 0.00 -0.62 0.00 0.00 57.03 56.42 1c3y h ASP 98 Cb -0.03 -0.26 0.01 0.00 0.18 0.00 0.00 39.33 39.23 1c3y h ASP 98 CO -0.02 0.75 -0.47 -0.26 -3.12 0.00 0.00 179.24 176.13 1c3y h PHE 99 N 1.21 -1.21 -3.11 4.55 0.04 -0.22 -3.39 116.94 114.80 1c3y h PHE 99 Ca 0.32 -0.03 -0.39 0.00 2.80 0.00 0.00 57.97 60.67 1c3y h PHE 99 Cb -0.12 0.40 0.21 0.00 2.20 0.00 0.00 35.95 38.64 1c3y h PHE 99 CO 0.00 -0.75 -0.08 -0.06 -0.60 0.00 0.00 178.31 176.82 1c3y s PHE 100 N -5.88 -0.22 0.00 -0.55 0.40 -1.16 -3.69 117.98 106.88 1c3y s PHE 100 Ca -0.19 0.67 0.00 0.00 -0.60 0.00 0.00 56.93 56.80 1c3y s PHE 100 Cb 0.02 -2.97 0.00 0.00 0.51 0.00 0.00 43.02 40.58 1c3y s PHE 100 CO 0.59 -4.74 0.00 1.63 0.70 0.00 0.00 175.22 173.39 1c3y n LYS 101 N -5.47 0.00 -0.03 0.44 5.02 -1.26 -4.42 118.16 112.44 1c3y n LYS 101 Ca 0.11 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.34 1c3y n LYS 101 Cb 0.59 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.56 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 -0.22 0.00 0.00 0.00 -1.51 -1.77 -3.28 116.25 109.47 1c3y h VAL 103 Ca 0.02 -0.11 0.00 0.00 -1.23 0.00 0.00 66.70 65.38 1c3y h VAL 103 Cb 0.28 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 30.53 1c3y h VAL 103 CO -0.22 0.00 0.00 1.41 -1.23 0.00 0.00 177.57 177.53 1c3y n HIS 104 N -3.04 0.00 -2.34 5.19 -0.00 0.05 -4.53 115.22 110.54 1c3y n HIS 104 Ca -0.02 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.28 1c3y n HIS 104 Cb 0.12 -0.27 -0.00 0.00 -0.00 0.00 0.00 29.99 29.84 1c3y n HIS 104 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 1c3y n ASP 105 N -1.62 4.58 -4.96 0.41 8.00 0.30 -4.95 116.55 118.32 1c3y n ASP 105 Ca 0.00 -2.89 -0.23 0.00 0.71 0.00 0.00 54.79 52.39 1c3y n ASP 105 Cb 0.00 -1.72 0.04 0.00 -0.02 0.00 0.00 41.12 39.42 1c3y n ASP 105 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1c3y s ASN 106 N 4.10 5.35 -0.53 -2.24 4.22 -1.24 -4.76 114.94 119.84 1c3y s ASN 106 Ca 0.53 0.18 -0.00 0.00 -2.14 0.00 0.00 52.86 51.43 1c3y s ASN 106 Cb 0.06 -1.12 0.14 0.00 1.28 0.00 0.00 41.25 41.61 1c3y s ASN 106 CO 0.04 -1.11 0.31 -0.13 -2.04 0.00 0.00 177.10 174.17 1c3y s ARG 107 N -4.81 2.19 0.00 3.55 1.81 -1.26 -5.16 118.95 115.27 1c3y s ARG 107 Ca 0.55 -2.37 0.00 0.00 -1.72 0.00 0.00 55.73 52.19 1c3y s ARG 107 Cb -0.10 -3.54 0.00 0.00 -0.45 0.00 0.00 34.95 30.86 1c3y s ARG 107 CO 0.40 -1.11 0.00 0.45 -0.68 0.00 0.00 175.30 174.35