#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1crp n THR 2 N 0.00 0.00 -3.49 2.03 -1.04 -1.26 -4.10 114.28 106.41 1crp n THR 2 Ca 0.00 0.24 -0.12 0.00 -2.04 0.00 0.00 64.05 62.14 1crp n THR 2 Cb 0.00 -0.73 -0.03 0.00 -1.82 0.00 0.00 70.33 67.75 1crp n THR 2 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 1crp s GLU 3 N -2.73 0.98 0.03 -2.82 1.03 -1.26 -2.08 118.70 111.84 1crp s GLU 3 Ca 0.00 -0.19 0.01 0.00 0.03 0.00 0.00 54.97 54.82 1crp s GLU 3 Cb 0.00 0.45 -0.02 0.00 -0.80 0.00 0.00 34.13 33.77 1crp s GLU 3 CO 0.00 -0.39 -0.06 0.71 -1.33 0.00 0.00 175.26 174.19 1crp s TYR 4 N -2.70 0.49 -0.28 4.83 2.02 -0.84 -4.95 117.35 115.92 1crp s TYR 4 Ca -0.00 -0.41 -0.12 0.00 -0.37 0.00 0.00 57.07 56.17 1crp s TYR 4 Cb -0.01 -0.30 -0.04 0.00 -0.40 0.00 0.00 41.96 41.20 1crp s TYR 4 CO -0.05 -0.09 0.23 0.15 -1.57 0.00 0.00 175.55 174.21 1crp s LYS 5 N -1.22 3.92 -1.25 -0.62 1.02 -1.26 -1.71 119.74 118.62 1crp s LYS 5 Ca -0.09 -0.27 -0.13 0.00 0.02 0.00 0.00 55.97 55.50 1crp s LYS 5 Cb -0.08 -3.67 0.16 0.00 -0.52 0.00 0.00 37.83 33.71 1crp s LYS 5 CO -0.00 -0.22 1.63 1.28 -0.92 0.00 0.00 175.35 177.12 1crp n LEU 6 N 5.12 5.70 -4.55 3.17 4.77 -1.02 -1.91 117.00 128.28 1crp n LEU 6 Ca -0.13 -4.45 -0.27 0.00 -0.03 0.00 0.00 56.01 51.13 1crp n LEU 6 Cb 0.52 -1.59 -0.05 0.00 -2.33 0.00 0.00 43.42 39.97 1crp n LEU 6 CO 0.34 0.89 1.65 -0.69 -1.33 0.00 0.00 177.39 178.26 1crp s VAL 7 N 1.51 3.04 0.23 4.08 1.01 0.81 -2.83 120.40 128.26 1crp s VAL 7 Ca 0.43 -0.00 -0.16 0.00 0.00 0.00 0.00 61.98 62.24 1crp s VAL 7 Cb 0.02 -3.10 -0.08 0.00 0.00 0.00 0.00 36.38 33.23 1crp s VAL 7 CO 0.01 -0.09 0.67 -0.69 0.00 0.00 0.00 175.10 174.99 1crp s VAL 8 N 13.06 4.70 -0.25 2.92 1.01 -1.09 -2.22 120.40 138.54 1crp s VAL 8 Ca 0.93 1.01 -0.21 0.00 0.00 0.00 0.00 61.98 63.71 1crp s VAL 8 Cb -0.15 -3.74 0.07 0.00 0.00 0.00 0.00 36.38 32.56 1crp s VAL 8 CO 0.17 0.09 0.65 0.68 0.00 0.00 0.00 175.10 176.70 1crp s VAL 9 N -1.65 -0.00 -0.23 2.92 -7.23 -1.14 -4.68 120.40 108.39 1crp s VAL 9 Ca 0.45 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.62 1crp s VAL 9 Cb -0.14 -0.92 0.00 0.00 0.56 0.00 0.00 36.38 35.88 1crp s VAL 9 CO 0.20 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 1crp n GLY 10 N 3.12 -1.06 3.78 2.32 0.00 -1.26 -1.53 105.19 110.57 1crp n GLY 10 Ca -0.16 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 44.73 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 3.14 -1.04 4.61 0.00 -1.26 -4.92 121.76 121.29 1crp s ALA 11 Ca 0.00 0.78 -0.23 0.00 0.00 0.00 0.00 51.96 52.51 1crp s ALA 11 Cb 0.00 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.82 1crp s ALA 11 CO 0.00 -0.27 1.71 0.20 0.00 0.00 0.00 175.76 177.40 1crp s GLY 12 N -1.39 0.83 0.00 0.00 0.00 -1.26 -2.66 107.32 102.84 1crp s GLY 12 Ca 0.56 -2.09 0.00 0.00 0.00 0.00 0.00 44.72 43.19 1crp s GLY 12 CO 0.31 3.06 0.00 0.61 0.00 0.00 0.00 173.10 177.08 1crp n GLY 13 N 6.55 0.54 0.32 0.20 0.00 -1.26 -4.98 105.19 106.56 1crp n GLY 13 Ca 0.39 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.55 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 0.87 0.00 1.61 -1.51 -1.90 -3.45 116.25 111.87 1crp h VAL 14 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.46 1crp h VAL 14 Cb 0.00 0.85 0.00 0.00 -2.13 0.00 0.00 31.29 30.01 1crp h VAL 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 1crp n GLY 15 N -1.59 1.61 0.07 5.19 0.00 -1.26 -4.55 105.19 104.65 1crp n GLY 15 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 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 0.08 0.50 1.61 1.57 -1.87 -2.15 116.57 116.31 1crp h LYS 16 Ca 0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1crp h LYS 16 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1crp h LYS 16 CO 0.00 0.31 -0.24 0.77 -0.57 0.00 0.00 179.45 179.72 1crp h SER 17 N -0.17 -0.57 -1.11 0.86 0.02 -1.94 -2.35 113.55 108.28 1crp h SER 17 Ca 0.01 0.02 0.32 0.00 -0.84 0.00 0.00 61.79 61.31 1crp h SER 17 Cb 0.27 0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.91 1crp h SER 17 CO 0.00 -0.28 0.89 0.00 -1.14 0.00 0.00 176.83 176.30 1crp h ALA 18 N -1.43 3.01 -0.03 3.77 0.00 -1.88 0.35 119.26 123.03 1crp h ALA 18 Ca -0.07 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1crp h ALA 18 Cb 0.52 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.40 1crp h ALA 18 CO 0.11 -1.47 -0.36 -0.07 0.00 0.00 0.00 179.25 177.46 1crp h LEU 19 N 0.00 0.38 0.51 0.00 3.38 -1.28 -2.34 115.31 115.96 1crp h LEU 19 Ca 0.53 -0.71 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1crp h LEU 19 Cb 2.31 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.95 1crp h LEU 19 CO -0.01 1.03 -0.24 0.74 0.09 0.00 0.00 178.44 180.05 1crp h THR 20 N -0.24 0.00 -0.98 0.22 2.02 0.20 -2.65 112.91 111.48 1crp h THR 20 Ca -0.04 -0.02 0.28 0.00 0.77 0.00 0.00 66.41 67.40 1crp h THR 20 Cb 1.05 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 1crp h THR 20 CO 0.07 0.00 0.70 0.40 0.37 0.00 0.00 175.52 177.07 1crp h ILE 21 N -0.71 0.52 0.65 3.11 5.03 -1.42 -1.72 117.51 122.97 1crp h ILE 21 Ca -0.07 -0.01 -0.03 0.00 -0.12 0.00 0.00 64.86 64.63 1crp h ILE 21 Cb 0.52 0.48 -0.01 0.00 -3.03 0.00 0.00 36.82 34.79 1crp h ILE 21 CO 0.11 0.01 -0.45 -0.61 -0.68 0.00 0.00 178.15 176.54 1crp h GLN 22 N 0.03 -1.00 -0.11 2.37 4.15 -1.06 0.49 115.11 119.97 1crp h GLN 22 Ca 0.47 0.07 0.03 0.00 0.77 0.00 0.00 58.65 59.99 1crp h GLN 22 Cb 1.84 0.23 -0.00 0.00 0.21 0.00 0.00 27.48 29.75 1crp h GLN 22 CO -0.02 -0.67 0.26 1.25 -1.93 0.00 0.00 178.83 177.72 1crp h LEU 23 N -1.04 0.00 0.00 -2.39 6.46 -1.15 0.12 115.31 117.31 1crp h LEU 23 Ca -0.09 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.67 1crp h LEU 23 Cb 0.85 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.78 1crp h LEU 23 CO 0.06 0.00 0.00 -0.38 -0.62 0.00 0.00 178.44 177.50 1crp n ILE 24 N -3.30 0.00 0.28 4.05 5.41 -0.34 -4.66 119.36 120.80 1crp n ILE 24 Ca 0.00 0.00 0.13 0.00 1.00 0.00 0.00 62.75 63.88 1crp n ILE 24 Cb 0.35 -0.49 0.80 0.00 -0.71 0.00 0.00 39.64 39.59 1crp n ILE 24 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 1crp h GLN 25 N 0.00 0.00 -4.13 0.38 1.08 -0.22 -3.47 115.11 108.75 1crp h GLN 25 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1crp h GLN 25 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1crp h GLN 25 CO 0.00 0.05 -0.21 -1.71 -0.95 0.00 0.00 178.83 176.00 1crp n ASN 26 N -3.92 -4.92 -3.63 1.46 5.15 0.43 -5.01 115.26 104.82 1crp n ASN 26 Ca -0.03 0.23 -0.03 0.00 -0.60 0.00 0.00 54.58 54.15 1crp n ASN 26 Cb 0.14 -3.16 -0.04 0.00 -0.53 0.00 0.00 39.78 36.18 1crp n ASN 26 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 1crp s HIS 27 N -1.95 -0.09 -0.39 1.20 -3.43 -1.26 -5.02 115.29 104.35 1crp s HIS 27 Ca 0.11 0.15 -0.21 0.00 -0.80 0.00 0.00 55.06 54.30 1crp s HIS 27 Cb -0.03 0.49 0.01 0.00 -1.43 0.00 0.00 32.58 31.62 1crp s HIS 27 CO 0.38 -0.09 0.68 0.12 -2.00 0.00 0.00 174.74 173.83 1crp s PHE 28 N -1.17 3.10 -0.19 0.38 5.36 -1.26 -4.43 117.98 119.78 1crp s PHE 28 Ca 0.07 0.27 -0.12 0.00 -0.96 0.00 0.00 56.93 56.20 1crp s PHE 28 Cb -0.01 -3.30 -0.05 0.00 -0.34 0.00 0.00 43.02 39.32 1crp s PHE 28 CO -0.06 -0.75 0.21 0.14 -1.46 0.00 0.00 175.22 173.30 1crp s VAL 29 N 2.88 5.35 -0.21 3.12 -7.23 -1.26 -4.96 120.40 118.09 1crp s VAL 29 Ca 0.26 0.34 0.15 0.00 -1.81 0.00 0.00 61.98 60.92 1crp s VAL 29 Cb -0.14 -3.55 0.59 0.00 0.56 0.00 0.00 36.38 33.85 1crp s VAL 29 CO 0.17 0.39 1.51 0.47 -0.31 0.00 0.00 175.10 177.34 1crp n ASP 30 N 3.73 4.09 0.00 4.85 8.00 -1.26 -4.74 116.55 131.23 1crp n ASP 30 Ca -0.14 -3.11 0.00 0.00 0.71 0.00 0.00 54.79 52.25 1crp n ASP 30 Cb 0.52 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 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 -0.39 0.00 -1.31 -1.24 0.28 -1.26 -5.04 120.64 111.69 1crp n GLU 31 Ca 0.25 0.00 -0.28 0.00 -0.16 0.00 0.00 57.16 56.97 1crp n GLU 31 Cb 1.00 0.00 0.04 0.00 1.43 0.00 0.00 31.44 33.91 1crp n GLU 31 CO 0.00 0.00 0.00 0.98 -0.16 0.00 0.00 177.13 177.95 1crp n TYR 32 N 0.00 2.37 -2.21 -1.84 9.36 -1.26 -4.96 117.16 118.62 1crp n TYR 32 Ca 0.00 -2.40 0.00 0.00 3.32 0.00 0.00 57.90 58.82 1crp n TYR 32 Cb 0.00 -1.24 0.00 0.00 -0.63 0.00 0.00 39.34 37.47 1crp n TYR 32 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 1crp n ASP 33 N -0.14 -8.60 0.27 2.98 9.92 -1.26 -4.68 116.55 115.04 1crp n ASP 33 Ca 0.49 1.61 0.19 0.00 -0.53 0.00 0.00 54.79 56.55 1crp n ASP 33 Cb 0.55 -4.91 0.98 0.00 -0.64 0.00 0.00 41.12 37.10 1crp n ASP 33 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 1crp h PRO 34 N 4.34 0.00 -3.29 -0.24 0.11 -1.92 -3.27 132.00 127.73 1crp h PRO 34 Ca 0.00 0.00 -0.69 0.00 0.11 0.00 0.00 66.00 65.42 1crp h PRO 34 Cb 0.00 0.00 -0.36 0.00 0.11 0.00 0.00 31.00 30.75 1crp h PRO 34 CO 0.00 0.00 -0.18 0.95 -0.21 0.00 0.00 178.00 178.56 1crp s THR 35 N -3.92 4.11 -0.35 -1.15 -4.23 -1.26 -4.65 115.64 104.20 1crp s THR 35 Ca -0.04 -3.91 -0.00 0.00 -1.18 0.00 0.00 61.69 56.56 1crp s THR 35 Cb 0.10 -3.57 0.14 0.00 1.34 0.00 0.00 72.50 70.51 1crp s THR 35 CO 0.34 -1.07 0.21 -0.63 -0.54 0.00 0.00 174.62 172.93 1crp s ILE 36 N -1.34 0.16 -0.33 2.99 -1.09 -1.24 -5.09 121.20 115.26 1crp s ILE 36 Ca 0.27 -1.70 -0.02 0.00 -2.23 0.00 0.00 60.65 56.97 1crp s ILE 36 Cb -0.07 -1.13 0.06 0.00 -1.58 0.00 0.00 42.46 39.74 1crp s ILE 36 CO -0.13 -0.98 0.05 -1.61 -1.23 0.00 0.00 174.94 171.04 1crp s GLU 37 N 1.09 2.36 0.00 2.79 8.01 -1.26 -4.31 118.70 127.37 1crp s GLU 37 Ca 0.18 -1.37 0.00 0.00 0.01 0.00 0.00 54.97 53.79 1crp s GLU 37 Cb -0.23 -3.29 0.00 0.00 -4.31 0.00 0.00 34.13 26.30 1crp s GLU 37 CO 0.00 -0.71 0.00 -0.25 0.01 0.00 0.00 175.26 174.31 1crp n ASP 38 N 4.63 0.00 -3.66 -0.19 8.00 -1.26 -5.04 116.55 119.04 1crp n ASP 38 Ca -0.11 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.39 1crp n ASP 38 Cb 0.43 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.53 1crp n ASP 38 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1crp s SER 39 N 1.50 -0.09 -0.33 -2.24 1.04 -1.26 -4.87 113.70 107.45 1crp s SER 39 Ca 0.00 -0.29 0.04 0.00 0.48 0.00 0.00 55.95 56.18 1crp s SER 39 Cb 0.00 0.31 0.17 0.00 0.10 0.00 0.00 66.02 66.60 1crp s SER 39 CO 0.00 -0.58 0.47 -0.31 0.98 0.00 0.00 173.24 173.80 1crp s TYR 40 N -2.67 -1.08 0.20 5.02 2.02 -0.94 -4.95 117.35 114.95 1crp s TYR 40 Ca 0.15 0.12 -0.06 0.00 -0.37 0.00 0.00 57.07 56.92 1crp s TYR 40 Cb 0.02 -0.07 -0.06 0.00 -0.40 0.00 0.00 41.96 41.45 1crp s TYR 40 CO -0.01 -1.03 0.46 1.03 -1.57 0.00 0.00 175.55 174.43 1crp s ARG 41 N 2.17 3.66 -0.08 -0.62 0.52 -1.26 -1.39 118.95 121.94 1crp s ARG 41 Ca 0.13 -0.00 -0.20 0.00 -0.52 0.00 0.00 55.73 55.14 1crp s ARG 41 Cb -0.11 -2.75 0.04 0.00 0.52 0.00 0.00 34.95 32.65 1crp s ARG 41 CO -0.19 0.37 0.46 0.21 0.02 0.00 0.00 175.30 176.18 1crp s LYS 42 N -2.95 0.73 -0.31 3.54 2.47 -0.98 -4.93 119.74 117.30 1crp s LYS 42 Ca 0.43 0.23 0.02 0.00 -1.56 0.00 0.00 55.97 55.08 1crp s LYS 42 Cb -0.11 0.34 0.08 0.00 -1.46 0.00 0.00 37.83 36.67 1crp s LYS 42 CO 0.25 -0.18 -0.00 -1.14 0.16 0.00 0.00 175.35 174.44 1crp s GLN 43 N -0.73 2.00 0.41 4.03 0.74 -1.26 -1.70 119.66 123.15 1crp s GLN 43 Ca -0.08 -1.56 0.04 0.00 0.05 0.00 0.00 55.36 53.81 1crp s GLN 43 Cb -0.03 -3.13 -0.02 0.00 1.10 0.00 0.00 33.01 30.93 1crp s GLN 43 CO 0.04 -0.76 0.15 0.14 -0.55 0.00 0.00 175.29 174.32 1crp s VAL 44 N 1.07 0.49 -0.08 1.34 -7.23 -1.25 -4.99 120.40 109.76 1crp s VAL 44 Ca 0.00 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.21 1crp s VAL 44 Cb -0.20 -2.32 -0.01 0.00 0.56 0.00 0.00 36.38 34.41 1crp s VAL 44 CO -0.05 0.00 -0.20 -0.69 -0.31 0.00 0.00 175.10 173.85 1crp s VAL 45 N -3.21 2.52 -0.80 1.32 1.01 -1.26 -2.06 120.40 117.92 1crp s VAL 45 Ca 0.24 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 1crp s VAL 45 Cb 0.02 -1.97 0.17 0.00 0.00 0.00 0.00 36.38 34.59 1crp s VAL 45 CO 0.16 0.56 2.42 -0.38 0.00 0.00 0.00 175.10 177.86 1crp n ILE 46 N 2.99 4.15 -2.83 2.22 2.08 -1.19 -4.83 119.36 121.95 1crp n ILE 46 Ca -0.18 -3.93 -0.06 0.00 0.56 0.00 0.00 62.75 59.15 1crp n ILE 46 Cb 0.52 -1.62 0.01 0.00 -0.75 0.00 0.00 39.64 37.80 1crp n ILE 46 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1crp n ASP 47 N 0.66 -7.89 0.00 4.38 9.92 -1.26 -4.73 116.55 117.63 1crp n ASP 47 Ca 0.53 0.87 0.00 0.00 -0.53 0.00 0.00 54.79 55.65 1crp n ASP 47 Cb 0.38 -5.17 0.00 0.00 -0.64 0.00 0.00 41.12 35.69 1crp n ASP 47 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1crp n GLY 48 N 0.13 1.10 3.47 0.44 0.00 -1.26 -5.09 105.19 103.98 1crp n GLY 48 Ca 0.06 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 1crp n GLY 48 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1crp s GLU 49 N 0.00 1.65 0.67 1.61 -1.05 -1.26 -5.12 118.70 115.20 1crp s GLU 49 Ca 0.00 -1.81 -0.11 0.00 -0.15 0.00 0.00 54.97 52.90 1crp s GLU 49 Cb 0.00 -1.51 -0.00 0.00 -0.44 0.00 0.00 34.13 32.17 1crp s GLU 49 CO 0.00 0.18 1.06 0.99 0.95 0.00 0.00 175.26 178.44 1crp s THR 50 N -2.73 3.86 -0.29 1.83 2.01 -1.26 -3.18 115.64 115.88 1crp s THR 50 Ca 0.30 0.56 -0.14 0.00 0.31 0.00 0.00 61.69 62.71 1crp s THR 50 Cb 0.00 -3.59 0.11 0.00 0.01 0.00 0.00 72.50 69.03 1crp s THR 50 CO 0.14 -0.77 0.73 0.00 -0.69 0.00 0.00 174.62 174.03 1crp s LEU 52 N 1.98 3.40 -0.29 0.00 2.96 -0.88 -3.86 118.68 121.99 1crp s LEU 52 Ca -0.08 2.36 -0.02 0.00 -0.22 0.00 0.00 54.13 56.17 1crp s LEU 52 Cb -0.07 -4.59 0.12 0.00 0.50 0.00 0.00 46.19 42.15 1crp s LEU 52 CO -0.19 -2.08 0.20 -0.76 -1.32 0.00 0.00 176.35 172.20 1crp s LEU 53 N -4.88 0.22 -1.03 -0.68 1.43 -0.69 -1.98 118.68 111.08 1crp s LEU 53 Ca 0.75 -1.09 -0.23 0.00 -1.03 0.00 0.00 54.13 52.54 1crp s LEU 53 Cb -0.30 0.00 0.05 0.00 0.03 0.00 0.00 46.19 45.98 1crp s LEU 53 CO 0.42 -0.42 1.45 -0.62 0.23 0.00 0.00 176.35 177.42 1crp s ASP 54 N 2.19 6.52 0.18 2.29 -1.08 -0.69 -2.33 116.67 123.74 1crp s ASP 54 Ca 0.09 -1.51 -0.30 0.00 -0.52 0.00 0.00 52.55 50.31 1crp s ASP 54 Cb -0.15 -2.57 -0.08 0.00 -1.46 0.00 0.00 42.92 38.67 1crp s ASP 54 CO -0.35 -1.48 1.07 -0.63 0.52 0.00 0.00 175.17 174.30 1crp s ILE 55 N 4.88 3.94 -0.24 4.11 1.09 -0.49 -2.45 121.20 132.05 1crp s ILE 55 Ca 0.46 1.69 0.01 0.00 -1.10 0.00 0.00 60.65 61.72 1crp s ILE 55 Cb 0.00 -4.08 0.04 0.00 -1.06 0.00 0.00 42.46 37.36 1crp s ILE 55 CO -0.09 0.30 -0.12 -0.22 -0.10 0.00 0.00 174.94 174.71 1crp s LEU 56 N -0.41 3.04 -0.36 2.97 2.96 -1.13 -2.22 118.68 123.53 1crp s LEU 56 Ca 0.48 -1.06 0.04 0.00 -0.22 0.00 0.00 54.13 53.37 1crp s LEU 56 Cb -0.28 -1.56 0.10 0.00 0.50 0.00 0.00 46.19 44.95 1crp s LEU 56 CO 0.34 -0.13 0.08 -0.62 -1.32 0.00 0.00 176.35 174.70 1crp s ASP 57 N 1.21 4.74 0.67 3.68 -1.08 -1.26 -2.66 116.67 121.97 1crp s ASP 57 Ca -0.03 -2.25 -0.11 0.00 -0.52 0.00 0.00 52.55 49.64 1crp s ASP 57 Cb -0.17 -1.64 -0.01 0.00 -1.46 0.00 0.00 42.92 39.64 1crp s ASP 57 CO -0.07 -0.37 1.06 0.42 0.52 0.00 0.00 175.17 176.73 1crp s THR 58 N 0.78 4.07 -0.31 1.71 -4.23 -1.26 -4.58 115.64 111.82 1crp s THR 58 Ca 0.12 0.67 0.09 0.00 -1.18 0.00 0.00 61.69 61.39 1crp s THR 58 Cb -0.20 -3.65 0.31 0.00 1.34 0.00 0.00 72.50 70.30 1crp s THR 58 CO -0.07 -0.88 1.30 0.00 -0.54 0.00 0.00 174.62 174.43 1crp n ALA 59 N -2.90 1.20 -0.03 3.99 0.00 -1.26 -4.94 120.51 116.57 1crp n ALA 59 Ca 0.07 -0.88 0.03 0.00 0.00 0.00 0.00 53.44 52.65 1crp n ALA 59 Cb 0.56 -0.85 -0.12 0.00 0.00 0.00 0.00 19.45 19.04 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 -0.96 -0.71 7.00 0.00 0.00 -1.26 -4.03 105.19 105.23 1crp n GLY 60 Ca -0.12 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1crp n GLY 60 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1crp n GLN 61 N -2.21 0.00 -1.71 1.61 1.13 -1.26 -4.61 117.38 110.33 1crp n GLN 61 Ca -0.10 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.54 1crp n GLN 61 Cb 0.60 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.92 1crp n GLN 61 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1crp n GLU 62 N -0.10 2.77 -3.54 -1.09 4.71 -1.26 -4.88 120.64 117.24 1crp n GLU 62 Ca 0.00 1.00 0.00 0.00 -0.01 0.00 0.00 57.16 58.15 1crp n GLU 62 Cb 0.00 -2.85 0.00 0.00 -1.01 0.00 0.00 31.44 27.58 1crp n GLU 62 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1crp n GLU 63 N 4.25 -2.48 0.00 3.49 1.02 -1.26 -5.07 120.64 120.58 1crp n GLU 63 Ca 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1crp n GLU 63 Cb 0.35 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.77 1crp n GLU 63 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1crp n TYR 64 N 2.34 0.00 0.00 -0.32 9.36 -1.26 -4.69 117.16 122.59 1crp n TYR 64 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1crp n TYR 64 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 1crp n TYR 64 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1crp n SER 65 N -0.34 0.00 -0.36 2.98 7.64 -1.26 -4.71 113.62 117.56 1crp n SER 65 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 1crp n SER 65 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1crp n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1crp n ALA 66 N 5.14 -0.07 -0.04 -0.43 0.00 -1.26 -4.80 120.51 119.05 1crp n ALA 66 Ca 0.00 0.08 -0.03 0.00 0.00 0.00 0.00 53.44 53.49 1crp n ALA 66 Cb 0.00 -1.11 -0.07 0.00 0.00 0.00 0.00 19.45 18.27 1crp n ALA 66 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1crp n MET 67 N -1.34 2.23 -0.07 0.00 1.56 -1.26 -4.39 117.12 113.84 1crp n MET 67 Ca -0.05 -0.02 -0.10 0.00 -0.27 0.00 0.00 57.70 57.27 1crp n MET 67 Cb 0.35 -1.22 -0.03 0.00 2.15 0.00 0.00 33.22 34.47 1crp n MET 67 CO 0.00 0.00 0.00 -0.09 -0.73 0.00 0.00 175.97 175.15 1crp h ARG 68 N 0.00 0.36 -0.29 2.12 2.43 -1.95 -1.62 114.38 115.42 1crp h ARG 68 Ca -0.19 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.94 1crp h ARG 68 Cb 1.34 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 1crp h ARG 68 CO 0.01 0.30 0.19 0.22 -1.51 0.00 0.00 179.97 179.18 1crp h ASP 69 N 0.32 0.34 -0.71 -3.80 1.82 -1.98 -1.06 116.42 111.34 1crp h ASP 69 Ca 0.09 -0.01 -0.06 0.00 -0.39 0.00 0.00 57.03 56.66 1crp h ASP 69 Cb 0.04 -0.08 -0.03 0.00 0.68 0.00 0.00 39.33 39.94 1crp h ASP 69 CO -0.02 0.25 0.21 1.56 -1.61 0.00 0.00 179.24 179.63 1crp h GLN 70 N 0.40 1.13 0.00 0.28 7.50 -1.52 -2.09 115.11 120.80 1crp h GLN 70 Ca 0.11 -0.25 -0.09 0.00 0.50 0.00 0.00 58.65 58.91 1crp h GLN 70 Cb -0.03 -0.16 -0.01 0.00 0.05 0.00 0.00 27.48 27.33 1crp h GLN 70 CO -0.02 0.97 -0.44 1.88 -1.50 0.00 0.00 178.83 179.72 1crp h TYR 71 N 1.08 0.00 0.00 2.96 0.05 -0.55 -2.16 116.97 118.35 1crp h TYR 71 Ca 0.23 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.01 1crp h TYR 71 Cb 0.33 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.07 1crp h TYR 71 CO 0.03 0.44 0.00 0.52 -1.05 0.00 0.00 178.16 178.10 1crp h MET 72 N 0.00 0.00 0.02 4.88 2.86 -0.63 -1.42 114.93 120.63 1crp h MET 72 Ca -0.00 0.00 -0.39 0.00 -2.06 0.00 0.00 59.70 57.25 1crp h MET 72 Cb 0.87 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.46 1crp h MET 72 CO 0.06 0.00 -2.41 -2.13 1.06 0.00 0.00 176.91 173.48 1crp n ARG 73 N -2.92 0.67 0.13 1.72 0.63 -0.85 -4.44 116.66 111.59 1crp n ARG 73 Ca -0.02 0.16 -0.09 0.00 -0.92 0.00 0.00 57.85 56.98 1crp n ARG 73 Cb 0.11 -1.54 -0.05 0.00 0.45 0.00 0.00 32.46 31.43 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 0.01 0.27 -2.81 5.15 1.35 -1.16 -3.46 112.91 112.26 1crp h THR 74 Ca -0.56 -0.79 -0.36 0.00 -0.55 0.00 0.00 66.41 64.16 1crp h THR 74 Cb 1.93 0.45 0.20 0.00 -1.73 0.00 0.00 68.15 69.00 1crp h THR 74 CO -0.06 0.07 -0.18 0.61 -0.25 0.00 0.00 175.52 175.70 1crp n GLY 75 N 0.55 -3.46 0.00 5.82 0.00 -0.56 -5.00 105.19 102.53 1crp n GLY 75 Ca -0.07 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 -5.07 0.00 -2.64 1.61 4.71 -1.23 -4.93 120.64 113.09 1crp n GLU 76 Ca 0.11 0.00 -0.40 0.00 -0.01 0.00 0.00 57.16 56.86 1crp n GLU 76 Cb 0.56 -0.48 -0.05 0.00 -1.01 0.00 0.00 31.44 30.46 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 -2.55 3.09 -0.12 0.62 0.00 -0.80 -4.20 107.32 103.36 1crp s GLY 77 Ca 0.00 0.73 0.01 0.00 0.00 0.00 0.00 44.72 45.46 1crp s GLY 77 CO 0.00 1.32 -0.14 -1.36 0.00 0.00 0.00 173.10 172.92 1crp s PHE 78 N -1.14 1.98 -0.71 1.90 0.40 -1.15 -0.13 117.98 119.14 1crp s PHE 78 Ca 0.43 -0.98 -0.01 0.00 -0.60 0.00 0.00 56.93 55.76 1crp s PHE 78 Cb -0.28 -1.45 0.18 0.00 0.51 0.00 0.00 43.02 41.98 1crp s PHE 78 CO 0.36 -0.53 0.53 -1.17 0.70 0.00 0.00 175.22 175.11 1crp s LEU 79 N 1.16 5.21 -1.00 -0.37 2.96 -0.94 -0.47 118.68 125.22 1crp s LEU 79 Ca -0.03 -3.24 -0.24 0.00 -0.22 0.00 0.00 54.13 50.40 1crp s LEU 79 Cb -0.14 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.67 1crp s LEU 79 CO -0.04 -0.27 1.89 0.00 -1.32 0.00 0.00 176.35 176.61 1crp s VAL 81 N 9.64 2.96 -0.30 0.00 1.01 -0.58 -2.09 120.40 131.04 1crp s VAL 81 Ca 0.67 0.57 -0.01 0.00 0.00 0.00 0.00 61.98 63.21 1crp s VAL 81 Cb -0.04 -3.20 0.19 0.00 0.00 0.00 0.00 36.38 33.33 1crp s VAL 81 CO 0.02 -0.15 0.59 0.72 0.00 0.00 0.00 175.10 176.28 1crp s PHE 82 N -1.79 -1.58 0.25 5.22 -0.71 -0.62 -4.03 117.98 114.72 1crp s PHE 82 Ca 0.74 1.69 -0.30 0.00 -1.04 0.00 0.00 56.93 58.01 1crp s PHE 82 Cb -0.26 0.55 -0.10 0.00 -1.21 0.00 0.00 43.02 42.00 1crp s PHE 82 CO 0.31 -0.87 1.49 0.00 -1.34 0.00 0.00 175.22 174.81 1crp s ALA 83 N 2.85 3.67 -0.44 1.99 0.00 -1.26 -1.92 121.76 126.64 1crp s ALA 83 Ca 0.21 1.39 -0.02 0.00 0.00 0.00 0.00 51.96 53.54 1crp s ALA 83 Cb -0.15 -3.58 0.24 0.00 0.00 0.00 0.00 23.12 19.62 1crp s ALA 83 CO -0.21 -0.81 2.18 0.44 0.00 0.00 0.00 175.76 177.37 1crp n ILE 84 N 2.41 3.10 0.00 0.00 -6.64 -0.88 -3.93 119.36 113.42 1crp n ILE 84 Ca 0.08 -2.31 0.00 0.00 -1.77 0.00 0.00 62.75 58.74 1crp n ILE 84 Cb 0.39 -1.35 0.00 0.00 -1.44 0.00 0.00 39.64 37.24 1crp n ILE 84 CO 0.00 0.00 0.00 -3.20 -1.77 0.00 0.00 176.55 171.58 1crp n ASN 85 N 0.16 1.12 0.02 7.28 2.85 -1.26 -2.90 115.26 122.52 1crp n ASN 85 Ca 0.42 0.00 -0.01 0.00 -0.11 0.00 0.00 54.58 54.88 1crp n ASN 85 Cb 0.57 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 41.50 1crp n ASN 85 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 1crp n ASN 86 N -1.88 0.84 0.00 1.20 6.94 -1.26 -4.52 115.26 116.57 1crp n ASN 86 Ca 0.00 0.37 0.00 0.00 -0.02 0.00 0.00 54.58 54.93 1crp n ASN 86 Cb 0.15 0.16 0.00 0.00 -2.36 0.00 0.00 39.78 37.74 1crp n ASN 86 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 1crp n THR 87 N -2.90 0.00 0.09 5.53 -1.04 -1.25 -4.77 114.28 109.94 1crp n THR 87 Ca -0.11 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.84 1crp n THR 87 Cb 0.87 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 69.37 1crp n THR 87 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 1crp h LYS 88 N 1.28 0.08 -0.27 -2.82 1.63 -1.92 -3.01 116.57 111.53 1crp h LYS 88 Ca 0.00 -0.09 -0.06 0.00 -0.85 0.00 0.00 60.65 59.65 1crp h LYS 88 Cb 0.00 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 1crp h LYS 88 CO 0.00 0.89 -0.10 0.66 -3.45 0.00 0.00 179.45 177.45 1crp h SER 89 N 0.04 0.43 0.23 4.20 4.64 -1.86 -0.30 113.55 120.93 1crp h SER 89 Ca -0.02 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.18 1crp h SER 89 Cb 1.50 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 1crp h SER 89 CO 0.12 0.57 -0.11 0.15 -0.87 0.00 0.00 176.83 176.69 1crp h PHE 90 N 0.42 -0.29 0.00 4.77 3.57 -1.79 -0.04 116.94 123.58 1crp h PHE 90 Ca 0.08 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.58 1crp h PHE 90 Cb 0.44 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.27 1crp h PHE 90 CO 0.01 -0.07 0.00 0.93 -2.23 0.00 0.00 178.31 176.96 1crp h GLU 91 N -0.47 0.00 0.00 1.11 5.08 -1.40 -1.43 114.58 117.47 1crp h GLU 91 Ca -0.03 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 1crp h GLU 91 Cb 0.36 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1crp h GLU 91 CO 0.05 0.00 -0.90 -0.44 -1.00 0.00 0.00 179.01 176.72 1crp h ASP 92 N 0.00 0.00 0.52 1.42 5.19 -0.00 -3.31 116.42 120.23 1crp h ASP 92 Ca 0.00 0.00 -0.18 0.00 -0.62 0.00 0.00 57.03 56.23 1crp h ASP 92 Cb 0.18 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.68 1crp h ASP 92 CO 0.00 0.31 -0.80 0.40 -3.12 0.00 0.00 179.24 176.03 1crp h ILE 93 N 0.00 1.46 0.32 0.35 1.08 0.09 -2.03 117.51 118.78 1crp h ILE 93 Ca -0.06 -2.44 -0.00 0.00 -0.39 0.00 0.00 64.86 61.97 1crp h ILE 93 Cb 1.29 2.33 -0.02 0.00 -3.07 0.00 0.00 36.82 37.36 1crp h ILE 93 CO 0.03 0.71 -0.27 -0.74 -0.69 0.00 0.00 178.15 177.20 1crp h HIS 94 N 0.13 -0.71 -0.26 1.37 -0.00 -1.63 0.15 115.15 114.21 1crp h HIS 94 Ca -0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.22 1crp h HIS 94 Cb 1.39 0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 29.06 1crp h HIS 94 CO 0.03 -0.40 -0.31 1.96 -0.00 0.00 0.00 177.93 179.21 1crp h GLN 95 N -0.60 0.53 0.00 5.26 1.08 -1.70 -1.56 115.11 118.12 1crp h GLN 95 Ca -0.02 -0.23 0.00 0.00 -1.45 0.00 0.00 58.65 56.95 1crp h GLN 95 Cb 0.53 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 1crp h GLN 95 CO -0.02 0.78 0.00 1.88 -0.95 0.00 0.00 178.83 180.52 1crp h TYR 96 N 0.46 0.00 -0.45 2.96 -1.99 -0.97 -1.45 116.97 115.53 1crp h TYR 96 Ca 0.06 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.70 1crp h TYR 96 Cb 0.77 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 39.45 1crp h TYR 96 CO 0.03 0.00 0.10 -2.13 -0.00 0.00 0.00 178.16 176.16 1crp n ARG 97 N -2.67 3.16 0.00 4.88 0.00 0.51 -3.81 116.66 118.73 1crp n ARG 97 Ca -0.00 -2.06 0.00 0.00 -0.00 0.00 0.00 57.85 55.79 1crp n ARG 97 Cb 0.18 -1.95 0.00 0.00 0.00 0.00 0.00 32.46 30.68 1crp n ARG 97 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 1crp n GLU 98 N 0.17 0.77 0.15 -0.14 -0.00 -0.55 -4.60 120.64 116.45 1crp n GLU 98 Ca 0.23 0.00 -0.00 0.00 -0.00 0.00 0.00 57.16 57.39 1crp n GLU 98 Cb 0.97 -0.81 0.23 0.00 -0.00 0.00 0.00 31.44 31.83 1crp n GLU 98 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.13 177.50 1crp h GLN 99 N 0.00 0.00 -0.28 3.44 4.15 -1.69 -1.12 115.11 119.61 1crp h GLN 99 Ca 0.00 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.31 1crp h GLN 99 Cb 0.62 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.29 1crp h GLN 99 CO 0.00 0.54 -0.30 0.82 -1.93 0.00 0.00 178.83 177.97 1crp h ILE 100 N 0.00 1.28 0.00 2.39 2.04 -1.84 -1.12 117.51 120.26 1crp h ILE 100 Ca -0.01 -1.39 -0.08 0.00 1.00 0.00 0.00 64.86 64.38 1crp h ILE 100 Cb 0.97 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1crp h ILE 100 CO 0.07 0.45 -0.40 0.11 0.00 0.00 0.00 178.15 178.38 1crp h LYS 101 N 0.50 0.00 0.63 2.37 1.79 -1.68 -2.68 116.57 117.50 1crp h LYS 101 Ca 0.06 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.50 1crp h LYS 101 Cb 0.77 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.42 1crp h LYS 101 CO 0.06 0.40 -0.31 -0.09 -1.08 0.00 0.00 179.45 178.43 1crp h ARG 102 N 0.00 -0.82 0.05 3.15 2.43 -0.03 0.33 114.38 119.50 1crp h ARG 102 Ca -0.00 0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1crp h ARG 102 Cb 0.80 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 1crp h ARG 102 CO 0.05 -0.55 -0.08 0.28 -1.51 0.00 0.00 179.97 178.16 1crp h VAL 103 N -1.15 0.00 0.00 0.20 2.07 -1.32 -1.32 116.25 114.74 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 0.65 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1crp h VAL 103 CO 0.14 0.00 -0.01 0.11 0.02 0.00 0.00 177.57 177.84 1crp h LYS 104 N -0.14 0.00 -5.86 1.57 1.79 -1.62 -3.46 116.57 108.84 1crp h LYS 104 Ca -0.01 0.00 -0.37 0.00 -2.18 0.00 0.00 60.65 58.09 1crp h LYS 104 Cb 0.13 0.00 0.12 0.00 -1.58 0.00 0.00 32.23 30.90 1crp h LYS 104 CO -0.02 0.01 -0.80 -3.47 -1.08 0.00 0.00 179.45 174.09 1crp n ASP 105 N -3.24 -1.73 -3.13 0.86 2.03 0.11 -4.98 116.55 106.49 1crp n ASP 105 Ca -0.03 -0.71 -0.08 0.00 0.52 0.00 0.00 54.79 54.49 1crp n ASP 105 Cb 0.11 -4.63 0.01 0.00 -0.72 0.00 0.00 41.12 35.89 1crp n ASP 105 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1crp s SER 106 N -4.34 -0.04 -0.47 1.67 1.04 -0.96 -5.02 113.70 105.59 1crp s SER 106 Ca 0.02 -1.04 0.08 0.00 0.48 0.00 0.00 55.95 55.49 1crp s SER 106 Cb -0.01 0.82 0.31 0.00 0.10 0.00 0.00 66.02 67.25 1crp s SER 106 CO 0.77 -1.62 0.74 -0.67 0.98 0.00 0.00 173.24 173.44 1crp n ASP 107 N -1.21 2.05 -2.69 7.02 2.03 -1.26 -4.58 116.55 117.91 1crp n ASP 107 Ca -0.07 -3.17 -0.05 0.00 0.52 0.00 0.00 54.79 52.01 1crp n ASP 107 Cb 0.60 -0.62 0.10 0.00 -0.72 0.00 0.00 41.12 40.48 1crp n ASP 107 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1crp n ASP 108 N 0.49 -1.67 -4.98 1.67 9.92 -1.26 -5.15 116.55 115.57 1crp n ASP 108 Ca 0.26 -2.60 -0.20 0.00 -0.53 0.00 0.00 54.79 51.72 1crp n ASP 108 Cb 0.52 1.47 0.00 0.00 -0.64 0.00 0.00 41.12 42.47 1crp n ASP 108 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1crp s VAL 109 N 0.14 3.97 -1.49 2.53 1.01 -1.26 -4.97 120.40 120.33 1crp s VAL 109 Ca 0.21 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 61.27 1crp s VAL 109 Cb 0.29 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 33.28 1crp s VAL 109 CO -0.14 -0.20 2.54 -0.81 0.00 0.00 0.00 175.10 176.49 1crp n PRO 110 N -1.81 3.67 -1.51 2.72 -0.05 -1.26 -4.96 135.00 131.79 1crp n PRO 110 Ca 0.01 -2.71 -0.33 0.00 -0.05 0.00 0.00 63.50 60.41 1crp n PRO 110 Cb 0.58 -2.90 0.08 0.00 -0.05 0.00 0.00 33.50 31.21 1crp n PRO 110 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 175.50 176.86 1crp s MET 111 N 1.54 2.34 -0.32 0.54 1.75 -1.26 -2.92 119.30 120.95 1crp s MET 111 Ca 0.58 1.59 0.04 0.00 -1.25 0.00 0.00 55.69 56.64 1crp s MET 111 Cb 0.16 -1.87 0.17 0.00 2.84 0.00 0.00 34.83 36.12 1crp s MET 111 CO -0.07 -1.65 0.47 0.08 -0.65 0.00 0.00 175.02 173.20 1crp s VAL 112 N -2.19 -0.69 -0.25 10.11 1.01 0.38 -4.24 120.40 124.54 1crp s VAL 112 Ca 0.71 -0.33 -0.26 0.00 0.00 0.00 0.00 61.98 62.09 1crp s VAL 112 Cb -0.25 -0.78 0.00 0.00 0.00 0.00 0.00 36.38 35.35 1crp s VAL 112 CO 0.45 -0.25 0.90 -0.22 0.00 0.00 0.00 175.10 175.98 1crp s LEU 113 N 2.27 4.08 -0.08 3.92 0.20 -0.98 -1.19 118.68 126.90 1crp s LEU 113 Ca 0.12 1.12 0.03 0.00 0.69 0.00 0.00 54.13 56.09 1crp s LEU 113 Cb -0.11 -3.31 0.00 0.00 -0.43 0.00 0.00 46.19 42.35 1crp s LEU 113 CO -0.21 -0.59 -0.19 -0.69 -0.29 0.00 0.00 176.35 174.38 1crp s VAL 114 N 3.00 1.64 -0.37 1.68 1.01 -0.89 -2.50 120.40 123.97 1crp s VAL 114 Ca 0.38 -0.78 -0.18 0.00 0.00 0.00 0.00 61.98 61.40 1crp s VAL 114 Cb -0.15 -1.44 0.00 0.00 0.00 0.00 0.00 36.38 34.80 1crp s VAL 114 CO 0.08 0.47 0.51 -0.83 0.00 0.00 0.00 175.10 175.32 1crp s GLY 115 N 0.40 1.82 0.58 4.51 0.00 -0.91 -1.60 107.32 112.13 1crp s GLY 115 Ca -0.15 -1.13 0.01 0.00 0.00 0.00 0.00 44.72 43.45 1crp s GLY 115 CO 0.06 1.27 0.82 0.21 0.00 0.00 0.00 173.10 175.45 1crp s ASN 116 N 1.80 5.11 -0.42 1.64 2.47 -0.81 -1.60 114.94 123.14 1crp s ASN 116 Ca 0.18 -0.07 -0.02 0.00 0.42 0.00 0.00 52.86 53.36 1crp s ASN 116 Cb -0.16 -0.72 0.00 0.00 -1.45 0.00 0.00 41.25 38.93 1crp s ASN 116 CO 0.14 -1.27 0.36 1.17 -3.72 0.00 0.00 177.10 173.78 1crp n LYS 117 N -2.43 -2.45 -0.77 0.43 4.81 -0.43 -2.07 118.16 115.26 1crp n LYS 117 Ca 0.09 0.26 0.08 0.00 -0.87 0.00 0.00 58.31 57.88 1crp n LYS 117 Cb 0.60 -3.57 0.38 0.00 0.02 0.00 0.00 35.03 32.46 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 0.85 7.06 -3.31 0.00 5.75 -1.26 -4.95 116.55 120.69 1crp n ASP 119 Ca 0.27 -3.60 -0.08 0.00 -0.01 0.00 0.00 54.79 51.36 1crp n ASP 119 Cb 1.05 -1.20 0.01 0.00 -1.03 0.00 0.00 41.12 39.95 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 -3.85 -0.10 -0.20 -2.12 0.05 -1.26 -5.08 118.68 106.11 1crp s LEU 120 Ca 0.37 -0.93 -0.17 0.00 0.05 0.00 0.00 54.13 53.44 1crp s LEU 120 Cb 0.15 2.80 -0.19 0.00 -2.05 0.00 0.00 46.19 46.89 1crp s LEU 120 CO -0.05 -1.55 0.15 0.00 -0.55 0.00 0.00 176.35 174.34 1crp n ALA 121 N -0.50 0.87 -0.29 1.48 0.00 -1.26 -4.94 120.51 115.87 1crp n ALA 121 Ca -0.07 -0.60 -0.16 0.00 0.00 0.00 0.00 53.44 52.61 1crp n ALA 121 Cb 0.60 -0.48 0.27 0.00 0.00 0.00 0.00 19.45 19.83 1crp n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1crp n ALA 122 N -3.45 -4.76 -3.15 0.00 0.00 -1.26 -5.05 120.51 102.83 1crp n ALA 122 Ca -0.36 -1.39 0.06 0.00 0.00 0.00 0.00 53.44 51.76 1crp n ALA 122 Cb 0.78 -0.12 -0.00 0.00 0.00 0.00 0.00 19.45 20.10 1crp n ALA 122 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1crp s ARG 123 N -4.78 0.06 0.10 0.00 0.52 -1.26 -5.03 118.95 108.57 1crp s ARG 123 Ca 0.60 0.07 -0.14 0.00 -0.52 0.00 0.00 55.73 55.74 1crp s ARG 123 Cb -0.11 0.04 -0.08 0.00 0.52 0.00 0.00 34.95 35.32 1crp s ARG 123 CO 0.51 -0.10 1.42 1.79 0.02 0.00 0.00 175.30 178.94 1crp h THR 124 N 4.43 1.30 -4.45 0.02 1.35 -1.76 -3.43 112.91 110.36 1crp h THR 124 Ca -0.11 -1.47 -0.48 0.00 -0.55 0.00 0.00 66.41 63.80 1crp h THR 124 Cb 1.17 1.57 0.09 0.00 -1.73 0.00 0.00 68.15 69.25 1crp h THR 124 CO -0.16 0.47 0.39 -0.69 -0.25 0.00 0.00 175.52 175.28 1crp s VAL 125 N -4.36 2.88 -0.34 6.82 1.01 -1.24 -5.02 120.40 120.14 1crp s VAL 125 Ca -0.12 0.24 0.15 0.00 0.00 0.00 0.00 61.98 62.25 1crp s VAL 125 Cb 0.09 -3.27 0.46 0.00 0.00 0.00 0.00 36.38 33.65 1crp s VAL 125 CO 0.83 -0.35 1.00 -1.84 0.00 0.00 0.00 175.10 174.75 1crp n GLU 126 N -3.10 1.75 0.00 2.72 0.28 -1.26 -5.04 120.64 115.98 1crp n GLU 126 Ca 0.07 -3.56 0.00 0.00 -0.16 0.00 0.00 57.16 53.51 1crp n GLU 126 Cb 0.59 -1.52 0.00 0.00 1.43 0.00 0.00 31.44 31.94 1crp n GLU 126 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1crp n SER 127 N -0.22 0.00 0.04 -1.84 7.64 -1.26 -3.77 113.62 114.22 1crp n SER 127 Ca 0.16 0.00 0.20 0.00 1.01 0.00 0.00 58.87 60.25 1crp n SER 127 Cb 0.79 0.00 0.58 0.00 -1.01 0.00 0.00 64.21 64.57 1crp n SER 127 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1crp h ARG 128 N 0.00 0.00 0.06 1.43 2.43 -1.97 0.50 114.38 116.82 1crp h ARG 128 Ca 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1crp h ARG 128 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1crp h ARG 128 CO 0.00 0.00 -0.03 1.96 -1.51 0.00 0.00 179.97 180.39 1crp h GLN 129 N 0.00 -0.08 -0.05 0.20 4.20 -1.97 0.15 115.11 117.56 1crp h GLN 129 Ca 0.25 0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.91 1crp h GLN 129 Cb 1.76 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.54 1crp h GLN 129 CO -0.00 0.14 -0.25 0.00 -0.67 0.00 0.00 178.83 178.05 1crp h ALA 130 N 0.64 1.48 0.00 3.87 0.00 -1.25 -1.44 119.26 122.56 1crp h ALA 130 Ca -0.01 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1crp h ALA 130 Cb 0.26 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1crp h ALA 130 CO 0.01 0.38 -0.18 1.96 0.00 0.00 0.00 179.25 181.42 1crp h GLN 131 N 0.08 0.00 0.03 0.00 4.20 -0.93 -0.94 115.11 117.55 1crp h GLN 131 Ca 0.01 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.49 1crp h GLN 131 Cb 0.50 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1crp h GLN 131 CO 0.04 0.18 -1.12 -0.44 -0.67 0.00 0.00 178.83 176.81 1crp h ASP 132 N 0.00 0.10 0.92 1.46 3.32 0.12 -1.05 116.42 121.29 1crp h ASP 132 Ca -0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1crp h ASP 132 Cb 0.64 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1crp h ASP 132 CO 0.02 1.09 -0.69 0.25 -1.72 0.00 0.00 179.24 178.19 1crp h LEU 133 N 0.02 0.00 0.00 1.55 6.46 -1.22 -3.27 115.31 118.84 1crp h LEU 133 Ca -0.07 -0.17 -0.11 0.00 -0.12 0.00 0.00 57.88 57.42 1crp h LEU 133 Cb 1.84 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 41.75 1crp h LEU 133 CO 0.14 0.08 -1.27 0.00 -0.62 0.00 0.00 178.44 176.78 1crp n ALA 134 N -1.91 1.22 -0.05 1.25 0.00 -0.38 -4.24 120.51 116.41 1crp n ALA 134 Ca 0.03 -0.78 0.23 0.00 0.00 0.00 0.00 53.44 52.91 1crp n ALA 134 Cb 0.47 0.09 0.70 0.00 0.00 0.00 0.00 19.45 20.71 1crp n ALA 134 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1crp h ARG 135 N -0.87 0.00 -0.43 0.00 2.43 -1.35 0.32 114.38 114.48 1crp h ARG 135 Ca -0.16 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 58.95 1crp h ARG 135 Cb 1.05 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.58 1crp h ARG 135 CO -0.10 0.00 0.04 1.03 -1.51 0.00 0.00 179.97 179.43 1crp h SER 136 N 0.00 0.71 -0.17 -3.80 0.87 -1.69 -2.40 113.55 107.07 1crp h SER 136 Ca 0.30 -0.28 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1crp h SER 136 Cb 1.21 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 1crp h SER 136 CO -0.00 0.81 0.00 -1.22 -0.53 0.00 0.00 176.83 175.89 1crp n TYR 137 N -4.45 0.22 -3.41 2.24 4.01 0.03 -4.90 117.16 110.90 1crp n TYR 137 Ca -0.00 -0.11 -0.19 0.00 -0.16 0.00 0.00 57.90 57.44 1crp n TYR 137 Cb 0.26 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.37 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 0.92 -0.35 3.32 2.72 0.00 -0.77 -5.01 105.19 106.01 1crp n GLY 138 Ca 0.11 0.12 -0.27 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.31 1.97 0.59 -0.61 -4.36 -0.96 -5.01 121.20 109.51 1crp s ILE 139 Ca 0.30 -1.48 -0.19 0.00 -0.26 0.00 0.00 60.65 59.02 1crp s ILE 139 Cb -0.13 -1.73 -0.04 0.00 1.25 0.00 0.00 42.46 41.81 1crp s ILE 139 CO 0.66 0.16 1.22 -2.16 0.24 0.00 0.00 174.94 175.06 1crp s PRO 140 N -1.60 2.99 -0.02 0.37 0.04 -1.26 -4.17 135.00 131.35 1crp s PRO 140 Ca 0.10 1.86 0.07 0.00 0.04 0.00 0.00 61.00 63.08 1crp s PRO 140 Cb -0.10 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.46 1crp s PRO 140 CO 0.04 -1.20 -0.23 -0.47 0.04 0.00 0.00 177.00 175.18 1crp s TYR 141 N -1.56 2.04 0.30 0.56 5.04 -1.26 -2.33 117.35 120.14 1crp s TYR 141 Ca 0.77 -0.40 -0.00 0.00 -2.44 0.00 0.00 57.07 55.00 1crp s TYR 141 Cb -0.31 -1.31 -0.02 0.00 0.35 0.00 0.00 41.96 40.66 1crp s TYR 141 CO 0.34 -0.05 0.34 0.42 -1.34 0.00 0.00 175.55 175.26 1crp s ILE 142 N -0.50 0.00 0.18 3.14 1.01 -1.04 -5.02 121.20 118.97 1crp s ILE 142 Ca 0.08 -1.79 0.10 0.00 0.00 0.00 0.00 60.65 59.04 1crp s ILE 142 Cb -0.09 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 1crp s ILE 142 CO -0.01 0.00 -0.22 -0.70 0.00 0.00 0.00 174.94 174.02 1crp s GLU 143 N -3.53 1.41 0.09 2.79 2.12 -1.26 -2.15 118.70 118.17 1crp s GLU 143 Ca 0.35 -1.46 -0.18 0.00 0.36 0.00 0.00 54.97 54.04 1crp s GLU 143 Cb 0.02 -1.64 0.04 0.00 0.26 0.00 0.00 34.13 32.81 1crp s GLU 143 CO 0.20 0.35 0.43 0.95 -0.54 0.00 0.00 175.26 176.65 1crp s THR 144 N -1.76 0.05 -0.26 -1.70 -4.23 -0.62 -4.20 115.64 102.92 1crp s THR 144 Ca 0.18 -0.45 -0.07 0.00 -1.18 0.00 0.00 61.69 60.17 1crp s THR 144 Cb -0.07 -1.06 0.13 0.00 1.34 0.00 0.00 72.50 72.84 1crp s THR 144 CO 0.08 -0.25 0.53 -0.55 -0.54 0.00 0.00 174.62 173.90 1crp s SER 145 N -2.41 -0.74 0.00 3.99 0.15 0.95 -1.31 113.70 114.34 1crp s SER 145 Ca -0.01 1.10 0.21 0.00 0.70 0.00 0.00 55.95 57.95 1crp s SER 145 Cb 0.00 1.83 1.22 0.00 -1.71 0.00 0.00 66.02 67.37 1crp s SER 145 CO -0.07 -0.24 1.79 0.00 1.20 0.00 0.00 173.24 175.91 1crp n ALA 146 N 5.42 2.62 1.38 5.45 0.00 -1.26 -2.62 120.51 131.50 1crp n ALA 146 Ca -0.08 -0.13 0.13 0.00 0.00 0.00 0.00 53.44 53.36 1crp n ALA 146 Cb 0.50 -1.33 0.44 0.00 0.00 0.00 0.00 19.45 19.06 1crp n ALA 146 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1crp n LYS 147 N -0.81 1.78 -0.62 0.00 4.81 -1.26 -4.48 118.16 117.58 1crp n LYS 147 Ca 0.15 -1.14 -0.02 0.00 -0.87 0.00 0.00 58.31 56.43 1crp n LYS 147 Cb 0.07 -1.47 -0.02 0.00 0.02 0.00 0.00 35.03 33.63 1crp n LYS 147 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1crp n THR 148 N 0.38 0.00 -2.33 3.15 5.66 -1.21 -4.98 114.28 114.95 1crp n THR 148 Ca 0.18 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 61.08 1crp n THR 148 Cb 0.39 0.17 -0.01 0.00 -1.55 0.00 0.00 70.33 69.33 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 -2.25 -2.96 1.09 1.74 -1.08 -4.88 116.66 108.33 1crp n ARG 149 Ca -0.10 0.50 -0.43 0.00 -0.77 0.00 0.00 57.85 57.06 1crp n ARG 149 Cb 0.40 -5.04 -0.05 0.00 -1.02 0.00 0.00 32.46 26.75 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 -4.79 3.57 0.00 5.56 2.00 -1.08 -3.85 119.66 121.06 1crp s GLN 150 Ca 0.00 0.09 0.00 0.00 -2.00 0.00 0.00 55.36 53.45 1crp s GLN 150 Cb 0.00 -3.88 0.00 0.00 0.80 0.00 0.00 33.01 29.93 1crp s GLN 150 CO 0.00 -1.00 0.00 0.41 -0.50 0.00 0.00 175.29 174.20 1crp n GLY 151 N 4.78 3.02 0.46 2.59 0.00 -1.26 -0.03 105.19 114.75 1crp n GLY 151 Ca 0.03 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.33 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 0.54 0.25 1.61 2.07 -1.73 -1.18 116.25 117.80 1crp h VAL 152 Ca 0.00 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1crp h VAL 152 Cb 0.00 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1crp h VAL 152 CO 0.00 0.02 -0.12 -0.33 0.02 0.00 0.00 177.57 177.16 1crp h GLU 153 N 0.09 -0.33 -0.19 1.57 5.08 -1.90 -2.86 114.58 116.05 1crp h GLU 153 Ca 0.48 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.92 1crp h GLU 153 Cb 1.73 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 31.05 1crp h GLU 153 CO -0.06 0.02 0.15 -0.44 -1.00 0.00 0.00 179.01 177.68 1crp h ASP 154 N -0.76 0.00 0.00 1.42 5.19 -1.56 -1.76 116.42 118.95 1crp h ASP 154 Ca -0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1crp h ASP 154 Cb 0.50 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.01 1crp h ASP 154 CO 0.06 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.18 1crp n ALA 155 N -2.50 -0.17 0.07 3.45 0.00 -0.87 -2.37 120.51 118.12 1crp n ALA 155 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.33 1crp n ALA 155 Cb 0.29 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.68 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 -0.86 0.18 0.00 -1.00 -1.51 -1.54 116.94 112.22 1crp h PHE 156 Ca 0.00 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.82 1crp h PHE 156 Cb 0.00 0.37 -0.04 0.00 3.61 0.00 0.00 35.95 39.89 1crp h PHE 156 CO 0.08 -0.41 -0.40 1.88 -1.61 0.00 0.00 178.31 177.85 1crp h TYR 157 N -0.48 -1.10 -0.18 -0.55 -1.99 -1.49 -0.65 116.97 110.53 1crp h TYR 157 Ca 0.05 0.02 0.05 0.00 2.00 0.00 0.00 58.73 60.86 1crp h TYR 157 Cb 0.55 0.46 -0.01 0.00 2.00 0.00 0.00 36.73 39.74 1crp h TYR 157 CO -0.32 -0.51 0.22 1.15 -0.00 0.00 0.00 178.16 178.69 1crp h THR 158 N -0.67 0.42 -0.01 -2.88 2.02 -1.35 -1.61 112.91 108.82 1crp h THR 158 Ca 0.01 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.19 1crp h THR 158 Cb 0.67 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1crp h THR 158 CO -0.19 0.00 -0.00 0.25 0.37 0.00 0.00 175.52 175.95 1crp h LEU 159 N 0.00 0.02 -1.73 2.58 6.46 -0.06 -2.26 115.31 120.32 1crp h LEU 159 Ca 0.09 -0.34 -0.03 0.00 -0.12 0.00 0.00 57.88 57.47 1crp h LEU 159 Cb 0.52 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.44 1crp h LEU 159 CO -0.00 0.36 -0.16 0.58 -0.62 0.00 0.00 178.44 178.60 1crp h VAL 160 N -0.31 0.65 0.00 1.05 2.07 -0.97 -2.03 116.25 116.71 1crp h VAL 160 Ca 0.00 -0.69 -0.12 0.00 0.82 0.00 0.00 66.70 66.72 1crp h VAL 160 Cb 0.35 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1crp h VAL 160 CO 0.00 0.16 -0.55 -0.09 0.02 0.00 0.00 177.57 177.10 1crp h ARG 161 N 0.00 0.00 0.15 1.57 1.12 -1.13 -2.12 114.38 113.97 1crp h ARG 161 Ca -0.00 0.00 -0.22 0.00 -1.11 0.00 0.00 59.98 58.65 1crp h ARG 161 Cb 0.42 0.00 0.02 0.00 -0.01 0.00 0.00 29.97 30.41 1crp h ARG 161 CO 0.02 0.55 -0.96 0.93 -3.11 0.00 0.00 179.97 177.41 1crp h GLU 162 N 0.00 0.39 -0.32 0.20 4.39 -0.80 -3.04 114.58 115.40 1crp h GLU 162 Ca -0.01 -0.61 -0.06 0.00 0.34 0.00 0.00 59.36 59.02 1crp h GLU 162 Cb 1.08 0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 29.93 1crp h GLU 162 CO 0.07 1.28 -0.07 0.82 -1.16 0.00 0.00 179.01 179.95 1crp h ILE 163 N -0.18 1.22 0.11 3.13 2.04 -1.47 0.74 117.51 123.10 1crp h ILE 163 Ca -0.16 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 64.77 1crp h ILE 163 Cb 1.73 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 38.86 1crp h ILE 163 CO 0.18 0.31 -0.05 0.03 0.00 0.00 0.00 178.15 178.62 1crp h ARG 164 N 0.49 -0.14 0.00 2.37 2.47 -1.44 -3.37 114.38 114.76 1crp h ARG 164 Ca 0.10 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.83 1crp h ARG 164 Cb 0.43 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.78 1crp h ARG 164 CO 0.02 0.03 0.00 0.94 0.56 0.00 0.00 179.97 181.52 1crp n GLN 165 N -5.09 0.00 0.00 0.04 7.27 -1.12 -5.11 117.38 113.37 1crp n GLN 165 Ca -0.08 0.20 0.00 0.00 0.07 0.00 0.00 57.00 57.19 1crp n GLN 165 Cb 0.14 -0.64 0.00 0.00 2.41 0.00 0.00 30.24 32.15 1crp n GLN 165 CO 0.00 0.00 0.00 1.58 0.07 0.00 0.00 177.06 178.71