#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 1.54 -0.02 3.17 2.01 -1.26 -4.80 115.64 116.28 1crp s THR 2 Ca 0.00 0.00 -0.15 0.00 0.31 0.00 0.00 61.69 61.85 1crp s THR 2 Cb 0.00 -2.34 0.02 0.00 0.01 0.00 0.00 72.50 70.19 1crp s THR 2 CO 0.00 0.00 0.32 -1.61 -0.69 0.00 0.00 174.62 172.64 1crp s GLU 3 N -5.22 0.66 0.21 4.92 2.02 -1.26 -2.23 118.70 117.80 1crp s GLU 3 Ca 0.70 -0.16 0.04 0.00 0.02 0.00 0.00 54.97 55.57 1crp s GLU 3 Cb -0.12 0.29 -0.05 0.00 0.10 0.00 0.00 34.13 34.35 1crp s GLU 3 CO 0.57 -0.18 -0.02 0.71 0.02 0.00 0.00 175.26 176.36 1crp s TYR 4 N -1.26 1.50 -0.25 1.61 1.51 -0.89 -4.94 117.35 114.63 1crp s TYR 4 Ca -0.13 -0.89 0.02 0.00 -1.01 0.00 0.00 57.07 55.05 1crp s TYR 4 Cb -0.05 -0.85 0.06 0.00 -0.11 0.00 0.00 41.96 41.01 1crp s TYR 4 CO 0.04 -0.02 -0.07 0.21 -1.11 0.00 0.00 175.55 174.60 1crp s LYS 5 N -3.84 1.83 -0.33 -0.62 2.47 -1.26 -1.89 119.74 116.09 1crp s LYS 5 Ca 0.26 -1.13 -0.24 0.00 -1.56 0.00 0.00 55.97 53.31 1crp s LYS 5 Cb 0.05 -2.70 0.00 0.00 -1.46 0.00 0.00 37.83 33.73 1crp s LYS 5 CO 0.07 -0.60 0.80 -0.51 0.16 0.00 0.00 175.35 175.28 1crp s LEU 6 N 1.29 4.09 -0.64 5.43 1.43 -0.90 -2.27 118.68 127.12 1crp s LEU 6 Ca -0.07 0.57 -0.17 0.00 -1.03 0.00 0.00 54.13 53.43 1crp s LEU 6 Cb -0.19 -3.08 0.13 0.00 0.03 0.00 0.00 46.19 43.08 1crp s LEU 6 CO -0.06 -0.67 0.69 -0.69 0.23 0.00 0.00 176.35 175.85 1crp s VAL 7 N 3.05 5.04 0.19 -1.59 1.01 -0.28 -1.37 120.40 126.46 1crp s VAL 7 Ca 0.33 -1.40 -0.27 0.00 0.00 0.00 0.00 61.98 60.63 1crp s VAL 7 Cb -0.14 -4.47 -0.08 0.00 0.00 0.00 0.00 36.38 31.69 1crp s VAL 7 CO 0.14 -1.07 0.85 -0.69 0.00 0.00 0.00 175.10 174.33 1crp s VAL 8 N 2.01 4.25 -0.15 2.92 1.01 -1.04 -1.41 120.40 127.99 1crp s VAL 8 Ca 0.12 1.87 -0.27 0.00 0.00 0.00 0.00 61.98 63.69 1crp s VAL 8 Cb -0.22 -4.22 0.07 0.00 0.00 0.00 0.00 36.38 32.00 1crp s VAL 8 CO 0.02 0.51 0.68 -0.69 0.00 0.00 0.00 175.10 175.62 1crp s VAL 9 N -1.12 0.00 -2.83 2.92 1.01 -1.13 -4.83 120.40 114.42 1crp s VAL 9 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.35 1crp s VAL 9 Cb -0.24 -0.98 0.00 0.00 0.00 0.00 0.00 36.38 35.16 1crp s VAL 9 CO 0.29 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1crp n GLY 10 N 1.77 -0.58 3.89 4.51 0.00 -1.26 -1.06 105.19 112.46 1crp n GLY 10 Ca -0.17 -0.71 -0.29 0.00 0.00 0.00 0.00 46.02 44.86 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 3.33 -0.52 4.61 0.00 -1.25 -5.01 121.76 121.93 1crp s ALA 11 Ca 0.00 -0.35 -0.25 0.00 0.00 0.00 0.00 51.96 51.36 1crp s ALA 11 Cb 0.00 -2.71 0.03 0.00 0.00 0.00 0.00 23.12 20.45 1crp s ALA 11 CO 0.00 -0.32 0.97 0.20 0.00 0.00 0.00 175.76 176.61 1crp s GLY 12 N -3.86 1.40 0.00 0.00 0.00 -1.26 -3.37 107.32 100.23 1crp s GLY 12 Ca 0.50 -0.99 0.00 0.00 0.00 0.00 0.00 44.72 44.23 1crp s GLY 12 CO 0.43 2.11 0.00 0.61 0.00 0.00 0.00 173.10 176.25 1crp n GLY 13 N 5.03 1.61 0.34 0.20 0.00 -1.26 -4.97 105.19 106.14 1crp n GLY 13 Ca 0.05 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.23 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 0.82 0.00 1.61 -1.51 -1.93 -3.45 116.25 111.79 1crp h VAL 14 Ca 0.00 -0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1crp h VAL 14 Cb 0.00 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 29.97 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 -1.61 1.97 0.07 5.19 0.00 -1.26 -4.58 105.19 104.97 1crp n GLY 15 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 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 0.09 0.59 1.61 1.57 -1.88 -2.48 116.57 116.06 1crp h LYS 16 Ca 0.00 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 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 0.22 -0.28 0.66 -0.57 0.00 0.00 179.45 179.48 1crp h SER 17 N -0.06 -0.67 -0.83 0.86 4.64 -1.92 -2.24 113.55 113.33 1crp h SER 17 Ca 0.02 -0.02 0.24 0.00 -0.47 0.00 0.00 61.79 61.56 1crp h SER 17 Cb 0.16 0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.39 1crp h SER 17 CO -0.00 -0.39 0.71 0.00 -0.87 0.00 0.00 176.83 176.28 1crp h ALA 18 N -0.58 2.69 0.00 5.18 0.00 -1.90 0.32 119.26 124.97 1crp h ALA 18 Ca -0.08 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 1crp h ALA 18 Cb 0.65 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.51 1crp h ALA 18 CO 0.13 -1.14 -0.69 -0.07 0.00 0.00 0.00 179.25 177.48 1crp h LEU 19 N 0.00 0.60 0.27 0.00 3.38 -1.06 -2.22 115.31 116.28 1crp h LEU 19 Ca 0.40 -0.76 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 1crp h LEU 19 Cb 1.82 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.39 1crp h LEU 19 CO -0.00 1.28 -0.13 0.74 0.09 0.00 0.00 178.44 180.42 1crp h THR 20 N -0.01 0.00 -0.72 0.22 2.02 0.17 -2.69 112.91 111.89 1crp h THR 20 Ca -0.09 -0.04 0.21 0.00 0.77 0.00 0.00 66.41 67.27 1crp h THR 20 Cb 1.39 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 1crp h THR 20 CO 0.14 0.00 0.61 0.40 0.37 0.00 0.00 175.52 177.04 1crp h ILE 21 N -0.40 0.43 -0.10 3.11 5.03 -1.42 0.32 117.51 124.48 1crp h ILE 21 Ca -0.04 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.70 1crp h ILE 21 Cb 0.28 0.54 -0.01 0.00 -3.03 0.00 0.00 36.82 34.61 1crp h ILE 21 CO 0.06 0.00 0.07 1.56 -0.68 0.00 0.00 178.15 179.16 1crp h GLN 22 N 0.00 0.14 0.00 2.37 1.08 -1.08 -2.01 115.11 115.60 1crp h GLN 22 Ca 0.34 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.53 1crp h GLN 22 Cb 1.57 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.97 1crp h GLN 22 CO -0.00 0.10 0.00 -0.11 -0.95 0.00 0.00 178.83 177.87 1crp n LEU 23 N -5.01 0.31 -0.02 1.46 0.00 0.06 -1.21 117.00 112.60 1crp n LEU 23 Ca -0.05 0.54 -0.01 0.00 0.00 0.00 0.00 56.01 56.49 1crp n LEU 23 Cb 0.03 -0.45 -0.00 0.00 0.00 0.00 0.00 43.42 43.00 1crp n LEU 23 CO 0.33 -0.13 -0.05 0.40 0.00 0.00 0.00 177.39 177.94 1crp h ILE 24 N 0.00 0.00 0.00 1.96 1.08 -0.95 -3.43 117.51 116.17 1crp h ILE 24 Ca 0.00 -0.29 -0.22 0.00 -0.39 0.00 0.00 64.86 63.96 1crp h ILE 24 Cb 0.54 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.25 1crp h ILE 24 CO 0.00 0.00 -2.04 0.00 -0.69 0.00 0.00 178.15 175.42 1crp n GLN 25 N -2.87 1.11 -2.42 2.37 1.13 -0.81 -5.04 117.38 110.85 1crp n GLN 25 Ca -0.01 -0.05 -0.07 0.00 -1.94 0.00 0.00 57.00 54.93 1crp n GLN 25 Cb 0.04 -1.42 0.03 0.00 0.11 0.00 0.00 30.24 29.00 1crp n GLN 25 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1crp n ASN 26 N -2.48 -2.99 0.00 1.08 2.85 -0.35 -4.98 115.26 108.40 1crp n ASN 26 Ca -0.21 -0.28 0.00 0.00 -0.11 0.00 0.00 54.58 53.98 1crp n ASN 26 Cb 0.88 -2.48 0.00 0.00 1.24 0.00 0.00 39.78 39.42 1crp n ASN 26 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1crp n HIS 27 N -2.28 0.00 -2.64 1.20 1.44 -1.26 -5.04 115.22 106.64 1crp n HIS 27 Ca -0.08 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.61 1crp n HIS 27 Cb 0.56 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.65 1crp n HIS 27 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1crp n PHE 28 N -0.14 -4.13 -2.06 -1.40 7.35 -1.26 -4.93 117.46 110.88 1crp n PHE 28 Ca 0.00 2.06 -0.34 0.00 -0.76 0.00 0.00 57.45 58.41 1crp n PHE 28 Cb 0.05 -3.94 0.02 0.00 0.35 0.00 0.00 39.48 35.95 1crp n PHE 28 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1crp s VAL 29 N -1.24 3.18 -0.06 -2.13 -7.23 -1.26 -4.94 120.40 106.71 1crp s VAL 29 Ca -0.11 0.66 0.13 0.00 -1.81 0.00 0.00 61.98 60.85 1crp s VAL 29 Cb 0.01 -3.22 -0.12 0.00 0.56 0.00 0.00 36.38 33.61 1crp s VAL 29 CO 0.78 -0.23 1.04 0.44 -0.31 0.00 0.00 175.10 176.82 1crp h ASP 30 N 0.75 0.00 0.00 4.85 5.19 -2.01 -3.46 116.42 121.74 1crp h ASP 30 Ca -0.49 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 1crp h ASP 30 Cb 1.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.77 1crp h ASP 30 CO 0.56 0.74 0.00 -1.84 -3.12 0.00 0.00 179.24 175.58 1crp n GLU 31 N -3.11 0.00 -1.96 3.56 0.28 -1.26 -5.12 120.64 113.03 1crp n GLU 31 Ca -0.06 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.52 1crp n GLU 31 Cb 0.88 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 33.72 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 3.07 0.22 -1.84 6.14 -1.26 -4.91 117.35 118.78 1crp s TYR 32 Ca 0.00 0.70 -0.31 0.00 0.64 0.00 0.00 57.07 58.09 1crp s TYR 32 Cb 0.00 -3.90 -0.14 0.00 0.42 0.00 0.00 41.96 38.34 1crp s TYR 32 CO 0.00 -3.25 1.29 -3.47 0.64 0.00 0.00 175.55 170.76 1crp n ASP 33 N 3.80 2.17 -1.71 4.32 -0.08 -1.26 -4.83 116.55 118.95 1crp n ASP 33 Ca 0.13 1.15 -0.06 0.00 -1.51 0.00 0.00 54.79 54.49 1crp n ASP 33 Cb 0.39 -1.35 -0.04 0.00 2.34 0.00 0.00 41.12 42.46 1crp n ASP 33 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1crp n PRO 34 N 1.79 1.40 -1.09 -0.67 -0.04 -1.26 -3.82 135.00 131.31 1crp n PRO 34 Ca 0.12 -0.54 -0.01 0.00 -0.04 0.00 0.00 63.50 63.03 1crp n PRO 34 Cb 0.29 -1.37 -0.02 0.00 -0.04 0.00 0.00 33.50 32.36 1crp n PRO 34 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1crp n THR 35 N 1.58 0.00 -2.69 0.52 -2.24 -1.26 -3.97 114.28 106.21 1crp n THR 35 Ca 0.16 -0.39 -0.27 0.00 -2.27 0.00 0.00 64.05 61.28 1crp n THR 35 Cb 0.61 0.64 -0.02 0.00 -2.10 0.00 0.00 70.33 69.47 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 0.19 2.78 -2.06 2.28 5.41 -1.25 -5.03 119.36 121.68 1crp n ILE 36 Ca -0.09 -5.25 -0.43 0.00 1.00 0.00 0.00 62.75 57.98 1crp n ILE 36 Cb 0.85 -1.33 -0.03 0.00 -0.71 0.00 0.00 39.64 38.42 1crp n ILE 36 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1crp s GLU 37 N -3.53 3.32 0.00 0.38 2.02 -1.26 -4.70 118.70 114.93 1crp s GLU 37 Ca 0.48 1.28 0.00 0.00 0.02 0.00 0.00 54.97 56.75 1crp s GLU 37 Cb 0.34 -4.18 0.00 0.00 0.10 0.00 0.00 34.13 30.39 1crp s GLU 37 CO -0.17 -1.87 0.00 -0.25 0.02 0.00 0.00 175.26 172.99 1crp n ASP 38 N 10.22 0.00 -3.64 -0.19 8.00 -1.26 -4.98 116.55 124.70 1crp n ASP 38 Ca 0.22 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.68 1crp n ASP 38 Cb 0.47 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.51 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 1.08 -0.36 -0.12 -2.24 1.04 -1.26 -4.85 113.70 107.00 1crp s SER 39 Ca 0.00 0.62 0.01 0.00 0.48 0.00 0.00 55.95 57.07 1crp s SER 39 Cb 0.00 0.90 0.02 0.00 0.10 0.00 0.00 66.02 67.04 1crp s SER 39 CO 0.00 -0.10 -0.15 -0.31 0.98 0.00 0.00 173.24 173.66 1crp s TYR 40 N 0.74 2.03 0.33 5.02 2.02 -1.07 -5.04 117.35 121.38 1crp s TYR 40 Ca -0.02 -1.00 0.04 0.00 -0.37 0.00 0.00 57.07 55.71 1crp s TYR 40 Cb -0.04 -1.47 -0.01 0.00 -0.40 0.00 0.00 41.96 40.04 1crp s TYR 40 CO -0.12 -0.52 0.13 0.54 -1.57 0.00 0.00 175.55 174.01 1crp n ARG 41 N 4.31 0.62 -3.87 -0.62 1.74 -1.26 -0.56 116.66 117.01 1crp n ARG 41 Ca -0.19 -2.80 0.03 0.00 -0.77 0.00 0.00 57.85 54.12 1crp n ARG 41 Cb 0.51 1.59 0.01 0.00 -1.02 0.00 0.00 32.46 33.54 1crp n ARG 41 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1crp s LYS 42 N -3.25 0.31 -0.29 5.56 2.20 -1.24 -4.93 119.74 118.10 1crp s LYS 42 Ca 0.18 -0.19 0.00 0.00 -0.36 0.00 0.00 55.97 55.60 1crp s LYS 42 Cb 0.01 0.09 0.09 0.00 -1.51 0.00 0.00 37.83 36.51 1crp s LYS 42 CO 0.13 -0.14 0.05 -1.14 -0.36 0.00 0.00 175.35 173.89 1crp s GLN 43 N -2.10 1.03 0.17 4.03 0.74 -1.26 -2.77 119.66 119.49 1crp s GLN 43 Ca 0.25 -1.14 0.02 0.00 0.05 0.00 0.00 55.36 54.54 1crp s GLN 43 Cb 0.02 -2.35 0.02 0.00 1.10 0.00 0.00 33.01 31.80 1crp s GLN 43 CO -0.02 -0.87 0.15 1.33 -0.55 0.00 0.00 175.29 175.33 1crp n VAL 44 N 4.72 0.00 0.00 1.34 0.24 -1.26 -5.04 118.33 118.34 1crp n VAL 44 Ca -0.04 -0.64 0.00 0.00 -2.04 0.00 0.00 64.34 61.62 1crp n VAL 44 Cb 0.43 -0.46 0.00 0.00 -1.47 0.00 0.00 33.84 32.33 1crp n VAL 44 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1crp n VAL 45 N -1.00 0.00 -1.95 3.34 0.31 -1.26 -3.48 118.33 114.29 1crp n VAL 45 Ca 0.01 0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1crp n VAL 45 Cb 0.19 -0.98 0.00 0.00 -0.91 0.00 0.00 33.84 32.14 1crp n VAL 45 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1crp n ILE 46 N -1.89-11.96 -2.91 2.52 5.41 -1.26 -3.42 119.36 105.86 1crp n ILE 46 Ca 0.00 2.88 -0.19 0.00 1.00 0.00 0.00 62.75 66.44 1crp n ILE 46 Cb 0.00 -5.28 0.03 0.00 -0.71 0.00 0.00 39.64 33.68 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 1.61 -5.42 -1.82 4.38 8.00 -1.26 -2.01 116.55 120.04 1crp n ASP 47 Ca 0.00 -0.25 -0.16 0.00 0.71 0.00 0.00 54.79 55.09 1crp n ASP 47 Cb 0.00 -4.25 -0.05 0.00 -0.02 0.00 0.00 41.12 36.80 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 -1.42 0.82 0.00 0.44 0.00 -1.26 -4.93 105.19 98.85 1crp n GLY 48 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1crp n GLY 48 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1crp n GLU 49 N -2.38 3.83 -3.07 1.61 2.13 -0.85 -5.10 120.64 116.81 1crp n GLU 49 Ca -0.18 0.00 -0.00 0.00 0.66 0.00 0.00 57.16 57.64 1crp n GLU 49 Cb 0.58 0.00 -0.00 0.00 0.27 0.00 0.00 31.44 32.29 1crp n GLU 49 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1crp s THR 50 N 2.02 -0.95 -0.15 6.31 2.01 -1.22 -4.24 115.64 119.43 1crp s THR 50 Ca 0.00 -0.24 -0.01 0.00 0.31 0.00 0.00 61.69 61.75 1crp s THR 50 Cb 0.00 0.00 -0.01 0.00 0.01 0.00 0.00 72.50 72.50 1crp s THR 50 CO 0.00 0.00 -0.11 0.00 -0.69 0.00 0.00 174.62 173.82 1crp s LEU 52 N 0.65 3.19 -0.38 0.00 0.20 -0.95 -4.07 118.68 117.31 1crp s LEU 52 Ca -0.06 2.24 0.01 0.00 0.69 0.00 0.00 54.13 57.00 1crp s LEU 52 Cb -0.15 -4.57 0.13 0.00 -0.43 0.00 0.00 46.19 41.16 1crp s LEU 52 CO 0.03 -2.38 0.20 -0.76 -0.29 0.00 0.00 176.35 173.15 1crp s LEU 53 N -5.53 1.91 -0.91 -0.68 1.43 -1.11 -2.09 118.68 111.69 1crp s LEU 53 Ca 0.71 -2.26 -0.24 0.00 -1.03 0.00 0.00 54.13 51.30 1crp s LEU 53 Cb -0.26 -0.75 -0.02 0.00 0.03 0.00 0.00 46.19 45.19 1crp s LEU 53 CO 0.49 -0.31 1.81 -0.62 0.23 0.00 0.00 176.35 177.95 1crp s ASP 54 N 0.87 5.49 0.43 2.29 -1.08 -0.79 -3.63 116.67 120.24 1crp s ASP 54 Ca 0.16 -0.80 -0.22 0.00 -0.52 0.00 0.00 52.55 51.18 1crp s ASP 54 Cb -0.23 -2.56 -0.10 0.00 -1.46 0.00 0.00 42.92 38.57 1crp s ASP 54 CO -0.05 -2.41 0.98 -0.63 0.52 0.00 0.00 175.17 173.59 1crp s ILE 55 N 8.73 4.12 -0.55 4.11 1.09 0.27 -2.11 121.20 136.87 1crp s ILE 55 Ca 0.63 1.41 0.04 0.00 -1.10 0.00 0.00 60.65 61.64 1crp s ILE 55 Cb -0.05 -3.62 0.16 0.00 -1.06 0.00 0.00 42.46 37.88 1crp s ILE 55 CO -0.01 -0.20 0.37 -0.22 -0.10 0.00 0.00 174.94 174.78 1crp s LEU 56 N -3.05 3.45 0.15 2.97 2.96 -0.47 -2.61 118.68 122.09 1crp s LEU 56 Ca 0.61 -3.29 0.03 0.00 -0.22 0.00 0.00 54.13 51.27 1crp s LEU 56 Cb -0.14 -1.21 -0.06 0.00 0.50 0.00 0.00 46.19 45.29 1crp s LEU 56 CO 0.18 -0.16 1.34 -0.78 -1.32 0.00 0.00 176.35 175.61 1crp h ASP 57 N 5.89 0.19 -0.35 3.68 3.58 -1.88 -2.75 116.42 124.79 1crp h ASP 57 Ca 0.11 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.39 1crp h ASP 57 Cb 0.85 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.84 1crp h ASP 57 CO 0.58 1.02 0.00 0.35 -2.88 0.00 0.00 179.24 178.30 1crp n THR 58 N -3.58 0.00 0.03 2.25 -2.24 -1.26 -4.90 114.28 104.57 1crp n THR 58 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1crp n THR 58 Cb 0.85 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 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 0.78 3.00 0.00 6.98 0.00 -1.26 -4.71 120.51 125.30 1crp n ALA 59 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1crp n ALA 59 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.46 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 1.81 -0.49 1.89 0.00 0.00 -1.25 -4.87 105.19 102.27 1crp n GLY 60 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1crp n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1crp n GLN 61 N 0.00 -1.83 -0.29 1.61 10.64 -1.26 -4.92 117.38 121.32 1crp n GLN 61 Ca 0.00 1.30 -0.27 0.00 -1.83 0.00 0.00 57.00 56.20 1crp n GLN 61 Cb 0.00 -1.83 0.26 0.00 -0.86 0.00 0.00 30.24 27.80 1crp n GLN 61 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 1crp n GLU 62 N 1.79 -4.28 -1.32 2.61 0.28 -1.26 -4.81 120.64 113.64 1crp n GLU 62 Ca 0.00 -1.27 0.01 0.00 -0.16 0.00 0.00 57.16 55.74 1crp n GLU 62 Cb 0.00 -1.80 -0.01 0.00 1.43 0.00 0.00 31.44 31.06 1crp n GLU 62 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1crp n GLU 63 N -4.81 -3.44 0.00 3.44 1.02 -1.26 -5.07 120.64 110.53 1crp n GLU 63 Ca 0.12 2.68 0.00 0.00 -0.02 0.00 0.00 57.16 59.94 1crp n GLU 63 Cb 0.53 -3.40 0.00 0.00 -0.02 0.00 0.00 31.44 28.55 1crp n GLU 63 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 1crp n TYR 64 N -2.60 0.00 -1.73 -0.32 4.11 -1.26 -5.03 117.16 110.33 1crp n TYR 64 Ca -0.01 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.47 1crp n TYR 64 Cb 0.43 0.00 -0.02 0.00 -0.00 0.00 0.00 39.34 39.75 1crp n TYR 64 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.86 177.29 1crp n SER 65 N 0.00 3.82 -0.95 9.48 7.64 -1.26 -4.87 113.62 127.49 1crp n SER 65 Ca 0.00 1.11 0.05 0.00 1.01 0.00 0.00 58.87 61.04 1crp n SER 65 Cb 0.00 -1.57 0.20 0.00 -1.01 0.00 0.00 64.21 61.83 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 2.99 2.76 0.22 -0.43 0.00 -1.26 -4.12 120.51 120.68 1crp n ALA 66 Ca 0.12 -0.84 0.08 0.00 0.00 0.00 0.00 53.44 52.80 1crp n ALA 66 Cb 0.35 -1.01 0.51 0.00 0.00 0.00 0.00 19.45 19.30 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 2.30 0.00 -0.26 0.00 -0.00 -2.01 -2.58 114.93 112.37 1crp h MET 67 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1crp h MET 67 Cb 0.84 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.43 1crp h MET 67 CO 0.11 0.26 0.17 -0.09 -0.00 0.00 0.00 176.91 177.35 1crp h ARG 68 N 0.00 0.33 -0.62 -0.10 2.43 -1.99 -0.89 114.38 113.54 1crp h ARG 68 Ca -0.00 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1crp h ARG 68 Cb 0.57 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 1crp h ARG 68 CO 0.03 0.22 0.25 0.22 -1.51 0.00 0.00 179.97 179.18 1crp h ASP 69 N 0.34 0.85 0.50 -3.80 1.82 -1.78 -0.83 116.42 113.53 1crp h ASP 69 Ca 0.10 -0.17 -0.05 0.00 -0.39 0.00 0.00 57.03 56.52 1crp h ASP 69 Cb -0.03 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 39.75 1crp h ASP 69 CO -0.02 0.79 -0.23 1.56 -1.61 0.00 0.00 179.24 179.72 1crp h GLN 70 N 0.86 0.00 0.00 0.28 4.20 -1.30 -1.63 115.11 117.51 1crp h GLN 70 Ca 0.21 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.85 1crp h GLN 70 Cb 0.20 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 1crp h GLN 70 CO -0.02 0.23 -0.30 1.88 -0.67 0.00 0.00 178.83 179.96 1crp h TYR 71 N 0.00 0.00 0.00 2.96 0.05 -0.09 0.13 116.97 120.02 1crp h TYR 71 Ca -0.00 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.71 1crp h TYR 71 Cb 0.55 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.28 1crp h TYR 71 CO 0.00 0.30 -0.34 0.52 -1.05 0.00 0.00 178.16 177.59 1crp h MET 72 N 0.00 0.00 0.00 4.88 2.86 -0.84 -0.98 114.93 120.86 1crp h MET 72 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1crp h MET 72 Cb 0.56 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.22 1crp h MET 72 CO 0.04 0.34 -0.80 -2.13 1.06 0.00 0.00 176.91 175.42 1crp n ARG 73 N -4.00 0.29 -0.09 1.72 0.00 -0.32 -4.56 116.66 109.68 1crp n ARG 73 Ca -0.02 0.05 -0.11 0.00 -0.00 0.00 0.00 57.85 57.77 1crp n ARG 73 Cb 0.39 -1.64 -0.04 0.00 0.00 0.00 0.00 32.46 31.17 1crp n ARG 73 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1crp n THR 74 N -2.04 1.48 -0.68 5.15 -2.24 -0.12 -4.89 114.28 110.94 1crp n THR 74 Ca 0.03 0.08 -0.30 0.00 -2.27 0.00 0.00 64.05 61.59 1crp n THR 74 Cb 0.44 -2.25 0.19 0.00 -2.10 0.00 0.00 70.33 66.61 1crp n THR 74 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1crp s GLY 75 N -4.95 1.64 0.00 3.38 0.00 -0.41 -4.97 107.32 102.01 1crp s GLY 75 Ca -0.29 0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.76 1crp s GLY 75 CO 0.41 0.84 0.00 1.18 0.00 0.00 0.00 173.10 175.54 1crp n GLU 76 N -4.43 2.89 -2.42 2.90 4.71 -0.96 -4.88 120.64 118.44 1crp n GLU 76 Ca 0.09 0.00 -0.43 0.00 -0.01 0.00 0.00 57.16 56.81 1crp n GLU 76 Cb 0.53 -0.68 0.00 0.00 -1.01 0.00 0.00 31.44 30.28 1crp n GLU 76 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1crp n GLY 77 N 1.11 3.74 3.56 0.62 0.00 -1.00 -3.35 105.19 109.86 1crp n GLY 77 Ca 0.00 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 43.93 1crp n GLY 77 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1crp s PHE 78 N 2.37 1.71 -1.19 1.61 0.40 -1.05 -1.12 117.98 120.70 1crp s PHE 78 Ca 0.46 0.77 -0.20 0.00 -0.60 0.00 0.00 56.93 57.36 1crp s PHE 78 Cb 0.06 -4.01 0.07 0.00 0.51 0.00 0.00 43.02 39.64 1crp s PHE 78 CO 0.00 -1.93 1.62 -1.17 0.70 0.00 0.00 175.22 174.44 1crp s LEU 79 N 10.08 3.77 -0.98 -0.37 2.96 -0.50 -2.15 118.68 131.49 1crp s LEU 79 Ca 0.71 -2.10 -0.24 0.00 -0.22 0.00 0.00 54.13 52.28 1crp s LEU 79 Cb -0.09 -2.57 -0.06 0.00 0.50 0.00 0.00 46.19 43.97 1crp s LEU 79 CO 0.07 -1.28 1.94 0.00 -1.32 0.00 0.00 176.35 175.76 1crp s VAL 81 N 10.37 3.06 -0.31 0.00 1.01 -0.22 -2.13 120.40 132.18 1crp s VAL 81 Ca 0.70 0.08 -0.00 0.00 0.00 0.00 0.00 61.98 62.75 1crp s VAL 81 Cb -0.05 -3.05 0.10 0.00 0.00 0.00 0.00 36.38 33.38 1crp s VAL 81 CO 0.03 -0.01 0.09 0.12 0.00 0.00 0.00 175.10 175.34 1crp s PHE 82 N 4.63 1.91 0.59 5.22 5.36 -0.81 -3.75 117.98 131.13 1crp s PHE 82 Ca 0.88 -1.85 -0.19 0.00 -0.96 0.00 0.00 56.93 54.81 1crp s PHE 82 Cb -0.41 -1.82 -0.04 0.00 -0.34 0.00 0.00 43.02 40.40 1crp s PHE 82 CO 0.40 -0.88 1.19 0.00 -1.46 0.00 0.00 175.22 174.48 1crp s ALA 83 N 1.55 2.56 -0.27 11.12 0.00 -1.26 -1.46 121.76 134.00 1crp s ALA 83 Ca 0.10 0.97 0.09 0.00 0.00 0.00 0.00 51.96 53.12 1crp s ALA 83 Cb -0.17 -3.44 0.46 0.00 0.00 0.00 0.00 23.12 19.97 1crp s ALA 83 CO -0.23 -1.11 1.33 0.44 0.00 0.00 0.00 175.76 176.20 1crp n ILE 84 N -1.56 2.45 0.00 0.00 -6.64 -0.78 -4.41 119.36 108.42 1crp n ILE 84 Ca 0.13 -3.26 0.00 0.00 -1.77 0.00 0.00 62.75 57.85 1crp n ILE 84 Cb 0.50 -0.48 0.00 0.00 -1.44 0.00 0.00 39.64 38.22 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 -1.03 4.40 0.00 7.28 2.85 -1.26 -3.05 115.26 124.45 1crp n ASN 85 Ca 0.31 0.00 0.02 0.00 -0.11 0.00 0.00 54.58 54.80 1crp n ASN 85 Cb 0.87 0.29 -0.11 0.00 1.24 0.00 0.00 39.78 42.07 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 -2.14 0.44 0.00 1.20 0.23 -1.26 -4.66 115.26 109.07 1crp n ASN 86 Ca 0.00 0.19 0.00 0.00 -0.53 0.00 0.00 54.58 54.24 1crp n ASN 86 Cb 0.48 0.88 0.00 0.00 -2.08 0.00 0.00 39.78 39.06 1crp n ASN 86 CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 1crp n THR 87 N -2.66 0.00 0.34 5.53 -1.04 -1.26 -4.77 114.28 110.42 1crp n THR 87 Ca -0.12 0.00 0.21 0.00 -2.04 0.00 0.00 64.05 62.10 1crp n THR 87 Cb 0.79 0.00 1.12 0.00 -1.82 0.00 0.00 70.33 70.42 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 0.00 0.00 -0.33 -2.82 3.64 -1.94 -0.75 116.57 114.37 1crp h LYS 88 Ca 0.00 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 1crp h LYS 88 Cb 0.00 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1crp h LYS 88 CO 0.00 0.00 -0.20 0.77 -2.27 0.00 0.00 179.45 177.75 1crp h SER 89 N 0.00 0.74 -0.04 4.20 0.02 -1.86 -0.36 113.55 116.25 1crp h SER 89 Ca 0.00 -0.42 -0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1crp h SER 89 Cb 0.17 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 1crp h SER 89 CO -0.00 1.01 0.03 0.15 -1.14 0.00 0.00 176.83 176.87 1crp h PHE 90 N 0.49 0.06 0.00 3.45 3.57 -1.34 -0.19 116.94 122.97 1crp h PHE 90 Ca 0.07 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1crp h PHE 90 Cb 0.74 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.46 1crp h PHE 90 CO 0.06 0.07 -0.03 0.93 -2.23 0.00 0.00 178.31 177.11 1crp h GLU 91 N 0.03 0.00 0.00 1.11 4.39 -1.47 -1.58 114.58 117.06 1crp h GLU 91 Ca 0.02 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.60 1crp h GLU 91 Cb 0.03 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1crp h GLU 91 CO -0.00 0.03 -0.57 -0.44 -1.16 0.00 0.00 179.01 176.87 1crp h ASP 92 N 0.00 0.00 1.19 1.42 3.32 0.63 -3.23 116.42 119.75 1crp h ASP 92 Ca -0.00 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 1crp h ASP 92 Cb 0.25 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1crp h ASP 92 CO 0.00 0.57 -0.79 0.40 -1.72 0.00 0.00 179.24 177.70 1crp h ILE 93 N 0.00 1.37 0.00 0.35 1.08 -0.17 -1.96 117.51 118.19 1crp h ILE 93 Ca -0.01 -2.92 0.00 0.00 -0.39 0.00 0.00 64.86 61.54 1crp h ILE 93 Cb 1.43 2.67 0.00 0.00 -3.07 0.00 0.00 36.82 37.84 1crp h ILE 93 CO 0.07 0.78 0.00 1.57 -0.69 0.00 0.00 178.15 179.88 1crp n HIS 94 N -3.31 0.82 -0.03 1.37 -0.00 -1.08 -1.99 115.22 110.99 1crp n HIS 94 Ca 0.01 0.37 -0.07 0.00 0.46 0.00 0.00 57.72 58.49 1crp n HIS 94 Cb 0.85 -1.09 -0.03 0.00 -0.12 0.00 0.00 29.99 29.60 1crp n HIS 94 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 1crp n GLN 95 N -2.29 0.15 0.30 1.57 6.02 -1.19 -4.58 117.38 117.37 1crp n GLN 95 Ca 0.00 0.06 0.20 0.00 -0.01 0.00 0.00 57.00 57.25 1crp n GLN 95 Cb 0.14 -0.87 1.05 0.00 1.02 0.00 0.00 30.24 31.57 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 -0.17 0.00 -0.62 1.08 0.05 -1.41 -0.94 116.97 114.95 1crp h TYR 96 Ca -0.17 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.32 1crp h TYR 96 Cb 1.18 0.00 -0.17 0.00 1.01 0.00 0.00 36.73 38.75 1crp h TYR 96 CO -0.01 0.00 0.36 -2.13 -1.05 0.00 0.00 178.16 175.33 1crp n ARG 97 N -2.93 2.20 0.00 4.88 0.63 -0.84 -3.99 116.66 116.60 1crp n ARG 97 Ca -0.02 -2.06 0.00 0.00 -0.92 0.00 0.00 57.85 54.85 1crp n ARG 97 Cb 0.10 -1.84 0.00 0.00 0.45 0.00 0.00 32.46 31.17 1crp n ARG 97 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1crp n GLU 98 N -0.42 0.00 0.28 -0.14 1.02 -0.36 -4.71 120.64 116.31 1crp n GLU 98 Ca 0.37 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.64 1crp n GLU 98 Cb 1.22 -0.48 0.83 0.00 -0.02 0.00 0.00 31.44 32.99 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 -0.60 3.49 4.15 -1.69 0.59 115.11 121.05 1crp h GLN 99 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 1crp h GLN 99 Cb 0.49 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.16 1crp h GLN 99 CO 0.00 0.00 0.09 0.82 -1.93 0.00 0.00 178.83 177.81 1crp h ILE 100 N 0.00 1.26 0.00 2.39 2.04 -1.85 -0.19 117.51 121.16 1crp h ILE 100 Ca 0.01 -1.01 -0.04 0.00 1.00 0.00 0.00 64.86 64.81 1crp h ILE 100 Cb 0.04 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1crp h ILE 100 CO -0.00 0.37 -0.21 0.11 0.00 0.00 0.00 178.15 178.42 1crp h LYS 101 N 0.91 0.00 -0.03 2.37 6.56 -1.12 -2.36 116.57 122.89 1crp h LYS 101 Ca 0.18 0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 59.62 1crp h LYS 101 Cb 0.44 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.08 1crp h LYS 101 CO 0.01 0.21 -0.66 -0.09 -2.06 0.00 0.00 179.45 176.86 1crp h ARG 102 N 0.00 0.14 0.02 3.15 2.43 0.06 0.32 114.38 120.51 1crp h ARG 102 Ca -0.00 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1crp h ARG 102 Cb 0.60 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1crp h ARG 102 CO 0.03 0.75 -0.01 0.28 -1.51 0.00 0.00 179.97 179.51 1crp h VAL 103 N 0.10 0.00 0.00 0.20 2.07 -0.73 -3.30 116.25 114.60 1crp h VAL 103 Ca -0.01 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1crp h VAL 103 Cb 1.18 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1crp h VAL 103 CO 0.10 0.00 0.00 0.11 0.02 0.00 0.00 177.57 177.80 1crp h LYS 104 N -0.33 0.00 -5.33 1.57 1.57 -1.58 -3.46 116.57 109.00 1crp h LYS 104 Ca -0.00 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.45 1crp h LYS 104 Cb 0.02 0.00 0.14 0.00 0.08 0.00 0.00 32.23 32.48 1crp h LYS 104 CO 0.01 0.00 -0.66 -3.47 -0.57 0.00 0.00 179.45 174.75 1crp n ASP 105 N -2.56 -3.60 -3.53 0.86 -0.08 0.11 -4.99 116.55 102.76 1crp n ASP 105 Ca -0.00 -0.53 -0.07 0.00 -1.51 0.00 0.00 54.79 52.67 1crp n ASP 105 Cb 0.14 -4.65 -0.02 0.00 2.34 0.00 0.00 41.12 38.93 1crp n ASP 105 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1crp s SER 106 N -3.86 -0.30 -0.76 1.67 0.15 -0.81 -5.01 113.70 104.78 1crp s SER 106 Ca 0.21 0.00 0.03 0.00 0.70 0.00 0.00 55.95 56.90 1crp s SER 106 Cb -0.09 0.32 0.25 0.00 -1.71 0.00 0.00 66.02 64.78 1crp s SER 106 CO 0.66 -0.51 0.86 -0.67 1.20 0.00 0.00 173.24 174.78 1crp n ASP 107 N -0.19 4.24 -2.69 5.45 -0.08 -1.26 -4.32 116.55 117.69 1crp n ASP 107 Ca -0.06 -3.38 -0.06 0.00 -1.51 0.00 0.00 54.79 49.78 1crp n ASP 107 Cb 0.61 -0.83 0.11 0.00 2.34 0.00 0.00 41.12 43.35 1crp n ASP 107 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1crp n ASP 108 N 1.21 -1.36 -4.90 1.67 8.00 -1.26 -5.13 116.55 114.78 1crp n ASP 108 Ca 0.27 -2.41 -0.29 0.00 0.71 0.00 0.00 54.79 53.07 1crp n ASP 108 Cb 0.38 0.74 -0.04 0.00 -0.02 0.00 0.00 41.12 42.18 1crp n ASP 108 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1crp s VAL 109 N -0.28 5.10 -1.07 2.53 1.01 -1.26 -4.96 120.40 121.47 1crp s VAL 109 Ca 0.19 -0.01 -0.23 0.00 0.00 0.00 0.00 61.98 61.93 1crp s VAL 109 Cb 0.42 -3.69 -0.06 0.00 0.00 0.00 0.00 36.38 33.05 1crp s VAL 109 CO -0.09 -0.15 1.92 -2.16 0.00 0.00 0.00 175.10 174.62 1crp s PRO 110 N -3.15 2.61 0.35 2.72 0.05 -1.21 -4.92 135.00 131.45 1crp s PRO 110 Ca 0.42 -0.86 -0.08 0.00 0.05 0.00 0.00 61.00 60.53 1crp s PRO 110 Cb -0.11 -5.19 -0.06 0.00 0.05 0.00 0.00 34.50 29.19 1crp s PRO 110 CO 0.27 -3.63 0.67 1.41 0.05 0.00 0.00 177.00 175.77 1crp s MET 111 N 6.54 3.72 -0.24 4.56 1.75 -1.26 -2.54 119.30 131.83 1crp s MET 111 Ca 0.68 0.27 -0.03 0.00 -1.25 0.00 0.00 55.69 55.36 1crp s MET 111 Cb -0.03 -2.51 0.13 0.00 2.84 0.00 0.00 34.83 35.27 1crp s MET 111 CO 0.07 0.08 0.37 0.08 -0.65 0.00 0.00 175.02 174.97 1crp s VAL 112 N -2.23 -0.59 -0.45 10.11 1.01 -0.91 -4.28 120.40 123.06 1crp s VAL 112 Ca 0.48 -0.09 -0.24 0.00 0.00 0.00 0.00 61.98 62.14 1crp s VAL 112 Cb -0.10 -0.81 0.03 0.00 0.00 0.00 0.00 36.38 35.49 1crp s VAL 112 CO 0.30 -0.14 0.82 -0.22 0.00 0.00 0.00 175.10 175.86 1crp s LEU 113 N 2.53 4.19 0.28 3.92 2.96 -1.06 -1.51 118.68 129.99 1crp s LEU 113 Ca 0.12 -0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 53.97 1crp s LEU 113 Cb -0.15 -3.02 -0.04 0.00 0.50 0.00 0.00 46.19 43.47 1crp s LEU 113 CO -0.16 -0.94 0.51 -0.69 -1.32 0.00 0.00 176.35 173.75 1crp s VAL 114 N 3.39 5.09 -0.72 1.68 1.01 -0.91 -2.53 120.40 127.40 1crp s VAL 114 Ca 0.32 -0.18 0.04 0.00 0.00 0.00 0.00 61.98 62.15 1crp s VAL 114 Cb -0.12 -3.76 0.22 0.00 0.00 0.00 0.00 36.38 32.72 1crp s VAL 114 CO 0.23 -0.34 0.73 0.61 0.00 0.00 0.00 175.10 176.33 1crp n GLY 115 N -1.06 4.51 3.60 4.51 0.00 0.59 -1.93 105.19 115.41 1crp n GLY 115 Ca -0.03 -2.69 -0.30 0.00 0.00 0.00 0.00 46.02 43.00 1crp n GLY 115 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1crp s ASN 116 N -1.84 2.16 -0.97 1.61 3.84 -0.54 -1.93 114.94 117.27 1crp s ASN 116 Ca 0.33 1.85 0.00 0.00 0.21 0.00 0.00 52.86 55.25 1crp s ASN 116 Cb 0.06 -2.43 0.00 0.00 -0.55 0.00 0.00 41.25 38.32 1crp s ASN 116 CO -0.07 -3.52 0.00 0.29 -2.79 0.00 0.00 177.10 171.01 1crp n LYS 117 N -4.49 -0.85 0.18 0.43 5.02 -0.48 -1.86 118.16 116.12 1crp n LYS 117 Ca 0.08 0.60 0.04 0.00 -2.02 0.00 0.00 58.31 57.00 1crp n LYS 117 Cb 0.53 -4.67 0.33 0.00 -0.02 0.00 0.00 35.03 31.20 1crp n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1crp h ASP 119 N 0.00 0.00 -4.06 0.00 3.04 -1.91 -3.43 116.42 110.07 1crp h ASP 119 Ca -0.00 0.00 -0.51 0.00 -3.24 0.00 0.00 57.03 53.27 1crp h ASP 119 Cb 0.87 0.00 0.08 0.00 -1.04 0.00 0.00 39.33 39.24 1crp h ASP 119 CO 0.05 0.00 0.47 -0.76 -2.04 0.00 0.00 179.24 176.96 1crp s LEU 120 N -6.01 3.82 -0.18 0.15 1.43 -1.06 -4.97 118.68 111.86 1crp s LEU 120 Ca -0.04 2.30 -0.23 0.00 -1.03 0.00 0.00 54.13 55.12 1crp s LEU 120 Cb 0.12 -4.47 -0.20 0.00 0.03 0.00 0.00 46.19 41.67 1crp s LEU 120 CO 0.41 -1.23 0.40 0.00 0.23 0.00 0.00 176.35 176.16 1crp h ALA 121 N 1.40 0.15 -0.72 4.21 0.00 -1.90 -3.42 119.26 118.98 1crp h ALA 121 Ca -0.50 -0.89 -0.17 0.00 0.00 0.00 0.00 54.91 53.35 1crp h ALA 121 Cb 1.27 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 1crp h ALA 121 CO 0.58 0.42 0.53 0.00 0.00 0.00 0.00 179.25 180.77 1crp s ALA 122 N -2.33 1.11 -0.76 0.00 0.00 -1.26 -4.87 121.76 113.64 1crp s ALA 122 Ca -0.24 -0.75 -0.23 0.00 0.00 0.00 0.00 51.96 50.75 1crp s ALA 122 Cb 0.02 -4.52 0.07 0.00 0.00 0.00 0.00 23.12 18.70 1crp s ALA 122 CO 0.60 -5.36 1.10 0.50 0.00 0.00 0.00 175.76 172.60 1crp s ARG 123 N 8.37 3.26 0.28 0.00 3.52 -1.26 -4.80 118.95 128.31 1crp s ARG 123 Ca 0.88 -0.92 0.06 0.00 -0.13 0.00 0.00 55.73 55.62 1crp s ARG 123 Cb -0.13 -4.46 0.39 0.00 -1.56 0.00 0.00 34.95 29.19 1crp s ARG 123 CO 0.11 -1.91 1.66 1.79 -0.81 0.00 0.00 175.30 176.13 1crp h THR 124 N 6.05 1.33 -3.65 4.11 1.35 -1.81 -3.41 112.91 116.88 1crp h THR 124 Ca -0.16 -1.65 -0.62 0.00 -0.55 0.00 0.00 66.41 63.44 1crp h THR 124 Cb 1.05 1.76 -0.14 0.00 -1.73 0.00 0.00 68.15 69.09 1crp h THR 124 CO 1.21 0.49 -0.32 -0.69 -0.25 0.00 0.00 175.52 175.96 1crp s VAL 125 N -4.05 5.24 0.10 6.82 1.01 -1.22 -5.03 120.40 123.28 1crp s VAL 125 Ca -0.04 0.47 -0.30 0.00 0.00 0.00 0.00 61.98 62.10 1crp s VAL 125 Cb 0.13 -3.64 -0.06 0.00 0.00 0.00 0.00 36.38 32.81 1crp s VAL 125 CO 0.78 0.24 1.14 -1.61 0.00 0.00 0.00 175.10 175.64 1crp s GLU 126 N 1.58 4.51 0.65 2.72 0.41 -1.26 -4.90 118.70 122.41 1crp s GLU 126 Ca 0.13 1.71 0.42 0.00 -0.41 0.00 0.00 54.97 56.82 1crp s GLU 126 Cb -0.15 -3.33 2.24 0.00 -1.78 0.00 0.00 34.13 31.10 1crp s GLU 126 CO 0.08 -0.11 2.31 1.03 -0.49 0.00 0.00 175.26 178.08 1crp h SER 127 N 6.15 0.00 0.32 -0.19 0.87 -1.96 -2.45 113.55 116.29 1crp h SER 127 Ca -0.43 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.12 1crp h SER 127 Cb 1.21 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 1crp h SER 127 CO 0.77 0.00 -0.16 -0.09 -0.53 0.00 0.00 176.83 176.83 1crp h ARG 128 N 0.00 -0.42 -0.63 2.24 9.65 -1.99 -1.50 114.38 121.73 1crp h ARG 128 Ca -0.00 0.03 0.04 0.00 -1.10 0.00 0.00 59.98 58.95 1crp h ARG 128 Cb 0.08 0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.72 1crp h ARG 128 CO 0.00 -0.17 0.42 -0.56 2.80 0.00 0.00 179.97 182.46 1crp h GLN 129 N -1.05 0.69 -0.15 0.20 3.07 -1.92 0.18 115.11 116.13 1crp h GLN 129 Ca -0.04 -0.04 -0.11 0.00 0.09 0.00 0.00 58.65 58.54 1crp h GLN 129 Cb 0.45 -0.16 -0.01 0.00 0.08 0.00 0.00 27.48 27.84 1crp h GLN 129 CO 0.07 0.46 -0.39 0.00 0.09 0.00 0.00 178.83 179.06 1crp h ALA 130 N 1.64 1.06 -0.25 0.06 0.00 -1.49 -2.47 119.26 117.82 1crp h ALA 130 Ca 0.26 -0.41 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1crp h ALA 130 Cb 0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1crp h ALA 130 CO -0.07 0.59 -0.24 1.96 0.00 0.00 0.00 179.25 181.49 1crp h GLN 131 N 0.27 0.46 0.00 0.00 1.08 0.12 -2.46 115.11 114.59 1crp h GLN 131 Ca 0.03 -0.17 -0.08 0.00 -1.45 0.00 0.00 58.65 56.98 1crp h GLN 131 Cb 0.81 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.20 1crp h GLN 131 CO 0.06 0.67 -0.39 -0.44 -0.95 0.00 0.00 178.83 177.79 1crp h ASP 132 N 0.41 0.00 0.20 1.46 3.32 -1.02 -2.05 116.42 118.74 1crp h ASP 132 Ca 0.06 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 1crp h ASP 132 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1crp h ASP 132 CO 0.05 0.39 -0.10 0.25 -1.72 0.00 0.00 179.24 178.11 1crp h LEU 133 N 0.00 -0.23 -0.93 1.55 5.85 -1.05 -3.01 115.31 117.49 1crp h LEU 133 Ca -0.00 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1crp h LEU 133 Cb 1.08 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 1crp h LEU 133 CO 0.05 0.26 0.46 0.00 -0.34 0.00 0.00 178.44 178.87 1crp h ALA 134 N -0.99 1.18 -0.01 1.25 0.00 -1.57 -1.73 119.26 117.39 1crp h ALA 134 Ca -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1crp h ALA 134 Cb 0.26 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1crp h ALA 134 CO 0.05 0.65 0.01 0.00 0.00 0.00 0.00 179.25 179.96 1crp h ARG 135 N 1.21 0.00 -0.38 0.00 2.47 -1.48 -1.19 114.38 115.02 1crp h ARG 135 Ca 0.30 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.94 1crp h ARG 135 Cb 0.05 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.35 1crp h ARG 135 CO -0.05 0.00 -0.09 1.03 0.56 0.00 0.00 179.97 181.42 1crp h SER 136 N 0.00 0.63 -0.54 7.04 0.87 -1.16 -2.43 113.55 117.96 1crp h SER 136 Ca 0.01 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 1crp h SER 136 Cb 0.03 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.83 1crp h SER 136 CO -0.00 0.76 0.00 -1.22 -0.53 0.00 0.00 176.83 175.84 1crp n TYR 137 N -4.19 0.71 -3.02 2.24 4.02 -0.49 -4.92 117.16 111.50 1crp n TYR 137 Ca 0.01 -0.36 -0.22 0.00 -0.01 0.00 0.00 57.90 57.32 1crp n TYR 137 Cb 0.33 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.68 1crp n TYR 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1crp n GLY 138 N 1.42 -0.52 3.62 2.72 0.00 -0.92 -4.98 105.19 106.53 1crp n GLY 138 Ca 0.19 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.15 3.72 0.57 -0.61 -4.36 -0.96 -5.02 121.20 111.39 1crp s ILE 139 Ca 0.30 -0.86 -0.19 0.00 -0.26 0.00 0.00 60.65 59.64 1crp s ILE 139 Cb -0.14 -2.66 -0.04 0.00 1.25 0.00 0.00 42.46 40.87 1crp s ILE 139 CO 0.37 0.31 1.15 -2.16 0.24 0.00 0.00 174.94 174.85 1crp s PRO 140 N -1.69 3.17 0.03 0.37 0.04 -1.26 -4.33 135.00 131.34 1crp s PRO 140 Ca 0.19 1.65 0.09 0.00 0.04 0.00 0.00 61.00 62.97 1crp s PRO 140 Cb -0.11 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 1crp s PRO 140 CO 0.10 -1.00 -0.25 -0.47 0.04 0.00 0.00 177.00 175.42 1crp s TYR 141 N -1.79 2.35 0.30 0.56 5.04 -1.26 -2.55 117.35 120.00 1crp s TYR 141 Ca 0.73 -0.40 -0.03 0.00 -2.44 0.00 0.00 57.07 54.94 1crp s TYR 141 Cb -0.25 -1.42 0.01 0.00 0.35 0.00 0.00 41.96 40.65 1crp s TYR 141 CO 0.30 0.11 0.44 -0.89 -1.34 0.00 0.00 175.55 174.17 1crp n ILE 142 N 1.89 0.00 -4.08 3.14 5.41 -1.05 -5.02 119.36 119.65 1crp n ILE 142 Ca -0.17 -1.43 -0.19 0.00 1.00 0.00 0.00 62.75 61.97 1crp n ILE 142 Cb 0.52 0.92 -0.16 0.00 -0.71 0.00 0.00 39.64 40.20 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 -2.61 0.62 0.27 0.38 2.02 -1.26 -0.30 118.70 117.83 1crp s GLU 143 Ca 0.23 -0.04 0.06 0.00 0.02 0.00 0.00 54.97 55.25 1crp s GLU 143 Cb -0.01 -0.69 -0.06 0.00 0.10 0.00 0.00 34.13 33.47 1crp s GLU 143 CO 0.17 -0.10 -0.05 0.95 0.02 0.00 0.00 175.26 176.25 1crp s THR 144 N 0.93 1.59 -0.25 3.63 -4.23 -0.81 -4.16 115.64 112.33 1crp s THR 144 Ca -0.11 -2.12 -0.03 0.00 -1.18 0.00 0.00 61.69 58.26 1crp s THR 144 Cb -0.14 -2.44 0.14 0.00 1.34 0.00 0.00 72.50 71.40 1crp s THR 144 CO -0.00 -0.30 0.43 -0.55 -0.54 0.00 0.00 174.62 173.65 1crp s SER 145 N -3.43 -0.16 0.00 3.99 0.15 0.16 -1.38 113.70 113.03 1crp s SER 145 Ca 0.29 0.42 0.25 0.00 0.70 0.00 0.00 55.95 57.61 1crp s SER 145 Cb 0.04 1.37 1.08 0.00 -1.71 0.00 0.00 66.02 66.81 1crp s SER 145 CO 0.12 -0.29 1.80 0.00 1.20 0.00 0.00 173.24 176.07 1crp n ALA 146 N 5.38 2.15 -0.32 5.45 0.00 -1.26 -2.45 120.51 129.45 1crp n ALA 146 Ca -0.03 -0.09 0.10 0.00 0.00 0.00 0.00 53.44 53.42 1crp n ALA 146 Cb 0.50 -1.40 0.32 0.00 0.00 0.00 0.00 19.45 18.87 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 -1.47 3.00 -0.22 0.00 2.85 -1.26 -4.42 118.16 116.65 1crp n LYS 147 Ca 0.07 -2.59 0.00 0.00 -1.05 0.00 0.00 58.31 54.74 1crp n LYS 147 Cb 0.28 -1.67 0.00 0.00 -0.65 0.00 0.00 35.03 32.98 1crp n LYS 147 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 1crp n THR 148 N 1.35 0.00 -3.31 0.58 5.66 -1.19 -5.01 114.28 112.37 1crp n THR 148 Ca 0.24 0.00 -0.23 0.00 -3.05 0.00 0.00 64.05 61.01 1crp n THR 148 Cb 0.69 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.48 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 -3.57 -3.65 1.09 1.74 -1.03 -4.92 116.66 106.33 1crp n ARG 149 Ca 0.00 0.53 -0.39 0.00 -0.77 0.00 0.00 57.85 57.22 1crp n ARG 149 Cb 0.50 -5.26 -0.11 0.00 -1.02 0.00 0.00 32.46 26.58 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 -5.96 2.63 0.00 5.56 0.74 -1.15 -4.43 119.66 117.06 1crp s GLN 150 Ca 0.38 -1.31 0.00 0.00 0.05 0.00 0.00 55.36 54.48 1crp s GLN 150 Cb -0.20 -3.67 0.00 0.00 1.10 0.00 0.00 33.01 30.24 1crp s GLN 150 CO 0.47 -0.82 0.00 0.41 -0.55 0.00 0.00 175.29 174.80 1crp n GLY 151 N 4.89 3.26 0.37 2.59 0.00 -1.26 -0.66 105.19 114.38 1crp n GLY 151 Ca -0.11 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.04 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 0.86 0.00 1.61 2.07 -1.82 -0.09 116.25 118.87 1crp h VAL 152 Ca 0.00 -0.19 -0.12 0.00 0.82 0.00 0.00 66.70 67.21 1crp h VAL 152 Cb 0.00 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 1crp h VAL 152 CO 0.00 0.10 -0.76 -0.33 0.02 0.00 0.00 177.57 176.60 1crp h GLU 153 N 0.55 0.00 -0.43 1.57 5.08 -1.91 -2.91 114.58 116.53 1crp h GLU 153 Ca 0.37 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.63 1crp h GLU 153 Cb 0.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1crp h GLU 153 CO -0.13 0.47 -0.13 -0.44 -1.00 0.00 0.00 179.01 177.77 1crp h ASP 154 N 0.00 0.86 0.03 1.42 5.19 -1.40 -2.25 116.42 120.27 1crp h ASP 154 Ca -0.04 -0.37 -0.05 0.00 -0.62 0.00 0.00 57.03 55.95 1crp h ASP 154 Cb 1.45 -0.24 0.00 0.00 0.18 0.00 0.00 39.33 40.73 1crp h ASP 154 CO 0.06 1.04 -0.21 0.00 -3.12 0.00 0.00 179.24 177.02 1crp h ALA 155 N 0.85 -0.02 0.03 3.45 0.00 -1.54 -2.87 119.26 119.16 1crp h ALA 155 Ca 0.11 -0.56 0.03 0.00 0.00 0.00 0.00 54.91 54.49 1crp h ALA 155 Cb 0.68 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 1crp h ALA 155 CO 0.05 0.10 -0.23 0.74 0.00 0.00 0.00 179.25 179.90 1crp h PHE 156 N -0.85 -0.62 -0.01 0.00 -1.00 -1.60 -0.14 116.94 112.73 1crp h PHE 156 Ca -0.04 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.76 1crp h PHE 156 Cb 1.15 0.27 -0.00 0.00 3.61 0.00 0.00 35.95 40.98 1crp h PHE 156 CO 0.26 -0.32 0.00 1.88 -1.61 0.00 0.00 178.31 178.52 1crp h TYR 157 N -0.38 0.01 0.00 -0.55 -1.99 -1.56 -1.72 116.97 110.78 1crp h TYR 157 Ca 0.05 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.78 1crp h TYR 157 Cb 0.45 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.17 1crp h TYR 157 CO -0.26 0.06 0.00 1.15 -0.00 0.00 0.00 178.16 179.11 1crp h THR 158 N -0.04 0.00 0.05 -2.88 2.02 -1.26 -2.08 112.91 108.71 1crp h THR 158 Ca 0.00 -0.04 -0.10 0.00 0.77 0.00 0.00 66.41 67.04 1crp h THR 158 Cb 0.05 0.78 0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1crp h THR 158 CO -0.00 0.00 -0.41 -0.07 0.37 0.00 0.00 175.52 175.41 1crp h LEU 159 N 0.00 0.27 -1.15 2.58 4.07 -0.08 -2.63 115.31 118.37 1crp h LEU 159 Ca 0.00 -0.90 -0.05 0.00 0.08 0.00 0.00 57.88 57.00 1crp h LEU 159 Cb 0.05 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 41.70 1crp h LEU 159 CO 0.00 1.15 -0.25 0.58 -1.08 0.00 0.00 178.44 178.84 1crp h VAL 160 N -0.57 0.64 0.02 1.22 2.07 -1.23 -2.47 116.25 115.93 1crp h VAL 160 Ca -0.07 -1.16 -0.13 0.00 0.82 0.00 0.00 66.70 66.16 1crp h VAL 160 Cb 1.26 1.76 0.01 0.00 -1.52 0.00 0.00 31.29 32.80 1crp h VAL 160 CO 0.08 0.25 -0.53 0.03 0.02 0.00 0.00 177.57 177.41 1crp h ARG 161 N 0.00 0.33 -0.54 1.57 3.08 -1.45 -2.82 114.38 114.55 1crp h ARG 161 Ca -0.00 -0.38 -0.09 0.00 0.07 0.00 0.00 59.98 59.58 1crp h ARG 161 Cb 0.74 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 1crp h ARG 161 CO 0.03 1.08 -0.01 0.93 -1.07 0.00 0.00 179.97 180.93 1crp h GLU 162 N -0.25 0.97 -0.54 0.04 4.39 -1.43 -2.68 114.58 115.07 1crp h GLU 162 Ca -0.07 -0.32 -0.02 0.00 0.34 0.00 0.00 59.36 59.29 1crp h GLU 162 Cb 1.28 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.82 1crp h GLU 162 CO 0.10 0.99 0.26 0.82 -1.16 0.00 0.00 179.01 180.02 1crp h ILE 163 N 0.85 1.18 0.00 3.13 2.04 -1.53 -0.69 117.51 122.49 1crp h ILE 163 Ca 0.15 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1crp h ILE 163 Cb 0.56 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1crp h ILE 163 CO 0.03 0.21 0.00 0.54 0.00 0.00 0.00 178.15 178.94 1crp n ARG 164 N -4.37 0.00 0.04 2.37 5.12 -1.03 -4.06 116.66 114.73 1crp n ARG 164 Ca 0.05 0.38 -0.03 0.00 -1.93 0.00 0.00 57.85 56.31 1crp n ARG 164 Cb 0.13 -1.35 -0.02 0.00 -1.16 0.00 0.00 32.46 30.06 1crp n ARG 164 CO 0.00 0.00 0.00 0.37 -1.93 0.00 0.00 177.63 176.07 1crp h GLN 165 N 0.00 -0.16 0.00 5.56 -0.00 -1.52 -3.52 115.11 115.47 1crp h GLN 165 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.66 1crp h GLN 165 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 27.48 27.52 1crp h GLN 165 CO 0.00 -0.11 0.00 1.58 0.00 0.00 0.00 178.83 180.30