#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ci6 s ASN 3 N 0.00 6.47 0.00 4.04 3.84 -1.26 -5.06 114.94 122.98 3ci6 s ASN 3 Ca 0.00 1.29 0.00 0.00 0.21 0.00 0.00 52.86 54.36 3ci6 s ASN 3 Cb 0.00 -2.40 0.00 0.00 -0.55 0.00 0.00 41.25 38.30 3ci6 s ASN 3 CO 0.00 -0.56 0.00 0.00 -2.79 0.00 0.00 177.10 173.75 3ci6 n GLN 5 N -1.74 0.00 -0.27 0.43 6.02 -1.26 -1.33 117.38 119.22 3ci6 n GLN 5 Ca 0.04 0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 56.98 3ci6 n GLN 5 Cb 0.54 0.00 0.06 0.00 1.02 0.00 0.00 30.24 31.86 3ci6 n GLN 5 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3ci6 h LEU 6 N 0.00 0.95 -0.79 1.08 5.85 -1.99 -1.21 115.31 119.20 3ci6 h LEU 6 Ca 0.00 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.61 3ci6 h LEU 6 Cb 0.00 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 3ci6 h LEU 6 CO 0.00 0.79 0.51 0.44 -0.34 0.00 0.00 178.44 179.84 3ci6 h ASP 7 N 1.03 0.92 -0.27 1.25 3.32 -1.63 0.35 116.42 121.40 3ci6 h ASP 7 Ca 0.26 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 3ci6 h ASP 7 Cb 0.07 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3ci6 h ASP 7 CO -0.04 0.68 0.15 0.74 -1.72 0.00 0.00 179.24 179.05 3ci6 h THR 8 N 1.08 1.11 -0.22 0.35 2.02 -1.78 -0.78 112.91 114.68 3ci6 h THR 8 Ca 0.29 -0.29 0.02 0.00 0.77 0.00 0.00 66.41 67.20 3ci6 h THR 8 Cb -0.10 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 3ci6 h THR 8 CO -0.06 0.11 0.09 0.25 0.37 0.00 0.00 175.52 176.28 3ci6 h LEU 9 N 0.32 0.11 -0.77 2.58 5.85 -0.85 -1.93 115.31 120.64 3ci6 h LEU 9 Ca 0.09 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.88 3ci6 h LEU 9 Cb 0.04 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.02 3ci6 h LEU 9 CO -0.02 0.09 0.47 -0.09 -0.34 0.00 0.00 178.44 178.55 3ci6 h ARG 10 N 0.20 0.85 -0.49 1.25 2.43 -0.76 0.95 114.38 118.81 3ci6 h ARG 10 Ca 0.09 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3ci6 h ARG 10 Cb 0.05 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 3ci6 h ARG 10 CO -0.09 0.56 0.32 -0.09 -1.51 0.00 0.00 179.97 179.16 3ci6 h ARG 11 N 0.88 0.63 -0.31 0.20 2.43 -0.71 -0.68 114.38 116.81 3ci6 h ARG 11 Ca 0.33 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.36 3ci6 h ARG 11 Cb 0.11 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 3ci6 h ARG 11 CO -0.15 0.42 -0.17 0.82 -1.51 0.00 0.00 179.97 179.38 3ci6 h ILE 12 N 0.65 1.29 -1.00 1.20 2.04 -0.88 -2.09 117.51 118.73 3ci6 h ILE 12 Ca 0.18 -1.28 0.05 0.00 1.00 0.00 0.00 64.86 64.81 3ci6 h ILE 12 Cb -0.06 1.45 -0.06 0.00 -0.74 0.00 0.00 36.82 37.41 3ci6 h ILE 12 CO -0.05 0.41 0.65 0.58 0.00 0.00 0.00 178.15 179.74 3ci6 h VAL 13 N 0.42 1.13 -0.39 1.67 2.07 -0.54 0.17 116.25 120.79 3ci6 h VAL 13 Ca 0.07 -0.42 -0.15 0.00 0.82 0.00 0.00 66.70 67.02 3ci6 h VAL 13 Cb 0.70 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 3ci6 h VAL 13 CO 0.05 0.22 -0.34 1.56 0.02 0.00 0.00 177.57 179.08 3ci6 h GLN 14 N 1.22 0.90 -0.48 1.57 4.20 -1.01 0.16 115.11 121.66 3ci6 h GLN 14 Ca 0.41 -0.45 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 3ci6 h GLN 14 Cb 0.08 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 3ci6 h GLN 14 CO -0.15 1.10 -0.04 1.49 -0.67 0.00 0.00 178.83 180.56 3ci6 h GLU 15 N 0.75 0.88 -0.57 1.46 4.81 -0.77 -2.05 114.58 119.08 3ci6 h GLU 15 Ca 0.07 -0.30 -0.04 0.00 -0.13 0.00 0.00 59.36 58.96 3ci6 h GLU 15 Cb 0.92 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.21 3ci6 h GLU 15 CO 0.09 0.94 0.20 0.82 -0.73 0.00 0.00 179.01 180.32 3ci6 h ILE 16 N 0.73 1.23 -0.52 2.32 2.04 -0.79 -2.82 117.51 119.70 3ci6 h ILE 16 Ca 0.13 -0.77 -0.03 0.00 1.00 0.00 0.00 64.86 65.19 3ci6 h ILE 16 Cb 0.57 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 3ci6 h ILE 16 CO 0.03 0.29 0.18 -1.13 0.00 0.00 0.00 178.15 177.53 3ci6 h ASN 17 N 0.80 0.70 0.41 1.72 -0.73 -0.36 -2.39 115.58 115.73 3ci6 h ASN 17 Ca 0.19 -0.09 0.00 0.00 1.87 0.00 0.00 56.30 58.26 3ci6 h ASN 17 Cb 0.25 -0.18 0.00 0.00 0.27 0.00 0.00 38.32 38.66 3ci6 h ASN 17 CO -0.01 0.65 -0.34 -1.54 -0.37 0.00 0.00 177.43 175.82 3ci6 n SER 18 N -4.32 0.68 -4.75 1.15 3.41 -0.80 -4.92 113.62 104.06 3ci6 n SER 18 Ca 0.04 -0.50 -0.34 0.00 -0.26 0.00 0.00 58.87 57.82 3ci6 n SER 18 Cb 0.18 0.13 0.06 0.00 -0.26 0.00 0.00 64.21 64.32 3ci6 n SER 18 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3ci6 s SER 19 N -2.75 4.81 0.09 4.04 1.04 -0.90 -4.94 113.70 115.10 3ci6 s SER 19 Ca 0.18 2.17 0.23 0.00 0.48 0.00 0.00 55.95 59.02 3ci6 s SER 19 Cb 0.19 -2.57 0.19 0.00 0.10 0.00 0.00 66.02 63.93 3ci6 s SER 19 CO 0.60 -1.84 1.17 1.33 0.98 0.00 0.00 173.24 175.48 3ci6 n VAL 20 N -2.40 0.29 -3.79 5.02 0.24 -1.26 -4.94 118.33 111.49 3ci6 n VAL 20 Ca 0.12 -0.28 -0.09 0.00 -2.04 0.00 0.00 64.34 62.04 3ci6 n VAL 20 Cb 0.51 -0.01 -0.06 0.00 -1.47 0.00 0.00 33.84 32.81 3ci6 n VAL 20 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3ci6 s SER 21 N -4.19 -0.03 0.14 -1.34 1.04 -1.26 -5.04 113.70 103.02 3ci6 s SER 21 Ca 0.05 -0.56 -0.19 0.00 0.48 0.00 0.00 55.95 55.72 3ci6 s SER 21 Cb 0.13 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.67 3ci6 s SER 21 CO 0.76 -0.81 1.71 0.25 0.98 0.00 0.00 173.24 176.13 3ci6 h LEU 22 N 2.56 -0.14 -0.50 2.42 5.85 -1.92 -1.27 115.31 122.31 3ci6 h LEU 22 Ca -0.33 0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.53 3ci6 h LEU 22 Cb 1.23 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.31 3ci6 h LEU 22 CO 0.51 -0.04 0.14 -0.74 -0.34 0.00 0.00 178.44 177.97 3ci6 h HIS 23 N 0.05 0.23 -0.66 1.25 2.76 -2.00 -1.26 115.15 115.53 3ci6 h HIS 23 Ca 0.12 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.27 3ci6 h HIS 23 Cb 0.16 -0.03 -0.03 0.00 1.55 0.00 0.00 27.41 29.06 3ci6 h HIS 23 CO -0.21 0.04 0.22 -0.44 -1.30 0.00 0.00 177.93 176.23 3ci6 h ASP 24 N 0.29 0.94 -0.80 3.26 3.32 -1.89 -1.57 116.42 119.98 3ci6 h ASP 24 Ca 0.25 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 3ci6 h ASP 24 Cb 0.31 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 3ci6 h ASP 24 CO -0.29 0.89 0.49 0.77 -1.72 0.00 0.00 179.24 179.38 3ci6 h SER 25 N 0.94 0.96 -0.24 6.45 4.64 -0.46 -0.35 113.55 125.50 3ci6 h SER 25 Ca 0.21 -0.05 -0.15 0.00 -0.47 0.00 0.00 61.79 61.33 3ci6 h SER 25 Cb 0.28 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3ci6 h SER 25 CO -0.01 0.74 -0.43 -0.07 -0.87 0.00 0.00 176.83 176.19 3ci6 h LEU 26 N 1.11 0.79 -0.31 5.97 3.38 -1.01 -3.27 115.31 121.96 3ci6 h LEU 26 Ca 0.29 -0.54 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 3ci6 h LEU 26 Cb -0.05 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 3ci6 h LEU 26 CO -0.05 1.18 -0.00 -0.78 0.09 0.00 0.00 178.44 178.87 3ci6 h ASP 27 N 0.43 0.54 0.00 -0.43 3.58 -0.98 -1.60 116.42 117.96 3ci6 h ASP 27 Ca 0.01 -0.31 0.00 0.00 0.42 0.00 0.00 57.03 57.15 3ci6 h ASP 27 Cb 1.04 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.94 3ci6 h ASP 27 CO 0.10 0.72 0.00 -0.38 -2.88 0.00 0.00 179.24 176.80 3ci6 n ILE 28 N -4.55 0.00 0.00 2.25 5.41 -0.17 -2.26 119.36 120.05 3ci6 n ILE 28 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.73 3ci6 n ILE 28 Cb 0.26 -0.14 0.00 0.00 -0.71 0.00 0.00 39.64 39.05 3ci6 n ILE 28 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 3ci6 n VAL 30 N 0.64 0.00 -0.04 1.39 0.24 -0.60 -0.98 118.33 118.98 3ci6 n VAL 30 Ca 0.00 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.14 3ci6 n VAL 30 Cb 0.00 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.30 3ci6 n VAL 30 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 3ci6 h ASN 31 N 0.00 0.72 -0.09 -1.34 2.35 -1.71 -1.96 115.58 113.56 3ci6 h ASN 31 Ca 0.00 -0.60 -0.12 0.00 -0.55 0.00 0.00 56.30 55.02 3ci6 h ASN 31 Cb 0.00 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 3ci6 h ASN 31 CO 0.00 1.20 -0.35 1.56 -1.65 0.00 0.00 177.43 178.19 3ci6 h GLN 32 N 0.29 0.59 -0.31 0.81 1.08 -1.29 -1.89 115.11 114.39 3ci6 h GLN 32 Ca -0.02 -0.28 -0.01 0.00 -1.45 0.00 0.00 58.65 56.89 3ci6 h GLN 32 Cb 1.14 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.55 3ci6 h GLN 32 CO 0.11 0.86 0.15 0.28 -0.95 0.00 0.00 178.83 179.28 3ci6 h VAL 33 N 0.50 1.15 -0.88 -0.54 2.07 -1.77 -0.27 116.25 116.50 3ci6 h VAL 33 Ca 0.05 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 3ci6 h VAL 33 Cb 0.84 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 3ci6 h VAL 33 CO 0.07 0.15 0.52 0.00 0.02 0.00 0.00 177.57 178.34 3ci6 h ALA 34 N 1.01 1.26 -0.24 1.67 0.00 -1.15 -2.54 119.26 119.27 3ci6 h ALA 34 Ca 0.11 -0.10 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 3ci6 h ALA 34 Cb 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3ci6 h ALA 34 CO -0.01 0.63 -0.57 0.22 0.00 0.00 0.00 179.25 179.51 3ci6 h ASP 35 N 1.22 0.92 0.00 0.00 3.58 -1.16 0.12 116.42 121.10 3ci6 h ASP 35 Ca 0.31 -0.56 0.00 0.00 0.42 0.00 0.00 57.03 57.21 3ci6 h ASP 35 Cb -0.04 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 40.74 3ci6 h ASP 35 CO -0.06 1.32 0.00 0.00 -2.88 0.00 0.00 179.24 177.62 3ci6 n ALA 36 N -2.57 1.79 0.00 -0.78 0.00 -0.13 -4.88 120.51 113.93 3ci6 n ALA 36 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3ci6 n ALA 36 Cb 0.64 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.09 3ci6 n ALA 36 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ci6 n LYS 38 N 0.06 0.00 -4.34 0.00 4.76 0.39 -5.09 118.16 113.94 3ci6 n LYS 38 Ca 0.00 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.19 3ci6 n LYS 38 Cb 0.09 0.00 -0.09 0.00 -1.84 0.00 0.00 35.03 33.19 3ci6 n LYS 38 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3ci6 s VAL 39 N 0.00 3.06 0.12 -0.18 -7.23 -1.04 -5.06 120.40 110.08 3ci6 s VAL 39 Ca 0.00 -1.91 -0.14 0.00 -1.81 0.00 0.00 61.98 58.12 3ci6 s VAL 39 Cb 0.00 -2.57 -0.05 0.00 0.56 0.00 0.00 36.38 34.32 3ci6 s VAL 39 CO 0.00 -0.24 1.48 0.44 -0.31 0.00 0.00 175.10 176.47 3ci6 h ASP 40 N 2.51 0.80 -3.62 4.85 3.32 -1.90 -3.45 116.42 118.93 3ci6 h ASP 40 Ca -0.45 -0.42 -0.30 0.00 0.02 0.00 0.00 57.03 55.89 3ci6 h ASP 40 Cb 1.23 -0.22 -0.32 0.00 0.22 0.00 0.00 39.33 40.24 3ci6 h ASP 40 CO 0.56 1.04 -0.74 -0.69 -1.72 0.00 0.00 179.24 177.70 3ci6 s VAL 41 N -4.57 0.09 -0.07 -1.35 1.01 -0.64 -4.34 120.40 110.54 3ci6 s VAL 41 Ca -0.12 0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.92 3ci6 s VAL 41 Cb 0.10 -0.15 0.02 0.00 0.00 0.00 0.00 36.38 36.35 3ci6 s VAL 41 CO 0.83 0.09 -0.04 0.00 0.00 0.00 0.00 175.10 175.97 3ci6 s SER 43 N 1.38 1.44 -0.13 0.00 0.01 0.13 -0.50 113.70 116.04 3ci6 s SER 43 Ca -0.03 -0.87 -0.00 0.00 1.31 0.00 0.00 55.95 56.35 3ci6 s SER 43 Cb -0.13 0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.14 3ci6 s SER 43 CO -0.03 -0.31 -0.10 -0.63 0.41 0.00 0.00 173.24 172.58 3ci6 s ILE 44 N -2.77 1.25 -0.19 1.44 1.01 -0.44 -0.57 121.20 120.93 3ci6 s ILE 44 Ca 0.08 -0.43 -0.07 0.00 0.00 0.00 0.00 60.65 60.23 3ci6 s ILE 44 Cb -0.01 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 3ci6 s ILE 44 CO -0.01 0.40 0.05 -0.31 0.00 0.00 0.00 174.94 175.07 3ci6 s TYR 45 N 1.60 3.17 0.03 3.97 1.51 -0.40 -3.24 117.35 123.99 3ci6 s TYR 45 Ca 0.05 -0.11 0.02 0.00 -1.01 0.00 0.00 57.07 56.01 3ci6 s TYR 45 Cb -0.13 -2.10 -0.04 0.00 -0.11 0.00 0.00 41.96 39.59 3ci6 s TYR 45 CO -0.09 -0.00 0.06 -0.51 -1.11 0.00 0.00 175.55 173.90 3ci6 s LEU 46 N 0.67 3.75 0.11 -1.29 1.43 -0.20 -0.53 118.68 122.63 3ci6 s LEU 46 Ca 0.02 0.04 -0.33 0.00 -1.03 0.00 0.00 54.13 52.84 3ci6 s LEU 46 Cb -0.13 -2.29 -0.12 0.00 0.03 0.00 0.00 46.19 43.68 3ci6 s LEU 46 CO 0.02 0.23 1.76 -0.11 0.23 0.00 0.00 176.35 178.48 3ci6 n LEU 47 N 0.94 3.68 -4.08 1.79 7.94 -1.26 -0.74 117.00 125.27 3ci6 n LEU 47 Ca -0.12 1.02 -0.35 0.00 -1.11 0.00 0.00 56.01 55.46 3ci6 n LEU 47 Cb 0.52 -1.49 -0.12 0.00 0.53 0.00 0.00 43.42 42.86 3ci6 n LEU 47 CO 0.39 0.01 -0.16 -0.62 -1.11 0.00 0.00 177.39 175.91 3ci6 s ASP 48 N 2.20 5.05 0.15 1.96 -1.08 0.68 -4.91 116.67 120.72 3ci6 s ASP 48 Ca 0.82 -2.35 -0.18 0.00 -0.52 0.00 0.00 52.55 50.32 3ci6 s ASP 48 Cb -0.57 -1.77 0.04 0.00 -1.46 0.00 0.00 42.92 39.15 3ci6 s ASP 48 CO 0.39 -0.44 1.69 1.05 0.52 0.00 0.00 175.17 178.38 3ci6 h GLU 49 N 7.57 0.00 -0.75 4.34 4.11 -1.93 0.89 114.58 128.82 3ci6 h GLU 49 Ca -0.08 -0.00 0.07 0.00 0.07 0.00 0.00 59.36 59.41 3ci6 h GLU 49 Cb 1.00 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.19 3ci6 h GLU 49 CO 0.67 0.00 0.43 -0.09 0.07 0.00 0.00 179.01 180.09 3ci6 h ARG 50 N 0.00 0.76 -0.31 1.06 2.43 -1.95 -1.62 114.38 114.76 3ci6 h ARG 50 Ca 0.15 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3ci6 h ARG 50 Cb 0.23 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3ci6 h ARG 50 CO -0.32 0.50 0.00 0.09 -1.51 0.00 0.00 179.97 178.74 3ci6 n ASN 51 N -4.73 3.34 -3.78 -3.80 3.02 -1.11 -4.99 115.26 103.20 3ci6 n ASN 51 Ca 0.10 -1.99 -0.30 0.00 -0.03 0.00 0.00 54.58 52.37 3ci6 n ASN 51 Cb 0.19 -0.19 0.02 0.00 -0.61 0.00 0.00 39.78 39.19 3ci6 n ASN 51 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ci6 n GLN 52 N 1.45 -2.08 -3.69 3.52 1.13 0.28 -4.97 117.38 113.03 3ci6 n GLN 52 Ca 0.18 0.44 -0.10 0.00 -1.94 0.00 0.00 57.00 55.58 3ci6 n GLN 52 Cb 0.60 -4.26 -0.03 0.00 0.11 0.00 0.00 30.24 26.66 3ci6 n GLN 52 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 3ci6 s ARG 53 N -6.21 1.44 -0.11 -1.09 1.70 -1.04 -4.30 118.95 109.35 3ci6 s ARG 53 Ca 0.30 -0.79 -0.15 0.00 -0.47 0.00 0.00 55.73 54.61 3ci6 s ARG 53 Cb -0.11 0.56 -0.05 0.00 -0.57 0.00 0.00 34.95 34.78 3ci6 s ARG 53 CO 0.87 -0.63 0.36 0.71 -1.08 0.00 0.00 175.30 175.53 3ci6 s TYR 54 N -3.85 3.55 -0.10 5.89 2.02 0.60 -0.23 117.35 125.23 3ci6 s TYR 54 Ca 0.08 0.77 0.02 0.00 -0.37 0.00 0.00 57.07 57.56 3ci6 s TYR 54 Cb -0.02 -2.37 -0.02 0.00 -0.40 0.00 0.00 41.96 39.15 3ci6 s TYR 54 CO -0.03 0.34 -0.15 -1.17 -1.57 0.00 0.00 175.55 172.97 3ci6 s LEU 55 N 0.07 2.63 0.78 -1.29 2.96 0.09 -0.80 118.68 123.12 3ci6 s LEU 55 Ca 0.21 -0.31 -0.11 0.00 -0.22 0.00 0.00 54.13 53.69 3ci6 s LEU 55 Cb -0.14 -1.56 0.06 0.00 0.50 0.00 0.00 46.19 45.05 3ci6 s LEU 55 CO 0.08 0.23 1.11 -0.22 -1.32 0.00 0.00 176.35 176.23 3ci6 s LEU 56 N -0.05 3.06 0.64 -0.68 2.96 -0.25 -1.03 118.68 123.34 3ci6 s LEU 56 Ca -0.03 1.94 -0.18 0.00 -0.22 0.00 0.00 54.13 55.64 3ci6 s LEU 56 Cb -0.14 -4.54 -0.01 0.00 0.50 0.00 0.00 46.19 42.00 3ci6 s LEU 56 CO 0.04 -2.19 1.28 0.00 -1.32 0.00 0.00 176.35 174.15 3ci6 s ALA 58 N -2.74 2.39 -0.25 5.97 0.00 -1.20 -0.26 121.76 125.67 3ci6 s ALA 58 Ca 0.64 1.16 -0.23 0.00 0.00 0.00 0.00 51.96 53.53 3ci6 s ALA 58 Cb -0.19 -3.53 0.07 0.00 0.00 0.00 0.00 23.12 19.46 3ci6 s ALA 58 CO 0.54 -1.55 0.67 0.45 0.00 0.00 0.00 175.76 175.87 3ci6 s SER 59 N -1.46 -0.71 -0.29 0.00 0.15 -1.26 -1.33 113.70 108.80 3ci6 s SER 59 Ca 0.81 1.36 -0.09 0.00 0.70 0.00 0.00 55.95 58.73 3ci6 s SER 59 Cb -0.36 1.38 -0.02 0.00 -1.71 0.00 0.00 66.02 65.31 3ci6 s SER 59 CO 0.39 -0.23 0.14 -0.75 1.20 0.00 0.00 173.24 173.99 3ci6 s LYS 60 N 0.38 3.49 0.00 5.44 2.36 0.35 -4.67 119.74 127.09 3ci6 s LYS 60 Ca -0.00 -0.61 0.00 0.00 -2.55 0.00 0.00 55.97 52.81 3ci6 s LYS 60 Cb -0.05 -3.53 0.00 0.00 -1.05 0.00 0.00 37.83 33.20 3ci6 s LYS 60 CO 0.01 -0.33 0.00 0.41 1.55 0.00 0.00 175.35 176.98 3ci6 n GLY 61 N 4.98 1.67 3.84 5.54 0.00 -1.26 -1.22 105.19 118.75 3ci6 n GLY 61 Ca -0.14 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 3ci6 n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ci6 s LEU 62 N 0.00 2.82 0.12 0.99 1.43 -1.26 -4.96 118.68 117.82 3ci6 s LEU 62 Ca 0.00 1.29 -0.31 0.00 -1.03 0.00 0.00 54.13 54.08 3ci6 s LEU 62 Cb 0.00 -4.03 -0.09 0.00 0.03 0.00 0.00 46.19 42.09 3ci6 s LEU 62 CO 0.00 -1.60 1.60 0.21 0.23 0.00 0.00 176.35 176.79 3ci6 s ASN 63 N -4.07 6.60 0.59 2.29 3.84 -1.26 -4.87 114.94 118.05 3ci6 s ASN 63 Ca 0.59 2.55 0.29 0.00 0.21 0.00 0.00 52.86 56.50 3ci6 s ASN 63 Cb -0.13 -2.58 1.60 0.00 -0.55 0.00 0.00 41.25 39.60 3ci6 s ASN 63 CO 0.53 -0.85 2.05 -0.65 -2.79 0.00 0.00 177.10 175.39 3ci6 h PRO 64 N 7.47 0.00 -0.58 0.43 0.11 -1.94 -0.12 132.00 137.38 3ci6 h PRO 64 Ca -0.43 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.82 3ci6 h PRO 64 Cb 1.20 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 3ci6 h PRO 64 CO 0.92 0.00 0.40 0.93 -0.21 0.00 0.00 178.00 180.04 3ci6 h GLU 65 N 0.00 0.16 0.00 1.05 5.08 -2.02 -2.30 114.58 116.55 3ci6 h GLU 65 Ca 0.12 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 3ci6 h GLU 65 Cb 0.66 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 3ci6 h GLU 65 CO -0.00 0.11 -0.31 0.77 -1.00 0.00 0.00 179.01 178.57 3ci6 h SER 66 N 0.17 0.00 -2.85 1.42 0.02 -1.38 -3.43 113.55 107.50 3ci6 h SER 66 Ca 0.28 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.69 3ci6 h SER 66 Cb 0.87 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.42 3ci6 h SER 66 CO -0.04 0.31 0.87 -0.69 -1.14 0.00 0.00 176.83 176.14 3ci6 s VAL 67 N -3.76 3.33 0.00 2.27 1.01 -0.87 -1.16 120.40 121.23 3ci6 s VAL 67 Ca -0.01 0.82 0.00 0.00 0.00 0.00 0.00 61.98 62.80 3ci6 s VAL 67 Cb 0.11 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.97 3ci6 s VAL 67 CO 0.67 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.39 3ci6 n GLY 68 N 3.73 1.37 0.45 4.51 0.00 0.65 -4.85 105.19 111.06 3ci6 n GLY 68 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 3ci6 n GLY 68 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ci6 n HIS 69 N -2.00 0.00 -2.77 1.61 -0.00 -0.31 -4.96 115.22 106.79 3ci6 n HIS 69 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.30 3ci6 n HIS 69 Cb 0.00 -0.41 -0.03 0.00 -0.00 0.00 0.00 29.99 29.55 3ci6 n HIS 69 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 3ci6 s VAL 70 N -2.21 4.88 0.14 1.59 1.01 -0.80 -4.91 120.40 120.10 3ci6 s VAL 70 Ca -0.15 1.94 0.02 0.00 0.00 0.00 0.00 61.98 63.79 3ci6 s VAL 70 Cb 0.05 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3ci6 s VAL 70 CO 0.21 0.13 -0.04 -0.94 0.00 0.00 0.00 175.10 174.47 3ci6 s SER 71 N 1.00 1.31 0.01 3.32 1.04 -1.26 -1.09 113.70 118.03 3ci6 s SER 71 Ca 0.48 -1.09 0.03 0.00 0.48 0.00 0.00 55.95 55.86 3ci6 s SER 71 Cb -0.20 0.08 -0.01 0.00 0.10 0.00 0.00 66.02 65.99 3ci6 s SER 71 CO 0.24 -0.49 -0.11 -0.76 0.98 0.00 0.00 173.24 173.10 3ci6 s LEU 72 N -3.13 2.07 0.80 2.42 1.43 0.02 -4.97 118.68 117.32 3ci6 s LEU 72 Ca 0.18 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 52.91 3ci6 s LEU 72 Cb 0.05 -0.52 0.07 0.00 0.03 0.00 0.00 46.19 45.82 3ci6 s LEU 72 CO 0.00 0.09 1.09 -1.10 0.23 0.00 0.00 176.35 176.66 3ci6 s GLN 73 N -0.53 2.03 0.47 1.70 -1.52 -1.26 -0.29 119.66 120.27 3ci6 s GLN 73 Ca 0.03 0.96 0.20 0.00 -1.95 0.00 0.00 55.36 54.59 3ci6 s GLN 73 Cb -0.05 -1.89 1.17 0.00 -0.22 0.00 0.00 33.01 32.02 3ci6 s GLN 73 CO 0.00 -1.74 2.01 -0.07 -0.25 0.00 0.00 175.29 175.24 3ci6 h LEU 74 N -1.19 0.00 -3.23 2.90 3.38 -1.93 -1.72 115.31 113.52 3ci6 h LEU 74 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3ci6 h LEU 74 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3ci6 h LEU 74 CO 0.54 0.18 0.00 -1.54 0.09 0.00 0.00 178.44 177.71 3ci6 n SER 75 N -4.01 4.62 -4.58 -0.43 3.41 -1.26 -4.50 113.62 106.88 3ci6 n SER 75 Ca -0.02 -2.61 -0.40 0.00 -0.26 0.00 0.00 58.87 55.57 3ci6 n SER 75 Cb 0.26 -0.56 -0.08 0.00 -0.26 0.00 0.00 64.21 63.57 3ci6 n SER 75 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3ci6 s GLU 76 N -2.14 3.83 2.30 4.33 2.12 -0.65 -4.73 118.70 123.76 3ci6 s GLU 76 Ca 0.47 0.00 0.00 0.00 0.36 0.00 0.00 54.97 55.81 3ci6 s GLU 76 Cb 0.33 -3.73 0.00 0.00 0.26 0.00 0.00 34.13 30.99 3ci6 s GLU 76 CO 0.19 -0.48 0.00 0.41 -0.54 0.00 0.00 175.26 174.84 3ci6 n GLY 77 N 4.67 -0.40 0.29 -1.50 0.00 -1.26 -1.23 105.19 105.76 3ci6 n GLY 77 Ca -0.06 -1.05 -0.03 0.00 0.00 0.00 0.00 46.02 44.88 3ci6 n GLY 77 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ci6 h LEU 78 N 0.00 0.74 -0.36 0.99 3.38 -1.37 -1.15 115.31 117.54 3ci6 h LEU 78 Ca 0.00 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 3ci6 h LEU 78 Cb 0.00 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3ci6 h LEU 78 CO 0.00 0.77 0.15 0.58 0.09 0.00 0.00 178.44 180.03 3ci6 h VAL 79 N 0.75 1.18 -0.82 1.22 2.07 -1.84 -1.37 116.25 117.44 3ci6 h VAL 79 Ca 0.16 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.15 3ci6 h VAL 79 Cb 0.36 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 3ci6 h VAL 79 CO 0.01 0.20 0.54 1.23 0.02 0.00 0.00 177.57 179.57 3ci6 h GLY 80 N 0.44 1.16 1.20 2.17 0.00 -0.94 -2.29 103.07 104.82 3ci6 h GLY 80 Ca 0.12 -0.40 -0.13 0.00 0.00 0.00 0.00 47.33 46.92 3ci6 h GLY 80 CO -0.01 0.34 -0.24 -2.00 0.00 0.00 0.00 176.54 174.62 3ci6 h LEU 81 N 1.00 0.93 -0.55 3.11 5.85 -0.70 0.12 115.31 125.07 3ci6 h LEU 81 Ca 0.33 -0.36 0.02 0.00 0.84 0.00 0.00 57.88 58.72 3ci6 h LEU 81 Cb 0.06 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 3ci6 h LEU 81 CO -0.10 1.12 0.34 0.58 -0.34 0.00 0.00 178.44 180.04 3ci6 h VAL 82 N 0.78 1.07 -0.46 1.05 2.07 -0.93 0.47 116.25 120.30 3ci6 h VAL 82 Ca 0.10 -0.23 -0.13 0.00 0.82 0.00 0.00 66.70 67.26 3ci6 h VAL 82 Cb 0.80 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 3ci6 h VAL 82 CO 0.07 0.12 -0.22 1.23 0.02 0.00 0.00 177.57 178.79 3ci6 h GLY 83 N 0.67 1.02 0.86 2.17 0.00 -1.02 0.38 103.07 107.15 3ci6 h GLY 83 Ca 0.22 -0.90 -0.09 0.00 0.00 0.00 0.00 47.33 46.56 3ci6 h GLY 83 CO -0.09 0.82 -0.24 1.46 0.00 0.00 0.00 176.54 178.49 3ci6 h GLN 84 N 0.82 0.54 0.00 4.80 4.20 -0.41 -3.22 115.11 121.82 3ci6 h GLN 84 Ca 0.11 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 58.52 3ci6 h GLN 84 Cb 0.78 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.58 3ci6 h GLN 84 CO 0.06 0.88 0.00 0.00 -0.67 0.00 0.00 178.83 179.11 3ci6 h ARG 85 N 0.22 0.00 -5.94 1.46 3.08 -0.96 -3.48 114.38 108.77 3ci6 h ARG 85 Ca 0.03 0.00 -0.39 0.00 0.07 0.00 0.00 59.98 59.69 3ci6 h ARG 85 Cb 0.79 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.94 3ci6 h ARG 85 CO 0.06 0.00 -0.77 0.39 -1.07 0.00 0.00 179.97 178.57 3ci6 n GLU 86 N -2.90 -6.09 -3.89 0.04 1.02 0.11 -4.98 120.64 103.95 3ci6 n GLU 86 Ca 0.04 0.73 -0.11 0.00 -0.02 0.00 0.00 57.16 57.80 3ci6 n GLU 86 Cb 0.49 -5.57 -0.12 0.00 -0.02 0.00 0.00 31.44 26.22 3ci6 n GLU 86 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3ci6 s GLU 87 N -5.93 0.19 0.29 3.49 2.02 -1.16 -4.95 118.70 112.65 3ci6 s GLU 87 Ca 0.20 -0.17 -0.30 0.00 0.02 0.00 0.00 54.97 54.72 3ci6 s GLU 87 Cb -0.09 0.08 -0.11 0.00 0.10 0.00 0.00 34.13 34.11 3ci6 s GLU 87 CO 0.77 -0.03 1.48 0.42 0.02 0.00 0.00 175.26 177.92 3ci6 s ILE 88 N -0.56 2.40 -0.30 -1.63 1.01 -1.26 -4.42 121.20 116.44 3ci6 s ILE 88 Ca -0.06 0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.97 3ci6 s ILE 88 Cb -0.04 -3.22 0.08 0.00 0.01 0.00 0.00 42.46 39.29 3ci6 s ILE 88 CO -0.00 0.06 -0.02 -0.69 0.00 0.00 0.00 174.94 174.29 3ci6 s VAL 89 N -0.29 2.14 -0.43 2.92 1.01 -0.36 -5.01 120.40 120.38 3ci6 s VAL 89 Ca 0.58 -1.95 -0.01 0.00 0.00 0.00 0.00 61.98 60.61 3ci6 s VAL 89 Cb -0.44 -2.43 0.12 0.00 0.00 0.00 0.00 36.38 33.63 3ci6 s VAL 89 CO 0.49 -0.33 0.21 0.21 0.00 0.00 0.00 175.10 175.67 3ci6 s ASN 90 N 1.04 5.05 -0.34 3.32 2.47 -1.26 -0.90 114.94 124.32 3ci6 s ASN 90 Ca 0.01 -2.27 -0.09 0.00 0.42 0.00 0.00 52.86 50.93 3ci6 s ASN 90 Cb -0.19 -1.77 0.02 0.00 -1.45 0.00 0.00 41.25 37.86 3ci6 s ASN 90 CO -0.07 -0.45 0.15 -0.76 -3.72 0.00 0.00 177.10 172.24 3ci6 s LEU 91 N 0.77 4.36 0.13 3.21 1.43 0.43 -4.97 118.68 124.04 3ci6 s LEU 91 Ca 0.11 -0.92 -0.17 0.00 -1.03 0.00 0.00 54.13 52.12 3ci6 s LEU 91 Cb -0.22 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 3ci6 s LEU 91 CO -0.05 -0.31 1.68 -0.08 0.23 0.00 0.00 176.35 177.82 3ci6 h GLU 92 N 8.32 0.53 -3.51 1.70 4.81 -1.83 -2.36 114.58 122.24 3ci6 h GLU 92 Ca -0.27 -0.09 -0.62 0.00 -0.13 0.00 0.00 59.36 58.25 3ci6 h GLU 92 Cb 1.11 -0.09 -0.40 0.00 0.63 0.00 0.00 28.75 30.00 3ci6 h GLU 92 CO 0.63 0.51 -0.71 1.21 -0.73 0.00 0.00 179.01 179.92 3ci6 s ASN 93 N -5.79 4.11 0.00 1.04 3.84 -1.26 -1.90 114.94 114.99 3ci6 s ASN 93 Ca -0.13 -2.49 0.28 0.00 0.21 0.00 0.00 52.86 50.72 3ci6 s ASN 93 Cb 0.10 -1.30 1.25 0.00 -0.55 0.00 0.00 41.25 40.75 3ci6 s ASN 93 CO 0.74 -0.30 1.92 0.00 -2.79 0.00 0.00 177.10 176.67 3ci6 n ALA 94 N 3.76 2.31 0.03 1.71 0.00 0.96 -3.44 120.51 125.85 3ci6 n ALA 94 Ca 0.05 -0.11 0.05 0.00 0.00 0.00 0.00 53.44 53.44 3ci6 n ALA 94 Cb 0.36 -1.46 0.47 0.00 0.00 0.00 0.00 19.45 18.82 3ci6 n ALA 94 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3ci6 h SER 95 N 0.00 0.39 0.48 0.00 4.64 -1.87 -0.57 113.55 116.62 3ci6 h SER 95 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3ci6 h SER 95 Cb 0.43 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3ci6 h SER 95 CO 0.00 0.28 0.00 0.29 -0.87 0.00 0.00 176.83 176.53 3ci6 n LYS 96 N -4.48 0.17 -0.11 4.77 5.02 -1.22 -2.42 118.16 119.88 3ci6 n LYS 96 Ca 0.03 0.49 0.08 0.00 -2.02 0.00 0.00 58.31 56.89 3ci6 n LYS 96 Cb 0.10 -1.89 0.11 0.00 -0.02 0.00 0.00 35.03 33.33 3ci6 n LYS 96 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3ci6 n HIS 97 N -2.22 0.00 0.07 2.13 8.25 -0.26 -4.81 115.22 118.37 3ci6 n HIS 97 Ca 0.01 -0.84 -0.07 0.00 -0.26 0.00 0.00 57.72 56.57 3ci6 n HIS 97 Cb 0.16 -0.13 0.09 0.00 1.12 0.00 0.00 29.99 31.23 3ci6 n HIS 97 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 3ci6 h GLU 98 N 0.00 0.31 -0.82 -0.41 4.81 -1.11 -2.88 114.58 114.48 3ci6 h GLU 98 Ca 0.00 -0.22 0.01 0.00 -0.13 0.00 0.00 59.36 59.02 3ci6 h GLU 98 Cb 1.00 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 3ci6 h GLU 98 CO 0.00 0.84 0.54 -0.09 -0.73 0.00 0.00 179.01 179.57 3ci6 h ARG 99 N 0.22 1.06 -0.08 1.92 2.43 -1.87 -2.79 114.38 115.26 3ci6 h ARG 99 Ca -0.01 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.06 3ci6 h ARG 99 Cb 1.17 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 30.45 3ci6 h ARG 99 CO 0.10 0.70 -0.29 1.19 -1.51 0.00 0.00 179.97 180.16 3ci6 n PHE 100 N -4.53 0.26 0.23 2.20 3.72 -1.25 -4.64 117.46 113.45 3ci6 n PHE 100 Ca 0.09 -1.39 0.11 0.00 -0.05 0.00 0.00 57.45 56.20 3ci6 n PHE 100 Cb 0.03 -0.28 0.46 0.00 -0.94 0.00 0.00 39.48 38.75 3ci6 n PHE 100 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ci6 h ALA 101 N 0.84 1.00 -6.80 4.37 0.00 -1.26 -3.43 119.26 113.98 3ci6 h ALA 101 Ca 0.04 -0.18 -0.52 0.00 0.00 0.00 0.00 54.91 54.25 3ci6 h ALA 101 Cb 1.15 -0.03 -0.16 0.00 0.00 0.00 0.00 17.79 18.75 3ci6 h ALA 101 CO 0.09 0.25 -0.83 0.66 0.00 0.00 0.00 179.25 179.42 3ci6 n TYR 102 N -3.34 -1.08 -2.21 0.00 4.01 -1.26 -1.10 117.16 112.18 3ci6 n TYR 102 Ca 0.00 0.47 -0.35 0.00 -0.16 0.00 0.00 57.90 57.86 3ci6 n TYR 102 Cb 0.43 -2.37 0.00 0.00 -0.31 0.00 0.00 39.34 37.10 3ci6 n TYR 102 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3ci6 s LEU 103 N -6.77 3.70 0.00 7.72 1.43 -1.26 -4.29 118.68 119.21 3ci6 s LEU 103 Ca 0.05 2.11 0.00 0.00 -1.03 0.00 0.00 54.13 55.26 3ci6 s LEU 103 Cb -0.03 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.62 3ci6 s LEU 103 CO 0.85 -1.23 0.00 -0.81 0.23 0.00 0.00 176.35 175.39 3ci6 n PRO 104 N -1.45 0.00 0.00 1.29 -0.04 -1.26 -5.12 135.00 128.42 3ci6 n PRO 104 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 3ci6 n PRO 104 Cb 0.51 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.97 3ci6 n PRO 104 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ci6 n GLY 107 N 2.83 0.00 0.20 0.55 0.00 -1.26 -5.18 105.19 102.34 3ci6 n GLY 107 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 3ci6 n GLY 107 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ci6 h GLU 108 N 0.00 0.57 -6.89 1.61 4.39 -2.08 -3.47 114.58 108.71 3ci6 h GLU 108 Ca 0.00 -0.41 -0.56 0.00 0.34 0.00 0.00 59.36 58.73 3ci6 h GLU 108 Cb 0.00 0.07 0.14 0.00 -0.10 0.00 0.00 28.75 28.86 3ci6 h GLU 108 CO 0.00 1.03 0.43 0.39 -1.16 0.00 0.00 179.01 179.70 3ci6 n GLU 109 N -3.92 1.59 -4.82 2.33 -0.58 -1.26 -5.02 120.64 108.96 3ci6 n GLU 109 Ca -0.04 0.58 -0.33 0.00 -0.42 0.00 0.00 57.16 56.95 3ci6 n GLU 109 Cb 0.66 -2.39 -0.14 0.00 -0.57 0.00 0.00 31.44 29.00 3ci6 n GLU 109 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 3ci6 s ILE 110 N -1.30 3.00 -0.25 -3.67 2.07 -1.26 -5.10 121.20 114.68 3ci6 s ILE 110 Ca 0.68 -0.69 -0.01 0.00 -1.41 0.00 0.00 60.65 59.23 3ci6 s ILE 110 Cb -0.46 -2.24 0.04 0.00 0.13 0.00 0.00 42.46 39.92 3ci6 s ILE 110 CO 0.52 0.54 -0.07 -0.31 -1.91 0.00 0.00 174.94 173.71 3ci6 s TYR 111 N 0.19 3.11 -2.29 3.50 2.02 -1.26 -4.49 117.35 118.13 3ci6 s TYR 111 Ca -0.08 -1.76 0.20 0.00 -0.37 0.00 0.00 57.07 55.06 3ci6 s TYR 111 Cb -0.15 -2.03 0.58 0.00 -0.40 0.00 0.00 41.96 39.96 3ci6 s TYR 111 CO 0.05 -0.78 1.46 0.09 -1.57 0.00 0.00 175.55 174.81 3ci6 n ASN 112 N 4.61 2.37 -4.19 2.29 3.02 -0.41 -4.77 115.26 118.18 3ci6 n ASN 112 Ca -0.16 -1.85 -0.24 0.00 -0.03 0.00 0.00 54.58 52.30 3ci6 n ASN 112 Cb 0.46 -0.19 -0.14 0.00 -0.61 0.00 0.00 39.78 39.30 3ci6 n ASN 112 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3ci6 s SER 113 N -1.44 2.13 -0.03 6.41 1.04 -0.97 -0.02 113.70 120.82 3ci6 s SER 113 Ca 0.34 -0.43 -0.01 0.00 0.48 0.00 0.00 55.95 56.33 3ci6 s SER 113 Cb 0.19 -0.19 0.03 0.00 0.10 0.00 0.00 66.02 66.15 3ci6 s SER 113 CO 0.27 0.15 0.05 0.12 0.98 0.00 0.00 173.24 174.81 3ci6 s PHE 114 N -0.66 0.01 -0.26 5.02 2.19 -0.89 -2.94 117.98 120.46 3ci6 s PHE 114 Ca 0.06 0.21 -0.01 0.00 0.33 0.00 0.00 56.93 57.52 3ci6 s PHE 114 Cb -0.08 -0.28 0.08 0.00 -1.31 0.00 0.00 43.02 41.43 3ci6 s PHE 114 CO 0.01 -0.13 0.04 -1.17 1.83 0.00 0.00 175.22 175.80 3ci6 s LEU 115 N 1.38 2.12 -0.10 6.12 2.96 0.00 -0.43 118.68 130.73 3ci6 s LEU 115 Ca -0.05 -1.31 0.00 0.00 -0.22 0.00 0.00 54.13 52.55 3ci6 s LEU 115 Cb -0.13 -0.89 -0.02 0.00 0.50 0.00 0.00 46.19 45.65 3ci6 s LEU 115 CO -0.03 -0.34 -0.10 -0.83 -1.32 0.00 0.00 176.35 173.73 3ci6 s GLY 116 N 1.60 1.61 -0.08 7.98 0.00 -0.08 -0.66 107.32 117.70 3ci6 s GLY 116 Ca 0.03 -0.90 0.01 0.00 0.00 0.00 0.00 44.72 43.86 3ci6 s GLY 116 CO -0.15 -0.43 -0.09 0.14 0.00 0.00 0.00 173.10 172.58 3ci6 s VAL 117 N -0.21 0.97 0.35 1.40 1.01 0.11 -1.23 120.40 122.80 3ci6 s VAL 117 Ca 0.02 -0.33 -0.26 0.00 0.00 0.00 0.00 61.98 61.41 3ci6 s VAL 117 Cb -0.13 -0.94 -0.09 0.00 0.00 0.00 0.00 36.38 35.22 3ci6 s VAL 117 CO 0.03 0.33 1.02 -2.16 0.00 0.00 0.00 175.10 174.32 3ci6 s PRO 118 N 1.10 4.38 0.19 2.72 0.04 -1.26 -0.99 135.00 141.19 3ci6 s PRO 118 Ca -0.07 1.50 0.05 0.00 0.04 0.00 0.00 61.00 62.52 3ci6 s PRO 118 Cb -0.14 -2.74 -0.04 0.00 0.04 0.00 0.00 34.50 31.62 3ci6 s PRO 118 CO -0.01 0.06 0.24 0.08 0.04 0.00 0.00 177.00 177.41 3ci6 s VAL 119 N -1.56 4.90 0.00 -0.36 1.01 -0.13 -4.90 120.40 119.36 3ci6 s VAL 119 Ca 0.53 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.51 3ci6 s VAL 119 Cb -0.23 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.59 3ci6 s VAL 119 CO 0.29 -0.19 0.00 0.00 0.00 0.00 0.00 175.10 175.20 3ci6 n TYR 121 N -0.77 0.00 -3.99 5.22 9.36 -0.07 -2.94 117.16 123.97 3ci6 n TYR 121 Ca -0.08 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 60.87 3ci6 n TYR 121 Cb 0.55 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 39.24 3ci6 n TYR 121 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 3ci6 n ARG 122 N 0.00 -3.38 -0.80 2.98 0.63 -1.26 -0.55 116.66 114.28 3ci6 n ARG 122 Ca 0.00 0.41 0.00 0.00 -0.92 0.00 0.00 57.85 57.34 3ci6 n ARG 122 Cb 0.00 -4.66 0.00 0.00 0.45 0.00 0.00 32.46 28.25 3ci6 n ARG 122 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3ci6 n ARG 123 N -4.41 -0.36 -4.34 -0.14 1.74 -1.26 -5.00 116.66 102.89 3ci6 n ARG 123 Ca -0.24 0.09 -0.35 0.00 -0.77 0.00 0.00 57.85 56.58 3ci6 n ARG 123 Cb 0.65 -3.80 -0.09 0.00 -1.02 0.00 0.00 32.46 28.19 3ci6 n ARG 123 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 3ci6 s LYS 124 N -0.75 3.07 0.85 5.56 2.20 0.29 -5.19 119.74 125.77 3ci6 s LYS 124 Ca 0.00 -0.40 -0.12 0.00 -0.36 0.00 0.00 55.97 55.09 3ci6 s LYS 124 Cb 0.00 -2.83 0.10 0.00 -1.51 0.00 0.00 37.83 33.59 3ci6 s LYS 124 CO 0.00 0.67 1.15 0.08 -0.36 0.00 0.00 175.35 176.89 3ci6 s VAL 125 N -0.78 2.13 0.64 4.02 1.01 -1.26 -0.90 120.40 125.26 3ci6 s VAL 125 Ca 0.12 0.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.03 3ci6 s VAL 125 Cb -0.12 -2.91 0.15 0.00 0.00 0.00 0.00 36.38 33.50 3ci6 s VAL 125 CO 0.02 -0.05 0.87 0.61 0.00 0.00 0.00 175.10 176.55 3ci6 n GLY 127 N -2.72 -1.32 2.77 4.51 0.00 -1.15 -4.83 105.19 102.45 3ci6 n GLY 127 Ca 0.07 -1.70 -0.15 0.00 0.00 0.00 0.00 46.02 44.23 3ci6 n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ci6 s VAL 128 N -2.89 -0.03 -0.11 1.61 1.01 0.31 -0.96 120.40 119.35 3ci6 s VAL 128 Ca 0.49 0.21 -0.15 0.00 0.00 0.00 0.00 61.98 62.54 3ci6 s VAL 128 Cb -0.01 -0.11 -0.05 0.00 0.00 0.00 0.00 36.38 36.21 3ci6 s VAL 128 CO 0.35 0.10 0.35 -0.22 0.00 0.00 0.00 175.10 175.68 3ci6 s LEU 129 N 1.09 4.32 -0.09 3.92 2.96 -0.16 -1.27 118.68 129.45 3ci6 s LEU 129 Ca -0.09 0.69 0.03 0.00 -0.22 0.00 0.00 54.13 54.54 3ci6 s LEU 129 Cb -0.13 -2.48 0.01 0.00 0.50 0.00 0.00 46.19 44.09 3ci6 s LEU 129 CO -0.03 0.16 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.28 3ci6 s VAL 130 N 0.00 1.68 -0.15 1.68 1.01 0.26 -0.72 120.40 124.17 3ci6 s VAL 130 Ca 0.20 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 3ci6 s VAL 130 Cb -0.14 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.74 3ci6 s VAL 130 CO 0.08 0.48 -0.10 -0.69 0.00 0.00 0.00 175.10 174.86 3ci6 s VAL 131 N 0.60 3.24 0.06 2.92 1.01 0.16 -0.69 120.40 127.71 3ci6 s VAL 131 Ca -0.14 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.30 3ci6 s VAL 131 Cb -0.17 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 3ci6 s VAL 131 CO 0.04 0.50 -0.13 -1.10 0.00 0.00 0.00 175.10 174.42 3ci6 s GLN 132 N 0.58 0.76 0.04 2.72 -0.21 -0.36 -0.82 119.66 122.38 3ci6 s GLN 132 Ca -0.06 -0.91 0.01 0.00 0.02 0.00 0.00 55.36 54.42 3ci6 s GLN 132 Cb -0.15 -0.72 -0.03 0.00 1.00 0.00 0.00 33.01 33.11 3ci6 s GLN 132 CO 0.03 0.16 -0.05 -0.80 -2.12 0.00 0.00 175.29 172.51 3ci6 s ASN 133 N -1.69 0.55 0.11 5.90 0.01 -1.15 -1.62 114.94 117.06 3ci6 s ASN 133 Ca -0.04 -0.64 -0.20 0.00 -0.71 0.00 0.00 52.86 51.27 3ci6 s ASN 133 Cb -0.10 0.10 -0.09 0.00 0.41 0.00 0.00 41.25 41.57 3ci6 s ASN 133 CO 0.02 -0.33 1.75 0.11 -1.51 0.00 0.00 177.10 177.14 3ci6 h LYS 134 N 4.22 0.22 -6.60 -0.60 1.57 -1.90 -1.35 116.57 112.13 3ci6 h LYS 134 Ca -0.34 -0.02 -0.48 0.00 -1.87 0.00 0.00 60.65 57.94 3ci6 h LYS 134 Cb 1.19 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 33.47 3ci6 h LYS 134 CO 0.47 0.16 -0.12 -0.65 -0.57 0.00 0.00 179.45 178.74 3ci6 s GLN 135 N -6.11 3.51 0.39 3.15 -0.21 -1.26 -1.29 119.66 117.85 3ci6 s GLN 135 Ca -0.13 -0.19 -0.27 0.00 0.02 0.00 0.00 55.36 54.79 3ci6 s GLN 135 Cb 0.08 -2.60 -0.11 0.00 1.00 0.00 0.00 33.01 31.38 3ci6 s GLN 135 CO 0.69 0.08 1.36 -2.30 -2.12 0.00 0.00 175.29 173.00 3ci6 n PRO 136 N -1.80 2.23 -3.79 2.91 -0.02 -1.26 -3.69 135.00 129.59 3ci6 n PRO 136 Ca -0.03 0.79 -0.13 0.00 -2.02 0.00 0.00 63.50 62.10 3ci6 n PRO 136 Cb 0.56 -2.48 -0.13 0.00 -0.02 0.00 0.00 33.50 31.42 3ci6 n PRO 136 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3ci6 s GLN 137 N -2.13 0.16 -0.44 -0.52 -1.52 -0.80 -4.94 119.66 109.47 3ci6 s GLN 137 Ca 0.57 0.30 -0.16 0.00 -1.95 0.00 0.00 55.36 54.13 3ci6 s GLN 137 Cb -0.51 -0.01 0.04 0.00 -0.22 0.00 0.00 33.01 32.31 3ci6 s GLN 137 CO 0.61 -0.08 0.38 0.34 -0.25 0.00 0.00 175.29 176.28 3ci6 s ASP 138 N 0.54 6.15 -0.16 5.90 -1.08 -1.26 -4.19 116.67 122.56 3ci6 s ASP 138 Ca -0.04 -0.97 -0.10 0.00 -0.52 0.00 0.00 52.55 50.92 3ci6 s ASP 138 Cb -0.05 -2.19 -0.05 0.00 -1.46 0.00 0.00 42.92 39.17 3ci6 s ASP 138 CO -0.03 -0.56 0.17 -0.36 0.52 0.00 0.00 175.17 174.92 3ci6 s PHE 139 N 1.83 3.48 0.90 -5.34 0.08 -1.26 -5.09 117.98 112.58 3ci6 s PHE 139 Ca 0.07 0.46 -0.12 0.00 0.12 0.00 0.00 56.93 57.46 3ci6 s PHE 139 Cb -0.20 -2.14 0.18 0.00 -0.57 0.00 0.00 43.02 40.29 3ci6 s PHE 139 CO 0.10 0.42 1.24 -1.54 -0.10 0.00 0.00 175.22 175.34 3ci6 s SER 140 N -0.05 3.42 0.45 1.36 1.04 -1.26 -4.89 113.70 113.76 3ci6 s SER 140 Ca 0.12 0.09 0.13 0.00 0.48 0.00 0.00 55.95 56.76 3ci6 s SER 140 Cb -0.12 -0.21 1.00 0.00 0.10 0.00 0.00 66.02 66.80 3ci6 s SER 140 CO 0.01 -2.52 2.02 -0.33 0.98 0.00 0.00 173.24 173.41 3ci6 h GLU 141 N -1.36 0.13 -0.49 4.02 4.39 -1.99 -2.18 114.58 117.10 3ci6 h GLU 141 Ca -0.42 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.26 3ci6 h GLU 141 Cb 1.24 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 3ci6 h GLU 141 CO 0.38 0.20 0.31 0.00 -1.16 0.00 0.00 179.01 178.75 3ci6 h ALA 142 N 1.81 0.62 -0.51 3.43 0.00 -1.99 0.13 119.26 122.75 3ci6 h ALA 142 Ca 0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3ci6 h ALA 142 Cb 0.20 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3ci6 h ALA 142 CO 0.01 0.09 0.20 0.00 0.00 0.00 0.00 179.25 179.55 3ci6 h ALA 143 N 1.16 0.66 -0.42 0.00 0.00 -1.78 -0.39 119.26 118.50 3ci6 h ALA 143 Ca 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3ci6 h ALA 143 Cb -0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3ci6 h ALA 143 CO -0.04 0.27 0.27 0.93 0.00 0.00 0.00 179.25 180.69 3ci6 h GLU 144 N 0.69 0.56 -0.65 0.00 5.08 -1.08 -1.35 114.58 117.82 3ci6 h GLU 144 Ca 0.17 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 3ci6 h GLU 144 Cb 0.20 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3ci6 h GLU 144 CO -0.01 0.39 0.36 0.77 -1.00 0.00 0.00 179.01 179.51 3ci6 h SER 145 N 0.56 0.82 -0.07 1.42 0.02 -0.74 0.12 113.55 115.68 3ci6 h SER 145 Ca 0.15 -0.09 0.03 0.00 -0.84 0.00 0.00 61.79 61.04 3ci6 h SER 145 Cb -0.04 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.25 3ci6 h SER 145 CO -0.03 0.67 -0.13 0.15 -1.14 0.00 0.00 176.83 176.35 3ci6 h PHE 146 N 0.89 -0.34 -0.41 3.45 3.57 -0.86 -1.93 116.94 121.32 3ci6 h PHE 146 Ca 0.23 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.64 3ci6 h PHE 146 Cb 0.04 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 3ci6 h PHE 146 CO -0.01 -0.20 -0.18 -0.07 -2.23 0.00 0.00 178.31 175.63 3ci6 h LEU 147 N -0.19 0.86 -0.69 0.59 3.38 -0.92 -2.06 115.31 116.29 3ci6 h LEU 147 Ca 0.07 -0.40 0.08 0.00 0.09 0.00 0.00 57.88 57.73 3ci6 h LEU 147 Cb 0.29 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.73 3ci6 h LEU 147 CO -0.18 1.07 0.36 0.58 0.09 0.00 0.00 178.44 180.35 3ci6 h VAL 148 N 0.66 0.88 -0.32 1.22 2.07 -0.65 0.75 116.25 120.87 3ci6 h VAL 148 Ca 0.09 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 3ci6 h VAL 148 Cb 0.73 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 3ci6 h VAL 148 CO 0.06 0.11 0.01 0.74 0.02 0.00 0.00 177.57 178.51 3ci6 h THR 149 N 0.62 1.25 -0.78 2.57 2.02 -1.14 -0.65 112.91 116.81 3ci6 h THR 149 Ca 0.33 -0.94 -0.04 0.00 0.77 0.00 0.00 66.41 66.53 3ci6 h THR 149 Cb 0.31 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 3ci6 h THR 149 CO -0.24 0.31 0.32 -0.07 0.37 0.00 0.00 175.52 176.21 3ci6 h LEU 150 N 0.36 1.06 -1.14 2.58 3.38 -1.20 -1.93 115.31 118.42 3ci6 h LEU 150 Ca 0.09 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3ci6 h LEU 150 Cb 0.43 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3ci6 h LEU 150 CO 0.02 0.94 0.10 0.00 0.09 0.00 0.00 178.44 179.58 3ci6 h ALA 152 N 1.43 1.17 -0.28 0.00 0.00 -0.61 0.17 119.26 121.14 3ci6 h ALA 152 Ca 0.15 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 3ci6 h ALA 152 Cb 0.27 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3ci6 h ALA 152 CO -0.00 0.53 -0.01 0.37 0.00 0.00 0.00 179.25 180.13 3ci6 h GLN 153 N 0.38 0.50 -0.14 0.00 4.15 -0.81 -2.92 115.11 116.28 3ci6 h GLN 153 Ca 0.06 -0.17 -0.03 0.00 0.77 0.00 0.00 58.65 59.28 3ci6 h GLN 153 Cb 0.63 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.26 3ci6 h GLN 153 CO 0.04 0.67 -0.07 1.25 -1.93 0.00 0.00 178.83 178.80 3ci6 h LEU 154 N 0.28 0.19 -0.96 -2.39 5.85 -0.61 -3.05 115.31 114.63 3ci6 h LEU 154 Ca 0.08 -0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.81 3ci6 h LEU 154 Cb 0.45 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 3ci6 h LEU 154 CO 0.02 0.29 0.62 0.77 -0.34 0.00 0.00 178.44 179.80 3ci6 h SER 155 N 0.20 1.03 0.61 1.25 4.64 -0.47 0.11 113.55 120.92 3ci6 h SER 155 Ca 0.04 -0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 61.14 3ci6 h SER 155 Cb 0.26 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 3ci6 h SER 155 CO 0.01 0.70 -0.96 1.23 -0.87 0.00 0.00 176.83 176.94 3ci6 h GLY 156 N 1.20 0.24 0.85 -0.77 0.00 -1.63 -0.31 103.07 102.65 3ci6 h GLY 156 Ca 0.38 -0.46 0.03 0.00 0.00 0.00 0.00 47.33 47.28 3ci6 h GLY 156 CO -0.13 0.41 0.30 -2.08 0.00 0.00 0.00 176.54 175.05 3ci6 h VAL 157 N 0.10 1.04 -0.05 4.60 2.07 -1.39 0.19 116.25 122.80 3ci6 h VAL 157 Ca -0.06 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 3ci6 h VAL 157 Cb 1.63 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.78 3ci6 h VAL 157 CO 0.15 0.11 -0.00 0.40 0.02 0.00 0.00 177.57 178.25 3ci6 h ILE 158 N 0.60 1.27 -0.71 4.57 2.04 -0.92 -1.29 117.51 123.06 3ci6 h ILE 158 Ca 0.21 -0.82 0.09 0.00 1.00 0.00 0.00 64.86 65.35 3ci6 h ILE 158 Cb 0.04 1.72 -0.07 0.00 -0.74 0.00 0.00 36.82 37.77 3ci6 h ILE 158 CO -0.10 0.22 0.36 0.00 0.00 0.00 0.00 178.15 178.63 3ci6 h ALA 159 N 0.69 0.98 -0.63 1.87 0.00 -0.94 -0.84 119.26 120.39 3ci6 h ALA 159 Ca 0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3ci6 h ALA 159 Cb 0.36 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3ci6 h ALA 159 CO 0.00 -0.03 0.36 1.25 0.00 0.00 0.00 179.25 180.83 3ci6 h HIS 160 N 0.62 0.85 -0.68 0.00 -0.00 -0.87 -1.15 115.15 113.91 3ci6 h HIS 160 Ca 0.35 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.71 3ci6 h HIS 160 Cb 0.35 -0.27 -0.03 0.00 -0.00 0.00 0.00 27.41 27.46 3ci6 h HIS 160 CO -0.10 0.59 0.45 0.00 -0.00 0.00 0.00 177.93 178.87 3ci6 h ALA 161 N 1.18 0.86 -0.37 5.26 0.00 -0.33 -0.86 119.26 125.00 3ci6 h ALA 161 Ca 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3ci6 h ALA 161 Cb 0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3ci6 h ALA 161 CO -0.04 0.29 0.23 0.45 0.00 0.00 0.00 179.25 180.18 3ci6 h HIS 162 N 0.93 0.47 0.00 0.00 3.86 -0.85 -1.25 115.15 118.30 3ci6 h HIS 162 Ca 0.25 0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.42 3ci6 h HIS 162 Cb -0.11 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.20 3ci6 h HIS 162 CO -0.03 0.32 -0.23 0.00 0.86 0.00 0.00 177.93 178.85 3ci6 h ALA 163 N 1.11 1.10 -0.27 2.45 0.00 -0.04 -2.87 119.26 120.74 3ci6 h ALA 163 Ca 0.13 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3ci6 h ALA 163 Cb -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3ci6 h ALA 163 CO -0.03 0.28 0.00 1.33 0.00 0.00 0.00 179.25 180.84 3ci6 n VAL 164 N -3.51 0.69 -0.60 0.00 0.24 -0.44 -5.01 118.33 109.70 3ci6 n VAL 164 Ca -0.01 -0.85 0.00 0.00 -2.04 0.00 0.00 64.34 61.45 3ci6 n VAL 164 Cb 0.39 0.73 0.00 0.00 -1.47 0.00 0.00 33.84 33.49 3ci6 n VAL 164 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ci6 n GLY 165 N 0.65 1.08 3.68 7.63 0.00 -0.48 -5.01 105.19 112.74 3ci6 n GLY 165 Ca 0.11 -1.72 -0.37 0.00 0.00 0.00 0.00 46.02 44.04 3ci6 n GLY 165 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ci6 n ASN 166 N 0.00 1.51 -4.49 1.61 3.02 -1.26 -4.87 115.26 110.77 3ci6 n ASN 166 Ca 0.00 0.81 -0.43 0.00 -0.03 0.00 0.00 54.58 54.92 3ci6 n ASN 166 Cb 0.00 -1.49 -0.01 0.00 -0.61 0.00 0.00 39.78 37.67 3ci6 n ASN 166 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3ci6 s ILE 167 N -1.46 4.62 0.00 2.41 1.01 -1.26 -4.99 121.20 121.53 3ci6 s ILE 167 Ca 0.80 -1.85 0.00 0.00 0.00 0.00 0.00 60.65 59.60 3ci6 s ILE 167 Cb -0.39 -4.93 0.00 0.00 0.01 0.00 0.00 42.46 37.15 3ci6 s ILE 167 CO 0.43 -1.69 0.38 -0.90 0.00 0.00 0.00 174.94 173.16