#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 1.51 -0.11 3.17 2.01 -1.26 -4.73 115.64 116.23 1crp s THR 2 Ca 0.00 0.00 -0.05 0.00 0.31 0.00 0.00 61.69 61.95 1crp s THR 2 Cb 0.00 -2.24 0.05 0.00 0.01 0.00 0.00 72.50 70.32 1crp s THR 2 CO 0.00 0.00 0.26 -0.70 -0.69 0.00 0.00 174.62 173.49 1crp s GLU 3 N -5.09 0.21 0.43 4.92 2.12 -1.26 -2.35 118.70 117.69 1crp s GLU 3 Ca 0.69 0.55 0.04 0.00 0.36 0.00 0.00 54.97 56.61 1crp s GLU 3 Cb -0.14 -0.11 -0.05 0.00 0.26 0.00 0.00 34.13 34.09 1crp s GLU 3 CO 0.58 -0.17 0.03 0.71 -0.54 0.00 0.00 175.26 175.87 1crp s TYR 4 N 1.31 2.12 -0.22 5.30 2.02 -0.91 -5.01 117.35 121.95 1crp s TYR 4 Ca -0.09 -0.89 0.00 0.00 -0.37 0.00 0.00 57.07 55.73 1crp s TYR 4 Cb -0.10 -1.58 0.06 0.00 -0.40 0.00 0.00 41.96 39.94 1crp s TYR 4 CO -0.09 0.22 -0.05 0.15 -1.57 0.00 0.00 175.55 174.21 1crp s LYS 5 N -3.80 1.60 0.69 -0.62 1.02 -1.26 -1.79 119.74 115.58 1crp s LYS 5 Ca 0.23 -0.88 -0.11 0.00 0.02 0.00 0.00 55.97 55.23 1crp s LYS 5 Cb 0.06 -2.47 0.00 0.00 -0.52 0.00 0.00 37.83 34.90 1crp s LYS 5 CO 0.12 -0.56 1.06 -0.51 -0.92 0.00 0.00 175.35 174.54 1crp s LEU 6 N 1.45 3.07 -0.36 3.17 1.43 -0.95 -1.98 118.68 124.50 1crp s LEU 6 Ca -0.04 1.47 0.01 0.00 -1.03 0.00 0.00 54.13 54.54 1crp s LEU 6 Cb -0.18 -4.35 0.15 0.00 0.03 0.00 0.00 46.19 41.83 1crp s LEU 6 CO -0.07 -1.32 0.29 -0.69 0.23 0.00 0.00 176.35 174.79 1crp s VAL 7 N -3.13 -0.09 0.46 -1.59 1.01 0.23 -2.87 120.40 114.42 1crp s VAL 7 Ca 0.57 -1.37 -0.21 0.00 0.00 0.00 0.00 61.98 60.97 1crp s VAL 7 Cb -0.13 -0.90 -0.08 0.00 0.00 0.00 0.00 36.38 35.27 1crp s VAL 7 CO 0.54 -0.80 1.05 -0.69 0.00 0.00 0.00 175.10 175.20 1crp s VAL 8 N 1.24 3.71 0.00 2.92 1.01 -1.13 -2.21 120.40 125.94 1crp s VAL 8 Ca 0.18 1.15 0.00 0.00 0.00 0.00 0.00 61.98 63.30 1crp s VAL 8 Cb -0.19 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.68 1crp s VAL 8 CO -0.01 -0.15 0.00 0.52 0.00 0.00 0.00 175.10 175.46 1crp n VAL 9 N -0.69 0.00 0.00 2.92 0.31 -1.12 -4.32 118.33 115.42 1crp n VAL 9 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 1crp n VAL 9 Cb 0.51 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.44 1crp n VAL 9 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1crp n GLY 10 N 0.00 0.18 3.63 2.92 0.00 -1.26 -1.60 105.19 109.06 1crp n GLY 10 Ca 0.00 -2.03 -0.21 0.00 0.00 0.00 0.00 46.02 43.78 1crp n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1crp n ALA 11 N -0.75 0.25 -3.41 4.61 0.00 -1.23 -4.95 120.51 115.02 1crp n ALA 11 Ca 0.00 -1.84 -0.44 0.00 0.00 0.00 0.00 53.44 51.15 1crp n ALA 11 Cb 0.00 0.32 -0.05 0.00 0.00 0.00 0.00 19.45 19.72 1crp n ALA 11 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1crp s GLY 12 N -4.90 2.39 0.00 0.00 0.00 -1.26 -4.19 107.32 99.36 1crp s GLY 12 Ca 0.62 -2.98 0.00 0.00 0.00 0.00 0.00 44.72 42.36 1crp s GLY 12 CO 0.41 1.20 0.00 0.61 0.00 0.00 0.00 173.10 175.32 1crp n GLY 13 N 4.41 1.21 0.41 0.20 0.00 -1.26 -4.98 105.19 105.18 1crp n GLY 13 Ca 0.02 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.26 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 0.68 0.00 1.61 -1.51 -1.95 -3.44 116.25 111.64 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 0.65 0.00 0.00 -2.13 0.00 0.00 31.29 29.81 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 -1.66 1.55 0.09 5.19 0.00 -1.26 -4.58 105.19 104.52 1crp n GLY 15 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 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 0.18 0.61 1.61 1.57 -1.89 -2.54 116.57 116.11 1crp h LYS 16 Ca 0.00 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1crp h LYS 16 Cb 0.00 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.30 1crp h LYS 16 CO 0.00 0.48 -0.29 0.77 -0.57 0.00 0.00 179.45 179.84 1crp h SER 17 N -0.14 -0.69 -1.32 0.86 0.02 -1.96 -2.40 113.55 107.92 1crp h SER 17 Ca 0.02 0.02 0.38 0.00 -0.84 0.00 0.00 61.79 61.38 1crp h SER 17 Cb 0.41 0.18 -0.06 0.00 0.14 0.00 0.00 62.40 63.06 1crp h SER 17 CO 0.01 -0.35 0.94 0.00 -1.14 0.00 0.00 176.83 176.29 1crp h ALA 18 N -1.34 3.14 -0.08 3.77 0.00 -1.92 0.34 119.26 123.18 1crp h ALA 18 Ca -0.08 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1crp h ALA 18 Cb 0.62 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1crp h ALA 18 CO 0.14 -1.54 -0.23 -0.07 0.00 0.00 0.00 179.25 177.54 1crp h LEU 19 N 0.05 0.33 0.69 0.00 3.38 -1.34 -2.39 115.31 116.03 1crp h LEU 19 Ca 0.65 -0.61 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1crp h LEU 19 Cb 2.48 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 43.13 1crp h LEU 19 CO -0.07 0.88 -0.38 0.74 0.09 0.00 0.00 178.44 179.71 1crp h THR 20 N -0.20 0.00 -0.76 0.22 2.02 0.17 -2.11 112.91 112.25 1crp h THR 20 Ca -0.01 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.39 1crp h THR 20 Cb 0.85 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 1crp h THR 20 CO 0.05 0.00 0.61 0.40 0.37 0.00 0.00 175.52 176.95 1crp h ILE 21 N -0.98 0.48 0.90 3.11 5.03 -1.44 -1.56 117.51 123.04 1crp h ILE 21 Ca -0.09 0.00 -0.04 0.00 -0.12 0.00 0.00 64.86 64.61 1crp h ILE 21 Cb 0.77 0.56 0.00 0.00 -3.03 0.00 0.00 36.82 35.12 1crp h ILE 21 CO 0.13 0.00 -0.50 -0.61 -0.68 0.00 0.00 178.15 176.49 1crp h GLN 22 N 0.00 -1.24 -0.00 2.37 5.75 -0.84 0.31 115.11 121.47 1crp h GLN 22 Ca 0.36 0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.94 1crp h GLN 22 Cb 1.57 0.28 -0.00 0.00 1.07 0.00 0.00 27.48 30.40 1crp h GLN 22 CO -0.00 -0.83 0.05 1.25 -2.65 0.00 0.00 178.83 176.65 1crp h LEU 23 N -1.29 0.00 0.00 -2.39 5.85 -1.08 0.10 115.31 116.50 1crp h LEU 23 Ca -0.12 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1crp h LEU 23 Cb 1.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.04 1crp h LEU 23 CO 0.16 0.00 0.00 -0.38 -0.34 0.00 0.00 178.44 177.88 1crp n ILE 24 N -3.07 0.00 0.30 4.05 5.41 -0.62 -4.65 119.36 120.79 1crp n ILE 24 Ca -0.03 0.00 0.18 0.00 1.00 0.00 0.00 62.75 63.90 1crp n ILE 24 Cb 0.11 -0.66 0.96 0.00 -0.71 0.00 0.00 39.64 39.34 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 -4.44 0.38 4.20 -0.56 -3.47 115.11 111.22 1crp h GLN 25 Ca 0.00 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 1crp h GLN 25 Cb 0.00 0.00 0.11 0.00 0.30 0.00 0.00 27.48 27.89 1crp h GLN 25 CO 0.00 0.03 -0.48 -1.71 -0.67 0.00 0.00 178.83 176.00 1crp n ASN 26 N -3.40 -4.79 -3.80 1.46 2.85 0.02 -5.02 115.26 102.59 1crp n ASN 26 Ca -0.02 -0.40 -0.06 0.00 -0.11 0.00 0.00 54.58 53.99 1crp n ASN 26 Cb 0.15 -3.30 -0.02 0.00 1.24 0.00 0.00 39.78 37.85 1crp n ASN 26 CO 0.00 0.00 0.00 -1.38 -2.11 0.00 0.00 177.26 173.77 1crp s HIS 27 N -3.22 -0.17 -0.17 1.20 -3.43 -1.26 -5.04 115.29 103.20 1crp s HIS 27 Ca 0.26 -0.22 -0.06 0.00 -0.80 0.00 0.00 55.06 54.24 1crp s HIS 27 Cb -0.03 0.68 -0.04 0.00 -1.43 0.00 0.00 32.58 31.75 1crp s HIS 27 CO 0.44 -1.05 0.04 0.12 -2.00 0.00 0.00 174.74 172.29 1crp s PHE 28 N -3.63 3.20 -0.17 0.38 5.36 -1.26 -4.34 117.98 117.52 1crp s PHE 28 Ca 0.11 0.00 -0.05 0.00 -0.96 0.00 0.00 56.93 56.03 1crp s PHE 28 Cb -0.04 -2.04 -0.03 0.00 -0.34 0.00 0.00 43.02 40.57 1crp s PHE 28 CO 0.05 0.14 0.01 0.14 -1.46 0.00 0.00 175.22 174.09 1crp s VAL 29 N 0.29 4.31 -0.28 3.12 -7.23 -1.26 -4.99 120.40 114.36 1crp s VAL 29 Ca 0.02 -0.21 0.09 0.00 -1.81 0.00 0.00 61.98 60.07 1crp s VAL 29 Cb -0.13 -2.92 0.48 0.00 0.56 0.00 0.00 36.38 34.37 1crp s VAL 29 CO 0.01 0.48 1.39 -0.67 -0.31 0.00 0.00 175.10 176.00 1crp n ASP 30 N 3.54 2.63 -2.63 4.85 2.03 -1.26 -4.67 116.55 121.04 1crp n ASP 30 Ca -0.17 -3.83 -0.04 0.00 0.52 0.00 0.00 54.79 51.28 1crp n ASP 30 Cb 0.52 -0.59 -0.00 0.00 -0.72 0.00 0.00 41.12 40.33 1crp n ASP 30 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 1crp n GLU 31 N -1.08 0.26 -2.85 -0.67 0.28 -1.26 -5.13 120.64 110.19 1crp n GLU 31 Ca 0.31 -0.77 -0.41 0.00 -0.16 0.00 0.00 57.16 56.13 1crp n GLU 31 Cb 0.93 -0.01 -0.04 0.00 1.43 0.00 0.00 31.44 33.76 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 0.04 3.61 0.32 -1.84 5.04 -1.26 -5.00 117.35 118.25 1crp s TYR 32 Ca 0.05 1.50 -0.29 0.00 -2.44 0.00 0.00 57.07 55.88 1crp s TYR 32 Cb 0.09 -3.00 -0.11 0.00 0.35 0.00 0.00 41.96 39.29 1crp s TYR 32 CO -0.02 0.00 1.52 -0.51 -1.34 0.00 0.00 175.55 175.20 1crp s ASP 33 N 0.94 6.42 0.50 4.32 1.11 -1.26 -4.88 116.67 123.83 1crp s ASP 33 Ca 0.45 2.94 0.29 0.00 0.18 0.00 0.00 52.55 56.41 1crp s ASP 33 Cb -0.19 -2.65 1.24 0.00 1.07 0.00 0.00 42.92 42.39 1crp s ASP 33 CO 0.23 -0.85 1.95 1.55 1.18 0.00 0.00 175.17 179.23 1crp h PRO 34 N 4.09 0.00 -1.35 8.23 0.13 -2.03 -3.06 132.00 138.02 1crp h PRO 34 Ca -0.48 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.12 1crp h PRO 34 Cb 1.23 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.14 1crp h PRO 34 CO 0.73 0.12 0.66 0.25 -0.23 0.00 0.00 178.00 179.53 1crp n THR 35 N -3.32 3.25 -3.50 1.56 -2.24 -1.26 -3.99 114.28 104.77 1crp n THR 35 Ca -0.00 -2.48 -0.37 0.00 -2.27 0.00 0.00 64.05 58.93 1crp n THR 35 Cb 0.34 -1.27 -0.05 0.00 -2.10 0.00 0.00 70.33 67.25 1crp n THR 35 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1crp n ILE 36 N -0.24 3.45 -3.74 2.28 2.08 -1.16 -5.03 119.36 117.02 1crp n ILE 36 Ca 0.48 -5.26 -0.36 0.00 0.56 0.00 0.00 62.75 58.16 1crp n ILE 36 Cb 0.59 -2.34 -0.07 0.00 -0.75 0.00 0.00 39.64 37.07 1crp n ILE 36 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1crp s GLU 37 N -1.66 3.84 -0.25 0.38 2.12 -1.26 -4.90 118.70 116.96 1crp s GLU 37 Ca 0.30 -0.05 -0.30 0.00 0.36 0.00 0.00 54.97 55.27 1crp s GLU 37 Cb -0.04 -3.29 0.17 0.00 0.26 0.00 0.00 34.13 31.23 1crp s GLU 37 CO -0.08 0.55 1.27 0.34 -0.54 0.00 0.00 175.26 176.79 1crp s ASP 38 N -0.41 -0.12 -0.68 -1.70 2.15 -1.26 -5.09 116.67 109.56 1crp s ASP 38 Ca 0.14 0.11 -0.27 0.00 0.43 0.00 0.00 52.55 52.96 1crp s ASP 38 Cb -0.12 0.10 0.03 0.00 -0.30 0.00 0.00 42.92 42.63 1crp s ASP 38 CO 0.03 -0.12 1.24 -0.94 -0.17 0.00 0.00 175.17 175.21 1crp s SER 39 N -1.20 6.26 0.11 -0.34 1.04 -1.26 -3.69 113.70 114.61 1crp s SER 39 Ca 0.07 -0.28 -0.22 0.00 0.48 0.00 0.00 55.95 56.00 1crp s SER 39 Cb -0.01 -2.55 -0.07 0.00 0.10 0.00 0.00 66.02 63.49 1crp s SER 39 CO -0.05 -1.70 0.66 -0.31 0.98 0.00 0.00 173.24 172.82 1crp s TYR 40 N 5.40 3.85 0.09 5.02 1.51 -0.64 -4.94 117.35 127.63 1crp s TYR 40 Ca 0.37 1.43 0.09 0.00 -1.01 0.00 0.00 57.07 57.95 1crp s TYR 40 Cb -0.08 -2.62 -0.04 0.00 -0.11 0.00 0.00 41.96 39.11 1crp s TYR 40 CO 0.18 0.54 -0.22 1.03 -1.11 0.00 0.00 175.55 175.98 1crp s ARG 41 N -1.07 1.74 -0.23 -0.62 0.52 -1.26 -0.81 118.95 117.22 1crp s ARG 41 Ca 0.32 -1.17 -0.09 0.00 -0.52 0.00 0.00 55.73 54.26 1crp s ARG 41 Cb -0.21 -2.04 0.09 0.00 0.52 0.00 0.00 34.95 33.31 1crp s ARG 41 CO 0.22 0.49 0.52 0.21 0.02 0.00 0.00 175.30 176.76 1crp s LYS 42 N -1.79 0.46 -0.11 3.54 2.47 -1.23 -4.94 119.74 118.13 1crp s LYS 42 Ca 0.15 1.13 -0.05 0.00 -1.56 0.00 0.00 55.97 55.64 1crp s LYS 42 Cb -0.10 0.38 -0.04 0.00 -1.46 0.00 0.00 37.83 36.61 1crp s LYS 42 CO 0.06 -0.21 0.06 1.14 0.16 0.00 0.00 175.35 176.57 1crp s GLN 43 N 2.32 3.30 0.12 4.03 -2.07 -1.26 -2.68 119.66 123.41 1crp s GLN 43 Ca -0.06 -0.29 0.02 0.00 -1.82 0.00 0.00 55.36 53.21 1crp s GLN 43 Cb -0.10 -3.00 -0.01 0.00 -1.09 0.00 0.00 33.01 28.81 1crp s GLN 43 CO -0.15 0.67 0.12 1.33 -1.32 0.00 0.00 175.29 175.94 1crp n VAL 44 N 2.28 0.00 -3.84 3.63 0.24 -1.23 -5.00 118.33 114.41 1crp n VAL 44 Ca -0.19 -0.76 -0.30 0.00 -2.04 0.00 0.00 64.34 61.05 1crp n VAL 44 Cb 0.54 0.41 -0.14 0.00 -1.47 0.00 0.00 33.84 33.17 1crp n VAL 44 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1crp s VAL 45 N -2.50 1.78 -0.13 3.34 1.01 -1.26 -2.26 120.40 120.37 1crp s VAL 45 Ca 0.12 -2.48 -0.07 0.00 0.00 0.00 0.00 61.98 59.56 1crp s VAL 45 Cb 0.00 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1crp s VAL 45 CO 0.09 -0.77 0.12 -0.63 0.00 0.00 0.00 175.10 173.91 1crp s ILE 46 N 0.55 5.30 -1.61 2.22 1.01 -0.93 -4.32 121.20 123.43 1crp s ILE 46 Ca 0.15 0.13 -0.03 0.00 0.00 0.00 0.00 60.65 60.90 1crp s ILE 46 Cb -0.22 -3.32 0.01 0.00 0.01 0.00 0.00 42.46 38.93 1crp s ILE 46 CO -0.06 0.58 0.41 0.47 0.00 0.00 0.00 174.94 176.33 1crp n ASP 47 N 2.37 -5.92 -2.71 3.58 8.00 -1.26 -1.33 116.55 119.28 1crp n ASP 47 Ca -0.19 -0.20 -0.20 0.00 0.71 0.00 0.00 54.79 54.91 1crp n ASP 47 Cb 0.54 -4.83 0.03 0.00 -0.02 0.00 0.00 41.12 36.84 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 -1.34 -0.40 2.94 0.44 0.00 -1.26 -4.98 105.19 100.59 1crp n GLY 48 Ca -0.15 0.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.76 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 -5.56 0.17 0.67 1.61 2.12 -0.44 -5.13 118.70 112.14 1crp s GLU 49 Ca 0.26 0.61 -0.16 0.00 0.36 0.00 0.00 54.97 56.04 1crp s GLU 49 Cb -0.12 -0.33 0.01 0.00 0.26 0.00 0.00 34.13 33.95 1crp s GLU 49 CO 0.33 -0.40 1.20 0.99 -0.54 0.00 0.00 175.26 176.83 1crp s THR 50 N 2.41 2.55 -0.30 -1.70 2.01 -1.26 -2.18 115.64 117.17 1crp s THR 50 Ca 0.03 0.29 -0.13 0.00 0.31 0.00 0.00 61.69 62.20 1crp s THR 50 Cb -0.13 -2.93 0.15 0.00 0.01 0.00 0.00 72.50 69.60 1crp s THR 50 CO -0.10 -0.12 0.85 0.00 -0.69 0.00 0.00 174.62 174.56 1crp s LEU 52 N 2.64 4.38 -0.33 0.00 0.20 -0.99 -3.57 118.68 121.01 1crp s LEU 52 Ca -0.03 1.85 0.03 0.00 0.69 0.00 0.00 54.13 56.67 1crp s LEU 52 Cb -0.09 -3.58 0.10 0.00 -0.43 0.00 0.00 46.19 42.19 1crp s LEU 52 CO -0.18 -0.35 0.04 -0.76 -0.29 0.00 0.00 176.35 174.81 1crp s LEU 53 N 0.92 4.37 -0.78 -0.68 1.43 -1.09 -2.14 118.68 120.71 1crp s LEU 53 Ca 0.55 -2.02 -0.25 0.00 -1.03 0.00 0.00 54.13 51.37 1crp s LEU 53 Cb -0.25 -1.54 -0.07 0.00 0.03 0.00 0.00 46.19 44.35 1crp s LEU 53 CO 0.29 -0.36 2.10 -0.62 0.23 0.00 0.00 176.35 177.99 1crp s ASP 54 N 0.99 4.75 -0.18 2.29 -1.08 -0.74 -3.49 116.67 119.22 1crp s ASP 54 Ca 0.09 -0.13 -0.29 0.00 -0.52 0.00 0.00 52.55 51.69 1crp s ASP 54 Cb -0.19 -2.55 -0.01 0.00 -1.46 0.00 0.00 42.92 38.72 1crp s ASP 54 CO -0.09 -3.01 1.21 -0.63 0.52 0.00 0.00 175.17 173.17 1crp s ILE 55 N 11.41 4.38 -0.34 4.11 1.09 0.01 -2.25 121.20 139.61 1crp s ILE 55 Ca 0.78 1.67 -0.16 0.00 -1.10 0.00 0.00 60.65 61.84 1crp s ILE 55 Cb -0.10 -4.07 -0.01 0.00 -1.06 0.00 0.00 42.46 37.21 1crp s ILE 55 CO 0.08 -0.14 0.39 -0.22 -0.10 0.00 0.00 174.94 174.94 1crp s LEU 56 N 3.40 4.38 -0.51 2.97 2.96 -1.14 -1.63 118.68 129.12 1crp s LEU 56 Ca 0.52 -0.15 -0.18 0.00 -0.22 0.00 0.00 54.13 54.10 1crp s LEU 56 Cb -0.20 -2.39 0.07 0.00 0.50 0.00 0.00 46.19 44.17 1crp s LEU 56 CO 0.13 -0.35 0.58 -0.62 -1.32 0.00 0.00 176.35 174.77 1crp s ASP 57 N 1.73 6.20 0.38 3.68 2.15 -1.24 -2.83 116.67 126.74 1crp s ASP 57 Ca 0.13 -1.08 -0.23 0.00 0.43 0.00 0.00 52.55 51.80 1crp s ASP 57 Cb -0.16 -2.27 -0.10 0.00 -0.30 0.00 0.00 42.92 40.09 1crp s ASP 57 CO 0.12 -0.87 0.95 0.42 -0.17 0.00 0.00 175.17 175.62 1crp s THR 58 N 2.41 4.29 -0.23 1.71 -4.23 -1.26 -4.01 115.64 114.32 1crp s THR 58 Ca 0.12 1.63 -0.33 0.00 -1.18 0.00 0.00 61.69 61.93 1crp s THR 58 Cb -0.21 -3.78 0.16 0.00 1.34 0.00 0.00 72.50 70.01 1crp s THR 58 CO 0.10 -0.11 1.26 0.00 -0.54 0.00 0.00 174.62 175.32 1crp s ALA 59 N -1.92 -2.09 0.00 3.99 0.00 -1.26 -4.98 121.76 115.49 1crp s ALA 59 Ca 0.57 1.74 0.00 0.00 0.00 0.00 0.00 51.96 54.27 1crp s ALA 59 Cb -0.13 -0.69 0.00 0.00 0.00 0.00 0.00 23.12 22.30 1crp s ALA 59 CO 0.18 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1crp n GLY 60 N 0.22 3.61 1.17 0.00 0.00 -1.26 -4.80 105.19 104.14 1crp n GLY 60 Ca -0.00 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.57 0.00 -1.23 1.61 1.13 -1.26 -5.06 117.38 111.00 1crp n GLN 61 Ca 0.00 0.00 -0.04 0.00 -1.94 0.00 0.00 57.00 55.02 1crp n GLN 61 Cb 0.00 -0.08 0.02 0.00 0.11 0.00 0.00 30.24 30.29 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 -2.69 0.75 -1.54 -1.09 1.02 -1.26 -4.96 120.64 110.87 1crp n GLU 62 Ca 0.00 -0.57 -0.50 0.00 -0.02 0.00 0.00 57.16 56.07 1crp n GLU 62 Cb 0.00 -0.08 -0.06 0.00 -0.02 0.00 0.00 31.44 31.28 1crp n GLU 62 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1crp n GLU 63 N -1.29 1.41 0.00 3.49 2.13 -1.26 -4.72 120.64 120.40 1crp n GLU 63 Ca 0.03 0.43 0.00 0.00 0.66 0.00 0.00 57.16 58.29 1crp n GLU 63 Cb 0.11 -2.56 0.00 0.00 0.27 0.00 0.00 31.44 29.27 1crp n GLU 63 CO 0.00 0.00 0.00 2.48 -0.41 0.00 0.00 177.13 179.20 1crp n TYR 64 N 8.99 0.00 -3.61 4.31 4.11 -1.26 -5.13 117.16 124.58 1crp n TYR 64 Ca 0.35 0.00 -0.05 0.00 -0.00 0.00 0.00 57.90 58.20 1crp n TYR 64 Cb 0.26 0.05 -0.02 0.00 -0.00 0.00 0.00 39.34 39.64 1crp n TYR 64 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.86 175.74 1crp s SER 65 N -3.91 -0.22 0.00 9.48 0.01 -1.26 -5.06 113.70 112.74 1crp s SER 65 Ca 0.00 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.13 1crp s SER 65 Cb 0.00 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.56 1crp s SER 65 CO 0.00 -0.56 0.01 0.00 0.41 0.00 0.00 173.24 173.09 1crp n ALA 66 N -0.31 1.82 0.34 1.44 0.00 -1.26 -4.64 120.51 117.90 1crp n ALA 66 Ca -0.06 -0.01 0.22 0.00 0.00 0.00 0.00 53.44 53.59 1crp n ALA 66 Cb 0.61 0.00 1.18 0.00 0.00 0.00 0.00 19.45 21.24 1crp n ALA 66 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1crp h MET 67 N 0.00 0.00 -0.45 0.00 1.85 -2.00 -1.96 114.93 112.38 1crp h MET 67 Ca 0.00 0.00 -0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1crp h MET 67 Cb 0.00 0.00 -0.02 0.00 0.43 0.00 0.00 31.60 32.01 1crp h MET 67 CO 0.00 0.00 0.27 -0.09 -0.40 0.00 0.00 176.91 176.69 1crp h ARG 68 N 0.00 0.61 -0.69 0.39 2.43 -2.00 -1.43 114.38 113.69 1crp h ARG 68 Ca 0.00 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.06 1crp h ARG 68 Cb 0.05 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 1crp h ARG 68 CO -0.00 0.45 0.22 0.22 -1.51 0.00 0.00 179.97 179.35 1crp h ASP 69 N 0.59 0.98 0.19 -3.80 3.58 -1.70 -1.55 116.42 114.71 1crp h ASP 69 Ca 0.16 -0.17 -0.03 0.00 0.42 0.00 0.00 57.03 57.40 1crp h ASP 69 Cb -0.00 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 40.79 1crp h ASP 69 CO -0.03 0.91 -0.15 1.56 -2.88 0.00 0.00 179.24 178.65 1crp h GLN 70 N 1.02 0.00 0.00 0.28 7.50 -1.42 -0.96 115.11 121.53 1crp h GLN 70 Ca 0.22 0.00 -0.12 0.00 0.50 0.00 0.00 58.65 59.25 1crp h GLN 70 Cb 0.28 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.80 1crp h GLN 70 CO -0.01 0.15 -0.57 -0.92 -1.50 0.00 0.00 178.83 175.98 1crp h TYR 71 N 0.00 0.00 0.00 2.96 5.03 -0.26 -2.12 116.97 122.58 1crp h TYR 71 Ca -0.00 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.30 1crp h TYR 71 Cb 0.29 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.57 1crp h TYR 71 CO 0.00 0.57 -0.03 0.52 -1.32 0.00 0.00 178.16 177.91 1crp h MET 72 N 0.00 0.00 0.12 1.82 2.86 -0.78 -0.09 114.93 118.85 1crp h MET 72 Ca -0.01 0.00 -0.36 0.00 -2.06 0.00 0.00 59.70 57.27 1crp h MET 72 Cb 1.09 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.74 1crp h MET 72 CO 0.07 0.03 -2.00 -2.13 1.06 0.00 0.00 176.91 173.94 1crp n ARG 73 N -3.31 0.76 -0.02 1.72 0.63 -0.85 -4.37 116.66 111.22 1crp n ARG 73 Ca -0.02 0.26 -0.01 0.00 -0.92 0.00 0.00 57.85 57.16 1crp n ARG 73 Cb 0.15 -1.71 -0.00 0.00 0.45 0.00 0.00 32.46 31.35 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 0.07 0.00 -3.73 5.15 1.35 -1.00 -3.45 112.91 111.29 1crp h THR 74 Ca -0.43 -0.89 -0.54 0.00 -0.55 0.00 0.00 66.41 64.01 1crp h THR 74 Cb 2.03 0.00 0.19 0.00 -1.73 0.00 0.00 68.15 68.65 1crp h THR 74 CO 0.08 0.00 -0.10 0.61 -0.25 0.00 0.00 175.52 175.86 1crp n GLY 75 N 1.63 -0.95 0.00 5.82 0.00 -0.09 -4.95 105.19 106.64 1crp n GLY 75 Ca -0.01 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.25 2.82 -2.39 1.61 4.71 -0.84 -4.84 120.64 119.47 1crp n GLU 76 Ca 0.11 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.84 1crp n GLU 76 Cb 0.51 -0.86 -0.03 0.00 -1.01 0.00 0.00 31.44 30.05 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 -2.39 2.60 -0.39 0.62 0.00 -1.00 -3.61 107.32 103.16 1crp s GLY 77 Ca 0.00 0.92 0.02 0.00 0.00 0.00 0.00 44.72 45.66 1crp s GLY 77 CO 0.00 1.90 0.16 -1.36 0.00 0.00 0.00 173.10 173.80 1crp s PHE 78 N 0.22 2.46 -1.23 1.90 0.08 -1.04 0.77 117.98 121.14 1crp s PHE 78 Ca 0.54 -2.44 -0.11 0.00 0.12 0.00 0.00 56.93 55.04 1crp s PHE 78 Cb -0.32 -2.19 0.18 0.00 -0.57 0.00 0.00 43.02 40.12 1crp s PHE 78 CO 0.35 -0.84 1.63 -0.11 -0.10 0.00 0.00 175.22 176.14 1crp n LEU 79 N 4.05 5.97 -4.56 -0.37 7.94 -0.94 -1.45 117.00 127.64 1crp n LEU 79 Ca 0.04 -4.62 -0.29 0.00 -1.11 0.00 0.00 56.01 50.03 1crp n LEU 79 Cb 0.38 -1.53 -0.05 0.00 0.53 0.00 0.00 43.42 42.76 1crp n LEU 79 CO 0.21 1.12 1.43 0.00 -1.11 0.00 0.00 177.39 179.04 1crp s VAL 81 N 10.26 2.02 -0.20 0.00 1.01 -0.63 -2.77 120.40 130.10 1crp s VAL 81 Ca 0.72 0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.68 1crp s VAL 81 Cb -0.09 -3.01 0.07 0.00 0.00 0.00 0.00 36.38 33.34 1crp s VAL 81 CO 0.07 0.00 0.08 0.12 0.00 0.00 0.00 175.10 175.38 1crp s PHE 82 N -0.53 0.46 0.18 5.22 5.36 -0.48 -3.57 117.98 124.61 1crp s PHE 82 Ca 0.58 -0.57 -0.30 0.00 -0.96 0.00 0.00 56.93 55.68 1crp s PHE 82 Cb -0.48 -0.84 -0.08 0.00 -0.34 0.00 0.00 43.02 41.29 1crp s PHE 82 CO 0.56 -0.59 1.21 0.00 -1.46 0.00 0.00 175.22 174.93 1crp s ALA 83 N 2.05 3.45 -0.83 11.12 0.00 -1.26 -0.80 121.76 135.48 1crp s ALA 83 Ca 0.03 0.97 -0.02 0.00 0.00 0.00 0.00 51.96 52.94 1crp s ALA 83 Cb -0.16 -3.42 0.36 0.00 0.00 0.00 0.00 23.12 19.89 1crp s ALA 83 CO -0.14 -0.40 2.00 0.44 0.00 0.00 0.00 175.76 177.67 1crp n ILE 84 N 2.58 3.57 0.00 0.00 -5.35 -0.85 -4.15 119.36 115.15 1crp n ILE 84 Ca 0.05 -4.27 0.00 0.00 -0.27 0.00 0.00 62.75 58.26 1crp n ILE 84 Cb 0.44 -1.24 0.00 0.00 -1.74 0.00 0.00 39.64 37.11 1crp n ILE 84 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1crp n ASN 85 N -0.55 0.00 0.06 7.28 5.15 -1.26 -2.91 115.26 123.02 1crp n ASN 85 Ca 0.54 0.00 -0.03 0.00 -0.60 0.00 0.00 54.58 54.49 1crp n ASN 85 Cb 0.26 0.02 -0.08 0.00 -0.53 0.00 0.00 39.78 39.45 1crp n ASN 85 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1crp h ASN 86 N 0.00 0.00 0.00 1.20 7.08 -2.00 -3.37 115.58 118.49 1crp h ASN 86 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1crp h ASN 86 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 1crp h ASN 86 CO 0.00 0.76 0.00 0.41 -2.08 0.00 0.00 177.43 176.52 1crp n THR 87 N -3.13 0.00 0.23 6.14 -1.04 -1.26 -4.79 114.28 110.42 1crp n THR 87 Ca -0.06 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.08 1crp n THR 87 Cb 0.89 0.00 0.75 0.00 -1.82 0.00 0.00 70.33 70.15 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 0.12 0.00 -0.59 -2.82 3.64 -1.92 -0.49 116.57 114.51 1crp h LYS 88 Ca 0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1crp h LYS 88 Cb 0.00 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1crp h LYS 88 CO 0.00 0.00 0.01 0.66 -2.27 0.00 0.00 179.45 177.85 1crp h SER 89 N 0.00 0.99 -0.13 4.20 4.64 -1.87 -1.52 113.55 119.86 1crp h SER 89 Ca 0.05 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1crp h SER 89 Cb 0.21 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 1crp h SER 89 CO -0.00 1.04 0.09 0.15 -0.87 0.00 0.00 176.83 177.24 1crp h PHE 90 N 0.94 0.17 0.00 4.77 3.57 -1.32 -0.21 116.94 124.85 1crp h PHE 90 Ca 0.17 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 1crp h PHE 90 Cb 0.53 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 1crp h PHE 90 CO 0.04 0.11 -0.05 0.93 -2.23 0.00 0.00 178.31 177.11 1crp h GLU 91 N 0.17 0.00 0.00 1.11 5.08 -1.35 -1.24 114.58 118.35 1crp h GLU 91 Ca 0.05 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.25 1crp h GLU 91 Cb -0.01 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1crp h GLU 91 CO -0.01 0.05 -0.76 -0.44 -1.00 0.00 0.00 179.01 176.85 1crp h ASP 92 N 0.00 0.00 0.71 1.42 5.19 -0.02 -3.14 116.42 120.58 1crp h ASP 92 Ca -0.00 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.28 1crp h ASP 92 Cb 0.20 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.69 1crp h ASP 92 CO 0.01 0.76 -0.61 0.40 -3.12 0.00 0.00 179.24 176.68 1crp h ILE 93 N 0.00 1.36 0.62 0.35 1.08 -0.00 -1.36 117.51 119.56 1crp h ILE 93 Ca -0.01 -2.13 -0.02 0.00 -0.39 0.00 0.00 64.86 62.31 1crp h ILE 93 Cb 1.45 2.17 -0.01 0.00 -3.07 0.00 0.00 36.82 37.37 1crp h ILE 93 CO 0.10 0.59 -0.40 -0.74 -0.69 0.00 0.00 178.15 177.01 1crp h HIS 94 N 0.00 -1.07 0.00 1.37 2.76 -1.46 -2.60 115.15 114.15 1crp h HIS 94 Ca -0.01 -0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 58.07 1crp h HIS 94 Cb 1.12 0.39 -0.01 0.00 1.55 0.00 0.00 27.41 30.46 1crp h HIS 94 CO 0.00 -0.60 -0.41 1.96 -1.30 0.00 0.00 177.93 177.57 1crp h GLN 95 N -0.97 0.00 0.00 5.26 4.20 -1.65 -3.11 115.11 118.84 1crp h GLN 95 Ca -0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1crp h GLN 95 Cb 0.80 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.58 1crp h GLN 95 CO 0.06 0.41 0.00 0.66 -0.67 0.00 0.00 178.83 179.30 1crp n TYR 96 N -3.26 0.71 -0.63 2.96 4.02 -0.51 -1.66 117.16 118.79 1crp n TYR 96 Ca 0.02 0.30 -0.08 0.00 -0.01 0.00 0.00 57.90 58.13 1crp n TYR 96 Cb 0.66 -0.99 0.22 0.00 -0.02 0.00 0.00 39.34 39.21 1crp n TYR 96 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1crp n ARG 97 N -2.17 2.87 0.00 -0.72 3.00 -0.99 -3.66 116.66 114.98 1crp n ARG 97 Ca 0.01 -2.39 0.00 0.00 -0.01 0.00 0.00 57.85 55.46 1crp n ARG 97 Cb 0.17 -2.00 0.00 0.00 0.00 0.00 0.00 32.46 30.63 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 -0.24 0.00 -0.19 5.56 -0.58 -0.67 -4.55 120.64 119.98 1crp n GLU 98 Ca 0.36 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 57.00 1crp n GLU 98 Cb 1.24 -0.60 0.01 0.00 -0.57 0.00 0.00 31.44 31.52 1crp n GLU 98 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 1crp h GLN 99 N 0.00 0.99 0.00 3.49 -0.00 -1.71 -0.79 115.11 117.10 1crp h GLN 99 Ca 0.00 -0.35 -0.01 0.00 -0.00 0.00 0.00 58.65 58.29 1crp h GLN 99 Cb 0.64 -0.07 -0.00 0.00 0.00 0.00 0.00 27.48 28.04 1crp h GLN 99 CO 0.00 1.02 -0.07 0.82 0.00 0.00 0.00 178.83 180.61 1crp h ILE 100 N 0.86 0.46 0.02 2.39 2.04 -1.86 -0.39 117.51 121.03 1crp h ILE 100 Ca 0.14 -0.32 -0.21 0.00 1.00 0.00 0.00 64.86 65.47 1crp h ILE 100 Cb 0.62 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 1crp h ILE 100 CO 0.04 0.07 -0.97 0.11 0.00 0.00 0.00 178.15 177.40 1crp h LYS 101 N 0.00 0.06 0.50 2.37 1.57 -1.43 -2.95 116.57 116.69 1crp h LYS 101 Ca -0.00 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1crp h LYS 101 Cb 0.21 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1crp h LYS 101 CO 0.01 0.97 -0.24 0.00 -0.57 0.00 0.00 179.45 179.62 1crp h ARG 102 N 0.02 -0.64 0.01 3.15 3.08 0.02 0.18 114.38 120.20 1crp h ARG 102 Ca -0.03 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1crp h ARG 102 Cb 1.68 0.15 -0.00 0.00 0.08 0.00 0.00 29.97 31.87 1crp h ARG 102 CO 0.13 -0.35 -0.05 0.28 -1.07 0.00 0.00 179.97 178.91 1crp h VAL 103 N -1.05 0.00 0.00 2.04 2.07 -1.53 -0.50 116.25 117.28 1crp h VAL 103 Ca -0.07 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 1crp h VAL 103 Cb 0.59 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1crp h VAL 103 CO 0.11 0.00 -0.00 0.50 0.02 0.00 0.00 177.57 178.20 1crp h LYS 104 N -0.07 0.00 -6.17 1.57 1.63 -1.66 -3.45 116.57 108.42 1crp h LYS 104 Ca -0.00 0.00 -0.37 0.00 -0.85 0.00 0.00 60.65 59.43 1crp h LYS 104 Cb 0.07 0.00 -0.21 0.00 -0.60 0.00 0.00 32.23 31.50 1crp h LYS 104 CO -0.03 0.00 -0.53 -0.40 -3.45 0.00 0.00 179.45 175.04 1crp n ASP 105 N -3.19 -1.81 0.00 4.20 5.68 0.62 -4.68 116.55 117.38 1crp n ASP 105 Ca -0.03 -0.50 0.00 0.00 -0.50 0.00 0.00 54.79 53.76 1crp n ASP 105 Cb 0.10 -1.60 0.00 0.00 -1.14 0.00 0.00 41.12 38.48 1crp n ASP 105 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1crp n SER 106 N -2.09 2.46 -3.50 -1.12 2.88 -1.25 -5.04 113.62 105.95 1crp n SER 106 Ca 0.06 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.41 1crp n SER 106 Cb 0.48 0.41 0.08 0.00 -0.75 0.00 0.00 64.21 64.43 1crp n SER 106 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1crp n ASP 107 N -0.90 -2.61 -2.69 -3.46 8.00 -1.26 -4.91 116.55 108.72 1crp n ASP 107 Ca 0.00 -0.64 -0.06 0.00 0.71 0.00 0.00 54.79 54.81 1crp n ASP 107 Cb 0.08 -4.95 0.08 0.00 -0.02 0.00 0.00 41.12 36.31 1crp n ASP 107 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1crp n ASP 108 N -3.10 -1.64 -4.93 -2.24 2.03 -1.26 -5.15 116.55 100.27 1crp n ASP 108 Ca -0.24 -2.45 -0.27 0.00 0.52 0.00 0.00 54.79 52.35 1crp n ASP 108 Cb 0.65 1.34 -0.03 0.00 -0.72 0.00 0.00 41.12 42.36 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 0.13 5.19 -1.05 5.18 1.01 -1.26 -4.96 120.40 124.64 1crp s VAL 109 Ca 0.18 -0.40 -0.24 0.00 0.00 0.00 0.00 61.98 61.52 1crp s VAL 109 Cb 0.27 -3.76 -0.08 0.00 0.00 0.00 0.00 36.38 32.81 1crp s VAL 109 CO -0.11 -0.23 1.98 -2.16 0.00 0.00 0.00 175.10 174.58 1crp s PRO 110 N -3.49 2.38 0.47 2.72 0.05 -1.24 -4.91 135.00 130.98 1crp s PRO 110 Ca 0.39 -0.69 -0.11 0.00 0.05 0.00 0.00 61.00 60.63 1crp s PRO 110 Cb -0.11 -5.13 -0.06 0.00 0.05 0.00 0.00 34.50 29.25 1crp s PRO 110 CO 0.30 -3.87 0.85 1.41 0.05 0.00 0.00 177.00 175.74 1crp s MET 111 N 6.94 3.77 -0.26 4.56 1.75 -1.26 -2.51 119.30 132.28 1crp s MET 111 Ca 0.71 0.58 -0.02 0.00 -1.25 0.00 0.00 55.69 55.71 1crp s MET 111 Cb -0.04 -2.29 0.15 0.00 2.84 0.00 0.00 34.83 35.48 1crp s MET 111 CO 0.08 -0.17 0.43 0.08 -0.65 0.00 0.00 175.02 174.78 1crp s VAL 112 N -2.57 -0.69 -0.27 10.11 1.01 -0.53 -4.47 120.40 122.99 1crp s VAL 112 Ca 0.53 -0.08 -0.20 0.00 0.00 0.00 0.00 61.98 62.22 1crp s VAL 112 Cb -0.10 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 1crp s VAL 112 CO 0.36 -0.11 0.64 -0.22 0.00 0.00 0.00 175.10 175.76 1crp s LEU 113 N 2.61 4.08 0.17 3.92 2.96 -1.03 -2.16 118.68 129.22 1crp s LEU 113 Ca 0.14 0.66 0.07 0.00 -0.22 0.00 0.00 54.13 54.78 1crp s LEU 113 Cb -0.15 -2.86 -0.04 0.00 0.50 0.00 0.00 46.19 43.65 1crp s LEU 113 CO -0.19 -0.40 -0.00 -0.69 -1.32 0.00 0.00 176.35 173.75 1crp s VAL 114 N 2.54 3.72 -0.61 1.68 1.01 -1.11 -2.26 120.40 125.36 1crp s VAL 114 Ca 0.26 -1.40 0.01 0.00 0.00 0.00 0.00 61.98 60.85 1crp s VAL 114 Cb -0.15 -2.86 0.15 0.00 0.00 0.00 0.00 36.38 33.52 1crp s VAL 114 CO 0.09 -0.09 0.39 -0.83 0.00 0.00 0.00 175.10 174.66 1crp s GLY 115 N -2.90 2.57 0.81 4.51 0.00 -0.20 -1.39 107.32 110.72 1crp s GLY 115 Ca 0.27 -3.38 -0.12 0.00 0.00 0.00 0.00 44.72 41.50 1crp s GLY 115 CO 0.18 1.06 1.11 0.21 0.00 0.00 0.00 173.10 175.67 1crp s ASN 116 N -0.04 4.45 -0.53 1.64 3.04 0.02 -1.82 114.94 121.69 1crp s ASN 116 Ca 0.19 1.20 -0.02 0.00 0.04 0.00 0.00 52.86 54.27 1crp s ASN 116 Cb -0.20 -1.90 0.00 0.00 -1.54 0.00 0.00 41.25 37.60 1crp s ASN 116 CO -0.04 -1.98 0.23 1.17 -3.04 0.00 0.00 177.10 173.44 1crp n LYS 117 N -3.43 -1.80 -0.42 0.43 3.00 -0.60 -2.00 118.16 113.35 1crp n LYS 117 Ca 0.07 0.31 0.05 0.00 -0.00 0.00 0.00 58.31 58.74 1crp n LYS 117 Cb 0.57 -3.92 0.22 0.00 0.00 0.00 0.00 35.03 31.91 1crp n LYS 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1crp h ASP 119 N 2.45 0.26 -4.28 0.00 2.03 -1.91 -3.47 116.42 111.49 1crp h ASP 119 Ca 0.00 -0.56 -0.52 0.00 -0.73 0.00 0.00 57.03 55.22 1crp h ASP 119 Cb 1.08 -0.09 0.18 0.00 -0.83 0.00 0.00 39.33 39.68 1crp h ASP 119 CO 0.18 1.50 0.25 -1.48 -1.03 0.00 0.00 179.24 178.66 1crp s LEU 120 N -6.69 2.90 -0.15 0.15 2.34 -1.26 -4.97 118.68 111.00 1crp s LEU 120 Ca -0.14 2.10 -0.26 0.00 0.06 0.00 0.00 54.13 55.89 1crp s LEU 120 Cb 0.07 -4.56 -0.23 0.00 -0.56 0.00 0.00 46.19 40.91 1crp s LEU 120 CO 0.80 -2.83 0.63 0.00 -1.06 0.00 0.00 176.35 173.89 1crp h ALA 121 N -1.68 0.04 -2.07 1.48 0.00 -1.94 -3.46 119.26 111.63 1crp h ALA 121 Ca -0.43 -0.59 -0.41 0.00 0.00 0.00 0.00 54.91 53.47 1crp h ALA 121 Cb 1.26 0.13 0.21 0.00 0.00 0.00 0.00 17.79 19.39 1crp h ALA 121 CO 0.44 0.12 -0.04 0.00 0.00 0.00 0.00 179.25 179.77 1crp s ALA 122 N -2.26 -0.59 -0.30 0.00 0.00 -1.26 -5.06 121.76 112.29 1crp s ALA 122 Ca -0.20 -0.49 -0.16 0.00 0.00 0.00 0.00 51.96 51.11 1crp s ALA 122 Cb -0.01 -3.09 0.17 0.00 0.00 0.00 0.00 23.12 20.19 1crp s ALA 122 CO 0.64 -4.19 1.05 -0.98 0.00 0.00 0.00 175.76 172.28 1crp s ARG 123 N -4.78 0.24 0.21 0.00 1.70 -1.26 -4.97 118.95 110.09 1crp s ARG 123 Ca 0.69 0.59 0.03 0.00 -0.47 0.00 0.00 55.73 56.57 1crp s ARG 123 Cb -0.19 0.36 0.17 0.00 -0.57 0.00 0.00 34.95 34.71 1crp s ARG 123 CO 0.61 -0.09 1.50 1.79 -1.08 0.00 0.00 175.30 178.04 1crp h THR 124 N 5.41 1.41 -2.23 4.99 1.35 -1.70 -3.44 112.91 118.70 1crp h THR 124 Ca -0.15 -2.14 -0.49 0.00 -0.55 0.00 0.00 66.41 63.08 1crp h THR 124 Cb 1.12 2.12 -0.03 0.00 -1.73 0.00 0.00 68.15 69.62 1crp h THR 124 CO 0.07 0.63 -0.48 -0.69 -0.25 0.00 0.00 175.52 174.80 1crp s VAL 125 N -3.62 4.85 0.34 6.82 1.01 -1.26 -5.01 120.40 123.53 1crp s VAL 125 Ca -0.04 -1.17 0.03 0.00 0.00 0.00 0.00 61.98 60.79 1crp s VAL 125 Cb 0.11 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.86 1crp s VAL 125 CO 0.81 -0.32 0.09 -1.84 0.00 0.00 0.00 175.10 173.84 1crp n GLU 126 N -1.22 0.73 -0.04 2.72 0.28 -1.26 -4.98 120.64 116.87 1crp n GLU 126 Ca -0.08 -2.76 -0.09 0.00 -0.16 0.00 0.00 57.16 54.07 1crp n GLU 126 Cb 0.57 1.34 0.06 0.00 1.43 0.00 0.00 31.44 34.84 1crp n GLU 126 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1crp h SER 127 N 1.22 0.73 0.05 -1.84 4.64 -2.00 -2.70 113.55 113.64 1crp h SER 127 Ca -0.27 -0.33 -0.11 0.00 -0.47 0.00 0.00 61.79 60.61 1crp h SER 127 Cb 0.97 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.84 1crp h SER 127 CO 0.43 1.05 -0.35 -0.09 -0.87 0.00 0.00 176.83 176.99 1crp h ARG 128 N 0.56 0.42 0.15 4.77 2.43 -1.97 -1.08 114.38 119.66 1crp h ARG 128 Ca 0.04 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.02 1crp h ARG 128 Cb 0.95 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 1crp h ARG 128 CO 0.09 0.72 -0.07 1.96 -1.51 0.00 0.00 179.97 181.16 1crp h GLN 129 N 0.36 -0.19 0.00 0.20 1.08 -1.94 -1.32 115.11 113.29 1crp h GLN 129 Ca 0.04 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.24 1crp h GLN 129 Cb 0.79 0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 28.26 1crp h GLN 129 CO 0.06 0.18 -0.06 0.00 -0.95 0.00 0.00 178.83 178.07 1crp h ALA 130 N 0.14 1.23 0.00 3.87 0.00 -1.46 -1.16 119.26 121.89 1crp h ALA 130 Ca -0.02 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 1crp h ALA 130 Cb 0.46 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1crp h ALA 130 CO 0.03 0.07 -0.83 1.96 0.00 0.00 0.00 179.25 180.48 1crp h GLN 131 N 0.00 0.00 0.00 0.00 1.08 -0.90 -1.55 115.11 113.75 1crp h GLN 131 Ca -0.00 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.13 1crp h GLN 131 Cb 0.22 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 1crp h GLN 131 CO 0.01 0.83 -0.65 -0.44 -0.95 0.00 0.00 178.83 177.63 1crp h ASP 132 N 0.00 0.00 0.26 1.46 3.32 -0.07 -2.01 116.42 119.38 1crp h ASP 132 Ca -0.01 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 1crp h ASP 132 Cb 1.56 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.10 1crp h ASP 132 CO 0.11 0.28 -1.78 -0.11 -1.72 0.00 0.00 179.24 176.01 1crp n LEU 133 N -3.01 0.24 -0.12 1.55 7.94 -0.75 -4.01 117.00 118.83 1crp n LEU 133 Ca -0.00 0.09 -0.24 0.00 -1.11 0.00 0.00 56.01 54.75 1crp n LEU 133 Cb 0.66 0.03 -0.09 0.00 0.53 0.00 0.00 43.42 44.56 1crp n LEU 133 CO 0.39 0.01 -1.31 0.00 -1.11 0.00 0.00 177.39 175.37 1crp n ALA 134 N -2.29 1.46 0.14 1.96 0.00 -0.58 -4.26 120.51 116.93 1crp n ALA 134 Ca -0.06 -0.96 0.10 0.00 0.00 0.00 0.00 53.44 52.52 1crp n ALA 134 Cb 0.63 0.15 0.60 0.00 0.00 0.00 0.00 19.45 20.84 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 -0.71 0.12 -0.09 0.00 2.43 -1.51 -1.37 114.38 113.24 1crp h ARG 135 Ca -0.59 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.56 1crp h ARG 135 Cb 1.58 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 31.10 1crp h ARG 135 CO -0.32 0.08 0.04 1.03 -1.51 0.00 0.00 179.97 179.29 1crp h SER 136 N 0.13 0.12 1.07 -3.80 0.87 -1.70 -2.20 113.55 108.04 1crp h SER 136 Ca 0.10 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1crp h SER 136 Cb 0.22 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1crp h SER 136 CO -0.01 0.22 0.00 1.88 -0.53 0.00 0.00 176.83 178.38 1crp h TYR 137 N 0.01 0.00 -0.73 2.24 -1.99 -1.55 -3.46 116.97 111.49 1crp h TYR 137 Ca 0.03 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1crp h TYR 137 Cb 0.13 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.86 1crp h TYR 137 CO -0.03 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.54 1crp n GLY 138 N 0.15 0.96 3.33 3.88 0.00 -0.59 -5.08 105.19 107.83 1crp n GLY 138 Ca 0.01 -0.53 -0.27 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.73 1.98 0.56 -0.61 -4.36 -0.98 -5.03 121.20 110.03 1crp s ILE 139 Ca 0.00 -1.52 -0.20 0.00 -0.26 0.00 0.00 60.65 58.68 1crp s ILE 139 Cb 0.00 -1.74 -0.05 0.00 1.25 0.00 0.00 42.46 41.92 1crp s ILE 139 CO 0.00 0.13 1.20 -2.16 0.24 0.00 0.00 174.94 174.35 1crp s PRO 140 N -1.68 3.15 0.07 0.37 0.04 -1.26 -4.29 135.00 131.39 1crp s PRO 140 Ca 0.10 1.82 0.09 0.00 0.04 0.00 0.00 61.00 63.05 1crp s PRO 140 Cb -0.10 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 1crp s PRO 140 CO 0.04 -1.07 -0.22 -0.47 0.04 0.00 0.00 177.00 175.32 1crp s TYR 141 N -1.59 2.44 0.22 0.56 5.04 -1.26 -2.48 117.35 120.28 1crp s TYR 141 Ca 0.75 -0.33 0.00 0.00 -2.44 0.00 0.00 57.07 55.05 1crp s TYR 141 Cb -0.30 -1.39 0.00 0.00 0.35 0.00 0.00 41.96 40.63 1crp s TYR 141 CO 0.33 0.25 0.28 -0.89 -1.34 0.00 0.00 175.55 174.19 1crp n ILE 142 N 1.40 0.00 -3.69 3.14 5.41 -0.96 -5.01 119.36 119.64 1crp n ILE 142 Ca -0.17 -1.21 -0.10 0.00 1.00 0.00 0.00 62.75 62.27 1crp n ILE 142 Cb 0.52 0.71 -0.10 0.00 -0.71 0.00 0.00 39.64 40.06 1crp n ILE 142 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1crp s GLU 143 N -2.57 0.42 0.21 0.38 2.02 -1.26 -1.04 118.70 116.87 1crp s GLU 143 Ca 0.20 0.82 -0.04 0.00 0.02 0.00 0.00 54.97 55.96 1crp s GLU 143 Cb -0.00 0.00 -0.03 0.00 0.10 0.00 0.00 34.13 34.20 1crp s GLU 143 CO 0.14 -0.15 0.22 -0.08 0.02 0.00 0.00 175.26 175.41 1crp s THR 144 N 1.37 0.00 -0.07 3.63 -1.32 -0.76 -4.34 115.64 114.15 1crp s THR 144 Ca -0.09 -1.85 -0.04 0.00 -1.21 0.00 0.00 61.69 58.50 1crp s THR 144 Cb -0.08 -2.42 0.03 0.00 -1.51 0.00 0.00 72.50 68.52 1crp s THR 144 CO -0.13 0.00 0.17 -0.55 -2.21 0.00 0.00 174.62 171.90 1crp s SER 145 N -3.12 -0.16 0.17 8.08 0.15 -0.17 -1.55 113.70 117.09 1crp s SER 145 Ca 0.35 0.35 0.24 0.00 0.70 0.00 0.00 55.95 57.58 1crp s SER 145 Cb 0.05 0.29 0.27 0.00 -1.71 0.00 0.00 66.02 64.92 1crp s SER 145 CO 0.11 -0.11 1.29 0.00 1.20 0.00 0.00 173.24 175.73 1crp h ALA 146 N 6.64 0.61 -0.32 5.45 0.00 -1.92 -2.89 119.26 126.83 1crp h ALA 146 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1crp h ALA 146 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1crp h ALA 146 CO 0.41 0.00 0.00 1.17 0.00 0.00 0.00 179.25 180.83 1crp n LYS 147 N -2.35 2.06 0.00 0.00 0.00 -1.26 -4.18 118.16 112.43 1crp n LYS 147 Ca 0.03 -1.27 0.00 0.00 0.00 0.00 0.00 58.31 57.06 1crp n LYS 147 Cb 0.48 -1.43 0.00 0.00 0.00 0.00 0.00 35.03 34.08 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 0.43 0.00 -3.59 3.15 5.66 -1.25 -5.01 114.28 113.67 1crp n THR 148 Ca 0.12 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.85 1crp n THR 148 Cb 0.40 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.17 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 -3.54 -3.74 1.09 3.00 -1.10 -4.92 116.66 107.46 1crp n ARG 149 Ca 0.00 0.46 -0.38 0.00 -0.01 0.00 0.00 57.85 57.92 1crp n ARG 149 Cb 0.46 -5.19 -0.12 0.00 0.00 0.00 0.00 32.46 27.61 1crp n ARG 149 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 1crp s GLN 150 N -6.26 2.85 0.00 5.56 2.00 -1.19 -4.46 119.66 118.17 1crp s GLN 150 Ca 0.50 -1.03 0.00 0.00 -2.00 0.00 0.00 55.36 52.83 1crp s GLN 150 Cb -0.26 -3.46 0.00 0.00 0.80 0.00 0.00 33.01 30.09 1crp s GLN 150 CO 0.61 -0.57 0.00 0.41 -0.50 0.00 0.00 175.29 175.24 1crp n GLY 151 N 4.86 3.24 0.44 2.59 0.00 -1.26 -1.00 105.19 114.06 1crp n GLY 151 Ca -0.13 0.00 0.25 0.00 0.00 0.00 0.00 46.02 46.14 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 0.56 -0.20 1.61 2.07 -1.81 -0.38 116.25 118.10 1crp h VAL 152 Ca 0.00 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1crp h VAL 152 Cb 0.00 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1crp h VAL 152 CO 0.00 0.04 -0.00 -0.33 0.02 0.00 0.00 177.57 177.30 1crp h GLU 153 N 0.25 0.35 -0.33 1.57 5.08 -1.90 -2.83 114.58 116.77 1crp h GLU 153 Ca 0.51 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.73 1crp h GLU 153 Cb 1.56 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.76 1crp h GLU 153 CO -0.15 0.55 0.10 -0.44 -1.00 0.00 0.00 179.01 178.07 1crp h ASP 154 N 0.11 0.43 0.00 1.42 3.32 -1.45 -2.03 116.42 118.21 1crp h ASP 154 Ca 0.06 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1crp h ASP 154 Cb 0.39 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1crp h ASP 154 CO 0.01 0.42 0.00 0.00 -1.72 0.00 0.00 179.24 177.95 1crp n ALA 155 N -2.48 -0.31 0.02 3.45 0.00 -0.97 -2.07 120.51 118.14 1crp n ALA 155 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.35 1crp n ALA 155 Cb 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.58 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 0.04 0.00 0.04 -1.56 -2.51 116.94 112.25 1crp h PHE 156 Ca 0.00 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.82 1crp h PHE 156 Cb 0.00 0.32 -0.04 0.00 2.20 0.00 0.00 35.95 38.43 1crp h PHE 156 CO 0.14 -0.34 -0.22 1.88 -0.60 0.00 0.00 178.31 179.17 1crp h TYR 157 N -0.35 -0.59 -0.25 -0.55 -1.99 -1.51 -1.20 116.97 110.55 1crp h TYR 157 Ca 0.09 0.02 0.07 0.00 2.00 0.00 0.00 58.73 60.91 1crp h TYR 157 Cb 0.48 0.25 -0.01 0.00 2.00 0.00 0.00 36.73 39.45 1crp h TYR 157 CO -0.34 -0.31 0.28 1.15 -0.00 0.00 0.00 178.16 178.94 1crp h THR 158 N -0.37 0.41 -0.10 -2.88 2.02 -1.26 -1.18 112.91 109.55 1crp h THR 158 Ca 0.05 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.18 1crp h THR 158 Cb 0.43 0.77 -0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1crp h THR 158 CO -0.17 0.00 -0.14 -0.07 0.37 0.00 0.00 175.52 175.51 1crp h LEU 159 N 0.00 0.30 -1.45 2.58 4.07 -0.78 -2.65 115.31 117.39 1crp h LEU 159 Ca 0.12 -0.51 -0.02 0.00 0.08 0.00 0.00 57.88 57.54 1crp h LEU 159 Cb 0.68 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.33 1crp h LEU 159 CO -0.00 0.75 -0.11 0.58 -1.08 0.00 0.00 178.44 178.58 1crp h VAL 160 N -0.15 0.31 0.00 1.22 2.07 -1.02 -2.71 116.25 115.99 1crp h VAL 160 Ca 0.01 -0.75 -0.20 0.00 0.82 0.00 0.00 66.70 66.59 1crp h VAL 160 Cb 0.68 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 1crp h VAL 160 CO 0.03 0.11 -0.87 0.03 0.02 0.00 0.00 177.57 176.89 1crp h ARG 161 N 0.00 0.19 0.03 1.57 3.08 -1.23 -2.20 114.38 115.81 1crp h ARG 161 Ca -0.00 -0.21 -0.25 0.00 0.07 0.00 0.00 59.98 59.59 1crp h ARG 161 Cb 0.56 0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.68 1crp h ARG 161 CO 0.01 0.95 -1.03 0.93 -1.07 0.00 0.00 179.97 179.76 1crp h GLU 162 N 0.11 0.49 -0.16 0.04 4.39 -1.21 -2.69 114.58 115.55 1crp h GLU 162 Ca -0.04 -0.56 -0.16 0.00 0.34 0.00 0.00 59.36 58.93 1crp h GLU 162 Cb 1.49 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 30.31 1crp h GLU 162 CO 0.13 1.20 -0.58 0.82 -1.16 0.00 0.00 179.01 179.42 1crp h ILE 163 N 0.26 1.33 0.09 3.13 2.04 -1.52 -3.03 117.51 119.81 1crp h ILE 163 Ca -0.11 -1.86 -0.00 0.00 1.00 0.00 0.00 64.86 63.89 1crp h ILE 163 Cb 1.68 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 39.60 1crp h ILE 163 CO 0.18 0.57 -0.04 -0.09 0.00 0.00 0.00 178.15 178.78 1crp h ARG 164 N 0.38 -0.11 -0.71 2.37 2.43 -1.43 -3.16 114.38 114.15 1crp h ARG 164 Ca -0.00 0.01 0.15 0.00 -0.81 0.00 0.00 59.98 59.33 1crp h ARG 164 Cb 1.13 0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 30.60 1crp h ARG 164 CO 0.11 0.24 0.18 0.37 -1.51 0.00 0.00 179.97 179.36 1crp h GLN 165 N -0.49 0.28 0.00 0.20 -0.00 -1.51 -3.51 115.11 110.08 1crp h GLN 165 Ca -0.01 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.62 1crp h GLN 165 Cb 0.41 -0.06 0.00 0.00 0.00 0.00 0.00 27.48 27.83 1crp h GLN 165 CO 0.02 0.19 0.00 1.58 0.00 0.00 0.00 178.83 180.62