#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cyp n PRO 3 N 0.00 1.93 -2.70 0.00 -0.02 -1.26 -4.95 135.00 128.00 2cyp n PRO 3 Ca 0.00 0.69 -0.31 0.00 -2.02 0.00 0.00 63.50 61.85 2cyp n PRO 3 Cb 0.00 -2.38 -0.04 0.00 -0.02 0.00 0.00 33.50 31.06 2cyp n PRO 3 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2cyp s LEU 4 N -1.70 3.78 -0.14 2.45 1.02 -1.21 -5.03 118.68 117.86 2cyp s LEU 4 Ca 0.61 1.38 -0.02 0.00 0.02 0.00 0.00 54.13 56.12 2cyp s LEU 4 Cb -0.51 -4.27 -0.02 0.00 0.02 0.00 0.00 46.19 41.41 2cyp s LEU 4 CO 0.58 -0.45 -0.09 -0.69 0.02 0.00 0.00 176.35 175.72 2cyp s VAL 5 N -2.42 3.46 -0.40 -1.59 1.01 -1.26 -4.80 120.40 114.40 2cyp s VAL 5 Ca 0.56 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 62.05 2cyp s VAL 5 Cb -0.10 -2.48 0.11 0.00 0.00 0.00 0.00 36.38 33.91 2cyp s VAL 5 CO 0.28 0.51 0.14 -1.00 0.00 0.00 0.00 175.10 175.03 2cyp s HIS 6 N 0.31 3.23 -0.17 5.22 3.76 -1.26 -5.06 115.29 121.31 2cyp s HIS 6 Ca -0.07 -2.89 -0.18 0.00 -0.15 0.00 0.00 55.06 51.76 2cyp s HIS 6 Cb -0.15 -2.69 -0.03 0.00 1.11 0.00 0.00 32.58 30.81 2cyp s HIS 6 CO 0.04 -0.86 0.51 0.54 -0.85 0.00 0.00 174.74 174.12 2cyp s VAL 7 N 0.53 5.13 0.34 -0.90 0.11 -1.26 0.76 120.40 125.10 2cyp s VAL 7 Ca 0.13 0.96 -0.28 0.00 -2.93 0.00 0.00 61.98 59.87 2cyp s VAL 7 Cb -0.22 -3.84 -0.09 0.00 -1.53 0.00 0.00 36.38 30.70 2cyp s VAL 7 CO -0.06 0.22 1.19 0.00 -3.33 0.00 0.00 175.10 173.12 2cyp s ALA 8 N 1.32 3.36 -0.05 1.54 0.00 -0.34 -4.82 121.76 122.77 2cyp s ALA 8 Ca 0.25 1.04 -0.01 0.00 0.00 0.00 0.00 51.96 53.24 2cyp s ALA 8 Cb -0.15 -3.39 0.03 0.00 0.00 0.00 0.00 23.12 19.60 2cyp s ALA 8 CO 0.10 -0.44 0.03 -1.54 0.00 0.00 0.00 175.76 173.91 2cyp s SER 9 N -0.83 1.10 0.14 0.00 1.04 0.49 -4.82 113.70 110.82 2cyp s SER 9 Ca 0.50 0.01 -0.32 0.00 0.48 0.00 0.00 55.95 56.62 2cyp s SER 9 Cb -0.34 -0.25 -0.11 0.00 0.10 0.00 0.00 66.02 65.42 2cyp s SER 9 CO 0.44 -0.20 1.81 0.52 0.98 0.00 0.00 173.24 176.79 2cyp n VAL 10 N 4.98 0.28 -1.59 5.02 0.31 -1.26 -4.38 118.33 121.68 2cyp n VAL 10 Ca -0.10 -0.05 -0.50 0.00 -0.01 0.00 0.00 64.34 63.68 2cyp n VAL 10 Cb 0.50 -2.07 -0.05 0.00 -0.91 0.00 0.00 33.84 31.31 2cyp n VAL 10 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2cyp n GLU 11 N 5.23 1.26 -1.55 5.55 4.71 -1.26 -4.63 120.64 129.96 2cyp n GLU 11 Ca 0.18 0.45 -0.56 0.00 -0.01 0.00 0.00 57.16 57.22 2cyp n GLU 11 Cb 0.36 -2.05 -0.08 0.00 -1.01 0.00 0.00 31.44 28.66 2cyp n GLU 11 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 2cyp n LYS 12 N 2.28 0.94 -1.25 3.49 4.81 -1.26 -1.21 118.16 125.96 2cyp n LYS 12 Ca 0.17 0.31 -0.09 0.00 -0.87 0.00 0.00 58.31 57.83 2cyp n LYS 12 Cb 0.22 -2.14 -0.04 0.00 0.02 0.00 0.00 35.03 33.10 2cyp n LYS 12 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2cyp n GLY 13 N 5.57 0.92 3.80 3.14 0.00 -1.26 -5.00 105.19 112.36 2cyp n GLY 13 Ca 0.36 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.88 2cyp n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cyp s ARG 14 N -2.52 4.41 0.00 1.61 1.81 -0.35 -5.08 118.95 118.84 2cyp s ARG 14 Ca 0.00 1.07 0.00 0.00 -1.72 0.00 0.00 55.73 55.08 2cyp s ARG 14 Cb 0.00 -2.88 0.00 0.00 -0.45 0.00 0.00 34.95 31.62 2cyp s ARG 14 CO 0.00 0.36 0.00 -1.13 -0.68 0.00 0.00 175.30 173.85 2cyp n SER 15 N 0.72 0.56 -0.20 0.23 3.41 -1.26 -4.88 113.62 112.20 2cyp n SER 15 Ca -0.01 -0.74 -0.00 0.00 -0.26 0.00 0.00 58.87 57.85 2cyp n SER 15 Cb 0.50 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.53 2cyp n SER 15 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2cyp h TYR 16 N 0.74 -0.20 -0.68 7.33 5.03 -2.00 -2.00 116.97 125.20 2cyp h TYR 16 Ca 0.00 0.05 0.06 0.00 2.58 0.00 0.00 58.73 61.42 2cyp h TYR 16 Cb 0.00 0.18 -0.04 0.00 1.55 0.00 0.00 36.73 38.42 2cyp h TYR 16 CO 0.00 -0.22 0.45 0.93 -1.32 0.00 0.00 178.16 178.00 2cyp h GLU 17 N 0.05 0.67 -0.31 1.82 5.08 -1.98 -1.09 114.58 118.80 2cyp h GLU 17 Ca 0.30 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.52 2cyp h GLU 17 Cb 0.48 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2cyp h GLU 17 CO -0.58 0.44 -0.20 -0.44 -1.00 0.00 0.00 179.01 177.23 2cyp h ASP 18 N 0.69 0.72 -0.35 1.42 5.19 -1.77 -2.46 116.42 119.86 2cyp h ASP 18 Ca 0.29 -0.43 -0.12 0.00 -0.62 0.00 0.00 57.03 56.15 2cyp h ASP 18 Cb 0.27 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.57 2cyp h ASP 18 CO -0.09 1.00 -0.25 -0.26 -3.12 0.00 0.00 179.24 176.51 2cyp h PHE 19 N 0.45 0.92 -0.83 4.55 -1.00 -1.06 -2.66 116.94 117.31 2cyp h PHE 19 Ca 0.06 -0.25 0.15 0.00 2.81 0.00 0.00 57.97 60.74 2cyp h PHE 19 Cb 0.75 -0.20 -0.10 0.00 3.61 0.00 0.00 35.95 40.01 2cyp h PHE 19 CO 0.06 1.01 0.40 0.37 -1.61 0.00 0.00 178.31 178.54 2cyp h GLN 20 N 0.56 0.54 -0.66 1.51 5.75 -1.24 0.62 115.11 122.19 2cyp h GLN 20 Ca 0.07 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.49 2cyp h GLN 20 Cb 0.81 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 29.21 2cyp h GLN 20 CO 0.07 0.36 0.25 0.87 -2.65 0.00 0.00 178.83 177.73 2cyp h LYS 21 N 0.56 0.99 -0.31 1.69 1.57 -1.10 -1.51 116.57 118.46 2cyp h LYS 21 Ca 0.46 -0.19 -0.04 0.00 -1.87 0.00 0.00 60.65 59.01 2cyp h LYS 21 Cb 0.68 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 2cyp h LYS 21 CO -0.39 0.84 0.04 0.28 -0.57 0.00 0.00 179.45 179.65 2cyp h VAL 22 N 0.94 1.24 -0.59 0.50 2.07 -1.07 -1.20 116.25 118.14 2cyp h VAL 22 Ca 0.22 -0.85 0.05 0.00 0.82 0.00 0.00 66.70 66.94 2cyp h VAL 22 Cb 0.22 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 31.13 2cyp h VAL 22 CO -0.02 0.28 0.31 0.22 0.02 0.00 0.00 177.57 178.38 2cyp h TYR 23 N 0.35 0.57 -0.71 1.57 3.20 -0.87 -1.85 116.97 119.23 2cyp h TYR 23 Ca 0.09 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 2cyp h TYR 23 Cb 0.37 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 2cyp h TYR 23 CO 0.03 0.27 0.33 -0.91 -1.64 0.00 0.00 178.16 176.24 2cyp h ASN 24 N 0.59 0.91 -0.06 -2.11 -0.26 -1.11 0.32 115.58 113.86 2cyp h ASN 24 Ca 0.27 -0.10 -0.01 0.00 -0.56 0.00 0.00 56.30 55.89 2cyp h ASN 24 Cb 0.17 -0.23 -0.00 0.00 -1.06 0.00 0.00 38.32 37.20 2cyp h ASN 24 CO -0.18 0.77 -0.01 0.00 -1.06 0.00 0.00 177.43 176.95 2cyp h ALA 25 N 1.37 0.08 -0.26 -0.83 0.00 -0.64 0.67 119.26 119.65 2cyp h ALA 25 Ca 0.24 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2cyp h ALA 25 Cb 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2cyp h ALA 25 CO -0.03 -0.21 0.15 0.82 0.00 0.00 0.00 179.25 179.98 2cyp h ILE 26 N -0.23 1.04 -0.28 0.00 2.04 -0.95 -1.71 117.51 117.42 2cyp h ILE 26 Ca 0.02 -0.11 0.06 0.00 1.00 0.00 0.00 64.86 65.83 2cyp h ILE 26 Cb 0.40 0.69 -0.07 0.00 -0.74 0.00 0.00 36.82 37.10 2cyp h ILE 26 CO 0.01 0.06 -0.17 0.00 0.00 0.00 0.00 178.15 178.04 2cyp h ALA 27 N 1.11 0.03 -0.48 1.87 0.00 -0.86 0.43 119.26 121.35 2cyp h ALA 27 Ca 0.10 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 2cyp h ALA 27 Cb -0.01 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2cyp h ALA 27 CO -0.04 -0.57 0.01 -0.07 0.00 0.00 0.00 179.25 178.58 2cyp h LEU 28 N -0.14 0.76 -0.82 0.00 3.38 -0.83 -2.39 115.31 115.26 2cyp h LEU 28 Ca 0.15 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 2cyp h LEU 28 Cb 0.37 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2cyp h LEU 28 CO -0.37 0.82 -0.44 0.50 0.09 0.00 0.00 178.44 179.04 2cyp h LYS 29 N 0.74 0.33 -0.42 1.13 3.64 -0.33 -2.46 116.57 119.20 2cyp h LYS 29 Ca 0.15 -0.17 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2cyp h LYS 29 Cb 0.43 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 2cyp h LYS 29 CO 0.02 0.71 0.27 -0.07 -2.27 0.00 0.00 179.45 178.10 2cyp h LEU 30 N 0.27 0.45 -0.86 5.20 3.38 -0.59 0.10 115.31 123.26 2cyp h LEU 30 Ca 0.02 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2cyp h LEU 30 Cb 0.88 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 2cyp h LEU 30 CO 0.07 0.32 0.39 0.03 0.09 0.00 0.00 178.44 179.34 2cyp h ARG 31 N 0.54 1.21 0.18 1.13 3.08 -1.18 -3.34 114.38 116.00 2cyp h ARG 31 Ca 0.16 -0.19 -0.25 0.00 0.07 0.00 0.00 59.98 59.77 2cyp h ARG 31 Cb -0.03 -0.21 0.02 0.00 0.08 0.00 0.00 29.97 29.83 2cyp h ARG 31 CO -0.05 0.94 -1.13 0.93 -1.07 0.00 0.00 179.97 179.59 2cyp h GLU 32 N 1.20 0.38 -2.72 0.04 4.39 -1.04 -3.37 114.58 113.45 2cyp h GLU 32 Ca 0.29 -0.64 -0.75 0.00 0.34 0.00 0.00 59.36 58.59 2cyp h GLU 32 Cb 0.14 0.24 -0.15 0.00 -0.10 0.00 0.00 28.75 28.88 2cyp h GLU 32 CO -0.03 1.31 2.17 -0.25 -1.16 0.00 0.00 179.01 181.05 2cyp n ASP 33 N -3.95 7.49 -0.88 1.42 10.43 -0.01 -4.73 116.55 126.32 2cyp n ASP 33 Ca -0.16 -3.20 0.12 0.00 2.57 0.00 0.00 54.79 54.11 2cyp n ASP 33 Cb 0.93 -1.36 0.27 0.00 1.84 0.00 0.00 41.12 42.81 2cyp n ASP 33 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 2cyp n ASP 34 N 1.85 2.65 0.02 -2.24 5.75 -1.26 -4.16 116.55 119.17 2cyp n ASP 34 Ca 0.56 -1.86 0.12 0.00 -0.01 0.00 0.00 54.79 53.60 2cyp n ASP 34 Cb 0.27 -0.13 0.22 0.00 -1.03 0.00 0.00 41.12 40.45 2cyp n ASP 34 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2cyp n GLU 35 N 0.99 0.12 -1.76 0.11 1.02 -1.26 -3.92 120.64 115.94 2cyp n GLU 35 Ca 0.17 0.03 -0.40 0.00 -0.02 0.00 0.00 57.16 56.95 2cyp n GLU 35 Cb 0.50 -1.57 0.02 0.00 -0.02 0.00 0.00 31.44 30.37 2cyp n GLU 35 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2cyp n TYR 36 N -1.74 2.62 -3.71 -0.32 4.19 -1.26 -2.19 117.16 114.75 2cyp n TYR 36 Ca 0.05 0.44 -0.25 0.00 3.31 0.00 0.00 57.90 61.45 2cyp n TYR 36 Cb 0.38 -2.44 0.03 0.00 0.49 0.00 0.00 39.34 37.79 2cyp n TYR 36 CO 0.00 0.00 0.00 -3.47 0.91 0.00 0.00 176.86 174.30 2cyp n ASP 37 N -0.28 -2.77 -3.69 2.98 -0.08 -1.26 -1.09 116.55 110.36 2cyp n ASP 37 Ca 0.06 -0.91 -0.23 0.00 -1.51 0.00 0.00 54.79 52.19 2cyp n ASP 37 Cb 0.42 -3.74 0.05 0.00 2.34 0.00 0.00 41.12 40.18 2cyp n ASP 37 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2cyp n ASN 38 N -2.94 -3.25 -0.36 1.67 3.02 -1.19 -1.59 115.26 110.63 2cyp n ASN 38 Ca -0.22 -0.72 -0.05 0.00 -0.03 0.00 0.00 54.58 53.56 2cyp n ASN 38 Cb 0.65 -4.38 -0.02 0.00 -0.61 0.00 0.00 39.78 35.42 2cyp n ASN 38 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2cyp n TYR 39 N -4.49 0.00 -0.06 3.10 4.02 -0.93 -4.90 117.16 113.89 2cyp n TYR 39 Ca -0.15 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.60 2cyp n TYR 39 Cb 0.61 -1.21 -0.07 0.00 -0.02 0.00 0.00 39.34 38.66 2cyp n TYR 39 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 2cyp h ILE 40 N 0.00 1.35 0.00 -0.72 2.04 -0.65 -3.47 117.51 116.06 2cyp h ILE 40 Ca -0.10 -1.46 0.00 0.00 1.00 0.00 0.00 64.86 64.31 2cyp h ILE 40 Cb 0.40 1.90 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 2cyp h ILE 40 CO 0.14 0.44 0.00 0.61 0.00 0.00 0.00 178.15 179.34 2cyp n GLY 41 N 0.31 -0.22 0.27 5.37 0.00 -0.25 -4.67 105.19 106.01 2cyp n GLY 41 Ca -0.06 -1.87 0.14 0.00 0.00 0.00 0.00 46.02 44.23 2cyp n GLY 41 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2cyp n TYR 42 N -0.30 0.00 -0.01 1.61 4.02 -1.26 -4.44 117.16 116.78 2cyp n TYR 42 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.77 2cyp n TYR 42 Cb 0.00 -0.07 -0.08 0.00 -0.02 0.00 0.00 39.34 39.17 2cyp n TYR 42 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2cyp h GLY 43 N 4.92 -1.19 0.81 2.72 0.00 -1.93 -2.20 103.07 106.20 2cyp h GLY 43 Ca 0.00 0.69 0.02 0.00 0.00 0.00 0.00 47.33 48.04 2cyp h GLY 43 CO 0.00 -0.28 0.01 -2.55 0.00 0.00 0.00 176.54 173.73 2cyp h PRO 44 N -0.46 0.06 -0.35 4.80 0.11 -1.88 -1.69 132.00 132.60 2cyp h PRO 44 Ca 0.03 -0.00 0.09 0.00 0.11 0.00 0.00 66.00 66.22 2cyp h PRO 44 Cb 0.54 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.62 2cyp h PRO 44 CO -0.35 0.04 0.25 -0.24 -0.21 0.00 0.00 178.00 177.48 2cyp h VAL 45 N 0.06 0.85 -0.11 3.15 3.04 -1.83 -0.88 116.25 120.54 2cyp h VAL 45 Ca 0.06 -0.02 -0.16 0.00 -1.01 0.00 0.00 66.70 65.57 2cyp h VAL 45 Cb 0.07 0.79 0.01 0.00 -2.01 0.00 0.00 31.29 30.15 2cyp h VAL 45 CO -0.10 0.01 -0.57 -0.07 -1.01 0.00 0.00 177.57 175.83 2cyp h LEU 46 N 0.06 0.69 -0.33 3.16 3.38 -0.74 0.11 115.31 121.64 2cyp h LEU 46 Ca 0.16 -0.65 0.05 0.00 0.09 0.00 0.00 57.88 57.53 2cyp h LEU 46 Cb 0.58 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 2cyp h LEU 46 CO -0.01 1.22 0.06 0.58 0.09 0.00 0.00 178.44 180.38 2cyp h VAL 47 N 0.20 0.83 -0.76 1.22 2.07 -0.78 -1.22 116.25 117.80 2cyp h VAL 47 Ca -0.04 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.46 2cyp h VAL 47 Cb 1.22 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 2cyp h VAL 47 CO 0.12 0.03 0.48 -0.09 0.02 0.00 0.00 177.57 178.13 2cyp h ARG 48 N 0.17 0.89 -0.73 1.57 2.43 -0.91 -1.15 114.38 116.67 2cyp h ARG 48 Ca 0.16 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 2cyp h ARG 48 Cb 0.18 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 2cyp h ARG 48 CO -0.21 0.59 0.35 1.25 -1.51 0.00 0.00 179.97 180.45 2cyp h LEU 49 N 0.92 0.94 -0.93 3.80 5.85 -0.59 0.16 115.31 125.46 2cyp h LEU 49 Ca 0.31 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2cyp h LEU 49 Cb 0.05 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.79 2cyp h LEU 49 CO -0.12 0.81 0.59 0.00 -0.34 0.00 0.00 178.44 179.38 2cyp h ALA 50 N 1.17 1.19 -0.10 1.25 0.00 -0.66 -1.33 119.26 120.78 2cyp h ALA 50 Ca 0.25 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2cyp h ALA 50 Cb 0.11 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2cyp h ALA 50 CO -0.03 0.61 -0.07 2.35 0.00 0.00 0.00 179.25 182.11 2cyp h TRP 51 N 1.27 0.25 -0.02 0.00 2.91 -0.48 -2.69 115.95 117.20 2cyp h TRP 51 Ca 0.34 -0.07 -0.08 0.00 1.13 0.00 0.00 58.89 60.21 2cyp h TRP 51 Cb -0.10 -0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 28.48 2cyp h TRP 51 CO -0.00 0.60 -0.37 0.45 -1.03 0.00 0.00 178.44 178.10 2cyp h HIS 52 N -0.17 0.05 -0.04 2.65 3.86 -0.59 0.50 115.15 121.41 2cyp h HIS 52 Ca 0.02 -0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 59.08 2cyp h HIS 52 Cb 0.55 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 2cyp h HIS 52 CO 0.08 0.40 -0.61 1.79 0.86 0.00 0.00 177.93 180.45 2cyp h THR 53 N 0.04 1.41 0.00 2.45 1.35 -1.28 -3.21 112.91 113.67 2cyp h THR 53 Ca 0.00 -2.04 -0.04 0.00 -0.55 0.00 0.00 66.41 63.78 2cyp h THR 53 Cb 0.67 2.06 -0.01 0.00 -1.73 0.00 0.00 68.15 69.14 2cyp h THR 53 CO 0.05 0.59 -0.95 0.28 -0.25 0.00 0.00 175.52 175.24 2cyp h SER 54 N 0.11 0.00 -0.02 5.36 0.02 -1.11 -3.28 113.55 114.63 2cyp h SER 54 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2cyp h SER 54 Cb 1.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.65 2cyp h SER 54 CO 0.09 0.15 0.00 0.61 -1.14 0.00 0.00 176.83 176.54 2cyp n GLY 55 N 1.22 -0.41 0.00 -3.77 0.00 0.17 -3.10 105.19 99.30 2cyp n GLY 55 Ca -0.02 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.82 2cyp n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cyp n THR 56 N -0.31 0.02 -1.90 2.61 -2.24 -1.26 -4.69 114.28 106.52 2cyp n THR 56 Ca 0.20 0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.60 2cyp n THR 56 Cb 0.24 -0.51 0.03 0.00 -2.10 0.00 0.00 70.33 67.99 2cyp n THR 56 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2cyp s TRP 57 N -2.80 2.46 -0.20 4.78 -0.00 -1.18 -4.28 118.94 117.71 2cyp s TRP 57 Ca 0.20 1.40 -0.00 0.00 -0.00 0.00 0.00 56.10 57.70 2cyp s TRP 57 Cb 0.19 -3.72 0.05 0.00 -0.00 0.00 0.00 33.47 29.99 2cyp s TRP 57 CO 0.49 -2.57 -0.04 0.34 -0.00 0.00 0.00 176.95 175.17 2cyp s ASP 58 N -0.97 3.31 0.66 5.86 -1.08 -0.57 -4.61 116.67 119.27 2cyp s ASP 58 Ca 0.68 -0.92 0.39 0.00 -0.52 0.00 0.00 52.55 52.18 2cyp s ASP 58 Cb -0.38 -0.98 2.15 0.00 -1.46 0.00 0.00 42.92 42.25 2cyp s ASP 58 CO 0.46 -0.23 2.23 0.07 0.52 0.00 0.00 175.17 178.23 2cyp h LYS 59 N 8.07 0.00 -0.23 4.34 2.10 -1.64 -0.61 116.57 128.60 2cyp h LYS 59 Ca -0.20 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.30 2cyp h LYS 59 Cb 1.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.43 2cyp h LYS 59 CO 0.40 0.00 -0.43 0.45 -2.00 0.00 0.00 179.45 177.87 2cyp h HIS 60 N 0.00 0.88 0.00 0.07 3.86 -1.95 -3.38 115.15 114.63 2cyp h HIS 60 Ca 0.01 -0.31 0.00 0.00 -1.16 0.00 0.00 60.37 58.90 2cyp h HIS 60 Cb 0.21 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.52 2cyp h HIS 60 CO 0.00 1.09 0.00 -0.40 0.86 0.00 0.00 177.93 179.48 2cyp n ASP 61 N -4.18 1.09 -2.78 2.45 5.68 -1.13 -4.87 116.55 112.82 2cyp n ASP 61 Ca -0.05 -1.48 -0.21 0.00 -0.50 0.00 0.00 54.79 52.55 2cyp n ASP 61 Cb 0.56 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.55 2cyp n ASP 61 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2cyp n ASN 62 N -0.24 -5.51 -4.91 -1.12 5.15 -0.25 -3.32 115.26 105.07 2cyp n ASN 62 Ca 0.00 -0.14 -0.27 0.00 -0.60 0.00 0.00 54.58 53.56 2cyp n ASN 62 Cb 0.29 -4.53 -0.01 0.00 -0.53 0.00 0.00 39.78 35.00 2cyp n ASN 62 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2cyp s THR 63 N -3.03 4.97 0.00 -0.44 -4.23 -1.23 -4.69 115.64 106.99 2cyp s THR 63 Ca 0.17 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.75 2cyp s THR 63 Cb -0.08 -3.82 0.00 0.00 1.34 0.00 0.00 72.50 69.94 2cyp s THR 63 CO 0.21 -0.61 0.00 0.61 -0.54 0.00 0.00 174.62 174.29 2cyp n GLY 64 N -1.71 0.57 1.16 3.99 0.00 -1.26 -1.51 105.19 106.43 2cyp n GLY 64 Ca -0.01 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.18 2cyp n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cyp n GLY 65 N 0.00 -2.86 0.23 -0.02 0.00 -1.26 -4.60 105.19 96.68 2cyp n GLY 65 Ca 0.00 -1.80 0.12 0.00 0.00 0.00 0.00 46.02 44.34 2cyp n GLY 65 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2cyp h SER 66 N 0.00 0.00 0.15 1.61 4.64 -1.76 -3.40 113.55 114.80 2cyp h SER 66 Ca 0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 2cyp h SER 66 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 2cyp h SER 66 CO 0.00 0.13 -0.40 0.22 -0.87 0.00 0.00 176.83 175.91 2cyp h TYR 67 N 0.00 -1.12 0.00 4.77 3.20 -1.86 -3.20 116.97 118.77 2cyp h TYR 67 Ca -0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2cyp h TYR 67 Cb 0.82 0.47 0.00 0.00 1.54 0.00 0.00 36.73 39.56 2cyp h TYR 67 CO 0.00 -0.51 0.00 0.41 -1.64 0.00 0.00 178.16 176.42 2cyp n GLY 68 N -1.46 -1.08 4.16 1.82 0.00 -1.25 -2.61 105.19 104.77 2cyp n GLY 68 Ca -0.07 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 2cyp n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cyp n GLY 69 N 1.02 -0.31 0.00 -0.02 0.00 -1.21 -2.52 105.19 102.16 2cyp n GLY 69 Ca 0.19 0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.44 2cyp n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cyp n THR 70 N -4.40 0.66 0.30 2.61 -2.24 -1.26 -2.99 114.28 106.96 2cyp n THR 70 Ca -0.12 0.16 0.19 0.00 -2.27 0.00 0.00 64.05 62.01 2cyp n THR 70 Cb 0.59 -0.86 0.89 0.00 -2.10 0.00 0.00 70.33 68.85 2cyp n THR 70 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2cyp h TYR 71 N 0.00 0.00 0.00 4.78 5.03 -1.93 -1.28 116.97 123.56 2cyp h TYR 71 Ca 0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 2cyp h TYR 71 Cb 0.26 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.54 2cyp h TYR 71 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 178.16 176.91 2cyp h ARG 72 N 0.00 0.00 -6.31 1.82 0.11 -1.93 -3.26 114.38 104.81 2cyp h ARG 72 Ca 0.00 0.00 -0.56 0.00 0.10 0.00 0.00 59.98 59.52 2cyp h ARG 72 Cb 0.25 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.30 2cyp h ARG 72 CO 0.00 0.00 -0.01 -0.06 0.10 0.00 0.00 179.97 180.00 2cyp s PHE 73 N -3.50 3.78 0.26 4.08 2.99 -0.49 -4.93 117.98 120.17 2cyp s PHE 73 Ca 0.03 1.29 -0.11 0.00 0.00 0.00 0.00 56.93 58.14 2cyp s PHE 73 Cb 0.09 -2.52 0.38 0.00 0.00 0.00 0.00 43.02 40.97 2cyp s PHE 73 CO 0.46 0.54 1.56 1.57 -0.00 0.00 0.00 175.22 179.35 2cyp h LYS 74 N 4.27 -0.01 -0.52 0.44 5.09 -1.87 -2.01 116.57 121.97 2cyp h LYS 74 Ca -0.49 0.00 0.09 0.00 0.09 0.00 0.00 60.65 60.34 2cyp h LYS 74 Cb 1.21 0.00 -0.08 0.00 0.10 0.00 0.00 32.23 33.46 2cyp h LYS 74 CO 0.64 -0.00 0.08 -0.22 -2.09 0.00 0.00 179.45 177.85 2cyp h LYS 75 N -0.01 0.20 -0.01 0.07 3.64 -1.94 0.43 116.57 118.95 2cyp h LYS 75 Ca 0.43 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.65 2cyp h LYS 75 Cb 0.67 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2cyp h LYS 75 CO -0.98 0.13 -0.56 1.49 -2.27 0.00 0.00 179.45 177.26 2cyp h GLU 76 N 0.20 0.41 -0.64 1.90 4.81 -1.68 -3.09 114.58 116.49 2cyp h GLU 76 Ca 0.26 -0.42 0.03 0.00 -0.13 0.00 0.00 59.36 59.10 2cyp h GLU 76 Cb 0.38 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 2cyp h GLU 76 CO -0.37 1.08 0.42 0.35 -0.73 0.00 0.00 179.01 179.77 2cyp h PHE 77 N -0.10 0.74 -0.02 0.92 3.04 -1.26 -2.68 116.94 117.58 2cyp h PHE 77 Ca -0.07 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.90 2cyp h PHE 77 Cb 1.27 -0.25 0.00 0.00 2.56 0.00 0.00 35.95 39.53 2cyp h PHE 77 CO 0.14 0.44 -0.02 0.09 -2.02 0.00 0.00 178.31 176.95 2cyp n ASN 78 N -4.46 1.67 -4.66 0.41 3.02 0.13 -4.85 115.26 106.52 2cyp n ASN 78 Ca 0.07 -1.52 -0.48 0.00 -0.03 0.00 0.00 54.58 52.62 2cyp n ASN 78 Cb 0.11 0.01 -0.05 0.00 -0.61 0.00 0.00 39.78 39.25 2cyp n ASN 78 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2cyp n ASP 79 N 0.27 2.89 0.22 6.41 -0.08 -1.01 -4.85 116.55 120.39 2cyp n ASP 79 Ca 0.18 1.06 0.13 0.00 -1.51 0.00 0.00 54.79 54.65 2cyp n ASP 79 Cb 0.39 -1.36 0.73 0.00 2.34 0.00 0.00 41.12 43.22 2cyp n ASP 79 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2cyp h PRO 80 N 6.58 0.00 0.00 -0.67 0.13 -1.91 0.69 132.00 136.82 2cyp h PRO 80 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2cyp h PRO 80 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 2cyp h PRO 80 CO 0.89 0.00 -0.02 0.77 -0.23 0.00 0.00 178.00 179.41 2cyp h SER 81 N 0.00 0.00 -0.59 1.44 0.02 -1.95 -2.69 113.55 109.78 2cyp h SER 81 Ca 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2cyp h SER 81 Cb 0.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 2cyp h SER 81 CO -0.00 0.02 0.00 0.59 -1.14 0.00 0.00 176.83 176.30 2cyp n ASN 82 N -3.16 3.72 -4.68 3.07 3.02 0.24 -4.98 115.26 112.49 2cyp n ASN 82 Ca -0.01 -2.19 -0.44 0.00 -0.03 0.00 0.00 54.58 51.90 2cyp n ASN 82 Cb 0.22 -0.47 -0.03 0.00 -0.61 0.00 0.00 39.78 38.89 2cyp n ASN 82 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2cyp n ALA 83 N 1.12 1.34 0.00 5.41 0.00 -1.02 -1.18 120.51 126.18 2cyp n ALA 83 Ca 0.21 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.06 2cyp n ALA 83 Cb 0.65 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.79 2cyp n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cyp n GLY 84 N 2.27 2.92 0.15 0.00 0.00 -1.26 -4.86 105.19 104.40 2cyp n GLY 84 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.26 2cyp n GLY 84 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cyp h LEU 85 N 0.00 0.00 -2.60 0.99 3.38 -1.54 -2.66 115.31 112.88 2cyp h LEU 85 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 2cyp h LEU 85 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2cyp h LEU 85 CO 0.00 0.00 0.06 0.06 0.09 0.00 0.00 178.44 178.65 2cyp h GLN 86 N 0.00 0.00 -0.61 1.13 -0.00 -1.91 -0.30 115.11 113.42 2cyp h GLN 86 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 58.65 58.58 2cyp h GLN 86 Cb 0.43 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.89 2cyp h GLN 86 CO 0.00 0.00 0.11 -0.91 -0.00 0.00 0.00 178.83 178.03 2cyp h ASN 87 N 0.00 0.93 0.10 0.06 2.35 -1.87 -1.25 115.58 115.90 2cyp h ASN 87 Ca 0.01 -0.20 -0.28 0.00 -0.55 0.00 0.00 56.30 55.29 2cyp h ASN 87 Cb 0.13 -0.25 0.03 0.00 0.05 0.00 0.00 38.32 38.28 2cyp h ASN 87 CO -0.00 0.92 -1.14 1.23 -1.65 0.00 0.00 177.43 176.80 2cyp h GLY 88 N 1.03 0.67 0.42 2.83 0.00 -1.28 -2.99 103.07 103.76 2cyp h GLY 88 Ca 0.19 -1.37 0.05 0.00 0.00 0.00 0.00 47.33 46.20 2cyp h GLY 88 CO 0.01 1.21 -0.11 -2.75 0.00 0.00 0.00 176.54 174.89 2cyp h PHE 89 N 0.22 -0.27 -0.64 5.60 3.04 -1.25 -2.27 116.94 121.36 2cyp h PHE 89 Ca -0.17 0.03 0.08 0.00 3.98 0.00 0.00 57.97 61.89 2cyp h PHE 89 Cb 1.82 0.15 -0.07 0.00 2.56 0.00 0.00 35.95 40.42 2cyp h PHE 89 CO 0.12 -0.17 0.29 0.87 -2.02 0.00 0.00 178.31 177.40 2cyp h LYS 90 N -0.09 0.51 -0.52 1.11 6.56 -1.29 -1.97 116.57 120.89 2cyp h LYS 90 Ca 0.12 -0.03 0.04 0.00 -1.06 0.00 0.00 60.65 59.72 2cyp h LYS 90 Cb 0.27 -0.11 -0.04 0.00 -0.57 0.00 0.00 32.23 31.77 2cyp h LYS 90 CO -0.28 0.34 0.27 0.35 -2.06 0.00 0.00 179.45 178.06 2cyp h PHE 91 N 0.52 0.50 0.00 -1.35 3.04 -1.30 -3.03 116.94 115.32 2cyp h PHE 91 Ca 0.31 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 62.23 2cyp h PHE 91 Cb 0.32 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.67 2cyp h PHE 91 CO -0.13 0.25 -0.25 -0.07 -2.02 0.00 0.00 178.31 176.09 2cyp h LEU 92 N 0.53 0.00 -0.52 0.59 3.38 -0.91 -3.38 115.31 115.00 2cyp h LEU 92 Ca 0.23 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.29 2cyp h LEU 92 Cb 0.12 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.77 2cyp h LEU 92 CO -0.15 0.25 -0.32 -0.33 0.09 0.00 0.00 178.44 177.98 2cyp h GLU 93 N 0.00 -0.18 -0.96 1.13 4.39 -1.24 -1.09 114.58 116.64 2cyp h GLU 93 Ca -0.00 0.01 0.11 0.00 0.34 0.00 0.00 59.36 59.82 2cyp h GLU 93 Cb 1.08 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 29.69 2cyp h GLU 93 CO 0.03 -0.12 0.61 -1.35 -1.16 0.00 0.00 179.01 177.03 2cyp h PRO 94 N -0.19 0.92 -0.57 2.33 0.11 -1.75 -1.12 132.00 131.73 2cyp h PRO 94 Ca 0.21 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.18 2cyp h PRO 94 Cb 0.54 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.42 2cyp h PRO 94 CO -0.63 0.61 0.00 0.82 -0.21 0.00 0.00 178.00 178.60 2cyp h ILE 95 N 0.95 1.26 -0.01 4.15 2.04 -1.46 -2.54 117.51 121.91 2cyp h ILE 95 Ca 0.46 -1.13 -0.07 0.00 1.00 0.00 0.00 64.86 65.11 2cyp h ILE 95 Cb 0.45 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 2cyp h ILE 95 CO -0.22 0.41 -0.35 -0.74 0.00 0.00 0.00 178.15 177.25 2cyp h HIS 96 N 0.90 0.01 -0.04 1.37 2.76 -0.31 -0.99 115.15 118.85 2cyp h HIS 96 Ca 0.16 -0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 58.13 2cyp h HIS 96 Cb 0.55 -0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.50 2cyp h HIS 96 CO 0.04 0.36 -0.82 0.87 -1.30 0.00 0.00 177.93 177.07 2cyp h LYS 97 N 0.01 0.39 -0.06 5.26 6.56 -1.15 -2.67 116.57 124.91 2cyp h LYS 97 Ca -0.00 -0.37 -0.14 0.00 -1.06 0.00 0.00 60.65 59.08 2cyp h LYS 97 Cb 0.62 0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 32.35 2cyp h LYS 97 CO 0.05 1.02 -0.60 1.49 -2.06 0.00 0.00 179.45 179.35 2cyp h GLU 98 N 0.25 0.21 -2.35 3.15 4.81 -1.03 -3.37 114.58 116.25 2cyp h GLU 98 Ca -0.05 -0.14 -0.59 0.00 -0.13 0.00 0.00 59.36 58.45 2cyp h GLU 98 Cb 1.42 0.02 -0.40 0.00 0.63 0.00 0.00 28.75 30.42 2cyp h GLU 98 CO 0.14 0.74 -0.80 1.19 -0.73 0.00 0.00 179.01 179.55 2cyp n PHE 99 N -3.87 1.63 0.38 0.92 3.01 -0.42 -4.95 117.46 114.15 2cyp n PHE 99 Ca -0.02 -3.87 0.12 0.00 1.01 0.00 0.00 57.45 54.69 2cyp n PHE 99 Cb 0.61 -0.37 0.52 0.00 -0.01 0.00 0.00 39.48 40.23 2cyp n PHE 99 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2cyp h PRO 100 N 4.62 0.00 0.00 -1.08 0.14 -1.65 -2.88 132.00 131.15 2cyp h PRO 100 Ca 0.16 0.00 -0.06 0.00 0.14 0.00 0.00 66.00 66.25 2cyp h PRO 100 Cb 0.79 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 31.92 2cyp h PRO 100 CO 0.62 0.00 -0.27 0.11 0.14 0.00 0.00 178.00 178.61 2cyp h TRP 101 N 0.00 0.00 -3.38 1.56 5.08 -1.93 -3.45 115.95 113.83 2cyp h TRP 101 Ca 0.00 0.00 -0.52 0.00 1.08 0.00 0.00 58.89 59.45 2cyp h TRP 101 Cb 0.37 0.00 0.02 0.00 -3.00 0.00 0.00 29.16 26.55 2cyp h TRP 101 CO 0.00 0.27 0.60 -1.50 -1.28 0.00 0.00 178.44 176.53 2cyp s ILE 102 N -3.29 3.50 0.61 0.12 2.07 -1.09 -4.92 121.20 118.19 2cyp s ILE 102 Ca 0.03 1.21 -0.19 0.00 -1.41 0.00 0.00 60.65 60.30 2cyp s ILE 102 Cb 0.08 -3.77 -0.03 0.00 0.13 0.00 0.00 42.46 38.87 2cyp s ILE 102 CO 0.68 0.17 1.24 -0.94 -1.91 0.00 0.00 174.94 174.18 2cyp s SER 103 N 0.38 4.96 0.22 4.50 1.04 -1.26 -4.88 113.70 118.65 2cyp s SER 103 Ca 0.56 2.49 -0.07 0.00 0.48 0.00 0.00 55.95 59.40 2cyp s SER 103 Cb -0.34 -2.61 0.19 0.00 0.10 0.00 0.00 66.02 63.36 2cyp s SER 103 CO 0.36 -1.76 1.78 0.28 0.98 0.00 0.00 173.24 174.88 2cyp h SER 104 N 0.76 1.07 -0.39 7.02 0.02 -1.91 -2.48 113.55 117.64 2cyp h SER 104 Ca -0.51 -0.17 -0.11 0.00 -0.84 0.00 0.00 61.79 60.16 2cyp h SER 104 Cb 1.31 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 2cyp h SER 104 CO 0.54 0.96 -0.18 1.23 -1.14 0.00 0.00 176.83 178.24 2cyp h GLY 105 N 1.14 0.87 0.85 -3.77 0.00 -1.80 -1.28 103.07 99.09 2cyp h GLY 105 Ca 0.25 -0.78 0.02 0.00 0.00 0.00 0.00 47.33 46.83 2cyp h GLY 105 CO -0.02 0.71 0.23 -0.55 0.00 0.00 0.00 176.54 176.91 2cyp h ASP 106 N 0.61 0.36 -0.48 0.19 3.32 -1.79 -1.53 116.42 117.10 2cyp h ASP 106 Ca 0.09 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.08 2cyp h ASP 106 Cb 0.73 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 2cyp h ASP 106 CO 0.06 0.26 0.04 0.25 -1.72 0.00 0.00 179.24 178.12 2cyp h LEU 107 N 0.46 0.79 -0.18 1.55 5.85 -1.24 0.16 115.31 122.70 2cyp h LEU 107 Ca 0.17 -0.28 -0.04 0.00 0.84 0.00 0.00 57.88 58.57 2cyp h LEU 107 Cb 0.04 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 2cyp h LEU 107 CO -0.10 0.87 -0.05 -0.26 -0.34 0.00 0.00 178.44 178.57 2cyp h PHE 108 N 0.67 0.40 0.13 1.25 0.05 -1.12 -0.04 116.94 118.29 2cyp h PHE 108 Ca 0.14 -0.09 -0.01 0.00 3.82 0.00 0.00 57.97 61.83 2cyp h PHE 108 Cb 0.44 -0.10 0.00 0.00 2.00 0.00 0.00 35.95 38.30 2cyp h PHE 108 CO 0.03 0.62 -0.06 0.66 -0.18 0.00 0.00 178.31 179.38 2cyp h SER 109 N 0.07 -0.15 -0.32 2.17 4.64 -1.33 -3.08 113.55 115.55 2cyp h SER 109 Ca 0.05 -0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.33 2cyp h SER 109 Cb 0.50 0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 2cyp h SER 109 CO 0.02 -0.10 0.09 0.25 -0.87 0.00 0.00 176.83 176.21 2cyp h LEU 110 N -0.18 0.54 -1.87 5.97 5.85 -0.49 -2.53 115.31 122.60 2cyp h LEU 110 Ca -0.02 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 2cyp h LEU 110 Cb 0.14 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 2cyp h LEU 110 CO 0.03 0.55 0.02 1.23 -0.34 0.00 0.00 178.44 179.93 2cyp h GLY 111 N 0.81 0.11 1.37 3.75 0.00 -0.92 -0.82 103.07 107.36 2cyp h GLY 111 Ca 0.13 -0.04 -0.23 0.00 0.00 0.00 0.00 47.33 47.19 2cyp h GLY 111 CO -0.00 0.04 -0.89 -1.33 0.00 0.00 0.00 176.54 174.36 2cyp h GLY 112 N 0.18 0.66 0.82 4.60 0.00 -1.38 -1.71 103.07 106.23 2cyp h GLY 112 Ca 0.03 -1.04 -0.01 0.00 0.00 0.00 0.00 47.33 46.31 2cyp h GLY 112 CO -0.00 0.93 0.02 -2.08 0.00 0.00 0.00 176.54 175.41 2cyp h VAL 113 N 0.37 1.17 -0.11 4.60 2.07 -1.17 -2.09 116.25 121.09 2cyp h VAL 113 Ca -0.08 -0.51 -0.00 0.00 0.82 0.00 0.00 66.70 66.93 2cyp h VAL 113 Cb 1.52 1.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 2cyp h VAL 113 CO 0.17 0.14 0.07 0.74 0.02 0.00 0.00 177.57 178.71 2cyp h THR 114 N -0.08 1.05 -0.34 2.57 2.02 -1.11 -2.20 112.91 114.82 2cyp h THR 114 Ca 0.02 -0.12 0.05 0.00 0.77 0.00 0.00 66.41 67.13 2cyp h THR 114 Cb 0.21 0.93 -0.05 0.00 -1.74 0.00 0.00 68.15 67.50 2cyp h THR 114 CO -0.00 0.05 0.05 0.00 0.37 0.00 0.00 175.52 175.99 2cyp h ALA 115 N 1.01 0.35 -0.07 6.16 0.00 -1.19 0.48 119.26 126.00 2cyp h ALA 115 Ca 0.04 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2cyp h ALA 115 Cb 0.02 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2cyp h ALA 115 CO -0.01 -0.35 -0.11 0.28 0.00 0.00 0.00 179.25 179.06 2cyp h VAL 116 N 0.17 0.69 -0.81 0.00 2.07 -1.31 0.11 116.25 117.16 2cyp h VAL 116 Ca 0.16 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.64 2cyp h VAL 116 Cb 0.19 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 2cyp h VAL 116 CO -0.23 0.00 0.34 1.56 0.02 0.00 0.00 177.57 179.26 2cyp h GLN 117 N -0.16 1.20 0.00 1.57 4.20 -1.17 -1.33 115.11 119.42 2cyp h GLN 117 Ca 0.07 -0.20 -0.10 0.00 0.06 0.00 0.00 58.65 58.47 2cyp h GLN 117 Cb 0.25 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2cyp h GLN 117 CO -0.17 0.95 -0.50 0.93 -0.67 0.00 0.00 178.83 179.37 2cyp h GLU 118 N 1.17 0.00 -0.90 1.46 4.39 -0.66 -2.62 114.58 117.42 2cyp h GLU 118 Ca 0.27 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.97 2cyp h GLU 118 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2cyp h GLU 118 CO -0.03 0.50 0.00 -1.33 -1.16 0.00 0.00 179.01 176.99 2cyp n MET 119 N -3.85 1.86 -1.21 2.33 2.81 0.35 -4.88 117.12 114.53 2cyp n MET 119 Ca -0.01 -0.70 -0.07 0.00 -1.81 0.00 0.00 57.70 55.11 2cyp n MET 119 Cb 0.53 -1.66 -0.03 0.00 -0.71 0.00 0.00 33.22 31.35 2cyp n MET 119 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2cyp n GLN 120 N 0.14 -0.63 -1.16 0.03 6.02 -0.99 0.08 117.38 120.87 2cyp n GLN 120 Ca 0.06 0.72 -0.30 0.00 -0.01 0.00 0.00 57.00 57.47 2cyp n GLN 120 Cb 0.46 -4.55 0.24 0.00 1.02 0.00 0.00 30.24 27.41 2cyp n GLN 120 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2cyp s GLY 121 N -2.78 1.61 0.92 1.08 0.00 -0.53 -4.75 107.32 102.87 2cyp s GLY 121 Ca 0.00 -1.02 -0.12 0.00 0.00 0.00 0.00 44.72 43.58 2cyp s GLY 121 CO 0.00 -0.13 1.10 2.56 0.00 0.00 0.00 173.10 176.63 2cyp s PRO 122 N -5.49 1.07 0.22 2.90 0.04 -1.26 -4.67 135.00 127.80 2cyp s PRO 122 Ca 0.72 0.67 -0.30 0.00 0.04 0.00 0.00 61.00 62.12 2cyp s PRO 122 Cb -0.08 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.57 2cyp s PRO 122 CO 0.56 -2.33 0.98 0.15 0.04 0.00 0.00 177.00 176.39 2cyp s LYS 123 N -4.99 4.78 -0.28 4.56 -0.14 -1.26 -4.36 119.74 118.05 2cyp s LYS 123 Ca 0.64 1.55 -0.00 0.00 -1.36 0.00 0.00 55.97 56.80 2cyp s LYS 123 Cb -0.18 -3.28 0.05 0.00 -1.68 0.00 0.00 37.83 32.74 2cyp s LYS 123 CO 0.57 0.38 -0.05 0.42 -0.76 0.00 0.00 175.35 175.91 2cyp s ILE 124 N -0.89 2.69 0.32 2.17 1.01 -1.26 -4.84 121.20 120.39 2cyp s ILE 124 Ca 0.43 -1.40 -0.29 0.00 0.00 0.00 0.00 60.65 59.39 2cyp s ILE 124 Cb -0.27 -2.52 -0.11 0.00 0.01 0.00 0.00 42.46 39.57 2cyp s ILE 124 CO 0.33 -0.02 1.52 -2.84 0.00 0.00 0.00 174.94 173.93 2cyp s PRO 125 N 1.22 4.15 -0.02 2.79 0.02 -1.26 -4.79 135.00 137.11 2cyp s PRO 125 Ca -0.05 2.52 0.01 0.00 0.02 0.00 0.00 61.00 63.50 2cyp s PRO 125 Cb -0.19 -3.02 0.01 0.00 0.02 0.00 0.00 34.50 31.32 2cyp s PRO 125 CO -0.03 -0.55 -0.04 -0.46 -0.33 0.00 0.00 177.00 175.59 2cyp s TRP 126 N -0.46 0.52 -0.07 6.54 -0.00 -0.39 -4.81 118.94 120.26 2cyp s TRP 126 Ca 0.58 -0.10 0.03 0.00 -0.00 0.00 0.00 56.10 56.61 2cyp s TRP 126 Cb -0.46 -0.42 -0.02 0.00 -0.00 0.00 0.00 33.47 32.56 2cyp s TRP 126 CO 0.53 -0.08 -0.15 1.03 -0.00 0.00 0.00 176.95 178.28 2cyp s ARG 127 N 0.39 2.77 0.58 5.86 0.52 -1.26 -0.02 118.95 127.79 2cyp s ARG 127 Ca -0.04 -0.72 0.00 0.00 -0.52 0.00 0.00 55.73 54.45 2cyp s ARG 127 Cb -0.08 -2.43 0.04 0.00 0.52 0.00 0.00 34.95 33.01 2cyp s ARG 127 CO -0.00 0.48 0.82 0.00 0.02 0.00 0.00 175.30 176.61 2cyp n GLY 129 N -2.45 1.12 3.77 0.00 0.00 -1.26 -4.77 105.19 101.60 2cyp n GLY 129 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2cyp n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cyp s ARG 130 N 0.00 4.13 -0.08 1.61 0.52 -1.26 -0.38 118.95 123.48 2cyp s ARG 130 Ca 0.00 1.72 0.04 0.00 -0.52 0.00 0.00 55.73 56.97 2cyp s ARG 130 Cb 0.00 -2.66 -0.00 0.00 0.52 0.00 0.00 34.95 32.81 2cyp s ARG 130 CO 0.00 -0.22 -0.22 0.08 0.02 0.00 0.00 175.30 174.96 2cyp s VAL 131 N -1.48 1.88 0.23 3.52 1.01 -1.07 -4.60 120.40 119.89 2cyp s VAL 131 Ca 0.57 -0.93 -0.31 0.00 0.00 0.00 0.00 61.98 61.30 2cyp s VAL 131 Cb -0.28 -1.63 -0.12 0.00 0.00 0.00 0.00 36.38 34.36 2cyp s VAL 131 CO 0.35 0.52 1.69 0.47 0.00 0.00 0.00 175.10 178.12 2cyp n ASP 132 N 3.42 3.95 -4.54 3.32 8.00 -1.26 -3.87 116.55 125.57 2cyp n ASP 132 Ca -0.19 1.09 -0.24 0.00 0.71 0.00 0.00 54.79 56.15 2cyp n ASP 132 Cb 0.53 -1.58 -0.09 0.00 -0.02 0.00 0.00 41.12 39.96 2cyp n ASP 132 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2cyp s THR 133 N 0.81 2.88 0.92 -3.53 -4.23 -1.05 -5.01 115.64 106.45 2cyp s THR 133 Ca 0.72 -2.13 -0.11 0.00 -1.18 0.00 0.00 61.69 58.98 2cyp s THR 133 Cb -0.50 -2.51 0.15 0.00 1.34 0.00 0.00 72.50 70.98 2cyp s THR 133 CO 0.37 -0.34 1.10 -2.84 -0.54 0.00 0.00 174.62 172.37 2cyp s PRO 134 N -3.44 0.98 0.57 3.99 0.02 -1.26 -4.87 135.00 130.98 2cyp s PRO 134 Ca 0.29 1.21 0.27 0.00 0.02 0.00 0.00 61.00 62.79 2cyp s PRO 134 Cb -0.06 -1.75 1.53 0.00 0.02 0.00 0.00 34.50 34.24 2cyp s PRO 134 CO 0.16 -2.54 2.03 1.49 -0.33 0.00 0.00 177.00 177.81 2cyp h GLU 135 N -1.79 0.00 -0.07 5.54 4.81 -1.99 -0.71 114.58 120.37 2cyp h GLU 135 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2cyp h GLU 135 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 2cyp h GLU 135 CO 0.48 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.36 2cyp n ASP 136 N -3.99 0.88 -0.69 1.04 5.75 -1.26 -2.86 116.55 115.42 2cyp n ASP 136 Ca 0.05 -1.51 0.11 0.00 -0.01 0.00 0.00 54.79 53.43 2cyp n ASP 136 Cb 0.46 -0.04 0.05 0.00 -1.03 0.00 0.00 41.12 40.56 2cyp n ASP 136 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2cyp n THR 137 N -0.23 0.00 -2.19 2.12 -2.24 -0.27 -4.97 114.28 106.50 2cyp n THR 137 Ca 0.16 -0.40 -0.42 0.00 -2.27 0.00 0.00 64.05 61.12 2cyp n THR 137 Cb 0.22 1.36 -0.03 0.00 -2.10 0.00 0.00 70.33 69.77 2cyp n THR 137 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2cyp s THR 138 N -2.04 3.32 0.50 4.28 2.01 -1.14 -4.71 115.64 117.87 2cyp s THR 138 Ca 0.22 0.97 -0.21 0.00 0.31 0.00 0.00 61.69 62.98 2cyp s THR 138 Cb 0.17 -3.62 -0.07 0.00 0.01 0.00 0.00 72.50 68.99 2cyp s THR 138 CO 0.39 0.09 1.12 -2.16 -0.69 0.00 0.00 174.62 173.36 2cyp s PRO 139 N 0.87 3.61 0.76 4.92 0.04 -1.26 -5.01 135.00 138.93 2cyp s PRO 139 Ca 0.63 1.60 -0.14 0.00 0.04 0.00 0.00 61.00 63.13 2cyp s PRO 139 Cb -0.36 -2.17 0.06 0.00 0.04 0.00 0.00 34.50 32.06 2cyp s PRO 139 CO 0.32 -0.64 1.19 -0.51 0.04 0.00 0.00 177.00 177.40 2cyp s ASP 140 N -1.68 4.03 0.77 6.66 -0.00 -1.26 -4.71 116.67 120.47 2cyp s ASP 140 Ca 0.68 2.31 -0.14 0.00 -0.00 0.00 0.00 52.55 55.40 2cyp s ASP 140 Cb -0.24 -2.58 0.06 0.00 -0.00 0.00 0.00 42.92 40.16 2cyp s ASP 140 CO 0.28 -2.37 1.19 0.20 -0.00 0.00 0.00 175.17 174.46 2cyp s ASN 141 N -2.19 3.96 0.00 0.27 0.01 -1.26 -4.33 114.94 111.39 2cyp s ASN 141 Ca 0.73 2.28 0.00 0.00 -0.71 0.00 0.00 52.86 55.16 2cyp s ASN 141 Cb -0.28 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 38.80 2cyp s ASN 141 CO 0.48 -2.42 0.00 0.61 -1.51 0.00 0.00 177.10 174.26 2cyp n GLY 142 N 0.24 0.89 0.32 0.66 0.00 -1.26 -5.00 105.19 101.03 2cyp n GLY 142 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.26 2cyp n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cyp n ARG 143 N -1.32 0.80 -3.07 1.61 1.74 -1.26 -4.92 116.66 110.24 2cyp n ARG 143 Ca 0.00 -0.64 -0.27 0.00 -0.77 0.00 0.00 57.85 56.17 2cyp n ARG 143 Cb 0.00 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 29.93 2cyp n ARG 143 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2cyp s LEU 144 N -2.64 3.89 0.49 0.55 1.43 -1.26 -4.71 118.68 116.43 2cyp s LEU 144 Ca 0.16 0.78 -0.19 0.00 -1.03 0.00 0.00 54.13 53.86 2cyp s LEU 144 Cb 0.18 -3.66 -0.08 0.00 0.03 0.00 0.00 46.19 42.65 2cyp s LEU 144 CO 0.65 -0.36 1.00 -2.16 0.23 0.00 0.00 176.35 175.71 2cyp s PRO 145 N -4.10 3.91 0.47 1.29 0.04 -1.26 -5.07 135.00 130.28 2cyp s PRO 145 Ca 0.45 1.14 -0.10 0.00 0.04 0.00 0.00 61.00 62.53 2cyp s PRO 145 Cb -0.10 -2.12 -0.06 0.00 0.04 0.00 0.00 34.50 32.26 2cyp s PRO 145 CO 0.36 -0.31 0.84 -0.51 0.04 0.00 0.00 177.00 177.41 2cyp s ASP 146 N -2.50 6.43 0.00 6.66 1.01 -1.26 -5.01 116.67 121.99 2cyp s ASP 146 Ca 0.62 1.17 0.20 0.00 0.71 0.00 0.00 52.55 55.25 2cyp s ASP 146 Cb -0.12 -2.35 -0.16 0.00 1.01 0.00 0.00 42.92 41.30 2cyp s ASP 146 CO 0.24 -0.53 0.88 0.00 0.21 0.00 0.00 175.17 175.96 2cyp n ALA 147 N -1.78 4.29 -1.40 5.23 0.00 -1.26 -4.49 120.51 121.11 2cyp n ALA 147 Ca 0.03 -0.57 -0.35 0.00 0.00 0.00 0.00 53.44 52.55 2cyp n ALA 147 Cb 0.54 -0.71 0.07 0.00 0.00 0.00 0.00 19.45 19.35 2cyp n ALA 147 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2cyp n ASP 148 N -1.12 7.66 -4.47 0.00 5.68 -1.26 -2.77 116.55 120.28 2cyp n ASP 148 Ca 0.05 -3.78 -0.31 0.00 -0.50 0.00 0.00 54.79 50.25 2cyp n ASP 148 Cb 0.34 -0.99 -0.07 0.00 -1.14 0.00 0.00 41.12 39.25 2cyp n ASP 148 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 2cyp s LYS 149 N -3.81 2.14 0.20 0.11 -0.14 -1.26 -4.97 119.74 112.01 2cyp s LYS 149 Ca 0.63 -2.37 0.02 0.00 -1.36 0.00 0.00 55.97 52.88 2cyp s LYS 149 Cb 0.49 -1.11 0.02 0.00 -1.68 0.00 0.00 37.83 35.55 2cyp s LYS 149 CO -0.06 -0.47 0.14 -0.40 -0.76 0.00 0.00 175.35 173.79 2cyp n ASP 150 N -1.39 1.67 -0.31 2.83 5.75 -1.26 -3.56 116.55 120.29 2cyp n ASP 150 Ca -0.15 -1.68 0.09 0.00 -0.01 0.00 0.00 54.79 53.03 2cyp n ASP 150 Cb 0.66 -0.01 0.25 0.00 -1.03 0.00 0.00 41.12 41.00 2cyp n ASP 150 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2cyp h ALA 151 N 0.74 1.38 -0.26 2.12 0.00 -1.90 -1.73 119.26 119.61 2cyp h ALA 151 Ca -0.13 0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 2cyp h ALA 151 Cb 0.45 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2cyp h ALA 151 CO 0.20 -0.10 -0.41 -0.44 0.00 0.00 0.00 179.25 178.50 2cyp h ASP 152 N 0.64 0.67 -0.09 0.00 3.32 -1.96 -0.82 116.42 118.17 2cyp h ASP 152 Ca 0.50 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 2cyp h ASP 152 Cb 0.74 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.10 2cyp h ASP 152 CO -0.38 1.00 -0.02 0.22 -1.72 0.00 0.00 179.24 178.34 2cyp h TYR 153 N 0.52 0.20 -0.45 4.55 3.20 -1.72 -2.06 116.97 121.20 2cyp h TYR 153 Ca 0.04 -0.04 0.06 0.00 3.14 0.00 0.00 58.73 61.93 2cyp h TYR 153 Cb 0.93 -0.05 -0.05 0.00 1.54 0.00 0.00 36.73 39.10 2cyp h TYR 153 CO 0.04 0.48 0.17 0.28 -1.64 0.00 0.00 178.16 177.49 2cyp h VAL 154 N -0.14 0.87 0.01 1.81 2.07 -1.08 0.99 116.25 120.79 2cyp h VAL 154 Ca 0.02 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.43 2cyp h VAL 154 Cb 0.41 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2cyp h VAL 154 CO 0.01 0.06 -0.04 -0.09 0.02 0.00 0.00 177.57 177.53 2cyp h ARG 155 N 0.35 -0.08 -0.23 1.57 2.43 -1.13 -1.22 114.38 116.08 2cyp h ARG 155 Ca 0.21 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.30 2cyp h ARG 155 Cb 0.20 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2cyp h ARG 155 CO -0.20 -0.05 -0.21 1.15 -1.51 0.00 0.00 179.97 179.14 2cyp h THR 156 N -0.08 1.32 -0.14 0.20 2.02 -1.22 -3.00 112.91 112.00 2cyp h THR 156 Ca 0.01 -1.36 0.05 0.00 0.77 0.00 0.00 66.41 65.88 2cyp h THR 156 Cb 0.09 1.69 -0.06 0.00 -1.74 0.00 0.00 68.15 68.13 2cyp h THR 156 CO -0.03 0.42 -0.29 0.15 0.37 0.00 0.00 175.52 176.13 2cyp h PHE 157 N 0.25 -0.80 0.00 3.16 3.57 -0.62 -3.07 116.94 119.42 2cyp h PHE 157 Ca 0.04 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 2cyp h PHE 157 Cb 0.75 0.37 -0.00 0.00 2.79 0.00 0.00 35.95 39.86 2cyp h PHE 157 CO 0.08 -0.37 -0.16 0.74 -2.23 0.00 0.00 178.31 176.36 2cyp h PHE 158 N -0.36 0.00 -0.56 0.41 -1.00 -1.17 -2.75 116.94 111.50 2cyp h PHE 158 Ca 0.10 0.00 0.08 0.00 2.81 0.00 0.00 57.97 60.97 2cyp h PHE 158 Cb 0.52 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.04 2cyp h PHE 158 CO -0.39 0.16 0.38 1.96 -1.61 0.00 0.00 178.31 178.82 2cyp h GLN 159 N 0.00 0.40 0.00 1.51 4.20 -1.42 -0.62 115.11 119.19 2cyp h GLN 159 Ca -0.00 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 2cyp h GLN 159 Cb 0.41 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 2cyp h GLN 159 CO 0.02 0.27 -0.14 -0.09 -0.67 0.00 0.00 178.83 178.22 2cyp h ARG 160 N 0.42 0.00 -0.65 1.46 2.43 -1.60 -1.18 114.38 115.26 2cyp h ARG 160 Ca 0.26 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 2cyp h ARG 160 Cb 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2cyp h ARG 160 CO -0.07 0.14 0.00 1.28 -1.51 0.00 0.00 179.97 179.81 2cyp n LEU 161 N -4.08 3.78 -3.21 3.80 7.99 -0.66 -1.67 117.00 122.95 2cyp n LEU 161 Ca -0.02 -1.84 -0.23 0.00 -0.01 0.00 0.00 56.01 53.91 2cyp n LEU 161 Cb 0.22 -0.43 0.04 0.00 -0.11 0.00 0.00 43.42 43.14 2cyp n LEU 161 CO 0.33 0.92 0.05 -3.20 -1.51 0.00 0.00 177.39 173.99 2cyp n ASN 162 N 1.59 -5.99 -4.70 -1.43 5.15 -0.44 -4.98 115.26 104.45 2cyp n ASN 162 Ca 0.23 -0.37 -0.35 0.00 -0.60 0.00 0.00 54.58 53.49 2cyp n ASN 162 Cb 0.61 -4.81 -0.09 0.00 -0.53 0.00 0.00 39.78 34.96 2cyp n ASN 162 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 2cyp s MET 163 N -5.90 3.50 0.66 1.20 -1.94 -0.33 -5.00 119.30 111.49 2cyp s MET 163 Ca 0.39 -0.33 0.04 0.00 -1.71 0.00 0.00 55.69 54.08 2cyp s MET 163 Cb -0.18 -3.04 0.11 0.00 2.01 0.00 0.00 34.83 33.74 2cyp s MET 163 CO 0.48 0.53 0.91 0.54 -0.01 0.00 0.00 175.02 177.47 2cyp s ASN 164 N -0.37 4.64 0.14 3.03 2.20 -1.26 -3.94 114.94 119.38 2cyp s ASN 164 Ca 0.09 -0.61 -0.20 0.00 -0.94 0.00 0.00 52.86 51.19 2cyp s ASN 164 Cb -0.12 0.18 0.02 0.00 -2.00 0.00 0.00 41.25 39.34 2cyp s ASN 164 CO 0.02 -1.66 1.67 0.44 -2.94 0.00 0.00 177.10 174.62 2cyp h ASP 165 N -0.23 -0.44 -0.62 3.54 3.32 -1.99 0.69 116.42 120.69 2cyp h ASP 165 Ca -0.33 0.10 0.02 0.00 0.02 0.00 0.00 57.03 56.84 2cyp h ASP 165 Cb 1.28 0.24 -0.04 0.00 0.22 0.00 0.00 39.33 41.03 2cyp h ASP 165 CO 0.40 -0.17 0.39 -0.09 -1.72 0.00 0.00 179.24 178.05 2cyp h ARG 166 N -0.11 0.76 -0.69 3.56 2.43 -1.96 -2.29 114.38 116.08 2cyp h ARG 166 Ca 0.13 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.20 2cyp h ARG 166 Cb 0.31 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 2cyp h ARG 166 CO -0.31 0.50 0.19 0.93 -1.51 0.00 0.00 179.97 179.77 2cyp h GLU 167 N 0.79 1.07 -0.02 0.20 5.08 -1.86 -0.46 114.58 119.38 2cyp h GLU 167 Ca 0.24 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2cyp h GLU 167 Cb -0.03 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.07 2cyp h GLU 167 CO -0.08 0.93 0.01 0.28 -1.00 0.00 0.00 179.01 179.15 2cyp h VAL 168 N 1.03 1.11 -0.48 3.13 2.07 -0.70 0.03 116.25 122.43 2cyp h VAL 168 Ca 0.22 -0.31 0.01 0.00 0.82 0.00 0.00 66.70 67.44 2cyp h VAL 168 Cb 0.33 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 2cyp h VAL 168 CO -0.00 0.08 0.31 0.58 0.02 0.00 0.00 177.57 178.56 2cyp h VAL 169 N -0.10 1.10 0.10 2.57 2.07 -1.27 -0.30 116.25 120.42 2cyp h VAL 169 Ca 0.01 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.33 2cyp h VAL 169 Cb 0.13 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 2cyp h VAL 169 CO -0.00 0.11 -0.21 0.00 0.02 0.00 0.00 177.57 177.49 2cyp h ALA 170 N 1.19 -0.35 -0.97 1.67 0.00 -0.93 -2.82 119.26 117.04 2cyp h ALA 170 Ca 0.18 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.15 2cyp h ALA 170 Cb -0.04 0.34 -0.07 0.00 0.00 0.00 0.00 17.79 18.02 2cyp h ALA 170 CO -0.06 -0.74 0.62 -0.07 0.00 0.00 0.00 179.25 179.00 2cyp h LEU 171 N -0.39 0.94 -0.84 0.00 3.38 -0.63 -2.39 115.31 115.39 2cyp h LEU 171 Ca 0.03 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2cyp h LEU 171 Cb 0.42 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2cyp h LEU 171 CO -0.13 0.56 0.00 0.80 0.09 0.00 0.00 178.44 179.76 2cyp n MET 172 N -4.58 0.20 0.02 1.13 1.56 -0.15 -1.98 117.12 113.32 2cyp n MET 172 Ca 0.16 0.46 0.05 0.00 -0.27 0.00 0.00 57.70 58.10 2cyp n MET 172 Cb 0.26 -1.90 0.21 0.00 2.15 0.00 0.00 33.22 33.94 2cyp n MET 172 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2cyp n GLY 173 N -0.19 -0.80 0.06 -5.12 0.00 -0.90 -0.87 105.19 97.38 2cyp n GLY 173 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 2cyp n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cyp n ALA 174 N -1.54 1.62 0.53 4.61 0.00 -0.84 -2.18 120.51 122.71 2cyp n ALA 174 Ca 0.02 0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.52 2cyp n ALA 174 Cb 0.09 -1.30 0.27 0.00 0.00 0.00 0.00 19.45 18.51 2cyp n ALA 174 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2cyp n HIS 175 N -1.86 0.00 0.29 0.00 8.25 -0.05 -1.14 115.22 120.72 2cyp n HIS 175 Ca 0.03 0.00 0.18 0.00 -0.26 0.00 0.00 57.72 57.67 2cyp n HIS 175 Cb 0.19 -0.17 0.84 0.00 1.12 0.00 0.00 29.99 31.96 2cyp n HIS 175 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2cyp h ALA 176 N 2.53 1.04 -2.67 -1.41 0.00 -1.68 -3.41 119.26 113.66 2cyp h ALA 176 Ca 0.00 -0.03 -0.62 0.00 0.00 0.00 0.00 54.91 54.26 2cyp h ALA 176 Cb 0.05 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 2cyp h ALA 176 CO 0.00 0.04 -0.27 -0.51 0.00 0.00 0.00 179.25 178.51 2cyp s LEU 177 N -6.35 4.44 0.00 0.00 1.43 -0.29 -4.44 118.68 113.47 2cyp s LEU 177 Ca -0.01 0.84 0.00 0.00 -1.03 0.00 0.00 54.13 53.92 2cyp s LEU 177 Cb 0.11 -2.52 0.00 0.00 0.03 0.00 0.00 46.19 43.81 2cyp s LEU 177 CO 0.52 0.33 0.00 0.61 0.23 0.00 0.00 176.35 178.03 2cyp n GLY 178 N 1.75 -0.06 3.76 -3.19 0.00 -0.22 -4.95 105.19 102.27 2cyp n GLY 178 Ca -0.15 -1.00 -0.03 0.00 0.00 0.00 0.00 46.02 44.84 2cyp n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cyp s LYS 179 N 0.00 1.17 0.17 1.61 -2.85 -1.26 -4.34 119.74 114.24 2cyp s LYS 179 Ca 0.00 -0.67 -0.02 0.00 -1.00 0.00 0.00 55.97 54.28 2cyp s LYS 179 Cb 0.00 0.39 -0.05 0.00 -2.06 0.00 0.00 37.83 36.11 2cyp s LYS 179 CO 0.00 -0.54 0.37 0.95 0.10 0.00 0.00 175.35 176.24 2cyp s THR 180 N -3.08 5.20 -0.08 3.79 -4.23 -0.60 -4.98 115.64 111.65 2cyp s THR 180 Ca 0.14 -0.21 0.02 0.00 -1.18 0.00 0.00 61.69 60.45 2cyp s THR 180 Cb -0.01 -3.68 0.01 0.00 1.34 0.00 0.00 72.50 70.16 2cyp s THR 180 CO 0.02 -0.08 -0.13 -1.00 -0.54 0.00 0.00 174.62 172.90 2cyp s HIS 181 N -1.77 1.62 0.18 3.99 0.09 -1.13 -2.78 115.29 115.49 2cyp s HIS 181 Ca 0.39 -0.68 -0.18 0.00 -0.00 0.00 0.00 55.06 54.60 2cyp s HIS 181 Cb -0.12 -1.20 0.12 0.00 -0.00 0.00 0.00 32.58 31.39 2cyp s HIS 181 CO 0.27 -0.36 1.64 1.25 -0.00 0.00 0.00 174.74 177.54 2cyp h LEU 182 N 7.24 -0.62 -2.17 0.89 5.85 -1.66 -1.51 115.31 123.34 2cyp h LEU 182 Ca -0.30 0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.59 2cyp h LEU 182 Cb 1.18 0.35 -0.00 0.00 0.37 0.00 0.00 40.66 42.56 2cyp h LEU 182 CO 0.47 -0.21 0.05 0.11 -0.34 0.00 0.00 178.44 178.51 2cyp h LYS 183 N -0.08 0.00 0.14 1.25 6.56 -1.97 0.11 116.57 122.58 2cyp h LYS 183 Ca 0.21 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.80 2cyp h LYS 183 Cb 0.41 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.07 2cyp h LYS 183 CO -0.50 0.00 -0.07 -0.91 -2.06 0.00 0.00 179.45 175.91 2cyp h ASN 184 N 0.00 -0.16 0.00 0.86 2.35 -1.63 -3.44 115.58 113.56 2cyp h ASN 184 Ca 0.03 -0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 2cyp h ASN 184 Cb 0.12 0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.53 2cyp h ASN 184 CO -0.00 0.36 0.00 -1.54 -1.65 0.00 0.00 177.43 174.60 2cyp n SER 185 N -4.89 0.12 -0.34 5.81 3.41 -0.97 -4.72 113.62 112.04 2cyp n SER 185 Ca -0.04 -0.47 -0.04 0.00 -0.26 0.00 0.00 58.87 58.07 2cyp n SER 185 Cb 0.13 0.61 -0.01 0.00 -0.26 0.00 0.00 64.21 64.68 2cyp n SER 185 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cyp n GLY 186 N 0.61 0.46 3.35 5.00 0.00 0.38 -5.05 105.19 109.93 2cyp n GLY 186 Ca 0.00 -0.83 -0.26 0.00 0.00 0.00 0.00 46.02 44.93 2cyp n GLY 186 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cyp s TYR 187 N -2.16 2.07 -0.05 1.61 2.02 -1.26 -4.66 117.35 114.91 2cyp s TYR 187 Ca 0.00 -0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 56.28 2cyp s TYR 187 Cb 0.00 -1.11 0.04 0.00 -0.40 0.00 0.00 41.96 40.49 2cyp s TYR 187 CO 0.00 0.30 0.10 -2.00 -1.57 0.00 0.00 175.55 172.38 2cyp s GLU 188 N -2.11 -0.01 0.00 -0.62 2.56 -1.26 -1.55 118.70 115.71 2cyp s GLU 188 Ca 0.12 0.39 0.00 0.00 0.00 0.00 0.00 54.97 55.47 2cyp s GLU 188 Cb -0.09 -0.33 0.00 0.00 2.00 0.00 0.00 34.13 35.71 2cyp s GLU 188 CO 0.06 -0.26 0.00 0.41 -0.56 0.00 0.00 175.26 174.91 2cyp n GLY 189 N 4.86 2.49 3.96 -1.50 0.00 -1.12 -4.85 105.19 109.03 2cyp n GLY 189 Ca -0.13 -2.14 -0.22 0.00 0.00 0.00 0.00 46.02 43.52 2cyp n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cyp s PRO 190 N -1.94 2.56 0.07 1.61 0.04 -1.26 -1.56 135.00 134.53 2cyp s PRO 190 Ca 0.00 -0.63 0.23 0.00 0.04 0.00 0.00 61.00 60.64 2cyp s PRO 190 Cb 0.00 -2.43 0.03 0.00 0.04 0.00 0.00 34.50 32.13 2cyp s PRO 190 CO 0.00 -0.75 1.00 0.91 0.04 0.00 0.00 177.00 178.20 2cyp n TRP 191 N -2.42 0.39 -3.81 0.56 8.01 -1.26 -0.53 117.44 118.38 2cyp n TRP 191 Ca 0.07 0.11 -0.00 0.00 -1.31 0.00 0.00 57.50 56.37 2cyp n TRP 191 Cb 0.59 -0.55 0.01 0.00 -2.01 0.00 0.00 31.31 29.35 2cyp n TRP 191 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2cyp n GLY 192 N 1.32 0.66 0.13 6.99 0.00 -1.26 -4.64 105.19 108.39 2cyp n GLY 192 Ca 0.01 -1.00 -0.22 0.00 0.00 0.00 0.00 46.02 44.81 2cyp n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cyp h ALA 193 N 2.00 0.22 -2.34 4.61 0.00 -1.95 -3.41 119.26 118.38 2cyp h ALA 193 Ca -0.14 -1.15 -0.77 0.00 0.00 0.00 0.00 54.91 52.86 2cyp h ALA 193 Cb 0.66 0.53 -0.23 0.00 0.00 0.00 0.00 17.79 18.75 2cyp h ALA 193 CO 0.19 0.92 0.61 0.00 0.00 0.00 0.00 179.25 180.98 2cyp s ALA 194 N -2.50 4.18 -0.99 0.00 0.00 -1.26 -4.84 121.76 116.35 2cyp s ALA 194 Ca -0.20 -3.42 0.23 0.00 0.00 0.00 0.00 51.96 48.56 2cyp s ALA 194 Cb 0.05 -3.76 0.98 0.00 0.00 0.00 0.00 23.12 20.40 2cyp s ALA 194 CO 0.77 -2.48 1.74 0.09 0.00 0.00 0.00 175.76 175.88 2cyp n ASN 195 N 4.32 0.02 -0.62 0.00 3.02 -1.26 -3.39 115.26 117.35 2cyp n ASN 195 Ca 0.24 0.50 0.04 0.00 -0.03 0.00 0.00 54.58 55.33 2cyp n ASN 195 Cb 0.44 -0.51 0.06 0.00 -0.61 0.00 0.00 39.78 39.16 2cyp n ASN 195 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2cyp n ASN 196 N -1.52 0.95 -4.16 6.41 0.23 -1.26 -1.06 115.26 114.84 2cyp n ASN 196 Ca 0.06 -2.47 -0.30 0.00 -0.53 0.00 0.00 54.58 51.33 2cyp n ASN 196 Cb 0.27 -0.31 -0.17 0.00 -2.08 0.00 0.00 39.78 37.49 2cyp n ASN 196 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 2cyp s VAL 197 N -1.04 1.85 -0.36 3.53 -7.23 -1.22 -4.73 120.40 111.21 2cyp s VAL 197 Ca 0.19 -0.89 -0.29 0.00 -1.81 0.00 0.00 61.98 59.18 2cyp s VAL 197 Cb 0.19 -1.62 0.02 0.00 0.56 0.00 0.00 36.38 35.52 2cyp s VAL 197 CO -0.04 0.51 1.16 0.12 -0.31 0.00 0.00 175.10 176.55 2cyp s PHE 198 N 0.52 2.93 0.19 2.82 5.36 0.11 -4.85 117.98 125.06 2cyp s PHE 198 Ca -0.15 0.98 0.00 0.00 -0.96 0.00 0.00 56.93 56.80 2cyp s PHE 198 Cb -0.17 -3.95 -0.00 0.00 -0.34 0.00 0.00 43.02 38.55 2cyp s PHE 198 CO 0.06 -1.17 0.23 0.25 -1.46 0.00 0.00 175.22 173.13 2cyp n THR 199 N 6.24 0.00 -0.55 0.12 -2.24 -1.26 -4.42 114.28 112.17 2cyp n THR 199 Ca 0.13 -1.06 -0.02 0.00 -2.27 0.00 0.00 64.05 60.83 2cyp n THR 199 Cb 0.47 0.61 0.26 0.00 -2.10 0.00 0.00 70.33 69.58 2cyp n THR 199 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2cyp n ASN 200 N -1.98 4.35 -0.09 3.42 2.04 -1.26 -4.52 115.26 117.22 2cyp n ASN 200 Ca 0.01 -2.88 0.15 0.00 -0.44 0.00 0.00 54.58 51.42 2cyp n ASN 200 Cb 0.32 -0.68 0.54 0.00 -2.53 0.00 0.00 39.78 37.43 2cyp n ASN 200 CO 0.00 0.00 0.00 -0.08 -0.44 0.00 0.00 177.26 176.74 2cyp h GLU 201 N 2.39 0.32 -0.54 -3.83 4.81 -1.95 -2.67 114.58 113.11 2cyp h GLU 201 Ca 0.15 -0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.47 2cyp h GLU 201 Cb 1.90 -0.07 -0.09 0.00 0.63 0.00 0.00 28.75 31.12 2cyp h GLU 201 CO 0.53 0.21 0.00 0.35 -0.73 0.00 0.00 179.01 179.38 2cyp h PHE 202 N 0.33 -0.03 -0.16 0.92 3.57 -1.85 -0.45 116.94 119.27 2cyp h PHE 202 Ca 0.30 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.77 2cyp h PHE 202 Cb 0.73 0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.56 2cyp h PHE 202 CO -0.00 -0.13 -0.20 1.88 -2.23 0.00 0.00 178.31 177.64 2cyp h TYR 203 N 0.12 0.50 0.03 0.41 -1.99 -1.83 -2.14 116.97 112.07 2cyp h TYR 203 Ca 0.27 -0.16 0.03 0.00 2.00 0.00 0.00 58.73 60.87 2cyp h TYR 203 Cb 0.42 -0.10 -0.04 0.00 2.00 0.00 0.00 36.73 39.01 2cyp h TYR 203 CO -0.33 0.82 -0.26 -0.07 -0.00 0.00 0.00 178.16 178.32 2cyp h LEU 204 N 0.04 -0.76 -0.47 3.88 3.38 -1.44 -2.19 115.31 117.75 2cyp h LEU 204 Ca 0.02 0.10 0.06 0.00 0.09 0.00 0.00 57.88 58.15 2cyp h LEU 204 Cb 0.75 0.31 -0.05 0.00 0.09 0.00 0.00 40.66 41.76 2cyp h LEU 204 CO 0.05 -0.33 0.19 0.78 0.09 0.00 0.00 178.44 179.21 2cyp h ASN 205 N -0.42 0.22 -0.26 -0.43 2.35 -1.06 -1.55 115.58 114.42 2cyp h ASN 205 Ca 0.05 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 2cyp h ASN 205 Cb 0.49 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.86 2cyp h ASN 205 CO -0.21 0.16 0.15 0.25 -1.65 0.00 0.00 177.43 176.13 2cyp h LEU 206 N 0.38 0.33 -0.58 1.61 5.85 -1.13 -1.23 115.31 120.54 2cyp h LEU 206 Ca 0.22 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.75 2cyp h LEU 206 Cb 0.19 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 2cyp h LEU 206 CO -0.20 0.32 -0.48 -0.07 -0.34 0.00 0.00 178.44 177.67 2cyp h LEU 207 N 0.31 0.00 0.00 2.25 3.38 -1.33 -3.39 115.31 116.54 2cyp h LEU 207 Ca 0.09 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 2cyp h LEU 207 Cb 0.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2cyp h LEU 207 CO -0.01 0.48 -1.75 0.59 0.09 0.00 0.00 178.44 177.83 2cyp n ASN 208 N -3.44 1.77 -4.91 -0.43 4.13 -0.59 -5.02 115.26 106.77 2cyp n ASN 208 Ca 0.00 0.00 -0.27 0.00 1.68 0.00 0.00 54.58 55.99 2cyp n ASN 208 Cb 0.62 1.30 0.02 0.00 -1.54 0.00 0.00 39.78 40.18 2cyp n ASN 208 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2cyp s GLU 209 N -2.70 3.17 -0.43 3.52 0.41 -0.48 -5.04 118.70 117.14 2cyp s GLU 209 Ca -0.06 0.12 -0.17 0.00 -0.41 0.00 0.00 54.97 54.46 2cyp s GLU 209 Cb 0.07 -2.29 0.03 0.00 -1.78 0.00 0.00 34.13 30.16 2cyp s GLU 209 CO 0.57 -0.54 0.41 0.34 -0.49 0.00 0.00 175.26 175.55 2cyp s ASP 210 N -4.23 6.17 0.18 -0.19 2.15 -1.26 -4.96 116.67 114.52 2cyp s ASP 210 Ca 0.52 -0.86 -0.06 0.00 0.43 0.00 0.00 52.55 52.58 2cyp s ASP 210 Cb -0.10 -2.21 -0.06 0.00 -0.30 0.00 0.00 42.92 40.25 2cyp s ASP 210 CO 0.46 -0.59 0.44 0.26 -0.17 0.00 0.00 175.17 175.57 2cyp s TRP 211 N 1.99 3.46 -0.08 -5.34 0.52 -1.26 -4.26 118.94 113.97 2cyp s TRP 211 Ca 0.09 0.65 0.02 0.00 0.02 0.00 0.00 56.10 56.88 2cyp s TRP 211 Cb -0.19 -2.08 0.01 0.00 -1.15 0.00 0.00 33.47 30.06 2cyp s TRP 211 CO 0.11 0.36 -0.13 0.15 0.02 0.00 0.00 176.95 177.47 2cyp s LYS 212 N -2.81 1.82 -0.32 4.98 3.01 0.11 -4.91 119.74 121.62 2cyp s LYS 212 Ca 0.43 -0.44 -0.29 0.00 -1.01 0.00 0.00 55.97 54.66 2cyp s LYS 212 Cb -0.12 -1.52 -0.01 0.00 -1.01 0.00 0.00 37.83 35.17 2cyp s LYS 212 CO 0.24 0.00 1.52 -1.17 0.51 0.00 0.00 175.35 176.45 2cyp s LEU 213 N 0.77 3.71 0.33 3.17 2.96 -1.26 -0.94 118.68 127.41 2cyp s LEU 213 Ca -0.12 1.20 0.05 0.00 -0.22 0.00 0.00 54.13 55.04 2cyp s LEU 213 Cb -0.16 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 42.93 2cyp s LEU 213 CO 0.02 -1.37 0.02 -1.61 -1.32 0.00 0.00 176.35 172.09 2cyp s GLU 214 N 4.85 1.68 -0.13 1.98 2.02 -0.20 -4.98 118.70 123.91 2cyp s GLU 214 Ca 0.66 -1.91 0.01 0.00 0.02 0.00 0.00 54.97 53.75 2cyp s GLU 214 Cb -0.19 -1.09 -0.01 0.00 0.10 0.00 0.00 34.13 32.95 2cyp s GLU 214 CO 0.30 -0.10 -0.17 0.21 0.02 0.00 0.00 175.26 175.53 2cyp s LYS 215 N -3.81 3.24 0.72 1.61 2.20 -1.26 -0.35 119.74 122.09 2cyp s LYS 215 Ca 0.34 -0.76 0.02 0.00 -0.36 0.00 0.00 55.97 55.21 2cyp s LYS 215 Cb 0.08 -2.54 0.14 0.00 -1.51 0.00 0.00 37.83 33.99 2cyp s LYS 215 CO 0.15 0.14 0.99 0.54 -0.36 0.00 0.00 175.35 176.81 2cyp s ASN 216 N 0.51 4.33 0.42 1.43 2.20 0.11 -4.91 114.94 119.03 2cyp s ASN 216 Ca -0.11 -0.58 0.26 0.00 -0.94 0.00 0.00 52.86 51.49 2cyp s ASN 216 Cb -0.16 0.27 1.41 0.00 -2.00 0.00 0.00 41.25 40.77 2cyp s ASN 216 CO 0.05 -1.89 1.78 0.44 -2.94 0.00 0.00 177.10 174.54 2cyp h ASP 217 N -0.47 0.00 -0.19 3.54 5.19 -1.94 0.86 116.42 123.40 2cyp h ASP 217 Ca -0.33 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.08 2cyp h ASP 217 Cb 1.27 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.78 2cyp h ASP 217 CO 0.37 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.49 2cyp n ALA 218 N -1.82 2.49 -1.10 3.45 0.00 -1.26 -4.94 120.51 117.33 2cyp n ALA 218 Ca -0.02 -0.67 -0.04 0.00 0.00 0.00 0.00 53.44 52.71 2cyp n ALA 218 Cb 0.11 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.54 2cyp n ALA 218 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2cyp n ASN 219 N 0.79 -3.52 -4.67 0.00 2.85 0.30 -5.02 115.26 105.99 2cyp n ASN 219 Ca 0.17 0.09 -0.33 0.00 -0.11 0.00 0.00 54.58 54.40 2cyp n ASN 219 Cb 0.45 -1.33 -0.09 0.00 1.24 0.00 0.00 39.78 40.05 2cyp n ASN 219 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 2cyp s ASN 220 N -2.81 5.06 0.11 1.20 0.01 -1.25 -4.84 114.94 112.42 2cyp s ASN 220 Ca 0.00 -0.02 -0.25 0.00 -0.71 0.00 0.00 52.86 51.88 2cyp s ASN 220 Cb 0.00 -1.31 -0.07 0.00 0.41 0.00 0.00 41.25 40.28 2cyp s ASN 220 CO 0.00 0.28 0.75 -1.61 -1.51 0.00 0.00 177.10 175.01 2cyp s GLU 221 N -1.51 4.50 0.05 -0.60 2.02 -1.26 -0.71 118.70 121.19 2cyp s GLU 221 Ca 0.19 1.08 -0.08 0.00 0.02 0.00 0.00 54.97 56.18 2cyp s GLU 221 Cb -0.11 -3.29 -0.00 0.00 0.10 0.00 0.00 34.13 30.82 2cyp s GLU 221 CO 0.09 0.48 0.17 1.14 0.02 0.00 0.00 175.26 177.16 2cyp s GLN 222 N -0.76 0.69 -0.08 1.61 -2.07 0.52 -4.66 119.66 114.90 2cyp s GLN 222 Ca 0.36 -0.71 -0.30 0.00 -1.82 0.00 0.00 55.36 52.89 2cyp s GLN 222 Cb -0.22 0.28 -0.02 0.00 -1.09 0.00 0.00 33.01 31.96 2cyp s GLN 222 CO 0.24 -0.20 1.13 -1.58 -1.32 0.00 0.00 175.29 173.57 2cyp s TRP 223 N -2.77 3.29 0.02 9.60 0.52 -0.77 -1.03 118.94 127.79 2cyp s TRP 223 Ca -0.03 1.34 0.08 0.00 0.02 0.00 0.00 56.10 57.50 2cyp s TRP 223 Cb -0.00 -3.34 -0.03 0.00 -1.15 0.00 0.00 33.47 28.95 2cyp s TRP 223 CO -0.05 -0.95 -0.22 -0.51 0.02 0.00 0.00 176.95 175.25 2cyp s ASP 224 N 1.36 3.50 0.25 2.95 1.01 -0.12 0.04 116.67 125.66 2cyp s ASP 224 Ca 0.53 -0.47 0.10 0.00 0.71 0.00 0.00 52.55 53.42 2cyp s ASP 224 Cb -0.22 -0.49 -0.04 0.00 1.01 0.00 0.00 42.92 43.18 2cyp s ASP 224 CO 0.20 0.28 -0.07 -0.94 0.21 0.00 0.00 175.17 174.85 2cyp s SER 225 N -1.18 4.28 0.49 0.27 1.04 -0.48 -0.71 113.70 117.40 2cyp s SER 225 Ca 0.13 -0.71 0.26 0.00 0.48 0.00 0.00 55.95 56.11 2cyp s SER 225 Cb -0.10 -0.70 1.23 0.00 0.10 0.00 0.00 66.02 66.54 2cyp s SER 225 CO 0.03 0.03 1.97 0.07 0.98 0.00 0.00 173.24 176.32 2cyp h LYS 226 N 2.20 0.00 0.00 4.02 -0.00 -1.89 -2.21 116.57 118.70 2cyp h LYS 226 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.21 2cyp h LYS 226 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.47 2cyp h LYS 226 CO 0.59 0.17 0.00 0.43 -0.00 0.00 0.00 179.45 180.64 2cyp n SER 227 N -3.52 0.00 0.00 7.07 7.64 -1.26 -4.89 113.62 118.66 2cyp n SER 227 Ca -0.01 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.11 2cyp n SER 227 Cb 0.32 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 2cyp n SER 227 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cyp n GLY 228 N 0.72 0.90 3.99 0.23 0.00 -0.83 -5.07 105.19 105.13 2cyp n GLY 228 Ca 0.08 -0.14 -0.18 0.00 0.00 0.00 0.00 46.02 45.78 2cyp n GLY 228 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cyp s TYR 229 N -2.00 2.92 0.11 1.61 4.12 -1.25 -4.53 117.35 118.33 2cyp s TYR 229 Ca 0.00 -0.33 0.03 0.00 0.02 0.00 0.00 57.07 56.79 2cyp s TYR 229 Cb 0.00 -2.20 -0.04 0.00 -1.52 0.00 0.00 41.96 38.20 2cyp s TYR 229 CO 0.00 -0.23 -0.09 0.00 0.02 0.00 0.00 175.55 175.25 2cyp s MET 230 N -4.26 0.89 -0.03 -0.62 0.23 0.32 -1.38 119.30 114.45 2cyp s MET 230 Ca 0.50 -1.27 0.02 0.00 -1.03 0.00 0.00 55.69 53.91 2cyp s MET 230 Cb -0.09 -0.45 0.01 0.00 -1.53 0.00 0.00 34.83 32.76 2cyp s MET 230 CO 0.32 0.05 -0.08 -1.64 -2.03 0.00 0.00 175.02 171.64 2cyp s MET 231 N -3.30 0.87 0.69 3.16 -1.94 0.11 -4.21 119.30 114.67 2cyp s MET 231 Ca 0.10 -0.25 -0.11 0.00 -1.71 0.00 0.00 55.69 53.71 2cyp s MET 231 Cb 0.01 -0.82 0.01 0.00 2.01 0.00 0.00 34.83 36.03 2cyp s MET 231 CO -0.01 0.08 1.06 -0.51 -0.01 0.00 0.00 175.02 175.62 2cyp s LEU 232 N 0.29 3.16 0.29 -0.03 1.43 -1.26 -1.86 118.68 120.70 2cyp s LEU 232 Ca -0.04 1.64 0.04 0.00 -1.03 0.00 0.00 54.13 54.74 2cyp s LEU 232 Cb -0.09 -4.50 0.68 0.00 0.03 0.00 0.00 46.19 42.31 2cyp s LEU 232 CO 0.00 -1.45 1.77 -0.65 0.23 0.00 0.00 176.35 176.25 2cyp h PRO 233 N -0.65 0.68 -0.11 1.29 0.11 -1.83 -0.63 132.00 130.87 2cyp h PRO 233 Ca -0.44 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.51 2cyp h PRO 233 Cb 1.21 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2cyp h PRO 233 CO 0.57 0.45 -0.45 1.79 -0.21 0.00 0.00 178.00 180.14 2cyp h THR 234 N 0.70 1.33 -0.19 -1.15 1.35 -1.57 -1.90 112.91 111.48 2cyp h THR 234 Ca 0.55 -1.62 -0.03 0.00 -0.55 0.00 0.00 66.41 64.75 2cyp h THR 234 Cb 0.84 1.75 -0.01 0.00 -1.73 0.00 0.00 68.15 69.00 2cyp h THR 234 CO -0.39 0.48 0.00 0.44 -0.25 0.00 0.00 175.52 175.81 2cyp h ASP 235 N 0.21 0.32 0.25 5.36 3.32 -1.53 -3.26 116.42 121.09 2cyp h ASP 235 Ca 0.01 -0.30 -0.04 0.00 0.02 0.00 0.00 57.03 56.72 2cyp h ASP 235 Cb 0.88 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 2cyp h ASP 235 CO 0.07 0.55 -0.21 0.22 -1.72 0.00 0.00 179.24 178.15 2cyp h TYR 236 N 0.09 0.00 -0.23 4.55 5.03 -0.97 -2.47 116.97 122.96 2cyp h TYR 236 Ca 0.05 0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.43 2cyp h TYR 236 Cb 0.38 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.65 2cyp h TYR 236 CO 0.03 0.21 0.30 0.66 -1.32 0.00 0.00 178.16 178.04 2cyp h SER 237 N 0.00 0.00 0.62 -2.11 4.64 -1.39 -1.00 113.55 114.31 2cyp h SER 237 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 2cyp h SER 237 Cb 0.39 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 2cyp h SER 237 CO 0.03 0.00 -0.23 -0.07 -0.87 0.00 0.00 176.83 175.69 2cyp h LEU 238 N 0.00 0.00 -1.54 5.97 3.38 -1.57 -1.75 115.31 119.80 2cyp h LEU 238 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2cyp h LEU 238 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2cyp h LEU 238 CO -0.00 0.23 -0.19 2.30 0.09 0.00 0.00 178.44 180.87 2cyp n ILE 239 N -3.60 0.00 0.06 1.22 -5.35 -0.39 -1.73 119.36 109.58 2cyp n ILE 239 Ca -0.01 -0.41 0.02 0.00 -0.27 0.00 0.00 62.75 62.08 2cyp n ILE 239 Cb 0.36 1.39 -0.05 0.00 -1.74 0.00 0.00 39.64 39.61 2cyp n ILE 239 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 2cyp h GLN 240 N 3.71 0.00 -5.68 6.28 4.20 -1.27 -3.46 115.11 118.89 2cyp h GLN 240 Ca 0.00 0.00 -0.66 0.00 0.06 0.00 0.00 58.65 58.05 2cyp h GLN 240 Cb 0.88 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.55 2cyp h GLN 240 CO 0.00 0.29 -0.55 0.34 -0.67 0.00 0.00 178.83 178.25 2cyp s ASP 241 N -5.86 5.84 0.23 1.46 2.15 -0.95 -5.00 116.67 114.53 2cyp s ASP 241 Ca -0.01 0.28 -0.01 0.00 0.43 0.00 0.00 52.55 53.24 2cyp s ASP 241 Cb 0.09 -1.84 0.23 0.00 -0.30 0.00 0.00 42.92 41.09 2cyp s ASP 241 CO 0.79 0.35 1.60 1.55 -0.17 0.00 0.00 175.17 179.29 2cyp h PRO 242 N 5.42 0.53 -0.07 4.34 0.13 -1.90 0.82 132.00 141.27 2cyp h PRO 242 Ca -0.50 -0.27 -0.04 0.00 -0.87 0.00 0.00 66.00 64.33 2cyp h PRO 242 Cb 1.20 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2cyp h PRO 242 CO 0.60 0.85 -0.09 0.87 -0.23 0.00 0.00 178.00 179.99 2cyp h LYS 243 N 0.43 0.19 -0.08 0.86 6.56 -1.94 -3.05 116.57 119.54 2cyp h LYS 243 Ca 0.04 -0.11 0.02 0.00 -1.06 0.00 0.00 60.65 59.54 2cyp h LYS 243 Cb 0.91 0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 32.56 2cyp h LYS 243 CO 0.08 0.65 -0.05 1.88 -2.06 0.00 0.00 179.45 179.95 2cyp h TYR 244 N -0.26 -0.12 -0.99 -1.35 0.99 -1.79 -3.11 116.97 110.34 2cyp h TYR 244 Ca 0.01 0.01 0.10 0.00 2.00 0.00 0.00 58.73 60.85 2cyp h TYR 244 Cb 0.63 0.07 -0.08 0.00 1.00 0.00 0.00 36.73 38.35 2cyp h TYR 244 CO 0.10 -0.08 0.63 1.25 -0.00 0.00 0.00 178.16 180.05 2cyp h LEU 245 N -0.05 0.96 -1.37 3.88 5.85 0.05 -0.20 115.31 124.43 2cyp h LEU 245 Ca 0.05 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2cyp h LEU 245 Cb 0.13 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 2cyp h LEU 245 CO -0.12 0.55 0.43 0.28 -0.34 0.00 0.00 178.44 179.25 2cyp h SER 246 N 1.06 0.73 0.15 1.25 0.02 -1.47 -0.83 113.55 114.46 2cyp h SER 246 Ca 0.46 -0.02 -0.30 0.00 -0.84 0.00 0.00 61.79 61.09 2cyp h SER 246 Cb 0.35 -0.18 0.03 0.00 0.14 0.00 0.00 62.40 62.74 2cyp h SER 246 CO -0.23 0.52 -1.27 0.40 -1.14 0.00 0.00 176.83 175.11 2cyp h ILE 247 N 0.86 1.28 -0.63 3.27 2.04 -1.26 -1.38 117.51 121.69 2cyp h ILE 247 Ca 0.25 -2.49 0.13 0.00 1.00 0.00 0.00 64.86 63.74 2cyp h ILE 247 Cb -0.06 2.73 -0.10 0.00 -0.74 0.00 0.00 36.82 38.65 2cyp h ILE 247 CO -0.06 0.76 0.07 0.58 0.00 0.00 0.00 178.15 179.50 2cyp h VAL 248 N 0.27 0.54 -0.12 1.67 2.07 -0.93 0.71 116.25 120.45 2cyp h VAL 248 Ca -0.19 -0.06 -0.14 0.00 0.82 0.00 0.00 66.70 67.12 2cyp h VAL 248 Cb 1.94 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.05 2cyp h VAL 248 CO 0.24 0.03 -0.54 0.11 0.02 0.00 0.00 177.57 177.43 2cyp h LYS 249 N 0.18 0.36 -0.54 1.57 1.57 -0.93 -2.05 116.57 116.72 2cyp h LYS 249 Ca 0.33 -0.22 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 2cyp h LYS 249 Cb 0.54 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 2cyp h LYS 249 CO -0.49 0.81 0.19 1.49 -0.57 0.00 0.00 179.45 180.89 2cyp h GLU 250 N 0.28 0.83 0.00 3.15 4.81 0.20 -2.76 114.58 121.09 2cyp h GLU 250 Ca 0.01 -0.16 -0.04 0.00 -0.13 0.00 0.00 59.36 59.04 2cyp h GLU 250 Cb 1.04 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 2cyp h GLU 250 CO 0.09 0.74 -0.17 1.88 -0.73 0.00 0.00 179.01 180.82 2cyp h TYR 251 N 0.74 0.00 0.00 0.92 0.99 -0.89 -2.24 116.97 116.50 2cyp h TYR 251 Ca 0.18 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.79 2cyp h TYR 251 Cb 0.24 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 37.95 2cyp h TYR 251 CO 0.01 0.17 -0.55 0.00 -0.00 0.00 0.00 178.16 177.80 2cyp h ALA 252 N 1.83 1.01 -0.13 3.88 0.00 -1.31 -3.14 119.26 121.40 2cyp h ALA 252 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2cyp h ALA 252 Cb 0.96 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2cyp h ALA 252 CO 0.02 0.69 0.00 0.09 0.00 0.00 0.00 179.25 180.05 2cyp n ASN 253 N -3.77 2.80 -3.32 0.00 3.02 -1.02 -4.80 115.26 108.17 2cyp n ASN 253 Ca -0.01 -1.84 -0.12 0.00 -0.03 0.00 0.00 54.58 52.58 2cyp n ASN 253 Cb 0.58 -0.07 -0.06 0.00 -0.61 0.00 0.00 39.78 39.61 2cyp n ASN 253 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2cyp s ASP 254 N -1.51 0.48 0.29 6.41 -1.08 -0.87 -5.01 116.67 115.37 2cyp s ASP 254 Ca 0.26 -1.20 -0.02 0.00 -0.52 0.00 0.00 52.55 51.07 2cyp s ASP 254 Cb 0.17 0.94 0.44 0.00 -1.46 0.00 0.00 42.92 43.01 2cyp s ASP 254 CO 0.25 -0.26 1.93 1.56 0.52 0.00 0.00 175.17 179.17 2cyp h GLN 255 N 7.25 1.11 -0.45 4.34 4.20 -1.87 -2.72 115.11 126.97 2cyp h GLN 255 Ca 0.02 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.60 2cyp h GLN 255 Cb 1.09 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 28.61 2cyp h GLN 255 CO 0.19 0.73 0.01 0.22 -0.67 0.00 0.00 178.83 179.31 2cyp h ASP 256 N 1.14 0.78 -0.38 1.46 3.58 -1.95 0.12 116.42 121.17 2cyp h ASP 256 Ca 0.37 -0.30 -0.02 0.00 0.42 0.00 0.00 57.03 57.50 2cyp h ASP 256 Cb 0.04 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.86 2cyp h ASP 256 CO -0.12 0.89 0.17 0.50 -2.88 0.00 0.00 179.24 177.81 2cyp h LYS 257 N 0.64 0.56 0.46 0.28 1.63 -1.93 -1.33 116.57 116.88 2cyp h LYS 257 Ca 0.13 -0.09 -0.01 0.00 -0.85 0.00 0.00 60.65 59.83 2cyp h LYS 257 Cb 0.49 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.00 2cyp h LYS 257 CO 0.02 0.51 -0.40 0.35 -3.45 0.00 0.00 179.45 176.48 2cyp h PHE 258 N 0.48 -1.08 -0.44 1.91 3.57 -1.15 -0.71 116.94 119.51 2cyp h PHE 258 Ca 0.13 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.72 2cyp h PHE 258 Cb 0.14 0.41 -0.09 0.00 2.79 0.00 0.00 35.95 39.21 2cyp h PHE 258 CO -0.01 -0.56 -0.17 0.74 -2.23 0.00 0.00 178.31 176.08 2cyp h PHE 259 N -0.86 -0.40 -0.97 0.41 0.05 -0.52 0.09 116.94 114.74 2cyp h PHE 259 Ca -0.05 0.04 0.01 0.00 3.82 0.00 0.00 57.97 61.80 2cyp h PHE 259 Cb 0.75 0.24 -0.05 0.00 2.00 0.00 0.00 35.95 38.89 2cyp h PHE 259 CO -0.19 -0.25 0.64 -0.22 -0.18 0.00 0.00 178.31 178.11 2cyp h LYS 260 N -0.07 1.26 -0.01 1.51 3.64 -1.12 -0.92 116.57 120.86 2cyp h LYS 260 Ca 0.21 -0.08 -0.23 0.00 -1.27 0.00 0.00 60.65 59.28 2cyp h LYS 260 Cb 0.40 -0.28 0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2cyp h LYS 260 CO -0.49 0.83 -0.95 -0.44 -2.27 0.00 0.00 179.45 176.13 2cyp h ASP 261 N 1.29 0.63 -0.49 4.20 3.32 -0.90 -2.77 116.42 121.71 2cyp h ASP 261 Ca 0.36 -0.50 -0.10 0.00 0.02 0.00 0.00 57.03 56.81 2cyp h ASP 261 Cb -0.12 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.22 2cyp h ASP 261 CO -0.09 1.30 -0.08 0.15 -1.72 0.00 0.00 179.24 178.80 2cyp h PHE 262 N 0.28 1.05 -0.32 4.55 3.57 -0.80 -2.38 116.94 122.89 2cyp h PHE 262 Ca -0.09 -0.20 0.01 0.00 3.53 0.00 0.00 57.97 61.22 2cyp h PHE 262 Cb 1.59 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 40.05 2cyp h PHE 262 CO 0.07 0.98 0.20 1.03 -2.23 0.00 0.00 178.31 178.35 2cyp h SER 263 N 0.86 0.33 -0.05 0.41 0.87 -1.09 0.27 113.55 115.15 2cyp h SER 263 Ca 0.14 -0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.72 2cyp h SER 263 Cb 0.61 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 2cyp h SER 263 CO 0.04 0.24 -0.04 0.11 -0.53 0.00 0.00 176.83 176.65 2cyp h LYS 264 N 0.40 -0.05 -0.38 2.24 6.56 -1.49 -0.95 116.57 122.89 2cyp h LYS 264 Ca 0.12 0.00 -0.14 0.00 -1.06 0.00 0.00 60.65 59.58 2cyp h LYS 264 Cb -0.02 0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 31.64 2cyp h LYS 264 CO -0.04 -0.03 -0.31 0.00 -2.06 0.00 0.00 179.45 177.00 2cyp h ALA 265 N 1.00 0.73 -0.42 3.86 0.00 -1.15 -2.01 119.26 121.27 2cyp h ALA 265 Ca 0.04 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.43 2cyp h ALA 265 Cb 0.11 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2cyp h ALA 265 CO -0.09 0.66 -0.13 0.35 0.00 0.00 0.00 179.25 180.05 2cyp h PHE 266 N 0.71 0.94 -0.72 0.00 -0.00 -0.41 -1.07 116.94 116.38 2cyp h PHE 266 Ca 0.08 -0.21 -0.07 0.00 -0.00 0.00 0.00 57.97 57.77 2cyp h PHE 266 Cb 0.86 -0.23 -0.03 0.00 -0.00 0.00 0.00 35.95 36.56 2cyp h PHE 266 CO 0.05 0.96 0.20 1.49 -0.00 0.00 0.00 178.31 181.00 2cyp h GLU 267 N 0.65 1.14 -0.66 1.11 4.81 -1.11 -1.20 114.58 119.32 2cyp h GLU 267 Ca 0.10 -0.26 -0.01 0.00 -0.13 0.00 0.00 59.36 59.06 2cyp h GLU 267 Cb 0.67 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.86 2cyp h GLU 267 CO 0.05 0.99 0.37 -0.22 -0.73 0.00 0.00 179.01 179.47 2cyp h LYS 268 N 1.08 0.91 -0.24 1.92 3.64 -1.35 -0.67 116.57 121.86 2cyp h LYS 268 Ca 0.23 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2cyp h LYS 268 Cb 0.35 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2cyp h LYS 268 CO -0.00 0.67 0.16 1.25 -2.27 0.00 0.00 179.45 179.26 2cyp h LEU 269 N 0.89 0.28 -1.67 5.20 5.85 -0.72 -0.97 115.31 124.18 2cyp h LEU 269 Ca 0.23 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 2cyp h LEU 269 Cb 0.02 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 40.98 2cyp h LEU 269 CO -0.04 0.20 -0.03 -0.07 -0.34 0.00 0.00 178.44 178.17 2cyp h LEU 270 N 0.33 0.00 0.00 2.25 3.38 -0.53 -3.27 115.31 117.47 2cyp h LEU 270 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2cyp h LEU 270 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2cyp h LEU 270 CO -0.02 0.03 -1.29 -0.62 0.09 0.00 0.00 178.44 176.63 2cyp n GLU 271 N -3.14 0.22 -1.68 1.13 1.02 -0.33 -4.66 120.64 113.20 2cyp n GLU 271 Ca -0.00 -0.06 -0.45 0.00 -0.02 0.00 0.00 57.16 56.63 2cyp n GLU 271 Cb 0.28 -1.51 -0.03 0.00 -0.02 0.00 0.00 31.44 30.16 2cyp n GLU 271 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2cyp n ASN 272 N -1.76 2.89 0.00 1.62 3.02 -0.43 -2.12 115.26 118.48 2cyp n ASN 272 Ca 0.01 1.13 0.00 0.00 -0.03 0.00 0.00 54.58 55.70 2cyp n ASN 272 Cb 0.41 -1.44 0.00 0.00 -0.61 0.00 0.00 39.78 38.14 2cyp n ASN 272 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cyp n GLY 273 N 2.32 0.96 3.67 7.41 0.00 -1.26 -4.36 105.19 113.93 2cyp n GLY 273 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 2cyp n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cyp s ILE 274 N -2.55 4.97 -0.26 -0.61 1.01 -0.90 -4.25 121.20 118.62 2cyp s ILE 274 Ca 0.00 0.03 -0.11 0.00 0.00 0.00 0.00 60.65 60.57 2cyp s ILE 274 Cb 0.00 -3.24 -0.05 0.00 0.01 0.00 0.00 42.46 39.18 2cyp s ILE 274 CO 0.00 0.47 0.17 -0.89 0.00 0.00 0.00 174.94 174.69 2cyp s THR 275 N 0.24 5.30 -0.29 2.92 2.01 0.23 -4.99 115.64 121.07 2cyp s THR 275 Ca 0.05 0.16 -0.08 0.00 0.31 0.00 0.00 61.69 62.13 2cyp s THR 275 Cb -0.12 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 68.89 2cyp s THR 275 CO -0.00 0.31 0.12 -0.36 -0.69 0.00 0.00 174.62 173.99 2cyp s PHE 276 N 1.37 3.15 0.74 4.92 0.08 -1.26 -1.19 117.98 125.78 2cyp s PHE 276 Ca 0.07 -0.63 -0.15 0.00 0.12 0.00 0.00 56.93 56.34 2cyp s PHE 276 Cb -0.15 -2.30 0.04 0.00 -0.57 0.00 0.00 43.02 40.05 2cyp s PHE 276 CO 0.07 -0.46 1.23 -2.14 -0.10 0.00 0.00 175.22 173.82 2cyp s PRO 277 N 1.59 2.05 0.58 0.24 0.02 -1.26 -4.88 135.00 133.34 2cyp s PRO 277 Ca 0.05 1.82 0.27 0.00 0.02 0.00 0.00 61.00 63.16 2cyp s PRO 277 Cb -0.17 -1.82 1.65 0.00 0.02 0.00 0.00 34.50 34.19 2cyp s PRO 277 CO 0.05 -1.92 2.15 1.57 -0.33 0.00 0.00 177.00 178.52 2cyp h LYS 278 N -0.32 0.00 0.00 5.54 -0.00 -2.01 0.82 116.57 120.59 2cyp h LYS 278 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.17 2cyp h LYS 278 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.53 2cyp h LYS 278 CO 0.49 0.00 0.00 0.22 -0.00 0.00 0.00 179.45 180.16 2cyp h ASP 279 N 0.00 0.00 -4.06 7.07 3.58 -2.04 -3.46 116.42 117.51 2cyp h ASP 279 Ca 0.06 0.00 -0.50 0.00 0.42 0.00 0.00 57.03 57.01 2cyp h ASP 279 Cb 0.32 0.00 0.07 0.00 1.72 0.00 0.00 39.33 41.44 2cyp h ASP 279 CO -0.00 0.00 0.45 0.00 -2.88 0.00 0.00 179.24 176.81 2cyp s ALA 280 N -3.68 2.78 0.84 -0.78 0.00 0.28 -5.00 121.76 116.19 2cyp s ALA 280 Ca 0.00 0.87 -0.11 0.00 0.00 0.00 0.00 51.96 52.72 2cyp s ALA 280 Cb 0.10 -3.37 0.10 0.00 0.00 0.00 0.00 23.12 19.94 2cyp s ALA 280 CO 0.46 -0.75 1.14 -1.25 0.00 0.00 0.00 175.76 175.36 2cyp s PRO 281 N -3.10 1.60 0.71 0.00 0.04 -1.26 -5.00 135.00 127.99 2cyp s PRO 281 Ca 0.70 1.46 -0.15 0.00 0.04 0.00 0.00 61.00 63.06 2cyp s PRO 281 Cb -0.26 -1.80 0.03 0.00 0.04 0.00 0.00 34.50 32.51 2cyp s PRO 281 CO 0.30 -2.18 1.15 -1.12 0.04 0.00 0.00 177.00 175.19 2cyp s SER 282 N -2.80 4.57 0.39 6.66 0.01 -1.26 -4.97 113.70 116.30 2cyp s SER 282 Ca 0.66 2.15 -0.27 0.00 1.31 0.00 0.00 55.95 59.80 2cyp s SER 282 Cb -0.22 -2.57 -0.11 0.00 0.21 0.00 0.00 66.02 63.34 2cyp s SER 282 CO 0.55 -2.00 1.41 -2.65 0.41 0.00 0.00 173.24 170.96 2cyp n PRO 283 N -2.69 2.39 -3.23 12.44 -0.02 -1.26 -4.94 135.00 137.69 2cyp n PRO 283 Ca 0.12 0.84 -0.38 0.00 -2.02 0.00 0.00 63.50 62.06 2cyp n PRO 283 Cb 0.51 -2.55 -0.06 0.00 -0.02 0.00 0.00 33.50 31.39 2cyp n PRO 283 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2cyp s PHE 284 N -1.14 3.78 -0.30 6.00 2.99 0.97 -4.79 117.98 125.50 2cyp s PHE 284 Ca 0.56 1.31 -0.08 0.00 0.00 0.00 0.00 56.93 58.72 2cyp s PHE 284 Cb -0.50 -2.53 -0.00 0.00 0.00 0.00 0.00 43.02 39.99 2cyp s PHE 284 CO 0.62 0.54 0.12 0.42 -0.00 0.00 0.00 175.22 176.91 2cyp s ILE 285 N -1.20 4.30 0.24 0.64 -1.09 -1.26 -1.26 121.20 121.57 2cyp s ILE 285 Ca 0.32 -0.54 -0.30 0.00 -2.23 0.00 0.00 60.65 57.90 2cyp s ILE 285 Cb -0.19 -3.20 -0.09 0.00 -1.58 0.00 0.00 42.46 37.40 2cyp s ILE 285 CO 0.20 0.08 0.95 -0.36 -1.23 0.00 0.00 174.94 174.58 2cyp s PHE 286 N 1.56 3.97 0.26 3.97 0.08 -1.26 -5.04 117.98 121.52 2cyp s PHE 286 Ca 0.04 1.91 -0.24 0.00 0.12 0.00 0.00 56.93 58.75 2cyp s PHE 286 Cb -0.17 -2.99 -0.09 0.00 -0.57 0.00 0.00 43.02 39.20 2cyp s PHE 286 CO 0.04 0.41 0.86 0.15 -0.10 0.00 0.00 175.22 176.58 2cyp s LYS 287 N -1.20 4.51 0.96 0.44 1.02 -1.26 -5.00 119.74 119.20 2cyp s LYS 287 Ca 0.41 1.19 -0.13 0.00 0.02 0.00 0.00 55.97 57.46 2cyp s LYS 287 Cb -0.26 -2.94 0.16 0.00 -0.52 0.00 0.00 37.83 34.28 2cyp s LYS 287 CO 0.32 0.38 1.14 0.95 -0.92 0.00 0.00 175.35 177.22 2cyp s THR 288 N -1.48 1.96 0.21 2.17 -4.23 -1.26 -4.90 115.64 108.12 2cyp s THR 288 Ca 0.45 0.00 -0.09 0.00 -1.18 0.00 0.00 61.69 60.87 2cyp s THR 288 Cb -0.19 -2.70 0.16 0.00 1.34 0.00 0.00 72.50 71.10 2cyp s THR 288 CO 0.24 0.00 1.83 -0.07 -0.54 0.00 0.00 174.62 176.09 2cyp h LEU 289 N -1.68 0.69 -0.67 4.79 3.38 -1.97 -2.15 115.31 117.70 2cyp h LEU 289 Ca -0.50 0.01 0.06 0.00 0.09 0.00 0.00 57.88 57.54 2cyp h LEU 289 Cb 1.32 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.89 2cyp h LEU 289 CO 0.57 0.46 0.37 -0.08 0.09 0.00 0.00 178.44 179.85 2cyp h GLU 290 N 0.82 0.65 0.00 1.13 4.81 -1.93 0.03 114.58 120.09 2cyp h GLU 290 Ca 0.31 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.47 2cyp h GLU 290 Cb 0.11 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 2cyp h GLU 290 CO -0.15 0.43 -0.12 0.93 -0.73 0.00 0.00 179.01 179.38 2cyp h GLU 291 N 0.67 0.00 0.00 1.92 5.08 -1.84 -2.85 114.58 117.56 2cyp h GLU 291 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 2cyp h GLU 291 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2cyp h GLU 291 CO -0.20 0.12 -0.45 1.04 -1.00 0.00 0.00 179.01 178.52 2cyp n GLN 292 N -3.25 0.00 -1.09 2.33 6.02 -0.16 -4.94 117.38 116.28 2cyp n GLN 292 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.96 2cyp n GLN 292 Cb 0.38 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.12 2cyp n GLN 292 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cyp n GLY 293 N 1.50 0.63 0.47 1.08 0.00 -0.27 -5.08 105.19 103.52 2cyp n GLY 293 Ca 0.06 -0.71 0.14 0.00 0.00 0.00 0.00 46.02 45.50 2cyp n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36