#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1crp s THR 2 N 0.00 1.14 -0.30 2.03 2.01 -1.26 -4.98 115.64 114.28 1crp s THR 2 Ca 0.00 -1.96 0.01 0.00 0.31 0.00 0.00 61.69 60.04 1crp s THR 2 Cb 0.00 -2.11 0.15 0.00 0.01 0.00 0.00 72.50 70.55 1crp s THR 2 CO 0.00 0.00 0.34 -0.70 -0.69 0.00 0.00 174.62 173.57 1crp s GLU 3 N -3.92 0.39 0.64 4.92 2.12 -1.26 -1.58 118.70 120.01 1crp s GLU 3 Ca 0.06 -0.15 0.03 0.00 0.36 0.00 0.00 54.97 55.27 1crp s GLU 3 Cb 0.01 -0.56 0.10 0.00 0.26 0.00 0.00 34.13 33.93 1crp s GLU 3 CO 0.03 -1.05 0.88 0.71 -0.54 0.00 0.00 175.26 175.29 1crp s TYR 4 N 2.30 1.79 0.15 5.30 1.51 -0.96 -4.95 117.35 122.49 1crp s TYR 4 Ca 0.10 -0.37 0.09 0.00 -1.01 0.00 0.00 57.07 55.88 1crp s TYR 4 Cb -0.14 -2.70 -0.04 0.00 -0.11 0.00 0.00 41.96 38.97 1crp s TYR 4 CO -0.29 -1.36 -0.22 0.21 -1.11 0.00 0.00 175.55 172.79 1crp s LYS 5 N -4.91 1.31 -0.50 -0.62 2.20 -1.26 -2.19 119.74 113.78 1crp s LYS 5 Ca 0.63 -1.36 0.03 0.00 -0.36 0.00 0.00 55.97 54.91 1crp s LYS 5 Cb -0.06 -1.55 0.15 0.00 -1.51 0.00 0.00 37.83 34.85 1crp s LYS 5 CO 0.41 0.34 0.31 -0.51 -0.36 0.00 0.00 175.35 175.54 1crp s LEU 6 N -2.38 3.06 -0.18 5.43 1.43 -0.09 -1.83 118.68 124.12 1crp s LEU 6 Ca 0.14 -2.98 -0.29 0.00 -1.03 0.00 0.00 54.13 49.97 1crp s LEU 6 Cb -0.08 -1.11 -0.03 0.00 0.03 0.00 0.00 46.19 45.00 1crp s LEU 6 CO 0.07 -0.21 1.49 -0.69 0.23 0.00 0.00 176.35 177.23 1crp s VAL 7 N -0.12 3.88 0.11 -1.59 1.01 0.31 -2.11 120.40 121.89 1crp s VAL 7 Ca 0.22 1.03 -0.02 0.00 0.00 0.00 0.00 61.98 63.20 1crp s VAL 7 Cb -0.16 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 1crp s VAL 7 CO -0.07 -0.23 0.30 -0.69 0.00 0.00 0.00 175.10 174.42 1crp s VAL 8 N 4.40 5.27 -0.28 2.92 1.01 -1.08 -1.41 120.40 131.22 1crp s VAL 8 Ca 0.65 -0.18 -0.15 0.00 0.00 0.00 0.00 61.98 62.30 1crp s VAL 8 Cb -0.25 -3.63 0.10 0.00 0.00 0.00 0.00 36.38 32.60 1crp s VAL 8 CO 0.25 0.07 0.74 0.68 0.00 0.00 0.00 175.10 176.84 1crp s VAL 9 N -1.61 -0.12 0.00 2.92 -7.23 -1.12 -4.91 120.40 108.34 1crp s VAL 9 Ca 0.38 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.55 1crp s VAL 9 Cb -0.12 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.82 1crp s VAL 9 CO 0.26 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.66 1crp n GLY 10 N 4.35 1.03 3.89 2.32 0.00 -1.26 -0.55 105.19 114.98 1crp n GLY 10 Ca -0.19 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.29 1crp n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1crp s ALA 11 N -1.00 3.80 -1.05 4.61 0.00 -1.24 -5.00 121.76 121.88 1crp s ALA 11 Ca 0.00 -0.55 -0.23 0.00 0.00 0.00 0.00 51.96 51.18 1crp s ALA 11 Cb 0.00 -2.12 0.01 0.00 0.00 0.00 0.00 23.12 21.01 1crp s ALA 11 CO 0.00 0.66 1.70 0.20 0.00 0.00 0.00 175.76 178.32 1crp s GLY 12 N -2.20 0.88 0.00 0.00 0.00 -1.26 -2.67 107.32 102.08 1crp s GLY 12 Ca 0.37 -2.13 0.00 0.00 0.00 0.00 0.00 44.72 42.96 1crp s GLY 12 CO 0.22 3.03 0.00 0.61 0.00 0.00 0.00 173.10 176.96 1crp n GLY 13 N 6.52 0.56 0.37 0.20 0.00 -1.26 -5.00 105.19 106.57 1crp n GLY 13 Ca 0.39 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.50 1crp n GLY 13 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1crp h VAL 14 N 0.00 0.91 0.00 1.61 -1.51 -1.91 -3.45 116.25 111.90 1crp h VAL 14 Ca 0.00 -0.29 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 1crp h VAL 14 Cb 0.00 -0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.15 1crp h VAL 14 CO 0.00 0.15 0.00 0.61 -1.23 0.00 0.00 177.57 177.10 1crp n GLY 15 N -1.40 0.86 0.13 5.19 0.00 -1.26 -4.31 105.19 104.40 1crp n GLY 15 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 1crp n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1crp h LYS 16 N 0.00 -0.21 0.64 1.61 1.57 -1.87 -2.43 116.57 115.87 1crp h LYS 16 Ca 0.00 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1crp h LYS 16 Cb 0.00 0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.36 1crp h LYS 16 CO 0.00 0.19 -0.31 0.77 -0.57 0.00 0.00 179.45 179.53 1crp h SER 17 N -0.70 -0.73 -0.96 0.86 0.02 -1.92 -2.31 113.55 107.82 1crp h SER 17 Ca -0.02 -0.01 0.28 0.00 -0.84 0.00 0.00 61.79 61.19 1crp h SER 17 Cb 0.50 0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.19 1crp h SER 17 CO 0.04 -0.37 0.74 0.00 -1.14 0.00 0.00 176.83 176.09 1crp h ALA 18 N -0.97 2.87 -0.11 3.77 0.00 -1.85 0.26 119.26 123.24 1crp h ALA 18 Ca -0.09 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 1crp h ALA 18 Cb 0.70 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1crp h ALA 18 CO 0.14 -1.23 -0.39 -0.07 0.00 0.00 0.00 179.25 177.70 1crp h LEU 19 N 0.00 0.53 0.57 0.00 3.38 -1.21 -1.11 115.31 117.47 1crp h LEU 19 Ca 0.46 -0.62 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 1crp h LEU 19 Cb 1.92 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 42.52 1crp h LEU 19 CO -0.00 1.06 -0.27 0.74 0.09 0.00 0.00 178.44 180.05 1crp h THR 20 N 0.03 0.00 -0.52 0.22 2.02 0.04 -2.66 112.91 112.04 1crp h THR 20 Ca -0.02 -0.05 0.15 0.00 0.77 0.00 0.00 66.41 67.26 1crp h THR 20 Cb 1.02 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 1crp h THR 20 CO 0.08 0.00 0.40 0.40 0.37 0.00 0.00 175.52 176.77 1crp h ILE 21 N -0.81 0.65 0.42 3.11 5.03 -1.40 -1.97 117.51 122.54 1crp h ILE 21 Ca -0.08 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.65 1crp h ILE 21 Cb 0.58 0.71 -0.01 0.00 -3.03 0.00 0.00 36.82 35.08 1crp h ILE 21 CO 0.13 0.00 -0.26 1.56 -0.68 0.00 0.00 178.15 178.90 1crp h GLN 22 N 0.00 -0.63 0.00 2.37 1.08 -0.86 0.38 115.11 117.46 1crp h GLN 22 Ca 0.25 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.49 1crp h GLN 22 Cb 1.05 0.14 0.00 0.00 -0.05 0.00 0.00 27.48 28.62 1crp h GLN 22 CO -0.00 -0.42 0.00 -0.11 -0.95 0.00 0.00 178.83 177.35 1crp n LEU 23 N -5.39 0.71 0.00 1.46 0.00 -0.79 -4.08 117.00 108.91 1crp n LEU 23 Ca -0.11 0.66 0.00 0.00 0.00 0.00 0.00 56.01 56.57 1crp n LEU 23 Cb 0.29 -0.55 0.00 0.00 0.00 0.00 0.00 43.42 43.16 1crp n LEU 23 CO 0.34 -0.53 0.00 -0.38 0.00 0.00 0.00 177.39 176.81 1crp n ILE 24 N -2.27 0.00 0.00 1.96 5.41 -0.77 -4.97 119.36 118.72 1crp n ILE 24 Ca 0.02 0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.86 1crp n ILE 24 Cb 0.25 -0.79 0.00 0.00 -0.71 0.00 0.00 39.64 38.39 1crp n ILE 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1crp n GLN 25 N -1.35 0.00 0.00 0.38 6.02 0.05 -5.08 117.38 117.41 1crp n GLN 25 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1crp n GLN 25 Cb 0.00 -0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1crp n GLN 25 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1crp n ASN 26 N 0.00 0.00 -3.63 1.08 2.04 -1.23 -4.95 115.26 108.57 1crp n ASN 26 Ca 0.00 0.00 -0.05 0.00 -0.44 0.00 0.00 54.58 54.09 1crp n ASN 26 Cb 0.00 0.00 -0.05 0.00 -2.53 0.00 0.00 39.78 37.20 1crp n ASN 26 CO 0.00 0.00 0.00 -1.38 -0.44 0.00 0.00 177.26 175.44 1crp s HIS 27 N 0.00 -0.15 -0.71 -2.53 -3.43 -1.26 -5.08 115.29 102.12 1crp s HIS 27 Ca 0.00 0.30 -0.22 0.00 -0.80 0.00 0.00 55.06 54.34 1crp s HIS 27 Cb 0.00 0.47 0.08 0.00 -1.43 0.00 0.00 32.58 31.71 1crp s HIS 27 CO 0.00 -0.12 0.98 0.12 -2.00 0.00 0.00 174.74 173.73 1crp s PHE 28 N -0.71 2.78 0.18 0.38 5.36 -1.26 -4.57 117.98 120.13 1crp s PHE 28 Ca 0.06 -0.74 -0.26 0.00 -0.96 0.00 0.00 56.93 55.03 1crp s PHE 28 Cb -0.02 -4.28 -0.08 0.00 -0.34 0.00 0.00 43.02 38.30 1crp s PHE 28 CO -0.07 -1.60 0.80 0.14 -1.46 0.00 0.00 175.22 173.02 1crp s VAL 29 N 3.73 4.33 -0.18 3.12 -7.23 -1.26 -4.96 120.40 117.94 1crp s VAL 29 Ca 0.24 1.75 0.16 0.00 -1.81 0.00 0.00 61.98 62.31 1crp s VAL 29 Cb -0.15 -4.16 0.48 0.00 0.56 0.00 0.00 36.38 33.12 1crp s VAL 29 CO 0.06 0.51 1.38 0.47 -0.31 0.00 0.00 175.10 177.20 1crp n ASP 30 N 1.54 3.44 0.00 4.85 8.00 -1.26 -4.68 116.55 128.45 1crp n ASP 30 Ca -0.05 -3.12 0.00 0.00 0.71 0.00 0.00 54.79 52.33 1crp n ASP 30 Cb 0.49 -0.54 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 1crp n ASP 30 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1crp n GLU 31 N -0.75 0.00 -3.43 -1.24 0.28 -1.26 -5.15 120.64 109.09 1crp n GLU 31 Ca 0.22 0.00 -0.38 0.00 -0.16 0.00 0.00 57.16 56.84 1crp n GLU 31 Cb 0.86 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.67 1crp n GLU 31 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 1crp s TYR 32 N 0.00 3.65 -1.16 -1.84 5.04 -1.26 -4.34 117.35 117.44 1crp s TYR 32 Ca 0.00 0.96 -0.06 0.00 -2.44 0.00 0.00 57.07 55.53 1crp s TYR 32 Cb 0.00 -2.39 -0.03 0.00 0.35 0.00 0.00 41.96 39.89 1crp s TYR 32 CO 0.00 0.47 0.86 -3.47 -1.34 0.00 0.00 175.55 172.07 1crp n ASP 33 N 2.50 -4.08 0.12 4.32 -0.08 -1.26 -4.87 116.55 113.19 1crp n ASP 33 Ca -0.11 -0.77 0.01 0.00 -1.51 0.00 0.00 54.79 52.40 1crp n ASP 33 Cb 0.52 -4.58 0.33 0.00 2.34 0.00 0.00 41.12 39.73 1crp n ASP 33 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1crp h PRO 34 N -1.59 0.22 0.00 -0.67 0.13 -2.01 -3.36 132.00 124.71 1crp h PRO 34 Ca -0.62 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 1crp h PRO 34 Cb 1.34 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1crp h PRO 34 CO 0.49 0.46 0.00 0.25 -0.23 0.00 0.00 178.00 178.97 1crp n THR 35 N -4.17 0.00 -2.01 1.56 -2.24 -1.26 -4.58 114.28 101.58 1crp n THR 35 Ca -0.01 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.48 1crp n THR 35 Cb 0.35 1.65 0.04 0.00 -2.10 0.00 0.00 70.33 70.27 1crp n THR 35 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1crp s ILE 36 N 0.00 3.62 -0.27 2.28 1.01 -1.26 -4.53 121.20 122.05 1crp s ILE 36 Ca 0.00 0.40 -0.25 0.00 0.00 0.00 0.00 60.65 60.80 1crp s ILE 36 Cb 0.00 -3.50 0.10 0.00 0.01 0.00 0.00 42.46 39.07 1crp s ILE 36 CO 0.00 -0.63 0.92 -0.70 0.00 0.00 0.00 174.94 174.53 1crp s GLU 37 N -5.26 0.63 0.00 2.79 2.12 -1.26 -4.54 118.70 113.18 1crp s GLU 37 Ca 0.57 0.72 0.00 0.00 0.36 0.00 0.00 54.97 56.62 1crp s GLU 37 Cb -0.11 0.31 0.00 0.00 0.26 0.00 0.00 34.13 34.59 1crp s GLU 37 CO 0.50 -0.08 0.00 -3.47 -0.54 0.00 0.00 175.26 171.67 1crp n ASP 38 N 2.32 0.00 -3.25 -1.70 2.03 -1.26 -5.08 116.55 109.62 1crp n ASP 38 Ca -0.13 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.22 1crp n ASP 38 Cb 0.56 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.93 1crp n ASP 38 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1crp s SER 39 N 2.00 -0.47 0.55 1.67 1.04 -1.26 -4.89 113.70 112.34 1crp s SER 39 Ca 0.00 0.46 -0.12 0.00 0.48 0.00 0.00 55.95 56.77 1crp s SER 39 Cb 0.00 1.46 -0.05 0.00 0.10 0.00 0.00 66.02 67.52 1crp s SER 39 CO 0.00 -0.09 0.96 -0.31 0.98 0.00 0.00 173.24 174.78 1crp s TYR 40 N 2.63 3.55 -0.02 5.02 2.02 -0.95 -4.94 117.35 124.65 1crp s TYR 40 Ca -0.01 1.26 -0.02 0.00 -0.37 0.00 0.00 57.07 57.94 1crp s TYR 40 Cb -0.07 -2.66 0.00 0.00 -0.40 0.00 0.00 41.96 38.82 1crp s TYR 40 CO -0.14 -0.48 0.05 1.03 -1.57 0.00 0.00 175.55 174.44 1crp s ARG 41 N -4.63 0.12 -0.25 -0.62 3.00 -1.26 -2.16 118.95 113.15 1crp s ARG 41 Ca 0.55 -0.03 -0.21 0.00 0.00 0.00 0.00 55.73 56.04 1crp s ARG 41 Cb -0.10 0.05 0.07 0.00 0.00 0.00 0.00 34.95 34.96 1crp s ARG 41 CO 0.43 -0.02 0.65 0.21 0.00 0.00 0.00 175.30 176.57 1crp s LYS 42 N -0.23 0.74 -0.04 3.54 2.47 -1.21 -5.01 119.74 119.99 1crp s LYS 42 Ca -0.03 0.97 0.03 0.00 -1.56 0.00 0.00 55.97 55.38 1crp s LYS 42 Cb -0.02 0.31 -0.03 0.00 -1.46 0.00 0.00 37.83 36.63 1crp s LYS 42 CO 0.00 -0.11 -0.11 1.14 0.16 0.00 0.00 175.35 176.44 1crp s GLN 43 N 0.65 2.57 0.05 4.03 -2.07 -1.26 -2.14 119.66 121.49 1crp s GLN 43 Ca -0.02 -0.66 -0.21 0.00 -1.82 0.00 0.00 55.36 52.65 1crp s GLN 43 Cb -0.05 -2.46 0.05 0.00 -1.09 0.00 0.00 33.01 29.46 1crp s GLN 43 CO -0.04 0.63 0.49 0.14 -1.32 0.00 0.00 175.29 175.19 1crp s VAL 44 N -0.80 0.04 -0.16 3.63 -7.23 -1.25 -5.01 120.40 109.61 1crp s VAL 44 Ca 0.13 -0.31 -0.17 0.00 -1.81 0.00 0.00 61.98 59.82 1crp s VAL 44 Cb -0.11 -0.98 -0.04 0.00 0.56 0.00 0.00 36.38 35.81 1crp s VAL 44 CO 0.02 -0.17 0.43 -0.69 -0.31 0.00 0.00 175.10 174.37 1crp s VAL 45 N -2.55 5.20 -0.12 1.32 1.01 -1.26 -2.57 120.40 121.43 1crp s VAL 45 Ca -0.05 0.81 0.11 0.00 0.00 0.00 0.00 61.98 62.85 1crp s VAL 45 Cb -0.01 -3.76 -0.16 0.00 0.00 0.00 0.00 36.38 32.46 1crp s VAL 45 CO -0.03 0.29 0.05 -0.38 0.00 0.00 0.00 175.10 175.04 1crp n ILE 46 N 3.98 0.83 -2.75 2.22 5.41 -1.25 -4.86 119.36 122.94 1crp n ILE 46 Ca -0.08 -0.53 -0.08 0.00 1.00 0.00 0.00 62.75 63.06 1crp n ILE 46 Cb 0.51 -0.63 0.06 0.00 -0.71 0.00 0.00 39.64 38.87 1crp n ILE 46 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1crp n ASP 47 N -2.45 -2.80 -2.25 4.38 8.00 -1.26 -4.93 116.55 115.24 1crp n ASP 47 Ca -0.20 -3.39 -0.20 0.00 0.71 0.00 0.00 54.79 51.72 1crp n ASP 47 Cb 0.89 1.86 -0.02 0.00 -0.02 0.00 0.00 41.12 43.83 1crp n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1crp n GLY 48 N 1.40 -0.05 3.07 0.44 0.00 -1.26 -4.92 105.19 103.87 1crp n GLY 48 Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.10 1crp n GLY 48 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1crp s GLU 49 N -4.79 0.51 0.30 1.61 2.12 -1.26 -5.13 118.70 112.06 1crp s GLU 49 Ca 0.00 0.56 -0.29 0.00 0.36 0.00 0.00 54.97 55.59 1crp s GLU 49 Cb 0.00 0.12 -0.11 0.00 0.26 0.00 0.00 34.13 34.40 1crp s GLU 49 CO 0.00 -0.91 1.50 0.99 -0.54 0.00 0.00 175.26 176.31 1crp s THR 50 N 2.74 2.29 -0.07 -1.70 2.01 -1.26 -3.87 115.64 115.78 1crp s THR 50 Ca 0.13 0.26 -0.01 0.00 0.31 0.00 0.00 61.69 62.38 1crp s THR 50 Cb -0.12 -3.16 0.03 0.00 0.01 0.00 0.00 72.50 69.25 1crp s THR 50 CO -0.25 0.05 -0.02 0.00 -0.69 0.00 0.00 174.62 173.71 1crp s LEU 52 N 1.71 4.37 -0.30 0.00 2.96 -0.61 -3.93 118.68 122.87 1crp s LEU 52 Ca 0.02 2.61 0.01 0.00 -0.22 0.00 0.00 54.13 56.55 1crp s LEU 52 Cb -0.13 -3.59 0.07 0.00 0.50 0.00 0.00 46.19 43.04 1crp s LEU 52 CO -0.05 -0.83 -0.02 -0.76 -1.32 0.00 0.00 176.35 173.38 1crp s LEU 53 N 1.18 3.97 -0.13 -0.68 1.43 -0.91 -2.26 118.68 121.28 1crp s LEU 53 Ca 0.70 -1.54 -0.29 0.00 -1.03 0.00 0.00 54.13 51.98 1crp s LEU 53 Cb -0.44 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.13 1crp s LEU 53 CO 0.31 -0.28 0.97 -0.62 0.23 0.00 0.00 176.35 176.97 1crp s ASP 54 N 1.18 7.17 -0.18 2.29 -1.08 -0.93 -3.31 116.67 121.81 1crp s ASP 54 Ca -0.03 1.44 -0.07 0.00 -0.52 0.00 0.00 52.55 53.37 1crp s ASP 54 Cb -0.20 -2.53 -0.04 0.00 -1.46 0.00 0.00 42.92 38.69 1crp s ASP 54 CO -0.04 -0.46 0.06 -0.63 0.52 0.00 0.00 175.17 174.62 1crp s ILE 55 N 2.16 4.78 -0.73 4.11 -1.09 -0.92 -0.91 121.20 128.60 1crp s ILE 55 Ca 0.46 -0.04 0.04 0.00 -2.23 0.00 0.00 60.65 58.88 1crp s ILE 55 Cb -0.18 -3.15 0.18 0.00 -1.58 0.00 0.00 42.46 37.73 1crp s ILE 55 CO 0.16 0.46 0.54 -0.22 -1.23 0.00 0.00 174.94 174.65 1crp s LEU 56 N 0.34 4.96 0.41 2.97 2.96 -0.90 -2.25 118.68 127.18 1crp s LEU 56 Ca 0.03 -3.79 0.20 0.00 -0.22 0.00 0.00 54.13 50.35 1crp s LEU 56 Cb -0.12 -1.70 0.87 0.00 0.50 0.00 0.00 46.19 45.74 1crp s LEU 56 CO 0.00 -0.11 1.83 -0.78 -1.32 0.00 0.00 176.35 175.96 1crp h ASP 57 N 5.58 0.00 -2.96 3.68 1.82 -1.92 -2.86 116.42 119.77 1crp h ASP 57 Ca 0.14 0.00 0.32 0.00 -0.39 0.00 0.00 57.03 57.10 1crp h ASP 57 Cb 0.77 0.00 -0.11 0.00 0.68 0.00 0.00 39.33 40.67 1crp h ASP 57 CO 0.74 0.31 -0.69 0.35 -1.61 0.00 0.00 179.24 178.34 1crp n THR 58 N -3.63 0.00 -2.94 2.25 -2.24 -1.26 -4.85 114.28 101.61 1crp n THR 58 Ca -0.01 0.31 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 1crp n THR 58 Cb 0.43 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 1crp n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1crp n ALA 59 N -2.85 0.00 -0.62 6.98 0.00 -1.26 -4.97 120.51 117.79 1crp n ALA 59 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.11 1crp n ALA 59 Cb 0.65 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.30 1crp n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1crp n GLY 60 N 0.00 -1.26 3.39 0.00 0.00 -1.26 -5.02 105.19 101.04 1crp n GLY 60 Ca 0.00 -0.88 -0.24 0.00 0.00 0.00 0.00 46.02 44.90 1crp n GLY 60 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1crp s GLN 61 N -4.36 1.45 -0.31 1.61 -0.21 -1.26 -4.78 119.66 111.79 1crp s GLN 61 Ca 0.66 -1.53 0.08 0.00 0.02 0.00 0.00 55.36 54.59 1crp s GLN 61 Cb -0.23 -1.61 0.52 0.00 1.00 0.00 0.00 33.01 32.69 1crp s GLN 61 CO 0.62 0.33 1.50 0.39 -2.12 0.00 0.00 175.29 176.01 1crp n GLU 62 N 0.09 1.92 -2.37 2.91 1.02 -1.26 -5.01 120.64 117.95 1crp n GLU 62 Ca -0.11 -3.22 0.01 0.00 -0.02 0.00 0.00 57.16 53.82 1crp n GLU 62 Cb 0.57 -1.87 0.00 0.00 -0.02 0.00 0.00 31.44 30.13 1crp n GLU 62 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1crp n GLU 63 N -1.12 0.03 -1.82 3.49 -0.58 -1.26 -5.12 120.64 114.27 1crp n GLU 63 Ca 0.36 -0.16 -0.42 0.00 -0.42 0.00 0.00 57.16 56.52 1crp n GLU 63 Cb 1.08 0.27 -0.03 0.00 -0.57 0.00 0.00 31.44 32.19 1crp n GLU 63 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 1crp s TYR 64 N -2.63 2.95 0.44 -0.32 5.04 -1.26 -4.93 117.35 116.64 1crp s TYR 64 Ca 0.07 0.45 -0.26 0.00 -2.44 0.00 0.00 57.07 54.90 1crp s TYR 64 Cb -0.00 -4.05 -0.08 0.00 0.35 0.00 0.00 41.96 38.17 1crp s TYR 64 CO -0.00 -3.95 1.40 -1.54 -1.34 0.00 0.00 175.55 170.12 1crp s SER 65 N 1.21 5.99 0.00 4.32 1.04 -1.26 -4.75 113.70 120.25 1crp s SER 65 Ca 0.73 2.87 0.00 0.00 0.48 0.00 0.00 55.95 60.03 1crp s SER 65 Cb -0.47 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.00 1crp s SER 65 CO 0.32 -1.09 0.00 0.00 0.98 0.00 0.00 173.24 173.45 1crp n ALA 66 N -0.09 0.00 0.11 5.32 0.00 -1.26 -4.94 120.51 119.64 1crp n ALA 66 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.47 1crp n ALA 66 Cb 0.42 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.85 1crp n ALA 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1crp h MET 67 N 0.00 0.00 -0.11 0.00 -0.00 -1.98 -2.58 114.93 110.25 1crp h MET 67 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.66 1crp h MET 67 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.60 1crp h MET 67 CO 0.00 0.71 -0.10 -0.09 -0.00 0.00 0.00 176.91 177.43 1crp h ARG 68 N 0.00 0.26 -0.73 -0.10 2.43 -1.96 -0.71 114.38 113.58 1crp h ARG 68 Ca -0.01 -0.13 -0.06 0.00 -0.81 0.00 0.00 59.98 58.97 1crp h ARG 68 Cb 1.52 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 31.04 1crp h ARG 68 CO 0.09 0.66 0.23 -0.44 -1.51 0.00 0.00 179.97 179.00 1crp h ASP 69 N -0.13 1.05 0.29 -3.80 3.32 -1.93 -0.95 116.42 114.27 1crp h ASP 69 Ca 0.02 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.84 1crp h ASP 69 Cb 0.60 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 1crp h ASP 69 CO 0.02 0.97 -0.16 -0.61 -1.72 0.00 0.00 179.24 177.74 1crp h GLN 70 N 1.08 0.00 -0.12 3.56 5.75 -1.35 -1.57 115.11 122.45 1crp h GLN 70 Ca 0.24 0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 58.59 1crp h GLN 70 Cb 0.29 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.83 1crp h GLN 70 CO -0.01 0.16 -0.54 -0.92 -2.65 0.00 0.00 178.83 174.87 1crp h TYR 71 N 0.00 0.45 0.00 3.99 5.03 0.26 -2.05 116.97 124.65 1crp h TYR 71 Ca -0.00 -0.16 -0.01 0.00 2.58 0.00 0.00 58.73 61.15 1crp h TYR 71 Cb 0.35 -0.09 -0.00 0.00 1.55 0.00 0.00 36.73 38.54 1crp h TYR 71 CO 0.00 0.82 -0.03 0.52 -1.32 0.00 0.00 178.16 178.15 1crp h MET 72 N 0.28 0.00 0.00 1.82 2.86 -0.83 -1.11 114.93 117.95 1crp h MET 72 Ca 0.01 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.43 1crp h MET 72 Cb 1.04 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.66 1crp h MET 72 CO 0.09 0.03 -1.73 -2.13 1.06 0.00 0.00 176.91 174.23 1crp n ARG 73 N -3.49 0.64 -0.05 1.72 0.63 -0.89 -4.59 116.66 110.63 1crp n ARG 73 Ca -0.02 0.15 -0.02 0.00 -0.92 0.00 0.00 57.85 57.04 1crp n ARG 73 Cb 0.13 -1.72 -0.01 0.00 0.45 0.00 0.00 32.46 31.32 1crp n ARG 73 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1crp h THR 74 N 0.00 0.00 -2.80 5.15 1.35 -0.68 -3.48 112.91 112.45 1crp h THR 74 Ca -0.25 -0.78 -0.36 0.00 -0.55 0.00 0.00 66.41 64.46 1crp h THR 74 Cb 1.76 0.00 0.21 0.00 -1.73 0.00 0.00 68.15 68.38 1crp h THR 74 CO 0.04 0.00 -0.19 0.61 -0.25 0.00 0.00 175.52 175.73 1crp n GLY 75 N 1.74 -3.36 0.00 5.82 0.00 -0.49 -5.00 105.19 103.90 1crp n GLY 75 Ca -0.03 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1crp n GLY 75 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1crp n GLU 76 N -4.97 0.81 -2.36 1.61 4.71 -1.26 -4.91 120.64 114.26 1crp n GLU 76 Ca 0.10 0.00 -0.36 0.00 -0.01 0.00 0.00 57.16 56.89 1crp n GLU 76 Cb 0.56 -0.42 -0.04 0.00 -1.01 0.00 0.00 31.44 30.53 1crp n GLU 76 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1crp s GLY 77 N -0.84 0.84 -1.26 0.62 0.00 -0.76 -3.83 107.32 102.10 1crp s GLY 77 Ca 0.00 -1.94 -0.15 0.00 0.00 0.00 0.00 44.72 42.63 1crp s GLY 77 CO 0.00 2.99 1.60 0.69 0.00 0.00 0.00 173.10 178.38 1crp n PHE 78 N 10.82 4.72 -2.29 1.90 3.01 -1.11 0.12 117.46 134.62 1crp n PHE 78 Ca 0.35 -3.12 -0.35 0.00 1.01 0.00 0.00 57.45 55.33 1crp n PHE 78 Cb 0.49 -2.36 -0.04 0.00 -0.01 0.00 0.00 39.48 37.57 1crp n PHE 78 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1crp s LEU 79 N 2.52 3.30 -1.04 4.37 2.96 -0.50 -2.35 118.68 127.94 1crp s LEU 79 Ca 0.47 -0.75 -0.23 0.00 -0.22 0.00 0.00 54.13 53.40 1crp s LEU 79 Cb 0.01 -2.56 -0.03 0.00 0.50 0.00 0.00 46.19 44.11 1crp s LEU 79 CO 0.03 -2.14 1.84 0.00 -1.32 0.00 0.00 176.35 174.76 1crp s VAL 81 N 8.88 2.76 -0.22 0.00 1.01 0.28 -2.66 120.40 130.45 1crp s VAL 81 Ca 0.64 0.74 -0.06 0.00 0.00 0.00 0.00 61.98 63.30 1crp s VAL 81 Cb -0.03 -3.47 0.11 0.00 0.00 0.00 0.00 36.38 32.99 1crp s VAL 81 CO 0.02 0.17 0.44 0.72 0.00 0.00 0.00 175.10 176.45 1crp s PHE 82 N -0.97 -0.89 -0.15 5.22 -0.12 -0.85 -3.70 117.98 116.51 1crp s PHE 82 Ca 0.50 1.44 -0.29 0.00 -0.05 0.00 0.00 56.93 58.53 1crp s PHE 82 Cb -0.40 0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 42.26 1crp s PHE 82 CO 0.51 -0.57 1.41 0.00 -0.05 0.00 0.00 175.22 176.51 1crp s ALA 83 N 2.64 3.59 0.38 1.99 0.00 -1.26 -1.19 121.76 127.91 1crp s ALA 83 Ca 0.03 0.56 0.06 0.00 0.00 0.00 0.00 51.96 52.61 1crp s ALA 83 Cb -0.13 -3.69 0.74 0.00 0.00 0.00 0.00 23.12 20.05 1crp s ALA 83 CO -0.14 -1.35 1.97 -0.84 0.00 0.00 0.00 175.76 175.39 1crp h ILE 84 N 5.61 1.15 0.00 0.00 -0.00 -1.76 -1.59 117.51 120.92 1crp h ILE 84 Ca -0.31 -0.50 -0.13 0.00 -0.00 0.00 0.00 64.86 63.93 1crp h ILE 84 Cb 1.13 0.75 -0.02 0.00 -0.00 0.00 0.00 36.82 38.68 1crp h ILE 84 CO 0.97 0.19 -0.60 -1.13 -0.00 0.00 0.00 178.15 177.58 1crp h ASN 85 N 0.50 0.00 -2.93 2.16 -0.73 -1.82 -2.45 115.58 110.32 1crp h ASN 85 Ca 0.12 0.00 -0.70 0.00 1.87 0.00 0.00 56.30 57.59 1crp h ASN 85 Cb 0.14 0.00 -0.19 0.00 0.27 0.00 0.00 38.32 38.54 1crp h ASN 85 CO -0.01 0.60 0.12 0.21 -0.37 0.00 0.00 177.43 177.98 1crp s ASN 86 N -6.84 6.19 0.52 1.15 3.84 -0.60 -4.53 114.94 114.67 1crp s ASN 86 Ca -0.01 -1.37 0.21 0.00 0.21 0.00 0.00 52.86 51.90 1crp s ASN 86 Cb 0.13 -2.30 1.37 0.00 -0.55 0.00 0.00 41.25 39.89 1crp s ASN 86 CO 0.76 -1.10 2.12 0.74 -2.79 0.00 0.00 177.10 176.82 1crp h THR 87 N 5.92 0.84 -0.27 -5.21 2.02 -1.76 -1.96 112.91 112.49 1crp h THR 87 Ca -0.29 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 1crp h THR 87 Cb 1.09 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.64 1crp h THR 87 CO 1.09 0.07 0.10 0.50 0.37 0.00 0.00 175.52 177.65 1crp h LYS 88 N 0.00 0.37 -0.06 6.66 1.63 -1.90 -0.55 116.57 122.72 1crp h LYS 88 Ca -0.00 -0.04 -0.10 0.00 -0.85 0.00 0.00 60.65 59.66 1crp h LYS 88 Cb 0.15 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 1crp h LYS 88 CO 0.01 0.32 -0.41 0.66 -3.45 0.00 0.00 179.45 176.58 1crp h SER 89 N 0.37 0.14 -0.02 4.20 4.64 -1.62 -1.57 113.55 119.69 1crp h SER 89 Ca 0.09 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1crp h SER 89 Cb 0.09 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1crp h SER 89 CO -0.01 0.54 0.01 0.15 -0.87 0.00 0.00 176.83 176.65 1crp h PHE 90 N 0.11 0.03 0.00 4.77 3.04 -1.14 -1.28 116.94 122.46 1crp h PHE 90 Ca 0.01 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.93 1crp h PHE 90 Cb 0.78 -0.01 -0.00 0.00 2.56 0.00 0.00 35.95 39.27 1crp h PHE 90 CO 0.01 0.16 -0.14 0.93 -2.02 0.00 0.00 178.31 177.24 1crp h GLU 91 N -0.11 0.00 -0.03 1.11 5.08 -1.28 -1.33 114.58 118.01 1crp h GLU 91 Ca 0.01 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 1crp h GLU 91 Cb 0.14 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1crp h GLU 91 CO -0.00 0.14 -0.49 -0.44 -1.00 0.00 0.00 179.01 177.22 1crp h ASP 92 N 0.00 0.09 0.59 1.42 3.32 -0.40 -2.73 116.42 118.70 1crp h ASP 92 Ca -0.00 -0.04 -0.14 0.00 0.02 0.00 0.00 57.03 56.86 1crp h ASP 92 Cb 0.32 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 1crp h ASP 92 CO 0.02 0.57 -0.65 0.40 -1.72 0.00 0.00 179.24 177.85 1crp h ILE 93 N 0.07 1.45 -0.96 0.35 1.08 -0.15 -0.96 117.51 118.40 1crp h ILE 93 Ca 0.00 -2.20 0.01 0.00 -0.39 0.00 0.00 64.86 62.28 1crp h ILE 93 Cb 0.90 2.18 -0.05 0.00 -3.07 0.00 0.00 36.82 36.78 1crp h ILE 93 CO 0.07 0.63 0.63 -0.74 -0.69 0.00 0.00 178.15 178.05 1crp h HIS 94 N 0.04 1.20 0.00 1.37 2.76 -1.26 -2.45 115.15 116.81 1crp h HIS 94 Ca -0.01 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.14 1crp h HIS 94 Cb 1.16 -0.41 -0.01 0.00 1.55 0.00 0.00 27.41 29.71 1crp h HIS 94 CO 0.01 0.76 -1.15 1.04 -1.30 0.00 0.00 177.93 177.29 1crp n GLN 95 N -4.42 0.61 0.23 5.26 6.02 -1.17 -3.76 117.38 120.15 1crp n GLN 95 Ca 0.11 0.15 0.15 0.00 -0.01 0.00 0.00 57.00 57.40 1crp n GLN 95 Cb 0.01 -1.82 0.62 0.00 1.02 0.00 0.00 30.24 30.08 1crp n GLN 95 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.06 177.93 1crp h TYR 96 N 0.00 0.00 -0.73 1.08 0.05 -0.80 -2.46 116.97 114.11 1crp h TYR 96 Ca -0.05 0.00 -0.37 0.00 0.05 0.00 0.00 58.73 58.36 1crp h TYR 96 Cb 1.18 0.00 -0.22 0.00 1.01 0.00 0.00 36.73 38.71 1crp h TYR 96 CO 0.00 0.00 0.47 -2.13 -1.05 0.00 0.00 178.16 175.45 1crp n ARG 97 N -2.79 2.06 0.00 4.88 0.00 -0.96 -3.74 116.66 116.12 1crp n ARG 97 Ca 0.01 -2.27 0.00 0.00 -0.00 0.00 0.00 57.85 55.59 1crp n ARG 97 Cb 0.28 -1.90 0.00 0.00 0.00 0.00 0.00 32.46 30.84 1crp n ARG 97 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1crp n GLU 98 N -0.66 0.00 0.23 -0.14 1.02 -0.93 -4.66 120.64 115.49 1crp n GLU 98 Ca 0.44 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.63 1crp n GLU 98 Cb 1.36 -0.37 0.52 0.00 -0.02 0.00 0.00 31.44 32.93 1crp n GLU 98 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1crp h GLN 99 N 0.00 0.00 -0.45 3.49 4.15 -1.70 -0.67 115.11 119.94 1crp h GLN 99 Ca 0.00 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.32 1crp h GLN 99 Cb 0.41 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.08 1crp h GLN 99 CO 0.00 0.18 -0.14 0.82 -1.93 0.00 0.00 178.83 177.76 1crp h ILE 100 N 0.00 1.26 -0.01 2.39 2.04 -1.85 -0.66 117.51 120.68 1crp h ILE 100 Ca -0.00 -1.24 -0.06 0.00 1.00 0.00 0.00 64.86 64.56 1crp h ILE 100 Cb 0.33 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 1crp h ILE 100 CO 0.02 0.42 -0.30 0.11 0.00 0.00 0.00 178.15 178.41 1crp h LYS 101 N 0.74 0.01 0.66 2.37 1.57 -1.33 -2.63 116.57 117.97 1crp h LYS 101 Ca 0.12 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 1crp h LYS 101 Cb 0.65 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.96 1crp h LYS 101 CO 0.05 0.31 -0.32 -0.09 -0.57 0.00 0.00 179.45 178.83 1crp h ARG 102 N 0.01 -0.86 0.50 3.15 2.43 0.08 1.04 114.38 120.72 1crp h ARG 102 Ca -0.00 0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1crp h ARG 102 Cb 0.54 0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.26 1crp h ARG 102 CO 0.04 -0.56 -0.50 0.28 -1.51 0.00 0.00 179.97 177.72 1crp h VAL 103 N -0.95 0.02 -0.25 0.20 2.07 -1.21 -2.16 116.25 113.97 1crp h VAL 103 Ca -0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1crp h VAL 103 Cb 0.70 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1crp h VAL 103 CO 0.15 0.00 0.00 0.29 0.02 0.00 0.00 177.57 178.03 1crp n LYS 104 N -5.57 1.58 -4.46 1.57 5.02 -1.01 -4.87 118.16 110.43 1crp n LYS 104 Ca -0.12 -0.89 -0.40 0.00 -2.02 0.00 0.00 58.31 54.88 1crp n LYS 104 Cb 0.46 -1.20 -0.08 0.00 -0.02 0.00 0.00 35.03 34.20 1crp n LYS 104 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1crp n ASP 105 N 0.23 -1.37 -3.60 4.39 5.75 0.35 -4.83 116.55 117.46 1crp n ASP 105 Ca 0.08 -1.23 0.01 0.00 -0.01 0.00 0.00 54.79 53.64 1crp n ASP 105 Cb 0.21 -1.74 -0.01 0.00 -1.03 0.00 0.00 41.12 38.55 1crp n ASP 105 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1crp s SER 106 N -3.51 -0.04 -0.78 -1.12 0.01 -0.46 -4.99 113.70 102.82 1crp s SER 106 Ca 0.64 -0.04 0.03 0.00 1.31 0.00 0.00 55.95 57.89 1crp s SER 106 Cb -0.37 0.08 0.26 0.00 0.21 0.00 0.00 66.02 66.20 1crp s SER 106 CO 1.01 -0.14 0.94 -0.67 0.41 0.00 0.00 173.24 174.79 1crp n ASP 107 N -0.33 4.48 -2.32 2.44 2.03 -1.26 -4.14 116.55 117.45 1crp n ASP 107 Ca -0.05 -3.41 0.00 0.00 0.52 0.00 0.00 54.79 51.85 1crp n ASP 107 Cb 0.61 -0.86 0.04 0.00 -0.72 0.00 0.00 41.12 40.20 1crp n ASP 107 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1crp n ASP 108 N 1.09 1.57 -4.90 1.67 2.03 -1.26 -5.09 116.55 111.67 1crp n ASP 108 Ca 0.28 -2.15 -0.31 0.00 0.52 0.00 0.00 54.79 53.13 1crp n ASP 108 Cb 0.38 -0.42 -0.05 0.00 -0.72 0.00 0.00 41.12 40.32 1crp n ASP 108 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1crp s VAL 109 N -2.64 5.15 -0.98 5.18 1.01 -1.26 -4.97 120.40 121.89 1crp s VAL 109 Ca 0.31 0.05 -0.24 0.00 0.00 0.00 0.00 61.98 62.09 1crp s VAL 109 Cb 0.35 -3.63 -0.08 0.00 0.00 0.00 0.00 36.38 33.02 1crp s VAL 109 CO -0.08 0.02 2.01 -2.16 0.00 0.00 0.00 175.10 174.89 1crp s PRO 110 N -2.70 2.33 0.44 2.72 0.05 -1.25 -4.92 135.00 131.68 1crp s PRO 110 Ca 0.41 -0.47 -0.12 0.00 0.05 0.00 0.00 61.00 60.88 1crp s PRO 110 Cb -0.12 -5.08 -0.07 0.00 0.05 0.00 0.00 34.50 29.29 1crp s PRO 110 CO 0.25 -3.82 0.84 1.41 0.05 0.00 0.00 177.00 175.72 1crp s MET 111 N 7.17 3.82 -0.29 4.56 1.75 -1.26 -2.77 119.30 132.27 1crp s MET 111 Ca 0.73 0.61 0.02 0.00 -1.25 0.00 0.00 55.69 55.80 1crp s MET 111 Cb -0.06 -2.31 0.16 0.00 2.84 0.00 0.00 34.83 35.47 1crp s MET 111 CO 0.06 -0.12 0.43 0.08 -0.65 0.00 0.00 175.02 174.81 1crp s VAL 112 N -2.48 -0.67 -0.47 10.11 1.01 -0.99 -4.28 120.40 122.63 1crp s VAL 112 Ca 0.53 -0.27 -0.27 0.00 0.00 0.00 0.00 61.98 61.98 1crp s VAL 112 Cb -0.10 -0.99 0.03 0.00 0.00 0.00 0.00 36.38 35.32 1crp s VAL 112 CO 0.32 -0.26 1.02 -0.22 0.00 0.00 0.00 175.10 175.97 1crp s LEU 113 N 2.57 3.84 -0.08 3.92 1.98 -0.81 -1.42 118.68 128.69 1crp s LEU 113 Ca 0.10 0.24 0.03 0.00 -2.89 0.00 0.00 54.13 51.61 1crp s LEU 113 Cb -0.12 -3.33 -0.02 0.00 0.66 0.00 0.00 46.19 43.38 1crp s LEU 113 CO -0.30 -1.15 -0.15 -0.69 -1.89 0.00 0.00 176.35 172.17 1crp s VAL 114 N 4.08 2.94 -0.56 1.68 1.01 -1.09 -2.57 120.40 125.90 1crp s VAL 114 Ca 0.41 -0.74 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 1crp s VAL 114 Cb -0.09 -2.17 0.08 0.00 0.00 0.00 0.00 36.38 34.20 1crp s VAL 114 CO 0.28 0.57 0.68 -0.83 0.00 0.00 0.00 175.10 175.81 1crp s GLY 115 N -0.30 1.75 0.61 4.51 0.00 -0.89 -2.01 107.32 111.01 1crp s GLY 115 Ca 0.02 -2.01 -0.08 0.00 0.00 0.00 0.00 44.72 42.66 1crp s GLY 115 CO 0.03 1.56 0.95 0.21 0.00 0.00 0.00 173.10 175.84 1crp s ASN 116 N 3.25 5.66 -0.47 1.64 3.04 -0.33 -1.26 114.94 126.47 1crp s ASN 116 Ca 0.13 0.88 -0.00 0.00 0.04 0.00 0.00 52.86 53.91 1crp s ASN 116 Cb -0.22 -1.86 -0.00 0.00 -1.54 0.00 0.00 41.25 37.63 1crp s ASN 116 CO 0.09 -1.07 0.39 1.17 -3.04 0.00 0.00 177.10 174.64 1crp n LYS 117 N -2.67 -2.52 -0.32 0.43 4.81 -0.22 -2.63 118.16 115.05 1crp n LYS 117 Ca 0.05 0.34 0.10 0.00 -0.87 0.00 0.00 58.31 57.93 1crp n LYS 117 Cb 0.57 -3.80 0.28 0.00 0.02 0.00 0.00 35.03 32.10 1crp n LYS 117 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1crp n ASP 119 N 1.33 7.19 -3.54 0.00 5.75 -1.26 -4.87 116.55 121.15 1crp n ASP 119 Ca 0.21 -3.02 -0.10 0.00 -0.01 0.00 0.00 54.79 51.87 1crp n ASP 119 Cb 0.53 -1.34 -0.02 0.00 -1.03 0.00 0.00 41.12 39.26 1crp n ASP 119 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 1crp s LEU 120 N -1.62 -0.46 -0.08 -2.12 0.05 -1.26 -5.06 118.68 108.12 1crp s LEU 120 Ca 0.59 -0.15 0.01 0.00 0.05 0.00 0.00 54.13 54.64 1crp s LEU 120 Cb 0.28 2.55 -0.25 0.00 -2.05 0.00 0.00 46.19 46.71 1crp s LEU 120 CO -0.13 -1.01 0.53 0.00 -0.55 0.00 0.00 176.35 175.19 1crp h ALA 121 N 2.00 0.55 -0.64 1.48 0.00 -1.98 -3.43 119.26 117.25 1crp h ALA 121 Ca -0.29 -1.40 -0.14 0.00 0.00 0.00 0.00 54.91 53.09 1crp h ALA 121 Cb 1.29 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 19.65 1crp h ALA 121 CO 0.33 1.41 0.42 0.00 0.00 0.00 0.00 179.25 181.41 1crp s ALA 122 N -2.58 1.02 -0.67 0.00 0.00 -1.26 -4.87 121.76 113.40 1crp s ALA 122 Ca -0.14 -0.77 -0.14 0.00 0.00 0.00 0.00 51.96 50.91 1crp s ALA 122 Cb 0.07 -4.53 0.17 0.00 0.00 0.00 0.00 23.12 18.83 1crp s ALA 122 CO 0.80 -5.48 0.61 0.50 0.00 0.00 0.00 175.76 172.19 1crp s ARG 123 N 8.47 3.22 0.27 0.00 3.52 -1.26 -4.65 118.95 128.52 1crp s ARG 123 Ca 0.89 -2.09 0.05 0.00 -0.13 0.00 0.00 55.73 54.45 1crp s ARG 123 Cb -0.13 -4.31 0.37 0.00 -1.56 0.00 0.00 34.95 29.33 1crp s ARG 123 CO 0.10 -1.30 1.65 1.79 -0.81 0.00 0.00 175.30 176.73 1crp h THR 124 N 5.37 1.33 -3.06 4.11 1.35 -1.80 -3.37 112.91 116.85 1crp h THR 124 Ca -0.10 -1.66 -0.74 0.00 -0.55 0.00 0.00 66.41 63.36 1crp h THR 124 Cb 1.06 1.76 -0.23 0.00 -1.73 0.00 0.00 68.15 69.02 1crp h THR 124 CO 0.88 0.50 -0.14 -0.69 -0.25 0.00 0.00 175.52 175.82 1crp s VAL 125 N -4.04 5.11 1.39 6.82 1.01 -0.92 -5.01 120.40 124.76 1crp s VAL 125 Ca -0.05 -1.34 -0.22 0.00 0.00 0.00 0.00 61.98 60.37 1crp s VAL 125 Cb 0.13 -4.37 0.35 0.00 0.00 0.00 0.00 36.38 32.49 1crp s VAL 125 CO 0.78 -0.92 0.78 -1.84 0.00 0.00 0.00 175.10 173.91 1crp n GLU 126 N 5.53 -4.42 -1.27 2.72 0.28 -1.26 -4.84 120.64 117.38 1crp n GLU 126 Ca -0.13 -1.31 -0.27 0.00 -0.16 0.00 0.00 57.16 55.29 1crp n GLU 126 Cb 0.41 -1.83 0.03 0.00 1.43 0.00 0.00 31.44 31.48 1crp n GLU 126 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1crp n SER 127 N -4.92 6.94 0.00 -1.84 3.41 -1.26 -4.16 113.62 111.79 1crp n SER 127 Ca 0.12 -3.39 0.00 0.00 -0.26 0.00 0.00 58.87 55.35 1crp n SER 127 Cb 0.54 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.41 1crp n SER 127 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1crp n ARG 128 N 0.03 0.00 -0.07 4.33 3.00 -1.26 -4.71 116.66 117.97 1crp n ARG 128 Ca 0.46 0.00 -0.10 0.00 -0.00 0.00 0.00 57.85 58.21 1crp n ARG 128 Cb 0.55 -0.23 -0.04 0.00 0.00 0.00 0.00 32.46 32.75 1crp n ARG 128 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 1crp h GLN 129 N 0.00 0.35 0.00 -0.14 1.08 -1.94 -1.66 115.11 112.80 1crp h GLN 129 Ca 0.00 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.11 1crp h GLN 129 Cb 0.00 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.37 1crp h GLN 129 CO 0.00 0.40 -0.14 0.00 -0.95 0.00 0.00 178.83 178.13 1crp h ALA 130 N 0.93 1.76 -0.58 3.87 0.00 -1.90 -1.83 119.26 121.52 1crp h ALA 130 Ca 0.08 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1crp h ALA 130 Cb 0.18 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1crp h ALA 130 CO -0.01 0.18 -0.05 1.96 0.00 0.00 0.00 179.25 181.33 1crp h GLN 131 N 0.00 1.05 0.00 0.00 4.20 -1.63 -2.48 115.11 116.25 1crp h GLN 131 Ca -0.00 -0.36 -0.04 0.00 0.06 0.00 0.00 58.65 58.31 1crp h GLN 131 Cb 0.25 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1crp h GLN 131 CO 0.02 1.05 -0.19 -0.44 -0.67 0.00 0.00 178.83 178.60 1crp h ASP 132 N 0.95 0.00 0.05 1.46 3.32 -0.55 -2.36 116.42 119.30 1crp h ASP 132 Ca 0.16 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.00 1crp h ASP 132 Cb 0.61 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.18 1crp h ASP 132 CO 0.04 0.19 -0.83 0.25 -1.72 0.00 0.00 179.24 177.17 1crp h LEU 133 N 0.00 0.64 0.10 1.55 7.12 -1.08 -3.15 115.31 120.49 1crp h LEU 133 Ca -0.00 -0.81 -0.14 0.00 0.13 0.00 0.00 57.88 57.06 1crp h LEU 133 Cb 0.94 -0.20 0.02 0.00 -0.53 0.00 0.00 40.66 40.89 1crp h LEU 133 CO 0.02 1.38 -0.62 0.00 -0.13 0.00 0.00 178.44 179.09 1crp h ALA 134 N 0.28 -0.06 -0.80 1.25 0.00 -1.50 -3.31 119.26 115.13 1crp h ALA 134 Ca -0.12 -0.64 0.12 0.00 0.00 0.00 0.00 54.91 54.28 1crp h ALA 134 Cb 1.55 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 19.35 1crp h ALA 134 CO 0.16 0.29 0.52 0.07 0.00 0.00 0.00 179.25 180.29 1crp h ARG 135 N -0.47 0.59 -0.98 0.00 0.11 -1.58 0.62 114.38 112.67 1crp h ARG 135 Ca -0.10 -0.04 0.02 0.00 0.10 0.00 0.00 59.98 59.96 1crp h ARG 135 Cb 1.46 -0.13 -0.05 0.00 1.11 0.00 0.00 29.97 32.36 1crp h ARG 135 CO 0.12 0.39 0.65 1.03 0.10 0.00 0.00 179.97 182.25 1crp h SER 136 N 0.61 1.10 0.26 0.08 0.87 -1.63 -1.69 113.55 113.14 1crp h SER 136 Ca 0.38 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.92 1crp h SER 136 Cb 0.64 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1crp h SER 136 CO -0.15 0.78 -0.34 -1.22 -0.53 0.00 0.00 176.83 175.36 1crp n TYR 137 N -4.43 0.00 -3.07 2.24 4.01 -0.26 -4.95 117.16 110.70 1crp n TYR 137 Ca 0.12 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.73 1crp n TYR 137 Cb 0.05 -0.13 0.05 0.00 -0.31 0.00 0.00 39.34 39.00 1crp n TYR 137 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1crp n GLY 138 N 1.38 0.04 3.45 2.72 0.00 0.05 -5.03 105.19 107.80 1crp n GLY 138 Ca 0.10 -0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 1crp n GLY 138 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1crp s ILE 139 N -3.19 2.54 0.35 -0.61 -4.36 -0.95 -5.02 121.20 109.96 1crp s ILE 139 Ca 0.26 -1.83 -0.28 0.00 -0.26 0.00 0.00 60.65 58.54 1crp s ILE 139 Cb -0.11 -2.20 -0.10 0.00 1.25 0.00 0.00 42.46 41.30 1crp s ILE 139 CO 0.43 -0.03 1.38 -2.16 0.24 0.00 0.00 174.94 174.80 1crp s PRO 140 N -2.47 4.23 -0.11 0.37 0.04 -1.26 -4.46 135.00 131.34 1crp s PRO 140 Ca 0.19 2.36 0.02 0.00 0.04 0.00 0.00 61.00 63.61 1crp s PRO 140 Cb -0.09 -3.01 -0.01 0.00 0.04 0.00 0.00 34.50 31.43 1crp s PRO 140 CO 0.10 -0.35 -0.18 -0.47 0.04 0.00 0.00 177.00 176.15 1crp s TYR 141 N -1.14 2.70 0.22 0.56 5.04 -1.26 -1.92 117.35 121.56 1crp s TYR 141 Ca 0.51 -0.78 0.04 0.00 -2.44 0.00 0.00 57.07 54.40 1crp s TYR 141 Cb -0.42 -1.78 -0.01 0.00 0.35 0.00 0.00 41.96 40.09 1crp s TYR 141 CO 0.57 -0.27 0.14 -0.89 -1.34 0.00 0.00 175.55 173.75 1crp n ILE 142 N 3.46 0.00 -3.33 3.14 5.41 -1.06 -5.02 119.36 121.95 1crp n ILE 142 Ca -0.18 -1.48 -0.11 0.00 1.00 0.00 0.00 62.75 61.97 1crp n ILE 142 Cb 0.53 0.65 -0.07 0.00 -0.71 0.00 0.00 39.64 40.04 1crp n ILE 142 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1crp s GLU 143 N -2.88 0.39 0.44 0.38 2.12 -1.26 -2.08 118.70 115.80 1crp s GLU 143 Ca 0.20 0.04 0.06 0.00 0.36 0.00 0.00 54.97 55.62 1crp s GLU 143 Cb 0.01 -0.41 -0.06 0.00 0.26 0.00 0.00 34.13 33.93 1crp s GLU 143 CO 0.14 -1.04 0.03 0.95 -0.54 0.00 0.00 175.26 174.81 1crp s THR 144 N 2.48 1.83 0.00 -1.70 -4.23 -0.39 -4.57 115.64 109.07 1crp s THR 144 Ca 0.10 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 1crp s THR 144 Cb -0.13 -2.79 0.00 0.00 1.34 0.00 0.00 72.50 70.92 1crp s THR 144 CO -0.31 0.00 0.00 -0.24 -0.54 0.00 0.00 174.62 173.53 1crp n SER 145 N -1.08 0.52 0.00 3.99 2.88 -0.34 -1.05 113.62 118.53 1crp n SER 145 Ca -0.08 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 1crp n SER 145 Cb 0.67 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.13 1crp n SER 145 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1crp n ALA 146 N -3.00 0.99 1.90 -1.46 0.00 -1.26 -4.65 120.51 113.02 1crp n ALA 146 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 1crp n ALA 146 Cb 0.00 0.00 0.47 0.00 0.00 0.00 0.00 19.45 19.92 1crp n ALA 146 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1crp n LYS 147 N -1.14 0.95 0.00 0.00 -0.00 -1.26 -3.75 118.16 112.96 1crp n LYS 147 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1crp n LYS 147 Cb 0.00 -1.26 0.00 0.00 -0.00 0.00 0.00 35.03 33.77 1crp n LYS 147 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1crp n THR 148 N -0.76 0.00 -3.53 0.58 5.66 -1.26 -5.01 114.28 109.95 1crp n THR 148 Ca 0.12 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.86 1crp n THR 148 Cb 0.05 0.60 0.01 0.00 -1.55 0.00 0.00 70.33 69.44 1crp n THR 148 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1crp n ARG 149 N 0.00 -4.25 -3.31 1.09 1.74 -1.25 -4.91 116.66 105.78 1crp n ARG 149 Ca 0.00 0.57 -0.46 0.00 -0.77 0.00 0.00 57.85 57.19 1crp n ARG 149 Cb 0.48 -5.36 -0.05 0.00 -1.02 0.00 0.00 32.46 26.50 1crp n ARG 149 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1crp s GLN 150 N -6.21 2.99 0.00 5.56 0.74 -1.26 -4.25 119.66 117.24 1crp s GLN 150 Ca 0.49 -1.60 0.00 0.00 0.05 0.00 0.00 55.36 54.30 1crp s GLN 150 Cb -0.25 -4.26 0.00 0.00 1.10 0.00 0.00 33.01 29.60 1crp s GLN 150 CO 0.60 -1.29 0.00 0.41 -0.55 0.00 0.00 175.29 174.46 1crp n GLY 151 N 5.24 2.44 0.47 2.59 0.00 -1.26 -1.20 105.19 113.47 1crp n GLY 151 Ca -0.13 0.00 0.29 0.00 0.00 0.00 0.00 46.02 46.17 1crp n GLY 151 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1crp h VAL 152 N 0.00 0.53 0.65 1.61 2.07 -1.83 -2.08 116.25 117.20 1crp h VAL 152 Ca 0.00 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.46 1crp h VAL 152 Cb 0.00 0.46 0.01 0.00 -1.52 0.00 0.00 31.29 30.23 1crp h VAL 152 CO 0.00 0.01 -0.31 -0.33 0.02 0.00 0.00 177.57 176.96 1crp h GLU 153 N 0.07 -0.84 -0.07 1.57 5.08 -1.91 -2.86 114.58 115.62 1crp h GLU 153 Ca 0.47 0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.91 1crp h GLU 153 Cb 1.75 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 31.19 1crp h GLU 153 CO -0.04 -0.56 0.09 0.38 -1.00 0.00 0.00 179.01 177.88 1crp h ASP 154 N -1.23 0.00 0.00 1.42 3.04 -1.82 -1.31 116.42 116.51 1crp h ASP 154 Ca -0.09 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.70 1crp h ASP 154 Cb 0.67 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.96 1crp h ASP 154 CO 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 179.24 177.35 1crp n ALA 155 N -2.27 -0.15 0.25 4.15 0.00 -0.85 -2.38 120.51 119.26 1crp n ALA 155 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.27 1crp n ALA 155 Cb 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.56 1crp n ALA 155 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1crp h PHE 156 N 0.00 -0.69 -0.15 0.00 -1.00 -1.50 -1.92 116.94 111.69 1crp h PHE 156 Ca 0.00 -0.01 0.05 0.00 2.81 0.00 0.00 57.97 60.82 1crp h PHE 156 Cb 0.00 0.25 -0.06 0.00 3.61 0.00 0.00 35.95 39.75 1crp h PHE 156 CO 0.07 -0.40 -0.26 1.88 -1.61 0.00 0.00 178.31 177.98 1crp h TYR 157 N -0.65 -0.71 -0.03 -0.55 0.05 -1.42 0.14 116.97 113.79 1crp h TYR 157 Ca -0.04 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.78 1crp h TYR 157 Cb 0.54 0.34 -0.00 0.00 1.01 0.00 0.00 36.73 38.61 1crp h TYR 157 CO -0.10 -0.35 0.02 1.15 -1.05 0.00 0.00 178.16 177.84 1crp h THR 158 N -0.32 0.83 -0.01 -2.88 2.02 -1.43 -2.07 112.91 109.05 1crp h THR 158 Ca 0.11 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.29 1crp h THR 158 Cb 0.48 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 67.88 1crp h THR 158 CO -0.33 0.00 0.00 0.25 0.37 0.00 0.00 175.52 175.81 1crp h LEU 159 N 0.00 0.01 -1.65 2.58 6.46 -0.14 -2.21 115.31 120.36 1crp h LEU 159 Ca 0.01 -0.15 -0.04 0.00 -0.12 0.00 0.00 57.88 57.58 1crp h LEU 159 Cb 0.06 -0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 1crp h LEU 159 CO -0.00 0.15 -0.20 0.58 -0.62 0.00 0.00 178.44 178.35 1crp h VAL 160 N -0.14 0.89 0.00 1.05 2.07 -0.86 -1.91 116.25 117.36 1crp h VAL 160 Ca 0.00 -0.76 -0.08 0.00 0.82 0.00 0.00 66.70 66.69 1crp h VAL 160 Cb 0.15 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1crp h VAL 160 CO -0.00 0.20 -0.37 0.03 0.02 0.00 0.00 177.57 177.45 1crp h ARG 161 N 0.00 0.00 0.17 1.57 3.08 -0.89 -2.15 114.38 116.16 1crp h ARG 161 Ca -0.00 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.78 1crp h ARG 161 Cb 0.42 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.49 1crp h ARG 161 CO 0.03 0.37 -1.27 0.93 -1.07 0.00 0.00 179.97 178.96 1crp h GLU 162 N 0.00 0.37 -0.21 0.04 3.07 -0.78 -3.31 114.58 113.76 1crp h GLU 162 Ca -0.00 -0.63 -0.05 0.00 -0.50 0.00 0.00 59.36 58.18 1crp h GLU 162 Cb 0.78 0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.91 1crp h GLU 162 CO 0.05 1.30 -0.07 0.82 -1.40 0.00 0.00 179.01 179.71 1crp h ILE 163 N -0.15 1.17 -0.62 3.13 2.04 -1.41 -2.13 117.51 119.54 1crp h ILE 163 Ca -0.24 -0.73 0.18 0.00 1.00 0.00 0.00 64.86 65.06 1crp h ILE 163 Cb 1.88 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 39.02 1crp h ILE 163 CO 0.17 0.24 0.45 -0.09 0.00 0.00 0.00 178.15 178.91 1crp h ARG 164 N 0.32 0.03 0.00 2.37 2.43 -1.47 -3.24 114.38 114.82 1crp h ARG 164 Ca 0.07 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1crp h ARG 164 Cb 0.33 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1crp h ARG 164 CO 0.02 0.02 0.00 0.94 -1.51 0.00 0.00 179.97 179.44 1crp n GLN 165 N -4.36 0.00 -0.47 0.20 7.27 -0.83 -5.13 117.38 114.06 1crp n GLN 165 Ca 0.12 0.08 0.00 0.00 0.07 0.00 0.00 57.00 57.27 1crp n GLN 165 Cb 0.68 -0.39 0.00 0.00 2.41 0.00 0.00 30.24 32.94 1crp n GLN 165 CO 0.00 0.00 0.00 1.58 0.07 0.00 0.00 177.06 178.71