#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 0.06 -1.01 3.84 -4.23 -1.26 -5.06 115.64 107.98 1c3y s THR 2 Ca 0.00 -1.46 -0.21 0.00 -1.18 0.00 0.00 61.69 58.84 1c3y s THR 2 Cb 0.00 -1.06 -0.10 0.00 1.34 0.00 0.00 72.50 72.68 1c3y s THR 2 CO 0.00 -0.91 1.94 -0.81 -0.54 0.00 0.00 174.62 174.30 1c3y n PRO 3 N 4.31 1.79 -1.38 3.99 -0.04 -1.26 -3.94 135.00 138.48 1c3y n PRO 3 Ca 0.08 -2.24 -0.03 0.00 -0.04 0.00 0.00 63.50 61.27 1c3y n PRO 3 Cb 0.39 -3.28 0.01 0.00 -0.04 0.00 0.00 33.50 30.57 1c3y n PRO 3 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1c3y n ARG 4 N 7.49 0.34 -3.73 0.54 3.00 -1.26 -5.11 116.66 117.93 1c3y n ARG 4 Ca 0.48 -0.68 -0.23 0.00 -0.00 0.00 0.00 57.85 57.42 1c3y n ARG 4 Cb 0.43 0.41 -0.18 0.00 0.00 0.00 0.00 32.46 33.12 1c3y n ARG 4 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 1c3y s GLU 5 N 0.03 0.37 -0.43 -0.14 2.56 -1.25 -5.01 118.70 114.83 1c3y s GLU 5 Ca 0.02 0.12 0.05 0.00 0.00 0.00 0.00 54.97 55.16 1c3y s GLU 5 Cb 0.11 -1.02 0.54 0.00 2.00 0.00 0.00 34.13 35.76 1c3y s GLU 5 CO -0.03 -0.37 1.70 1.63 -0.56 0.00 0.00 175.26 177.63 1c3y n LYS 6 N 5.19 2.37 -0.54 4.30 5.02 -1.26 -4.99 118.16 128.25 1c3y n LYS 6 Ca -0.06 -3.28 -0.05 0.00 -2.02 0.00 0.00 58.31 52.90 1c3y n LYS 6 Cb 0.50 -2.09 0.03 0.00 -0.02 0.00 0.00 35.03 33.44 1c3y n LYS 6 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1c3y n LEU 7 N -1.04 0.00 -4.30 -0.35 7.94 -1.26 -5.01 117.00 112.98 1c3y n LEU 7 Ca 0.50 -0.28 -0.45 0.00 -1.11 0.00 0.00 56.01 54.66 1c3y n LEU 7 Cb 1.14 -0.15 -0.04 0.00 0.53 0.00 0.00 43.42 44.90 1c3y n LEU 7 CO 0.48 -0.63 0.33 -0.54 -1.11 0.00 0.00 177.39 175.92 1c3y s LYS 8 N -3.26 3.36 -0.39 1.96 1.02 -1.26 -4.94 119.74 116.24 1c3y s LYS 8 Ca 0.12 -2.33 0.03 0.00 0.02 0.00 0.00 55.97 53.81 1c3y s LYS 8 Cb -0.00 -4.31 0.16 0.00 -0.52 0.00 0.00 37.83 33.15 1c3y s LYS 8 CO 0.08 -1.28 0.36 -0.65 -0.92 0.00 0.00 175.35 172.95 1c3y s GLN 9 N 0.40 0.71 -0.09 1.68 -1.52 -1.26 -4.94 119.66 114.64 1c3y s GLN 9 Ca 0.15 -1.25 -0.03 0.00 -1.95 0.00 0.00 55.36 52.28 1c3y s GLN 9 Cb -0.15 -0.94 0.04 0.00 -0.22 0.00 0.00 33.01 31.75 1c3y s GLN 9 CO -0.06 -1.25 0.09 -1.01 -0.25 0.00 0.00 175.29 172.80 1c3y s HIS 10 N 1.01 0.06 -0.17 0.91 3.76 -1.26 -5.00 115.29 114.59 1c3y s HIS 10 Ca 0.22 0.12 0.14 0.00 -0.15 0.00 0.00 55.06 55.38 1c3y s HIS 10 Cb -0.12 -0.52 -0.24 0.00 1.11 0.00 0.00 32.58 32.82 1c3y s HIS 10 CO -0.05 -0.32 0.17 0.43 -0.85 0.00 0.00 174.74 174.12 1c3y n SER 11 N 5.30 0.55 -4.57 1.40 7.64 -1.26 -4.80 113.62 117.88 1c3y n SER 11 Ca -0.05 0.08 -0.13 0.00 1.01 0.00 0.00 58.87 59.78 1c3y n SER 11 Cb 0.50 0.50 -0.08 0.00 -1.01 0.00 0.00 64.21 64.11 1c3y n SER 11 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1c3y s ASP 12 N -5.83 3.69 0.00 6.43 -4.77 -1.26 -2.52 116.67 112.41 1c3y s ASP 12 Ca -0.13 -0.25 0.00 0.00 -3.30 0.00 0.00 52.55 48.87 1c3y s ASP 12 Cb 0.07 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.33 1c3y s ASP 12 CO 0.80 -4.22 0.00 0.00 0.70 0.00 0.00 175.17 172.45 1c3y n ALA 13 N 19.20 0.00 0.59 2.11 0.00 -1.26 -4.94 120.51 136.20 1c3y n ALA 13 Ca 0.45 0.00 0.13 0.00 0.00 0.00 0.00 53.44 54.02 1c3y n ALA 13 Cb 0.44 0.00 0.45 0.00 0.00 0.00 0.00 19.45 20.34 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 0.24 0.00 2.10 -1.91 0.19 116.57 117.18 1c3y h LYS 15 Ca 0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 1c3y h LYS 15 Cb 0.58 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.91 1c3y h LYS 15 CO 0.00 0.32 -0.14 0.00 -2.00 0.00 0.00 179.45 177.64 1c3y h ALA 16 N 1.68 -1.03 0.00 0.07 0.00 -1.92 -3.13 119.26 114.93 1c3y h ALA 16 Ca -0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1c3y h ALA 16 Cb 0.99 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1c3y h ALA 16 CO 0.04 -1.01 -0.25 1.49 0.00 0.00 0.00 179.25 179.52 1c3y h GLU 17 N -0.35 0.00 0.00 0.00 4.81 -1.76 -3.43 114.58 113.85 1c3y h GLU 17 Ca -0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1c3y h GLU 17 Cb 0.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1c3y h GLU 17 CO 0.04 0.70 0.00 0.43 -0.73 0.00 0.00 179.01 179.45 1c3y n SER 18 N -4.62 0.00 -2.26 1.04 7.64 -0.46 -4.82 113.62 110.14 1c3y n SER 18 Ca -0.11 0.11 -0.15 0.00 1.01 0.00 0.00 58.87 59.73 1c3y n SER 18 Cb 0.39 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.57 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 1.67 -0.18 3.68 0.23 0.00 0.54 -4.82 105.19 106.30 1c3y n GLY 19 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 1c3y n GLY 19 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1c3y n VAL 20 N -3.29 0.56 -1.49 1.61 3.14 -1.26 -4.86 118.33 112.74 1c3y n VAL 20 Ca -0.17 -0.10 -0.31 0.00 -2.96 0.00 0.00 64.34 60.80 1c3y n VAL 20 Cb 0.61 -1.98 0.02 0.00 -1.06 0.00 0.00 33.84 31.42 1c3y n VAL 20 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1c3y n SER 21 N 6.49 7.08 -2.39 6.55 3.41 -1.26 -4.77 113.62 128.73 1c3y n SER 21 Ca 0.21 -3.51 -0.21 0.00 -0.26 0.00 0.00 58.87 55.11 1c3y n SER 21 Cb 0.33 -1.10 -0.01 0.00 -0.26 0.00 0.00 64.21 63.17 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 -0.05 -1.70 -0.06 4.33 2.13 -1.26 -4.90 120.64 119.13 1c3y n GLU 22 Ca 0.50 1.00 -0.03 0.00 0.66 0.00 0.00 57.16 59.29 1c3y n GLU 22 Cb 0.48 -5.67 -0.01 0.00 0.27 0.00 0.00 31.44 26.51 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 0.00 -0.25 5.31 4.81 -1.97 -3.17 114.58 119.31 1c3y h GLU 23 Ca -0.49 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 58.60 1c3y h GLU 23 Cb 1.36 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.73 1c3y h GLU 23 CO 0.58 0.06 -0.43 0.77 -0.73 0.00 0.00 179.01 179.26 1c3y h SER 24 N -1.00 0.68 -0.21 1.04 0.02 -1.97 -2.84 113.55 109.27 1c3y h SER 24 Ca -0.01 -0.31 -0.01 0.00 -0.84 0.00 0.00 61.79 60.62 1c3y h SER 24 Cb 0.31 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1c3y h SER 24 CO -0.01 1.02 0.12 -0.07 -1.14 0.00 0.00 176.83 176.75 1c3y h LEU 25 N 0.51 0.27 -0.87 5.07 3.38 -1.97 -1.67 115.31 120.04 1c3y h LEU 25 Ca 0.04 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1c3y h LEU 25 Cb 0.96 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.60 1c3y h LEU 25 CO 0.09 0.23 0.44 -1.13 0.09 0.00 0.00 178.44 178.16 1c3y h ASN 26 N 0.32 1.12 0.10 -0.43 -1.24 -1.47 -1.45 115.58 112.53 1c3y h ASN 26 Ca 0.08 -0.12 -0.01 0.00 0.71 0.00 0.00 56.30 56.96 1c3y h ASN 26 Cb 0.02 -0.29 -0.00 0.00 0.73 0.00 0.00 38.32 38.79 1c3y h ASN 26 CO -0.01 0.92 -0.05 0.11 -1.29 0.00 0.00 177.43 177.11 1c3y h LYS 27 N 1.23 0.00 0.00 6.67 1.57 -1.33 -1.16 116.57 123.56 1c3y h LYS 27 Ca 0.30 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.08 1c3y h LYS 27 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1c3y h LYS 27 CO -0.04 0.05 -0.03 0.28 -0.57 0.00 0.00 179.45 179.14 1c3y h VAL 28 N 0.00 0.73 -0.46 0.50 2.07 -1.18 -1.54 116.25 116.37 1c3y h VAL 28 Ca -0.00 -0.11 0.12 0.00 0.82 0.00 0.00 66.70 67.53 1c3y h VAL 28 Cb 0.12 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1c3y h VAL 28 CO 0.01 0.03 0.32 0.03 0.02 0.00 0.00 177.57 177.98 1c3y h ARG 29 N 0.00 0.08 -5.75 1.57 2.47 -1.28 -3.39 114.38 108.07 1c3y h ARG 29 Ca -0.00 -0.00 -0.58 0.00 -1.26 0.00 0.00 59.98 58.14 1c3y h ARG 29 Cb 0.06 -0.02 -0.08 0.00 -1.65 0.00 0.00 29.97 28.28 1c3y h ARG 29 CO 0.00 0.05 -0.06 1.21 0.56 0.00 0.00 179.97 181.73 1c3y s ASN 30 N -6.36 6.71 -1.20 7.04 2.47 -0.58 -4.98 114.94 118.04 1c3y s ASN 30 Ca -0.06 0.85 -0.21 0.00 0.42 0.00 0.00 52.86 53.87 1c3y s ASN 30 Cb 0.19 -2.31 -0.00 0.00 -1.45 0.00 0.00 41.25 37.67 1c3y s ASN 30 CO 0.72 -0.07 1.81 -0.13 -3.72 0.00 0.00 177.10 175.71 1c3y s ARG 31 N 0.93 3.24 0.00 0.43 0.52 -1.26 -4.15 118.95 118.66 1c3y s ARG 31 Ca 0.28 -1.46 0.00 0.00 -0.52 0.00 0.00 55.73 54.03 1c3y s ARG 31 Cb -0.16 -5.37 0.00 0.00 0.52 0.00 0.00 34.95 29.95 1c3y s ARG 31 CO 0.11 -3.04 0.00 0.39 0.02 0.00 0.00 175.30 172.79 1c3y n GLU 32 N 8.43 0.00 -3.77 3.54 1.02 -1.26 -5.18 120.64 123.41 1c3y n GLU 32 Ca 0.45 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.63 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 -1.83 1.18 0.00 0.00 177.13 176.48 1c3y s GLU 33 N -0.77 0.09 0.13 3.49 -1.05 -1.26 -5.11 118.70 114.21 1c3y s GLU 33 Ca 0.00 -0.05 0.00 0.00 -0.15 0.00 0.00 54.97 54.77 1c3y s GLU 33 Cb 0.00 0.03 0.00 0.00 -0.44 0.00 0.00 34.13 33.72 1c3y s GLU 33 CO 0.00 -0.04 0.00 0.28 0.95 0.00 0.00 175.26 176.45 1c3y n VAL 34 N -0.71 0.00 -2.71 1.83 0.31 -1.26 -4.71 118.33 111.07 1c3y n VAL 34 Ca -0.03 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1c3y n VAL 34 Cb 0.61 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 33.44 1c3y n VAL 34 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1c3y n ASP 35 N -2.84 -7.98 -3.73 4.52 2.03 -1.26 -5.07 116.55 102.22 1c3y n ASP 35 Ca 0.00 1.37 -0.13 0.00 0.52 0.00 0.00 54.79 56.55 1c3y n ASP 35 Cb 0.00 -5.31 -0.10 0.00 -0.72 0.00 0.00 41.12 34.99 1c3y n ASP 35 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1c3y s ASP 36 N -1.68 -0.41 -0.05 1.67 1.11 -1.26 -5.08 116.67 110.98 1c3y s ASP 36 Ca 0.02 0.76 -0.25 0.00 0.18 0.00 0.00 52.55 53.26 1c3y s ASP 36 Cb -0.00 0.79 -0.20 0.00 1.07 0.00 0.00 42.92 44.58 1c3y s ASP 36 CO 0.78 -0.17 1.09 1.55 1.18 0.00 0.00 175.17 179.60 1c3y h PRO 37 N 5.35 -0.07 -0.93 8.23 0.13 -2.00 -2.93 132.00 139.79 1c3y h PRO 37 Ca -0.27 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 65.00 1c3y h PRO 37 Cb 1.18 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 32.25 1c3y h PRO 37 CO 0.26 0.48 0.59 0.87 -0.23 0.00 0.00 178.00 179.98 1c3y h LYS 38 N -0.67 0.76 -0.19 0.86 1.57 -1.87 -0.01 116.57 117.02 1c3y h LYS 38 Ca -0.01 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1c3y h LYS 38 Cb 0.58 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1c3y h LYS 38 CO 0.01 0.50 0.02 1.25 -0.57 0.00 0.00 179.45 180.67 1c3y h LEU 39 N 0.78 0.30 -0.15 2.94 6.46 -1.94 0.88 115.31 124.59 1c3y h LEU 39 Ca 0.47 -0.27 -0.01 0.00 -0.12 0.00 0.00 57.88 57.95 1c3y h LEU 39 Cb 0.67 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.51 1c3y h LEU 39 CO -0.23 0.50 0.08 0.11 -0.62 0.00 0.00 178.44 178.27 1c3y h LYS 40 N 0.10 0.22 0.49 1.25 1.57 -1.11 -2.20 116.57 116.88 1c3y h LYS 40 Ca 0.06 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1c3y h LYS 40 Cb 0.33 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1c3y h LYS 40 CO 0.01 0.26 -0.23 0.93 -0.57 0.00 0.00 179.45 179.84 1c3y h GLU 41 N 0.13 -0.63 -0.82 3.15 3.07 -1.02 -3.06 114.58 115.40 1c3y h GLU 41 Ca 0.05 0.04 0.19 0.00 -0.50 0.00 0.00 59.36 59.15 1c3y h GLU 41 Cb 0.11 0.14 -0.12 0.00 -0.84 0.00 0.00 28.75 28.04 1c3y h GLU 41 CO -0.01 -0.35 0.25 1.25 -1.40 0.00 0.00 179.01 178.75 1c3y h HIS 42 N -0.81 0.39 0.36 4.33 2.76 -0.83 -1.40 115.15 119.95 1c3y h HIS 42 Ca -0.07 0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.14 1c3y h HIS 42 Cb 0.57 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.46 1c3y h HIS 42 CO -0.01 -0.10 -0.46 0.00 -1.30 0.00 0.00 177.93 176.06 1c3y h ALA 43 N 1.68 -1.07 -0.11 5.26 0.00 -1.33 -1.05 119.26 122.63 1c3y h ALA 43 Ca 0.49 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.28 1c3y h ALA 43 Cb 0.89 0.74 -0.00 0.00 0.00 0.00 0.00 17.79 19.41 1c3y h ALA 43 CO -0.55 -1.12 0.18 0.35 0.00 0.00 0.00 179.25 178.11 1c3y h PHE 44 N -0.85 0.00 -0.29 0.00 3.57 -1.32 0.07 116.94 118.12 1c3y h PHE 44 Ca -0.04 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.38 1c3y h PHE 44 Cb 0.76 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 1c3y h PHE 44 CO -0.30 0.00 -0.14 0.00 -2.23 0.00 0.00 178.31 175.64 1c3y n ILE 46 N -4.19 1.12 -0.21 0.00 -0.00 -0.16 -4.06 119.36 111.86 1c3y n ILE 46 Ca 0.00 -0.73 0.02 0.00 -0.00 0.00 0.00 62.75 62.05 1c3y n ILE 46 Cb 0.34 -0.56 0.27 0.00 -0.00 0.00 0.00 39.64 39.69 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 0.82 -0.53 1.39 -0.00 -1.00 0.91 115.31 116.89 1c3y h LEU 47 Ca -0.29 -0.01 -0.12 0.00 -0.00 0.00 0.00 57.88 57.46 1c3y h LEU 47 Cb 1.78 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 42.23 1c3y h LEU 47 CO 0.04 0.57 -0.13 0.50 -0.00 0.00 0.00 178.44 179.42 1c3y h LYS 48 N 0.95 1.02 0.00 1.13 3.64 -1.66 -2.98 116.57 118.67 1c3y h LYS 48 Ca 0.29 -0.39 -0.20 0.00 -1.27 0.00 0.00 60.65 59.08 1c3y h LYS 48 Cb 0.00 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1c3y h LYS 48 CO -0.08 1.08 -0.95 0.00 -2.27 0.00 0.00 179.45 177.23 1c3y h ARG 49 N 0.90 0.00 -0.08 1.90 3.08 -1.47 -3.22 114.38 115.49 1c3y h ARG 49 Ca 0.14 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.21 1c3y h ARG 49 Cb 0.70 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.74 1c3y h ARG 49 CO 0.05 0.95 0.08 0.00 -1.07 0.00 0.00 179.97 179.98 1c3y h ALA 50 N 1.05 1.82 -0.04 0.04 0.00 0.93 -3.45 119.26 119.60 1c3y h ALA 50 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1c3y h ALA 50 Cb 1.69 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1c3y h ALA 50 CO 0.12 -0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1c3y n GLY 51 N -1.44 1.40 0.47 0.00 0.00 -1.19 -5.02 105.19 99.42 1c3y n GLY 51 Ca -0.01 -0.28 -0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.83 0.00 -2.77 1.61 3.72 -1.14 -5.03 117.46 112.02 1c3y n PHE 52 Ca 0.00 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.07 1c3y n PHE 52 Cb 0.16 -0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.64 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 -1.01 4.45 0.51 4.37 2.07 -1.20 -4.41 121.20 125.99 1c3y s ILE 53 Ca -0.00 1.37 -0.00 0.00 -1.41 0.00 0.00 60.65 60.60 1c3y s ILE 53 Cb 0.00 -3.63 0.02 0.00 0.13 0.00 0.00 42.46 38.98 1c3y s ILE 53 CO 0.00 -0.39 0.75 1.51 -1.91 0.00 0.00 174.94 174.90 1c3y s ASP 54 N -2.39 5.54 0.63 4.50 1.47 -1.17 -4.51 116.67 120.74 1c3y s ASP 54 Ca 0.60 0.20 0.31 0.00 1.18 0.00 0.00 52.55 54.84 1c3y s ASP 54 Cb -0.09 -1.25 1.68 0.00 -0.34 0.00 0.00 42.92 42.92 1c3y s ASP 54 CO 0.17 -0.95 2.00 0.00 0.68 0.00 0.00 175.17 177.07 1c3y h ALA 55 N 0.18 1.57 -0.30 2.11 0.00 -1.94 0.16 119.26 121.04 1c3y h ALA 55 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1c3y h ALA 55 Cb 1.27 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1c3y h ALA 55 CO 0.56 -0.37 0.00 0.45 0.00 0.00 0.00 179.25 179.88 1c3y n SER 56 N -3.27 2.97 -1.48 0.00 2.88 -1.26 -4.87 113.62 108.59 1c3y n SER 56 Ca 0.01 -2.34 -0.18 0.00 -1.33 0.00 0.00 58.87 55.03 1c3y n SER 56 Cb 0.40 -0.50 -0.08 0.00 -0.75 0.00 0.00 64.21 63.28 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 0.50 1.75 3.68 0.46 0.00 0.55 -4.93 105.19 107.21 1c3y n GLY 57 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1c3y n GLY 57 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1c3y s GLU 58 N -3.55 4.35 0.41 1.61 2.02 -1.25 -4.47 118.70 117.81 1c3y s GLU 58 Ca 0.00 1.02 -0.26 0.00 0.02 0.00 0.00 54.97 55.75 1c3y s GLU 58 Cb 0.00 -3.54 -0.08 0.00 0.10 0.00 0.00 34.13 30.61 1c3y s GLU 58 CO 0.00 -0.22 1.25 -0.59 0.02 0.00 0.00 175.26 175.72 1c3y s PHE 59 N 1.77 2.90 -0.53 1.61 -0.12 -1.26 -3.04 117.98 119.32 1c3y s PHE 59 Ca 0.39 1.47 0.04 0.00 -0.05 0.00 0.00 56.93 58.78 1c3y s PHE 59 Cb -0.17 -3.56 0.16 0.00 -0.63 0.00 0.00 43.02 38.82 1c3y s PHE 59 CO 0.15 -1.80 0.38 -0.65 -0.05 0.00 0.00 175.22 173.26 1c3y s GLN 60 N -2.28 1.59 0.42 1.99 -0.21 -1.26 -4.94 119.66 114.97 1c3y s GLN 60 Ca 0.57 -2.58 0.23 0.00 0.02 0.00 0.00 55.36 53.60 1c3y s GLN 60 Cb -0.35 -2.38 0.80 0.00 1.00 0.00 0.00 33.01 32.08 1c3y s GLN 60 CO 0.45 -1.30 1.78 -0.07 -2.12 0.00 0.00 175.29 174.02 1c3y h LEU 61 N 5.75 0.00 -1.85 2.90 3.38 -1.94 -2.84 115.31 120.71 1c3y h LEU 61 Ca 0.17 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.16 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 0.53 0.26 0.15 0.44 0.09 0.00 0.00 178.44 179.91 1c3y h ASP 62 N 0.00 0.17 0.41 -0.43 3.32 -1.99 0.19 116.42 118.08 1c3y h ASP 62 Ca -0.00 -0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.74 1c3y h ASP 62 Cb 0.83 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 40.29 1c3y h ASP 62 CO 0.03 0.12 -1.80 1.41 -1.72 0.00 0.00 179.24 177.29 1c3y n HIS 63 N -4.50 0.96 0.08 4.55 8.25 -1.15 -3.90 115.22 119.52 1c3y n HIS 63 Ca 0.01 0.32 -0.13 0.00 -0.26 0.00 0.00 57.72 57.67 1c3y n HIS 63 Cb 0.16 -1.17 -0.08 0.00 1.12 0.00 0.00 29.99 30.01 1c3y n HIS 63 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1c3y h ILE 64 N 0.01 0.97 -0.72 1.59 2.04 -1.13 -2.43 117.51 117.84 1c3y h ILE 64 Ca -0.32 -0.71 0.12 0.00 1.00 0.00 0.00 64.86 64.95 1c3y h ILE 64 Cb 2.03 1.39 -0.09 0.00 -0.74 0.00 0.00 36.82 39.42 1c3y h ILE 64 CO 0.08 0.16 0.30 0.07 0.00 0.00 0.00 178.15 178.76 1c3y h LYS 65 N -0.57 0.46 0.61 2.37 2.10 -0.85 0.82 116.57 121.51 1c3y h LYS 65 Ca -0.02 -0.03 -0.03 0.00 -2.00 0.00 0.00 60.65 58.57 1c3y h LYS 65 Cb 0.43 -0.10 0.01 0.00 -0.90 0.00 0.00 32.23 31.66 1c3y h LYS 65 CO 0.04 0.30 -0.29 1.15 -2.00 0.00 0.00 179.45 178.65 1c3y h THR 66 N 0.47 0.36 -0.78 0.07 2.02 -1.67 0.14 112.91 113.52 1c3y h THR 66 Ca 0.38 -0.15 -0.02 0.00 0.77 0.00 0.00 66.41 67.39 1c3y h THR 66 Cb 0.53 0.41 -0.04 0.00 -1.74 0.00 0.00 68.15 67.32 1c3y h THR 66 CO -0.36 0.02 0.40 0.11 0.37 0.00 0.00 175.52 176.06 1c3y h LYS 67 N -0.93 1.11 0.00 6.66 1.57 -1.04 -1.57 116.57 122.37 1c3y h LYS 67 Ca -0.08 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.49 1c3y h LYS 67 Cb 0.66 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1c3y h LYS 67 CO 0.14 0.85 -0.28 0.74 -0.57 0.00 0.00 179.45 180.32 1c3y h PHE 68 N 1.10 0.00 0.21 -1.35 -1.00 0.71 -3.26 116.94 113.35 1c3y h PHE 68 Ca 0.27 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.04 1c3y h PHE 68 Cb 0.08 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.64 1c3y h PHE 68 CO 0.01 0.28 -0.10 -0.22 -1.61 0.00 0.00 178.31 176.67 1c3y h LYS 69 N 0.00 -0.27 -6.59 1.51 1.63 0.03 -3.45 116.57 109.43 1c3y h LYS 69 Ca -0.00 0.02 -0.59 0.00 -0.85 0.00 0.00 60.65 59.23 1c3y h LYS 69 Cb 0.58 0.06 0.10 0.00 -0.60 0.00 0.00 32.23 32.38 1c3y h LYS 69 CO 0.04 -0.18 0.40 -0.85 -3.45 0.00 0.00 179.45 175.41 1c3y n GLU 70 N -3.90 1.79 -2.76 1.90 0.28 -0.66 -3.88 120.64 113.41 1c3y n GLU 70 Ca -0.04 0.63 -0.03 0.00 -0.16 0.00 0.00 57.16 57.56 1c3y n GLU 70 Cb 0.11 -2.16 0.00 0.00 1.43 0.00 0.00 31.44 30.82 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 1.39 -7.93 -3.81 -1.84 5.15 -1.26 -4.91 115.26 102.04 1c3y n ASN 71 Ca 0.09 1.03 -0.06 0.00 -0.60 0.00 0.00 54.58 55.04 1c3y n ASN 71 Cb 0.33 -5.32 -0.02 0.00 -0.53 0.00 0.00 39.78 34.24 1c3y n ASN 71 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1c3y s SER 72 N -2.04 -0.23 0.12 1.20 0.15 -1.25 -5.00 113.70 106.64 1c3y s SER 72 Ca 0.11 -0.58 0.01 0.00 0.70 0.00 0.00 55.95 56.18 1c3y s SER 72 Cb -0.03 0.68 -0.16 0.00 -1.71 0.00 0.00 66.02 64.80 1c3y s SER 72 CO 0.77 -1.26 1.26 -0.33 1.20 0.00 0.00 173.24 174.88 1c3y h GLU 73 N 2.00 0.19 -1.56 5.44 3.07 -1.92 -3.40 114.58 118.40 1c3y h GLU 73 Ca -0.20 -0.26 -0.40 0.00 -0.50 0.00 0.00 59.36 57.99 1c3y h GLU 73 Cb 1.25 0.09 -0.28 0.00 -0.84 0.00 0.00 28.75 28.96 1c3y h GLU 73 CO 0.24 1.07 -0.79 -2.39 -1.40 0.00 0.00 179.01 175.74 1c3y n HIS 74 N -3.54 -2.04 -2.20 4.33 1.44 -1.26 -5.10 115.22 106.85 1c3y n HIS 74 Ca -0.05 -2.56 -0.40 0.00 -2.01 0.00 0.00 57.72 52.70 1c3y n HIS 74 Cb 0.92 0.70 -0.03 0.00 0.12 0.00 0.00 29.99 31.70 1c3y n HIS 74 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 1c3y s PRO 75 N 0.16 2.98 0.00 -1.40 0.04 -1.26 -4.00 135.00 131.52 1c3y s PRO 75 Ca 0.32 0.55 0.00 0.00 0.04 0.00 0.00 61.00 61.92 1c3y s PRO 75 Cb 0.08 -4.26 0.00 0.00 0.04 0.00 0.00 34.50 30.36 1c3y s PRO 75 CO -0.15 -2.32 0.00 -0.85 0.04 0.00 0.00 177.00 173.72 1c3y n GLU 76 N 8.96 0.00 0.00 4.56 0.28 -1.26 -4.95 120.64 128.23 1c3y n GLU 76 Ca 0.16 0.00 0.13 0.00 -0.16 0.00 0.00 57.16 57.29 1c3y n GLU 76 Cb 0.50 0.00 0.31 0.00 1.43 0.00 0.00 31.44 33.68 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 -0.48 1.10 -0.13 3.44 5.02 -1.26 -4.26 118.16 121.60 1c3y n LYS 77 Ca 0.00 -0.73 -0.07 0.00 -2.02 0.00 0.00 58.31 55.49 1c3y n LYS 77 Cb 0.00 -1.48 0.02 0.00 -0.02 0.00 0.00 35.03 33.54 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 1.78 1.02 -0.53 -0.18 2.07 -1.93 0.10 116.25 118.58 1c3y h VAL 78 Ca 0.00 -0.16 0.11 0.00 0.82 0.00 0.00 66.70 67.47 1c3y h VAL 78 Cb 0.58 0.51 -0.10 0.00 -1.52 0.00 0.00 31.29 30.76 1c3y h VAL 78 CO 0.00 0.08 -0.11 -2.24 0.02 0.00 0.00 177.57 175.32 1c3y h ASP 79 N 0.46 -0.45 -0.08 0.57 3.04 -1.87 0.97 116.42 119.06 1c3y h ASP 79 Ca 0.17 0.16 -0.19 0.00 -3.24 0.00 0.00 57.03 53.93 1c3y h ASP 79 Cb 0.04 0.31 -0.00 0.00 -1.04 0.00 0.00 39.33 38.64 1c3y h ASP 79 CO -0.09 -0.16 -0.63 0.44 -2.04 0.00 0.00 179.24 176.75 1c3y h ASP 80 N 0.02 0.79 -0.69 4.15 3.32 -1.77 -3.00 116.42 119.23 1c3y h ASP 80 Ca 0.26 -0.46 -0.07 0.00 0.02 0.00 0.00 57.03 56.79 1c3y h ASP 80 Cb 0.40 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1c3y h ASP 80 CO -0.53 1.22 0.17 0.25 -1.72 0.00 0.00 179.24 178.63 1c3y h LEU 81 N 0.51 1.05 0.94 1.55 6.46 0.52 0.39 115.31 126.72 1c3y h LEU 81 Ca -0.01 -0.23 -0.05 0.00 -0.12 0.00 0.00 57.88 57.47 1c3y h LEU 81 Cb 1.22 -0.28 0.01 0.00 -0.73 0.00 0.00 40.66 40.88 1c3y h LEU 81 CO 0.13 1.01 -0.45 0.58 -0.62 0.00 0.00 178.44 179.08 1c3y h VAL 82 N 1.03 0.00 -0.54 1.05 2.07 0.93 0.89 116.25 121.68 1c3y h VAL 82 Ca 0.22 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.73 1c3y h VAL 82 Cb 0.37 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 1c3y h VAL 82 CO 0.00 0.00 0.34 0.00 0.02 0.00 0.00 177.57 177.93 1c3y h ALA 83 N -1.41 1.58 -0.05 1.67 0.00 -1.55 0.92 119.26 120.42 1c3y h ALA 83 Ca -0.13 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 1c3y h ALA 83 Cb 0.97 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1c3y h ALA 83 CO 0.21 0.38 -0.78 -0.22 0.00 0.00 0.00 179.25 178.84 1c3y h LYS 84 N 0.74 0.36 0.00 0.00 1.63 -0.74 -3.29 116.57 115.26 1c3y h LYS 84 Ca 0.20 -0.32 -0.20 0.00 -0.85 0.00 0.00 60.65 59.48 1c3y h LYS 84 Cb -0.05 0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.62 1c3y h LYS 84 CO -0.04 0.98 -1.46 0.00 -3.45 0.00 0.00 179.45 175.47 1c3y n ALA 86 N -2.43 7.07 -1.79 0.00 0.00 0.31 -4.21 120.51 119.46 1c3y n ALA 86 Ca -0.11 -3.20 -0.39 0.00 0.00 0.00 0.00 53.44 49.74 1c3y n ALA 86 Cb 0.89 -2.92 -0.03 0.00 0.00 0.00 0.00 19.45 17.40 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 0.91 3.20 -0.15 0.00 -7.23 -1.26 -4.89 120.40 110.97 1c3y s VAL 87 Ca 0.65 0.14 -0.29 0.00 -1.81 0.00 0.00 61.98 60.68 1c3y s VAL 87 Cb 0.23 -3.42 -0.05 0.00 0.56 0.00 0.00 36.38 33.70 1c3y s VAL 87 CO -0.07 -0.37 1.86 -1.59 -0.31 0.00 0.00 175.10 174.62 1c3y s LYS 88 N 7.23 3.73 0.00 4.82 0.00 -1.26 -4.80 119.74 129.46 1c3y s LYS 88 Ca 0.85 2.01 0.00 0.00 0.00 0.00 0.00 55.97 58.83 1c3y s LYS 88 Cb -0.18 -4.15 0.00 0.00 0.00 0.00 0.00 37.83 33.50 1c3y s LYS 88 CO 0.26 -1.40 0.00 1.63 0.00 0.00 0.00 175.35 175.85 1c3y n LYS 89 N 7.89 0.00 0.00 1.78 4.01 -1.26 -5.08 118.16 125.50 1c3y n LYS 89 Ca 0.22 0.02 0.00 0.00 -0.51 0.00 0.00 58.31 58.03 1c3y n LYS 89 Cb 0.44 -0.20 0.00 0.00 -0.51 0.00 0.00 35.03 34.76 1c3y n LYS 89 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 1c3y n ASP 90 N -1.70 0.00 -4.92 4.39 5.68 -1.26 -5.11 116.55 113.63 1c3y n ASP 90 Ca 0.00 0.00 -0.30 0.00 -0.50 0.00 0.00 54.79 53.99 1c3y n ASP 90 Cb 0.00 0.07 -0.04 0.00 -1.14 0.00 0.00 41.12 40.01 1c3y n ASP 90 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1c3y s THR 91 N -1.60 5.30 0.02 2.12 -4.23 -1.26 -5.03 115.64 110.96 1c3y s THR 91 Ca 0.00 -0.32 -0.21 0.00 -1.18 0.00 0.00 61.69 59.98 1c3y s THR 91 Cb 0.00 -3.65 -0.17 0.00 1.34 0.00 0.00 72.50 70.02 1c3y s THR 91 CO 0.00 0.05 1.26 1.55 -0.54 0.00 0.00 174.62 176.94 1c3y h PRO 92 N 2.77 0.34 -0.23 3.99 0.13 -1.93 -2.41 132.00 134.66 1c3y h PRO 92 Ca -0.46 -0.23 0.07 0.00 -0.87 0.00 0.00 66.00 64.51 1c3y h PRO 92 Cb 1.17 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1c3y h PRO 92 CO 0.73 0.83 0.19 -0.56 -0.23 0.00 0.00 178.00 178.95 1c3y h GLN 93 N -0.10 0.00 0.09 0.86 -0.00 -1.92 -0.06 115.11 113.98 1c3y h GLN 93 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1c3y h GLN 93 Cb 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.30 1c3y h GLN 93 CO 0.05 0.00 -0.04 1.25 -0.00 0.00 0.00 178.83 180.09 1c3y h HIS 94 N 0.00 -0.12 -1.05 0.06 2.76 -1.80 -3.30 115.15 111.70 1c3y h HIS 94 Ca 0.11 -0.00 0.30 0.00 -2.20 0.00 0.00 60.37 58.58 1c3y h HIS 94 Cb 0.48 0.04 -0.04 0.00 1.55 0.00 0.00 27.41 29.43 1c3y h HIS 94 CO 0.00 -0.07 0.81 0.66 -1.30 0.00 0.00 177.93 178.03 1c3y h SER 95 N -0.49 0.00 -0.70 3.26 4.64 -1.27 0.13 113.55 119.12 1c3y h SER 95 Ca -0.01 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.33 1c3y h SER 95 Cb 0.10 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.14 1c3y h SER 95 CO 0.02 0.00 0.44 0.77 -0.87 0.00 0.00 176.83 177.19 1c3y h SER 96 N 0.00 0.74 0.64 4.97 4.64 -1.09 0.19 113.55 123.65 1c3y h SER 96 Ca 0.50 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.79 1c3y h SER 96 Cb 2.12 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 64.03 1c3y h SER 96 CO -0.01 0.52 -0.43 0.00 -0.87 0.00 0.00 176.83 176.05 1c3y h ALA 97 N 1.29 -1.06 -0.18 5.18 0.00 -0.81 -2.13 119.26 121.54 1c3y h ALA 97 Ca 0.27 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1c3y h ALA 97 Cb -0.02 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1c3y h ALA 97 CO -0.09 -1.12 0.12 -0.44 0.00 0.00 0.00 179.25 177.72 1c3y h ASP 98 N -1.02 0.17 -1.70 0.00 3.32 -1.57 -3.14 116.42 112.47 1c3y h ASP 98 Ca -0.08 -0.00 -0.77 0.00 0.02 0.00 0.00 57.03 56.20 1c3y h ASP 98 Cb 0.84 -0.04 -0.18 0.00 0.22 0.00 0.00 39.33 40.17 1c3y h ASP 98 CO 0.06 0.12 1.76 0.33 -1.72 0.00 0.00 179.24 179.79 1c3y n PHE 99 N -4.51 2.91 0.02 4.55 7.35 0.66 -3.50 117.46 124.94 1c3y n PHE 99 Ca 0.00 -2.78 0.00 0.00 -0.76 0.00 0.00 57.45 53.91 1c3y n PHE 99 Cb 0.12 -1.83 0.00 0.00 0.35 0.00 0.00 39.48 38.12 1c3y n PHE 99 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1c3y n PHE 100 N 3.46 -1.48 0.08 -5.13 7.35 -1.19 -4.78 117.46 115.78 1c3y n PHE 100 Ca 0.37 0.13 -0.10 0.00 -0.76 0.00 0.00 57.45 57.09 1c3y n PHE 100 Cb 0.36 0.55 -0.07 0.00 0.35 0.00 0.00 39.48 40.67 1c3y n PHE 100 CO 0.00 0.00 0.00 1.57 -0.76 0.00 0.00 176.76 177.57 1c3y h LYS 101 N 0.00 0.15 -0.93 -4.13 2.10 -1.75 -3.04 116.57 108.98 1c3y h LYS 101 Ca 0.00 -0.21 0.21 0.00 -2.00 0.00 0.00 60.65 58.65 1c3y h LYS 101 Cb 0.00 0.07 -0.07 0.00 -0.90 0.00 0.00 32.23 31.33 1c3y h LYS 101 CO 0.00 1.02 0.61 0.00 -2.00 0.00 0.00 179.45 179.09 1c3y n VAL 103 N -4.54 0.76 -0.07 0.00 0.24 -1.23 -3.98 118.33 109.51 1c3y n VAL 103 Ca 0.20 -0.60 0.04 0.00 -2.04 0.00 0.00 64.34 61.94 1c3y n VAL 103 Cb 0.72 -0.44 0.23 0.00 -1.47 0.00 0.00 33.84 32.88 1c3y n VAL 103 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1c3y n HIS 104 N -2.70 1.18 -1.90 6.34 -0.00 0.26 -3.97 115.22 114.44 1c3y n HIS 104 Ca -0.05 -0.41 -0.00 0.00 -0.00 0.00 0.00 57.72 57.26 1c3y n HIS 104 Cb 0.67 -0.33 0.13 0.00 -0.00 0.00 0.00 29.99 30.47 1c3y n HIS 104 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 1c3y n ASP 105 N 0.38 2.17 -0.10 0.41 5.68 -0.70 -4.76 116.55 119.63 1c3y n ASP 105 Ca 0.16 -3.45 -0.23 0.00 -0.50 0.00 0.00 54.79 50.77 1c3y n ASP 105 Cb 0.78 -0.45 -0.11 0.00 -1.14 0.00 0.00 41.12 40.20 1c3y n ASP 105 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1c3y n ASN 106 N -0.74 1.88 -2.74 -1.12 5.03 -1.25 -5.06 115.26 111.26 1c3y n ASN 106 Ca 0.21 0.40 -0.03 0.00 0.87 0.00 0.00 54.58 56.03 1c3y n ASN 106 Cb 0.83 -0.94 0.00 0.00 -1.02 0.00 0.00 39.78 38.65 1c3y n ASN 106 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.26 174.29 1c3y n ARG 107 N -4.37 -3.01 0.00 3.52 0.00 -1.26 -5.23 116.66 106.30 1c3y n ARG 107 Ca -0.35 2.50 0.00 0.00 -0.00 0.00 0.00 57.85 60.00 1c3y n ARG 107 Cb 0.72 -5.42 0.00 0.00 0.00 0.00 0.00 32.46 27.76 1c3y n ARG 107 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50