#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ccg s VAL 5 N 0.00 3.74 -0.36 4.08 1.01 -1.26 -4.81 120.40 122.80 1ccg s VAL 5 Ca 0.00 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1ccg s VAL 5 Cb 0.00 -2.54 0.11 0.00 0.00 0.00 0.00 36.38 33.95 1ccg s VAL 5 CO 0.00 0.59 0.12 -1.00 0.00 0.00 0.00 175.10 174.81 1ccg s HIS 6 N -0.74 2.64 0.02 5.22 3.76 -1.26 -5.05 115.29 119.87 1ccg s HIS 6 Ca 0.11 -2.45 -0.23 0.00 -0.15 0.00 0.00 55.06 52.34 1ccg s HIS 6 Cb -0.11 -2.29 -0.05 0.00 1.11 0.00 0.00 32.58 31.23 1ccg s HIS 6 CO 0.02 -0.88 0.69 0.08 -0.85 0.00 0.00 174.74 173.80 1ccg s VAL 7 N 0.97 4.82 -0.09 -0.90 1.01 -1.26 -0.78 120.40 124.18 1ccg s VAL 7 Ca 0.12 1.46 -0.30 0.00 0.00 0.00 0.00 61.98 63.27 1ccg s VAL 7 Cb -0.20 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1ccg s VAL 7 CO -0.12 0.38 1.43 0.00 0.00 0.00 0.00 175.10 176.78 1ccg s ALA 8 N -0.04 3.62 -0.26 5.51 0.00 0.07 -4.86 121.76 125.80 1ccg s ALA 8 Ca 0.35 0.72 -0.00 0.00 0.00 0.00 0.00 51.96 53.03 1ccg s ALA 8 Cb -0.19 -3.65 0.04 0.00 0.00 0.00 0.00 23.12 19.31 1ccg s ALA 8 CO 0.20 -1.18 -0.07 0.45 0.00 0.00 0.00 175.76 175.17 1ccg s SER 9 N 2.41 4.40 0.29 0.00 0.15 0.23 -4.74 113.70 116.44 1ccg s SER 9 Ca 0.63 -1.07 -0.30 0.00 0.70 0.00 0.00 55.95 55.92 1ccg s SER 9 Cb -0.28 -1.64 -0.13 0.00 -1.71 0.00 0.00 66.02 62.27 1ccg s SER 9 CO 0.23 -0.16 1.40 0.52 1.20 0.00 0.00 173.24 176.42 1ccg n VAL 10 N 4.60 1.39 -1.68 4.45 0.31 -1.26 -4.31 118.33 121.83 1ccg n VAL 10 Ca -0.15 -0.35 -0.44 0.00 -0.01 0.00 0.00 64.34 63.39 1ccg n VAL 10 Cb 0.45 -1.62 -0.03 0.00 -0.91 0.00 0.00 33.84 31.73 1ccg n VAL 10 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ccg n GLU 11 N 1.45 2.67 -1.62 5.55 4.71 -1.26 -4.76 120.64 127.38 1ccg n GLU 11 Ca 0.08 0.97 -0.49 0.00 -0.01 0.00 0.00 57.16 57.71 1ccg n GLU 11 Cb 0.34 -2.87 -0.05 0.00 -1.01 0.00 0.00 31.44 27.85 1ccg n GLU 11 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 1ccg n LYS 12 N 6.25 1.79 -0.07 3.49 4.81 -1.26 -1.47 118.16 131.69 1ccg n LYS 12 Ca 0.19 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 1ccg n LYS 12 Cb 0.36 -2.61 0.00 0.00 0.02 0.00 0.00 35.03 32.80 1ccg n LYS 12 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ccg n GLY 13 N 5.04 0.56 3.85 3.14 0.00 -1.26 -5.04 105.19 111.48 1ccg n GLY 13 Ca 0.28 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.94 1ccg n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ccg s ARG 14 N -0.82 3.80 0.06 1.61 1.81 -0.55 -5.09 118.95 119.78 1ccg s ARG 14 Ca 0.00 0.26 0.00 0.00 -1.72 0.00 0.00 55.73 54.27 1ccg s ARG 14 Cb 0.00 -3.12 0.00 0.00 -0.45 0.00 0.00 34.95 31.38 1ccg s ARG 14 CO 0.00 0.64 0.01 -1.13 -0.68 0.00 0.00 175.30 174.14 1ccg n SER 15 N 1.41 1.93 -0.23 0.23 3.41 -1.26 -4.90 113.62 114.21 1ccg n SER 15 Ca -0.12 -1.24 0.03 0.00 -0.26 0.00 0.00 58.87 57.29 1ccg n SER 15 Cb 0.53 0.03 0.15 0.00 -0.26 0.00 0.00 64.21 64.66 1ccg n SER 15 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1ccg h TYR 16 N 0.91 0.29 -0.11 7.33 3.20 -2.00 -2.15 116.97 124.43 1ccg h TYR 16 Ca -0.05 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 1ccg h TYR 16 Cb 0.14 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 1ccg h TYR 16 CO 0.00 -0.03 -0.02 0.93 -1.64 0.00 0.00 178.16 177.39 1ccg h GLU 17 N 0.30 0.15 -0.23 1.82 3.07 -1.98 -0.51 114.58 117.19 1ccg h GLU 17 Ca 0.37 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 59.19 1ccg h GLU 17 Cb 0.59 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.47 1ccg h GLU 17 CO -0.45 0.19 0.03 -0.44 -1.40 0.00 0.00 179.01 176.94 1ccg h ASP 18 N 0.15 0.37 -0.58 1.42 3.32 -1.78 -2.73 116.42 116.59 1ccg h ASP 18 Ca 0.04 -0.27 -0.10 0.00 0.02 0.00 0.00 57.03 56.71 1ccg h ASP 18 Cb 0.15 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 1ccg h ASP 18 CO 0.00 0.55 -0.03 -0.26 -1.72 0.00 0.00 179.24 177.78 1ccg h PHE 19 N 0.18 1.15 -0.33 4.55 0.04 -1.44 -2.63 116.94 118.46 1ccg h PHE 19 Ca 0.07 -0.21 0.03 0.00 2.80 0.00 0.00 57.97 60.65 1ccg h PHE 19 Cb 0.34 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.18 1ccg h PHE 19 CO 0.02 1.03 0.22 0.37 -0.60 0.00 0.00 178.31 179.36 1ccg h GLN 20 N 0.94 0.33 -0.42 1.51 5.75 -1.07 -0.44 115.11 121.71 1ccg h GLN 20 Ca 0.16 -0.02 -0.09 0.00 -0.15 0.00 0.00 58.65 58.56 1ccg h GLN 20 Cb 0.60 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.05 1ccg h GLN 20 CO 0.04 0.22 -0.09 0.87 -2.65 0.00 0.00 178.83 177.22 1ccg h LYS 21 N 0.34 0.74 -0.36 1.69 1.57 -1.15 -0.50 116.57 118.89 1ccg h LYS 21 Ca 0.13 -0.23 -0.14 0.00 -1.87 0.00 0.00 60.65 58.54 1ccg h LYS 21 Cb 0.11 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1ccg h LYS 21 CO -0.03 0.81 -0.34 0.28 -0.57 0.00 0.00 179.45 179.60 1ccg h VAL 22 N 0.67 1.28 0.76 0.50 2.07 -0.90 -0.90 116.25 119.72 1ccg h VAL 22 Ca 0.12 -1.50 -0.04 0.00 0.82 0.00 0.00 66.70 66.10 1ccg h VAL 22 Cb 0.54 1.36 0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1ccg h VAL 22 CO 0.03 0.50 -0.36 0.22 0.02 0.00 0.00 177.57 177.97 1ccg h TYR 23 N 0.69 -0.95 -0.92 1.57 5.03 -0.97 -1.69 116.97 119.73 1ccg h TYR 23 Ca 0.07 -0.02 0.27 0.00 2.58 0.00 0.00 58.73 61.62 1ccg h TYR 23 Cb 0.90 0.31 -0.15 0.00 1.55 0.00 0.00 36.73 39.34 1ccg h TYR 23 CO 0.05 -0.59 0.32 -0.91 -1.32 0.00 0.00 178.16 175.72 1ccg h ASN 24 N -1.06 0.12 0.00 -2.11 -0.26 -1.14 0.54 115.58 111.67 1ccg h ASN 24 Ca -0.10 0.20 -0.00 0.00 -0.56 0.00 0.00 56.30 55.84 1ccg h ASN 24 Cb 0.78 0.24 0.00 0.00 -1.06 0.00 0.00 38.32 38.29 1ccg h ASN 24 CO 0.17 -0.17 -0.00 0.00 -1.06 0.00 0.00 177.43 176.37 1ccg h ALA 25 N 1.82 -0.01 -0.26 -0.83 0.00 -0.88 -1.73 119.26 117.38 1ccg h ALA 25 Ca 0.62 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.53 1ccg h ALA 25 Cb 1.31 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 1ccg h ALA 25 CO -0.66 -0.48 0.09 0.82 0.00 0.00 0.00 179.25 179.02 1ccg h ILE 26 N -0.05 0.94 -0.62 0.00 2.04 -0.54 -2.05 117.51 117.23 1ccg h ILE 26 Ca -0.00 -0.07 -0.05 0.00 1.00 0.00 0.00 64.86 65.73 1ccg h ILE 26 Cb 0.05 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 1ccg h ILE 26 CO 0.00 0.04 0.17 0.00 0.00 0.00 0.00 178.15 178.36 1ccg h ALA 27 N 1.16 1.13 -0.31 1.87 0.00 -0.84 -0.57 119.26 121.70 1ccg h ALA 27 Ca 0.11 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 1ccg h ALA 27 Cb 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1ccg h ALA 27 CO -0.11 0.59 -0.33 -0.07 0.00 0.00 0.00 179.25 179.33 1ccg h LEU 28 N 0.92 0.72 -0.81 0.00 -0.00 -1.24 -1.44 115.31 113.47 1ccg h LEU 28 Ca 0.20 -0.30 -0.04 0.00 -0.00 0.00 0.00 57.88 57.74 1ccg h LEU 28 Cb 0.30 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 40.75 1ccg h LEU 28 CO -0.00 1.00 -0.21 0.50 -0.00 0.00 0.00 178.44 179.72 1ccg h LYS 29 N 0.58 0.00 -0.20 1.13 3.64 -0.95 -1.41 116.57 119.36 1ccg h LYS 29 Ca 0.06 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 1ccg h LYS 29 Cb 0.85 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 1ccg h LYS 29 CO 0.07 0.21 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.36 1ccg h LEU 30 N 0.00 0.38 -0.34 5.20 3.38 -0.11 -1.16 115.31 122.66 1ccg h LEU 30 Ca -0.00 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 57.67 1ccg h LEU 30 Cb 0.86 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.46 1ccg h LEU 30 CO 0.03 0.64 0.03 -0.09 0.09 0.00 0.00 178.44 179.14 1ccg h ARG 31 N 0.11 0.13 -0.22 1.13 2.43 -1.25 -3.24 114.38 113.47 1ccg h ARG 31 Ca 0.05 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.12 1ccg h ARG 31 Cb 0.47 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1ccg h ARG 31 CO 0.02 0.09 -0.25 1.49 -1.51 0.00 0.00 179.97 179.81 1ccg h GLU 32 N 0.14 0.56 -1.96 0.20 4.81 -1.19 -3.31 114.58 113.82 1ccg h GLU 32 Ca 0.16 -0.30 -0.45 0.00 -0.13 0.00 0.00 59.36 58.64 1ccg h GLU 32 Cb 0.20 0.02 -0.16 0.00 0.63 0.00 0.00 28.75 29.44 1ccg h GLU 32 CO -0.24 0.90 0.30 -0.25 -0.73 0.00 0.00 179.01 178.99 1ccg n ASP 33 N -4.37 6.33 0.00 1.04 9.92 -0.44 -4.65 116.55 124.37 1ccg n ASP 33 Ca -0.05 -3.11 0.08 0.00 -0.53 0.00 0.00 54.79 51.18 1ccg n ASP 33 Cb 0.44 -1.24 0.38 0.00 -0.64 0.00 0.00 41.12 40.06 1ccg n ASP 33 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1ccg n ASP 34 N 1.01 0.00 0.19 -2.24 5.75 -1.25 -3.52 116.55 116.50 1ccg n ASP 34 Ca 0.46 0.39 0.08 0.00 -0.01 0.00 0.00 54.79 55.71 1ccg n ASP 34 Cb 0.60 -0.45 0.23 0.00 -1.03 0.00 0.00 41.12 40.46 1ccg n ASP 34 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 1ccg h GLU 35 N 0.00 0.00 -6.71 0.11 9.09 -1.91 -3.31 114.58 111.85 1ccg h GLU 35 Ca 0.00 0.00 -0.57 0.00 0.05 0.00 0.00 59.36 58.84 1ccg h GLU 35 Cb 0.26 0.00 0.11 0.00 -1.65 0.00 0.00 28.75 27.47 1ccg h GLU 35 CO 0.00 0.26 0.47 0.98 0.05 0.00 0.00 179.01 180.77 1ccg n TYR 36 N -3.23 2.17 -3.54 2.06 9.36 -1.23 -0.89 117.16 121.86 1ccg n TYR 36 Ca 0.02 0.56 -0.22 0.00 3.32 0.00 0.00 57.90 61.58 1ccg n TYR 36 Cb 0.57 -2.40 0.03 0.00 -0.63 0.00 0.00 39.34 36.91 1ccg n TYR 36 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1ccg n ASP 37 N 0.90 -5.88 -4.06 2.98 2.03 -1.26 -0.83 116.55 110.43 1ccg n ASP 37 Ca 0.06 -0.79 -0.29 0.00 0.52 0.00 0.00 54.79 54.29 1ccg n ASP 37 Cb 0.35 -3.61 -0.03 0.00 -0.72 0.00 0.00 41.12 37.12 1ccg n ASP 37 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1ccg n ASN 38 N -2.51 -1.22 -1.48 1.67 4.13 -1.22 -1.93 115.26 112.71 1ccg n ASN 38 Ca -0.11 -1.02 -0.16 0.00 1.68 0.00 0.00 54.58 54.97 1ccg n ASN 38 Cb 0.59 -2.88 -0.04 0.00 -1.54 0.00 0.00 39.78 35.91 1ccg n ASN 38 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1ccg n TYR 39 N -4.42 -0.33 0.08 3.10 4.02 -0.07 -4.89 117.16 114.65 1ccg n TYR 39 Ca -0.19 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.61 1ccg n TYR 39 Cb 0.63 -2.99 -0.08 0.00 -0.02 0.00 0.00 39.34 36.87 1ccg n TYR 39 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 1ccg h ILE 40 N 0.00 1.61 0.00 -0.72 2.04 -0.87 -3.47 117.51 116.09 1ccg h ILE 40 Ca -0.35 -3.10 0.00 0.00 1.00 0.00 0.00 64.86 62.42 1ccg h ILE 40 Cb 1.14 2.75 0.00 0.00 -0.74 0.00 0.00 36.82 39.97 1ccg h ILE 40 CO 0.46 0.89 0.00 0.61 0.00 0.00 0.00 178.15 180.12 1ccg n GLY 41 N 1.22 -0.53 0.02 5.37 0.00 -0.01 -4.72 105.19 106.55 1ccg n GLY 41 Ca -0.03 -1.72 0.14 0.00 0.00 0.00 0.00 46.02 44.41 1ccg n GLY 41 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ccg n TYR 42 N -0.56 0.00 -0.11 1.61 4.02 -1.26 -4.40 117.16 116.46 1ccg n TYR 42 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.84 1ccg n TYR 42 Cb 0.00 -0.34 0.02 0.00 -0.02 0.00 0.00 39.34 39.00 1ccg n TYR 42 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1ccg h GLY 43 N 4.99 0.33 1.00 2.72 0.00 -1.94 -2.56 103.07 107.61 1ccg h GLY 43 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1ccg h GLY 43 CO 0.00 -0.11 0.20 -2.55 0.00 0.00 0.00 176.54 174.08 1ccg h PRO 44 N 0.06 0.40 0.00 4.80 0.11 -1.89 -1.26 132.00 134.22 1ccg h PRO 44 Ca 0.18 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.26 1ccg h PRO 44 Cb 0.26 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.28 1ccg h PRO 44 CO -0.33 0.28 -0.02 -0.24 -0.21 0.00 0.00 178.00 177.48 1ccg h VAL 45 N 0.41 0.06 0.12 3.15 3.04 -1.80 -0.82 116.25 120.41 1ccg h VAL 45 Ca 0.11 -0.42 -0.28 0.00 -1.01 0.00 0.00 66.70 65.11 1ccg h VAL 45 Cb -0.04 1.39 0.00 0.00 -2.01 0.00 0.00 31.29 30.63 1ccg h VAL 45 CO -0.02 0.02 -1.31 -0.07 -1.01 0.00 0.00 177.57 175.18 1ccg h LEU 46 N 0.00 0.41 -0.30 3.16 3.38 -1.08 0.44 115.31 121.33 1ccg h LEU 46 Ca -0.00 -0.46 -0.14 0.00 0.09 0.00 0.00 57.88 57.37 1ccg h LEU 46 Cb 0.39 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1ccg h LEU 46 CO 0.00 1.37 -0.65 -0.37 0.09 0.00 0.00 178.44 178.88 1ccg h VAL 47 N 0.07 1.21 -0.56 1.22 -1.51 -0.34 -2.73 116.25 113.61 1ccg h VAL 47 Ca -0.16 -2.44 -0.07 0.00 -1.23 0.00 0.00 66.70 62.80 1ccg h VAL 47 Cb 1.98 2.42 -0.02 0.00 -2.13 0.00 0.00 31.29 33.54 1ccg h VAL 47 CO 0.19 0.63 0.07 -0.09 -1.23 0.00 0.00 177.57 177.15 1ccg h ARG 48 N 0.00 0.94 -0.49 5.19 2.43 -1.14 -2.54 114.38 118.77 1ccg h ARG 48 Ca -0.01 -0.26 0.01 0.00 -0.81 0.00 0.00 59.98 58.91 1ccg h ARG 48 Cb 1.37 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.79 1ccg h ARG 48 CO 0.08 0.91 0.33 1.25 -1.51 0.00 0.00 179.97 181.03 1ccg h LEU 49 N 0.83 0.56 -1.26 3.80 5.85 -0.86 -1.25 115.31 122.98 1ccg h LEU 49 Ca 0.17 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 1ccg h LEU 49 Cb 0.44 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1ccg h LEU 49 CO 0.01 0.41 0.22 0.00 -0.34 0.00 0.00 178.44 178.75 1ccg h ALA 50 N 1.18 1.43 -0.17 1.25 0.00 -1.32 -1.84 119.26 119.78 1ccg h ALA 50 Ca 0.18 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1ccg h ALA 50 Cb -0.07 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1ccg h ALA 50 CO -0.04 0.44 -0.31 2.35 0.00 0.00 0.00 179.25 181.69 1ccg h TRP 51 N 0.73 0.65 -0.11 0.00 2.91 -1.22 -2.93 115.95 115.98 1ccg h TRP 51 Ca 0.18 -0.23 -0.07 0.00 1.13 0.00 0.00 58.89 59.90 1ccg h TRP 51 Cb 0.12 -0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 28.63 1ccg h TRP 51 CO 0.01 0.95 -0.24 0.45 -1.03 0.00 0.00 178.44 178.58 1ccg h HIS 52 N 0.17 0.21 0.00 2.65 3.86 -0.90 0.94 115.15 122.06 1ccg h HIS 52 Ca 0.01 -0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.10 1ccg h HIS 52 Cb 0.90 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 29.30 1ccg h HIS 52 CO 0.09 0.42 -0.42 -0.84 0.86 0.00 0.00 177.93 178.05 1ccg h ILE 53 N 0.18 0.82 0.01 2.45 -0.00 -1.41 -3.32 117.51 116.24 1ccg h ILE 53 Ca 0.03 -1.81 -0.23 0.00 -0.00 0.00 0.00 64.86 62.85 1ccg h ILE 53 Cb 0.52 2.15 -0.03 0.00 -0.00 0.00 0.00 36.82 39.46 1ccg h ILE 53 CO 0.04 0.41 -1.17 0.28 -0.00 0.00 0.00 178.15 177.70 1ccg h SER 54 N 0.00 0.04 0.16 2.16 0.02 -1.28 -3.06 113.55 111.60 1ccg h SER 54 Ca -0.00 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1ccg h SER 54 Cb 1.12 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1ccg h SER 54 CO 0.05 1.04 -0.01 0.61 -1.14 0.00 0.00 176.83 177.38 1ccg n GLY 55 N 1.41 -0.95 0.09 -3.77 0.00 0.29 -2.81 105.19 99.45 1ccg n GLY 55 Ca -0.04 -0.22 0.15 0.00 0.00 0.00 0.00 46.02 45.91 1ccg n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ccg n THR 56 N -0.93 0.00 -2.03 2.61 -2.24 -1.26 -4.66 114.28 105.77 1ccg n THR 56 Ca 0.20 -0.05 -0.41 0.00 -2.27 0.00 0.00 64.05 61.53 1ccg n THR 56 Cb 0.18 -0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 68.11 1ccg n THR 56 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1ccg s TRP 57 N -2.19 2.96 -0.28 4.78 -0.00 -1.12 -4.02 118.94 119.07 1ccg s TRP 57 Ca 0.40 1.26 -0.00 0.00 -0.00 0.00 0.00 56.10 57.76 1ccg s TRP 57 Cb 0.21 -3.78 0.05 0.00 -0.00 0.00 0.00 33.47 29.96 1ccg s TRP 57 CO 0.40 -2.27 -0.04 0.34 -0.00 0.00 0.00 176.95 175.38 1ccg s ASP 58 N -0.19 4.69 0.20 5.86 -1.08 -0.29 -4.52 116.67 121.34 1ccg s ASP 58 Ca 0.52 -1.27 0.12 0.00 -0.52 0.00 0.00 52.55 51.41 1ccg s ASP 58 Cb -0.41 -1.66 0.64 0.00 -1.46 0.00 0.00 42.92 40.03 1ccg s ASP 58 CO 0.52 -0.22 1.31 2.29 0.52 0.00 0.00 175.17 179.59 1ccg n LYS 59 N 4.57 0.08 -0.00 4.34 2.85 -0.69 -1.54 118.16 127.76 1ccg n LYS 59 Ca -0.14 0.55 -0.08 0.00 -1.05 0.00 0.00 58.31 57.59 1ccg n LYS 59 Cb 0.43 -1.84 -0.14 0.00 -0.65 0.00 0.00 35.03 32.84 1ccg n LYS 59 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1ccg h HIS 60 N 0.00 0.01 0.00 5.58 3.86 -1.95 -3.39 115.15 119.26 1ccg h HIS 60 Ca 0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1ccg h HIS 60 Cb 0.17 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.64 1ccg h HIS 60 CO 0.00 1.01 0.00 -0.40 0.86 0.00 0.00 177.93 179.40 1ccg n ASP 61 N -3.12 1.05 -1.65 2.45 5.68 -1.09 -5.02 116.55 114.85 1ccg n ASP 61 Ca -0.14 -1.50 -0.19 0.00 -0.50 0.00 0.00 54.79 52.46 1ccg n ASP 61 Cb 1.03 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.94 1ccg n ASP 61 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1ccg n ASN 62 N -0.25 -5.02 -4.89 -1.12 5.15 -0.59 -4.02 115.26 104.52 1ccg n ASN 62 Ca 0.00 0.41 -0.29 0.00 -0.60 0.00 0.00 54.58 54.11 1ccg n ASN 62 Cb 0.34 -4.44 0.01 0.00 -0.53 0.00 0.00 39.78 35.17 1ccg n ASN 62 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1ccg s THR 63 N -2.64 4.45 0.00 -0.44 -4.23 -1.25 -4.86 115.64 106.67 1ccg s THR 63 Ca 0.00 0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.93 1ccg s THR 63 Cb 0.00 -3.75 0.00 0.00 1.34 0.00 0.00 72.50 70.09 1ccg s THR 63 CO 0.00 -0.85 0.00 0.61 -0.54 0.00 0.00 174.62 173.84 1ccg n GLY 64 N -2.57 0.16 0.00 3.99 0.00 -1.26 -1.14 105.19 104.37 1ccg n GLY 64 Ca 0.04 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1ccg n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ccg n GLY 65 N 0.00 -0.36 0.25 -0.02 0.00 -1.25 -4.63 105.19 99.17 1ccg n GLY 65 Ca 0.00 -1.83 0.15 0.00 0.00 0.00 0.00 46.02 44.34 1ccg n GLY 65 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ccg h SER 66 N 0.00 0.00 -0.53 1.61 4.64 -1.75 -3.40 113.55 114.12 1ccg h SER 66 Ca 0.00 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.42 1ccg h SER 66 Cb 0.00 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 61.98 1ccg h SER 66 CO 0.00 0.00 -0.24 0.22 -0.87 0.00 0.00 176.83 175.94 1ccg h TYR 67 N 0.00 -0.61 -0.06 4.77 3.20 -1.86 -3.04 116.97 119.37 1ccg h TYR 67 Ca 0.00 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1ccg h TYR 67 Cb 0.72 0.35 0.00 0.00 1.54 0.00 0.00 36.73 39.34 1ccg h TYR 67 CO 0.00 -0.32 0.00 0.41 -1.64 0.00 0.00 178.16 176.61 1ccg n GLY 68 N -1.42 0.18 2.54 1.82 0.00 -1.25 -2.70 105.19 104.36 1ccg n GLY 68 Ca 0.04 -0.46 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 1ccg n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ccg n GLY 69 N 1.18 -0.50 0.01 -0.02 0.00 -1.15 -2.30 105.19 102.42 1ccg n GLY 69 Ca 0.18 0.02 0.05 0.00 0.00 0.00 0.00 46.02 46.27 1ccg n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ccg n THR 70 N -3.70 1.28 0.18 2.61 -2.24 -1.26 -2.91 114.28 108.24 1ccg n THR 70 Ca -0.16 0.33 0.13 0.00 -2.27 0.00 0.00 64.05 62.08 1ccg n THR 70 Cb 0.63 -1.17 0.69 0.00 -2.10 0.00 0.00 70.33 68.38 1ccg n THR 70 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1ccg h TYR 71 N 0.00 0.00 -0.05 4.78 3.20 -1.93 -0.52 116.97 122.45 1ccg h TYR 71 Ca 0.00 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.89 1ccg h TYR 71 Cb 0.18 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 1ccg h TYR 71 CO 0.00 0.00 0.05 0.07 -1.64 0.00 0.00 178.16 176.64 1ccg h ARG 72 N 0.00 0.00 -6.87 1.82 0.11 -1.93 -3.25 114.38 104.26 1ccg h ARG 72 Ca 0.08 0.00 -0.47 0.00 0.10 0.00 0.00 59.98 59.69 1ccg h ARG 72 Cb 0.34 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.40 1ccg h ARG 72 CO -0.00 0.00 0.35 -0.06 0.10 0.00 0.00 179.97 180.36 1ccg s PHE 73 N -4.72 3.71 0.23 4.08 0.08 -0.20 -4.89 117.98 116.26 1ccg s PHE 73 Ca -0.05 1.79 -0.10 0.00 0.12 0.00 0.00 56.93 58.69 1ccg s PHE 73 Cb 0.16 -2.94 0.33 0.00 -0.57 0.00 0.00 43.02 40.00 1ccg s PHE 73 CO 0.57 0.19 1.63 0.87 -0.10 0.00 0.00 175.22 178.39 1ccg h LYS 74 N 3.26 0.05 -0.34 0.44 6.56 -1.85 0.16 116.57 124.86 1ccg h LYS 74 Ca -0.47 -0.00 0.04 0.00 -1.06 0.00 0.00 60.65 59.16 1ccg h LYS 74 Cb 1.19 -0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 32.81 1ccg h LYS 74 CO 0.65 0.04 0.12 -0.22 -2.06 0.00 0.00 179.45 177.98 1ccg h LYS 75 N 0.06 0.26 0.02 3.15 3.64 -1.93 -0.60 116.57 121.17 1ccg h LYS 75 Ca 0.36 -0.02 -0.22 0.00 -1.27 0.00 0.00 60.65 59.51 1ccg h LYS 75 Cb 0.59 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1ccg h LYS 75 CO -0.66 0.18 -0.94 1.49 -2.27 0.00 0.00 179.45 177.24 1ccg h GLU 76 N 0.27 0.27 -0.67 1.90 4.81 -1.70 -3.10 114.58 116.36 1ccg h GLU 76 Ca 0.15 -0.32 -0.08 0.00 -0.13 0.00 0.00 59.36 58.98 1ccg h GLU 76 Cb 0.11 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1ccg h GLU 76 CO -0.15 1.04 0.10 0.35 -0.73 0.00 0.00 179.01 179.62 1ccg h PHE 77 N 0.14 1.19 -0.36 0.92 3.57 -0.72 -2.88 116.94 118.80 1ccg h PHE 77 Ca -0.07 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.27 1ccg h PHE 77 Cb 1.59 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 40.00 1ccg h PHE 77 CO 0.04 0.99 0.00 0.09 -2.23 0.00 0.00 178.31 177.21 1ccg n ASN 78 N -4.21 2.06 -4.68 0.41 5.03 -0.25 -4.84 115.26 108.78 1ccg n ASN 78 Ca 0.04 -2.04 -0.45 0.00 0.87 0.00 0.00 54.58 53.01 1ccg n ASN 78 Cb 0.30 -0.27 -0.04 0.00 -1.02 0.00 0.00 39.78 38.75 1ccg n ASN 78 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1ccg n ASP 79 N 0.54 3.59 -0.30 6.41 2.03 -1.09 -4.90 116.55 122.83 1ccg n ASP 79 Ca 0.12 1.02 0.12 0.00 0.52 0.00 0.00 54.79 56.57 1ccg n ASP 79 Cb 0.34 -1.47 0.28 0.00 -0.72 0.00 0.00 41.12 39.56 1ccg n ASP 79 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1ccg h PRO 80 N 7.76 0.41 0.00 -0.67 0.11 -1.92 0.24 132.00 137.93 1ccg h PRO 80 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ccg h PRO 80 Cb 1.24 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1ccg h PRO 80 CO 0.93 0.27 0.00 0.43 -0.21 0.00 0.00 178.00 179.42 1ccg n SER 81 N -5.03 0.51 -1.01 -2.05 7.64 -1.26 -1.78 113.62 110.64 1ccg n SER 81 Ca 0.21 0.68 0.12 0.00 1.01 0.00 0.00 58.87 60.88 1ccg n SER 81 Cb 0.60 -0.77 0.24 0.00 -1.01 0.00 0.00 64.21 63.27 1ccg n SER 81 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1ccg n ASN 82 N -2.12 3.03 -4.65 6.43 3.02 0.83 -5.02 115.26 116.77 1ccg n ASN 82 Ca 0.00 -1.93 -0.54 0.00 -0.03 0.00 0.00 54.58 52.08 1ccg n ASN 82 Cb 0.11 -0.19 -0.06 0.00 -0.61 0.00 0.00 39.78 39.03 1ccg n ASN 82 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ccg n ALA 83 N 1.23 -0.32 0.00 5.41 0.00 -0.73 -1.91 120.51 124.19 1ccg n ALA 83 Ca 0.18 0.44 0.00 0.00 0.00 0.00 0.00 53.44 54.06 1ccg n ALA 83 Cb 0.55 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.80 1ccg n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ccg n GLY 84 N 3.44 3.26 0.03 0.00 0.00 -1.26 -4.85 105.19 105.81 1ccg n GLY 84 Ca 0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1ccg n GLY 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ccg n LEU 85 N 0.00 0.22 0.28 0.99 4.77 -0.80 -3.34 117.00 119.12 1ccg n LEU 85 Ca 0.00 0.53 0.13 0.00 -0.03 0.00 0.00 56.01 56.65 1ccg n LEU 85 Cb 0.00 -0.48 0.81 0.00 -2.33 0.00 0.00 43.42 41.43 1ccg n LEU 85 CO 0.00 -0.16 1.06 1.56 -1.33 0.00 0.00 177.39 178.52 1ccg h GLN 86 N 0.00 0.00 -0.36 3.23 7.50 -1.91 0.14 115.11 123.70 1ccg h GLN 86 Ca 0.00 0.00 -0.14 0.00 0.50 0.00 0.00 58.65 59.01 1ccg h GLN 86 Cb 0.46 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.98 1ccg h GLN 86 CO 0.00 0.05 -0.35 -0.91 -1.50 0.00 0.00 178.83 176.12 1ccg h ASN 87 N 0.00 0.88 -0.21 1.46 2.35 -1.97 -0.54 115.58 117.54 1ccg h ASN 87 Ca -0.00 -0.38 -0.13 0.00 -0.55 0.00 0.00 56.30 55.24 1ccg h ASN 87 Cb 0.13 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 1ccg h ASN 87 CO 0.01 1.14 -0.33 1.23 -1.65 0.00 0.00 177.43 177.83 1ccg h GLY 88 N 0.89 0.79 0.91 2.83 0.00 -0.99 -2.09 103.07 105.40 1ccg h GLY 88 Ca 0.07 -0.74 -0.02 0.00 0.00 0.00 0.00 47.33 46.64 1ccg h GLY 88 CO 0.08 0.67 -0.15 -2.75 0.00 0.00 0.00 176.54 174.39 1ccg h PHE 89 N 0.61 -0.40 -0.11 5.60 3.57 -1.09 -2.26 116.94 122.86 1ccg h PHE 89 Ca 0.07 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.58 1ccg h PHE 89 Cb 0.85 0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.72 1ccg h PHE 89 CO 0.04 -0.18 0.08 0.87 -2.23 0.00 0.00 178.31 176.89 1ccg h LYS 90 N -0.53 0.04 -0.68 1.11 1.57 -1.10 -0.87 116.57 116.12 1ccg h LYS 90 Ca -0.04 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1ccg h LYS 90 Cb 0.39 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 1ccg h LYS 90 CO 0.07 0.03 0.25 0.35 -0.57 0.00 0.00 179.45 179.58 1ccg h PHE 91 N 0.05 1.06 0.00 -1.35 3.04 -1.03 -3.28 116.94 115.43 1ccg h PHE 91 Ca 0.05 -0.09 -0.20 0.00 3.98 0.00 0.00 57.97 61.71 1ccg h PHE 91 Cb 0.14 -0.31 -0.03 0.00 2.56 0.00 0.00 35.95 38.31 1ccg h PHE 91 CO -0.00 0.84 -1.14 -0.07 -2.02 0.00 0.00 178.31 175.92 1ccg h LEU 92 N 0.98 0.00 -0.77 0.59 3.38 -0.63 -3.40 115.31 115.47 1ccg h LEU 92 Ca 0.22 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.37 1ccg h LEU 92 Cb 0.25 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.88 1ccg h LEU 92 CO -0.01 0.80 0.16 -0.08 0.09 0.00 0.00 178.44 179.39 1ccg h GLU 93 N 0.00 0.22 -0.62 1.13 4.81 -1.28 0.17 114.58 119.02 1ccg h GLU 93 Ca -0.11 -0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.25 1ccg h GLU 93 Cb 1.70 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 31.00 1ccg h GLU 93 CO 0.09 0.15 0.43 -1.00 -0.73 0.00 0.00 179.01 177.94 1ccg h PRO 94 N 0.23 0.21 0.03 0.92 0.13 -1.77 -1.87 132.00 129.88 1ccg h PRO 94 Ca 0.44 -0.01 -0.23 0.00 -0.87 0.00 0.00 66.00 65.33 1ccg h PRO 94 Cb 0.79 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.87 1ccg h PRO 94 CO -0.56 0.14 -0.98 0.82 -0.23 0.00 0.00 178.00 177.18 1ccg h ILE 95 N 0.22 1.45 -0.38 -3.56 2.04 -0.95 -2.32 117.51 114.00 1ccg h ILE 95 Ca 0.30 -2.63 -0.11 0.00 1.00 0.00 0.00 64.86 63.42 1ccg h ILE 95 Cb 0.87 2.54 -0.01 0.00 -0.74 0.00 0.00 36.82 39.48 1ccg h ILE 95 CO -0.06 0.77 -0.19 -0.74 0.00 0.00 0.00 178.15 177.94 1ccg h HIS 96 N 0.16 0.93 -0.05 1.37 2.76 -0.73 -1.41 115.15 118.18 1ccg h HIS 96 Ca -0.08 -0.23 0.00 0.00 -2.20 0.00 0.00 60.37 57.86 1ccg h HIS 96 Cb 1.64 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 30.38 1ccg h HIS 96 CO 0.05 0.98 0.03 0.87 -1.30 0.00 0.00 177.93 178.57 1ccg h LYS 97 N 0.61 0.06 -0.06 5.26 1.79 -1.32 -2.42 116.57 120.50 1ccg h LYS 97 Ca 0.09 -0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 58.36 1ccg h LYS 97 Cb 0.74 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.37 1ccg h LYS 97 CO 0.06 0.04 -0.76 1.49 -1.08 0.00 0.00 179.45 179.20 1ccg h GLU 98 N 0.06 0.36 -2.75 3.15 4.81 -0.97 -3.37 114.58 115.88 1ccg h GLU 98 Ca 0.02 -0.31 -0.61 0.00 -0.13 0.00 0.00 59.36 58.33 1ccg h GLU 98 Cb -0.00 0.07 -0.41 0.00 0.63 0.00 0.00 28.75 29.04 1ccg h GLU 98 CO -0.00 0.96 -0.65 1.19 -0.73 0.00 0.00 179.01 179.78 1ccg n PHE 99 N -3.81 2.67 0.30 0.92 3.01 -0.57 -4.97 117.46 115.01 1ccg n PHE 99 Ca -0.04 -4.12 0.18 0.00 1.01 0.00 0.00 57.45 54.47 1ccg n PHE 99 Cb 0.73 -0.49 0.75 0.00 -0.01 0.00 0.00 39.48 40.46 1ccg n PHE 99 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1ccg h PRO 100 N 5.08 0.00 0.00 -1.08 0.11 -1.66 -2.92 132.00 131.53 1ccg h PRO 100 Ca 0.17 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.24 1ccg h PRO 100 Cb 0.76 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.86 1ccg h PRO 100 CO 0.69 0.00 -0.22 0.11 -0.21 0.00 0.00 178.00 178.37 1ccg h TRP 101 N 0.00 0.00 -3.47 0.65 5.08 -1.93 -3.46 115.95 112.82 1ccg h TRP 101 Ca 0.00 0.00 -0.52 0.00 1.08 0.00 0.00 58.89 59.45 1ccg h TRP 101 Cb 0.40 0.00 0.04 0.00 -3.00 0.00 0.00 29.16 26.60 1ccg h TRP 101 CO 0.00 0.22 0.64 -1.50 -1.28 0.00 0.00 178.44 176.52 1ccg s ILE 102 N -3.59 3.15 0.75 0.12 2.07 -1.10 -4.92 121.20 117.67 1ccg s ILE 102 Ca 0.01 0.98 -0.12 0.00 -1.41 0.00 0.00 60.65 60.11 1ccg s ILE 102 Cb 0.10 -3.62 0.04 0.00 0.13 0.00 0.00 42.46 39.11 1ccg s ILE 102 CO 0.64 0.16 1.10 -0.94 -1.91 0.00 0.00 174.94 173.99 1ccg s SER 103 N 0.16 4.60 0.12 4.50 1.04 -1.26 -4.87 113.70 117.98 1ccg s SER 103 Ca 0.55 1.89 -0.26 0.00 0.48 0.00 0.00 55.95 58.60 1ccg s SER 103 Cb -0.37 -2.53 -0.07 0.00 0.10 0.00 0.00 66.02 63.15 1ccg s SER 103 CO 0.40 -1.97 1.64 0.28 0.98 0.00 0.00 173.24 174.57 1ccg h SER 104 N -0.84 -0.74 -0.88 7.02 0.02 -1.92 -1.77 113.55 114.44 1ccg h SER 104 Ca -0.44 0.09 0.07 0.00 -0.84 0.00 0.00 61.79 60.67 1ccg h SER 104 Cb 1.24 0.29 -0.06 0.00 0.14 0.00 0.00 62.40 64.01 1ccg h SER 104 CO 0.52 -0.34 0.57 1.23 -1.14 0.00 0.00 176.83 177.67 1ccg h GLY 105 N -0.43 1.27 1.24 -3.77 0.00 -1.79 -0.31 103.07 99.28 1ccg h GLY 105 Ca 0.05 -0.40 -0.13 0.00 0.00 0.00 0.00 47.33 46.84 1ccg h GLY 105 CO -0.18 0.29 -0.28 -0.55 0.00 0.00 0.00 176.54 175.81 1ccg h ASP 106 N 0.99 0.89 -0.12 0.19 5.19 -1.81 -2.16 116.42 119.58 1ccg h ASP 106 Ca 0.38 -0.35 -0.02 0.00 -0.62 0.00 0.00 57.03 56.42 1ccg h ASP 106 Cb 0.22 -0.25 -0.00 0.00 0.18 0.00 0.00 39.33 39.48 1ccg h ASP 106 CO -0.14 1.11 0.01 0.25 -3.12 0.00 0.00 179.24 177.35 1ccg h LEU 107 N 0.73 0.20 -0.67 1.55 5.85 -0.28 -0.42 115.31 122.28 1ccg h LEU 107 Ca 0.09 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.56 1ccg h LEU 107 Cb 0.83 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.76 1ccg h LEU 107 CO 0.07 0.43 0.40 -0.26 -0.34 0.00 0.00 178.44 178.74 1ccg h PHE 108 N -0.04 0.74 -0.02 1.25 0.04 -1.19 -0.51 116.94 117.21 1ccg h PHE 108 Ca 0.04 0.02 -0.20 0.00 2.80 0.00 0.00 57.97 60.63 1ccg h PHE 108 Cb 0.33 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 38.23 1ccg h PHE 108 CO 0.03 0.40 -0.84 0.66 -0.60 0.00 0.00 178.31 177.95 1ccg h SER 109 N 0.77 0.37 0.77 2.17 4.64 -1.39 -3.15 113.55 117.73 1ccg h SER 109 Ca 0.28 -0.28 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 1ccg h SER 109 Cb 0.08 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 1ccg h SER 109 CO -0.13 1.06 -0.57 0.25 -0.87 0.00 0.00 176.83 176.57 1ccg h LEU 110 N 0.18 0.00 -0.54 5.97 5.85 -0.79 -2.97 115.31 123.00 1ccg h LEU 110 Ca -0.05 0.00 0.10 0.00 0.84 0.00 0.00 57.88 58.77 1ccg h LEU 110 Cb 1.45 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 42.40 1ccg h LEU 110 CO 0.14 0.57 0.07 1.23 -0.34 0.00 0.00 178.44 180.11 1ccg h GLY 111 N 2.11 0.64 0.97 3.75 0.00 -1.05 -0.92 103.07 108.57 1ccg h GLY 111 Ca -0.01 0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ccg h GLY 111 CO 0.07 -0.12 0.21 -1.33 0.00 0.00 0.00 176.54 175.38 1ccg h GLY 112 N 0.20 0.54 0.95 4.60 0.00 -1.59 0.06 103.07 107.82 1ccg h GLY 112 Ca 0.28 -0.23 0.01 0.00 0.00 0.00 0.00 47.33 47.39 1ccg h GLY 112 CO -0.40 0.22 0.26 -2.08 0.00 0.00 0.00 176.54 174.55 1ccg h VAL 113 N 0.47 1.07 -0.28 4.60 2.07 -1.32 -2.27 116.25 120.59 1ccg h VAL 113 Ca 0.13 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1ccg h VAL 113 Cb 0.03 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1ccg h VAL 113 CO -0.02 0.10 0.12 0.74 0.02 0.00 0.00 177.57 178.52 1ccg h THR 114 N 0.53 1.17 -0.33 2.57 2.02 -1.01 -2.04 112.91 115.84 1ccg h THR 114 Ca 0.16 -0.51 0.07 0.00 0.77 0.00 0.00 66.41 66.90 1ccg h THR 114 Cb -0.03 0.99 -0.07 0.00 -1.74 0.00 0.00 68.15 67.31 1ccg h THR 114 CO -0.06 0.18 -0.13 0.00 0.37 0.00 0.00 175.52 175.88 1ccg h ALA 115 N 0.96 0.15 0.02 6.16 0.00 -0.89 -0.53 119.26 125.13 1ccg h ALA 115 Ca 0.09 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1ccg h ALA 115 Cb 0.17 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ccg h ALA 115 CO -0.01 -0.51 -0.01 0.28 0.00 0.00 0.00 179.25 179.00 1ccg h VAL 116 N -0.06 1.02 -0.70 0.00 2.07 -1.40 0.44 116.25 117.63 1ccg h VAL 116 Ca 0.16 -0.13 -0.07 0.00 0.82 0.00 0.00 66.70 67.49 1ccg h VAL 116 Cb 0.31 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1ccg h VAL 116 CO -0.37 0.03 0.17 1.56 0.02 0.00 0.00 177.57 178.98 1ccg h GLN 117 N -0.08 1.11 0.00 1.57 4.20 -1.23 0.19 115.11 120.87 1ccg h GLN 117 Ca -0.00 -0.27 -0.06 0.00 0.06 0.00 0.00 58.65 58.38 1ccg h GLN 117 Cb 0.08 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1ccg h GLN 117 CO 0.00 0.98 -0.30 0.93 -0.67 0.00 0.00 178.83 179.78 1ccg h GLU 118 N 1.05 0.00 -1.05 1.46 4.39 -0.93 -2.94 114.58 116.56 1ccg h GLU 118 Ca 0.22 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.74 1ccg h GLU 118 Cb 0.37 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 28.92 1ccg h GLU 118 CO 0.00 0.30 0.22 -1.33 -1.16 0.00 0.00 179.01 177.04 1ccg n MET 119 N -3.52 1.42 -1.47 2.33 2.81 0.13 -4.86 117.12 113.97 1ccg n MET 119 Ca -0.00 -1.00 -0.14 0.00 -1.81 0.00 0.00 57.70 54.75 1ccg n MET 119 Cb 0.45 -1.39 -0.06 0.00 -0.71 0.00 0.00 33.22 31.51 1ccg n MET 119 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1ccg n GLN 120 N 0.01 -0.98 -0.68 0.03 1.13 -1.11 -0.76 117.38 115.02 1ccg n GLN 120 Ca 0.20 0.97 -0.10 0.00 -1.94 0.00 0.00 57.00 56.13 1ccg n GLN 120 Cb 0.86 -5.08 0.07 0.00 0.11 0.00 0.00 30.24 26.20 1ccg n GLN 120 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ccg n GLY 121 N -1.24 -1.21 3.76 1.08 0.00 0.64 -4.72 105.19 103.50 1ccg n GLY 121 Ca -0.14 -1.69 -0.31 0.00 0.00 0.00 0.00 46.02 43.88 1ccg n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ccg s PRO 122 N -3.99 2.03 0.09 1.61 0.04 -1.26 -4.72 135.00 128.79 1ccg s PRO 122 Ca 0.26 1.07 -0.31 0.00 0.04 0.00 0.00 61.00 62.07 1ccg s PRO 122 Cb -0.01 -1.88 -0.08 0.00 0.04 0.00 0.00 34.50 32.58 1ccg s PRO 122 CO 0.18 -1.77 1.43 0.15 0.04 0.00 0.00 177.00 177.03 1ccg s LYS 123 N -4.92 4.29 -0.39 4.56 -0.14 -1.26 -4.39 119.74 117.50 1ccg s LYS 123 Ca 0.62 2.09 -0.11 0.00 -1.36 0.00 0.00 55.97 57.21 1ccg s LYS 123 Cb -0.17 -3.35 0.04 0.00 -1.68 0.00 0.00 37.83 32.67 1ccg s LYS 123 CO 0.56 -0.51 0.23 0.42 -0.76 0.00 0.00 175.35 175.30 1ccg s ILE 124 N 1.55 4.53 0.05 2.17 -1.09 -1.26 -4.89 121.20 122.26 1ccg s ILE 124 Ca 0.66 -1.01 -0.34 0.00 -2.23 0.00 0.00 60.65 57.72 1ccg s ILE 124 Cb -0.36 -3.60 -0.13 0.00 -1.58 0.00 0.00 42.46 36.78 1ccg s ILE 124 CO 0.30 -0.33 1.68 -2.65 -1.23 0.00 0.00 174.94 172.71 1ccg n PRO 125 N 4.99 2.07 -4.51 2.79 -0.02 -1.26 -4.76 135.00 134.30 1ccg n PRO 125 Ca -0.11 0.75 -0.31 0.00 -2.02 0.00 0.00 63.50 61.81 1ccg n PRO 125 Cb 0.45 -2.54 -0.11 0.00 -0.02 0.00 0.00 33.50 31.28 1ccg n PRO 125 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1ccg s TRP 126 N 2.14 2.69 -0.05 6.00 -0.00 -0.38 -4.79 118.94 124.54 1ccg s TRP 126 Ca 0.85 -0.17 0.05 0.00 -0.00 0.00 0.00 56.10 56.82 1ccg s TRP 126 Cb -0.71 -1.50 -0.02 0.00 -0.00 0.00 0.00 33.47 31.24 1ccg s TRP 126 CO 0.44 0.32 -0.19 1.03 -0.00 0.00 0.00 176.95 178.56 1ccg s ARG 127 N -1.59 2.44 0.68 5.86 0.52 -1.26 0.08 118.95 125.68 1ccg s ARG 127 Ca 0.17 -0.78 -0.02 0.00 -0.52 0.00 0.00 55.73 54.58 1ccg s ARG 127 Cb -0.11 -2.27 0.10 0.00 0.52 0.00 0.00 34.95 33.18 1ccg s ARG 127 CO 0.08 0.56 0.95 0.00 0.02 0.00 0.00 175.30 176.91 1ccg n GLY 129 N -2.76 1.02 3.76 0.00 0.00 -1.26 -4.75 105.19 101.20 1ccg n GLY 129 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1ccg n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ccg s ARG 130 N 0.00 3.32 -0.05 1.61 0.52 -1.26 -0.60 118.95 122.49 1ccg s ARG 130 Ca 0.00 1.86 0.04 0.00 -0.52 0.00 0.00 55.73 57.11 1ccg s ARG 130 Cb 0.00 -2.17 0.00 0.00 0.52 0.00 0.00 34.95 33.30 1ccg s ARG 130 CO 0.00 -0.93 -0.17 0.08 0.02 0.00 0.00 175.30 174.30 1ccg s VAL 131 N -1.54 1.42 0.21 3.52 1.01 -1.10 -4.70 120.40 119.21 1ccg s VAL 131 Ca 0.71 -0.69 -0.31 0.00 0.00 0.00 0.00 61.98 61.69 1ccg s VAL 131 Cb -0.31 -1.23 -0.10 0.00 0.00 0.00 0.00 36.38 34.74 1ccg s VAL 131 CO 0.36 0.41 1.49 -1.81 0.00 0.00 0.00 175.10 175.55 1ccg s ASP 132 N 0.20 6.63 0.26 3.32 1.11 -1.26 -3.94 116.67 122.98 1ccg s ASP 132 Ca -0.07 2.64 0.10 0.00 0.18 0.00 0.00 52.55 55.39 1ccg s ASP 132 Cb -0.13 -2.61 -0.04 0.00 1.07 0.00 0.00 42.92 41.21 1ccg s ASP 132 CO 0.03 -0.75 -0.03 0.42 1.18 0.00 0.00 175.17 176.02 1ccg s THR 133 N 0.51 3.34 1.02 -1.27 -4.23 -0.97 -5.01 115.64 109.02 1ccg s THR 133 Ca 0.64 -1.96 -0.12 0.00 -1.18 0.00 0.00 61.69 59.07 1ccg s THR 133 Cb -0.42 -2.78 0.21 0.00 1.34 0.00 0.00 72.50 70.84 1ccg s THR 133 CO 0.38 -0.37 1.08 -2.84 -0.54 0.00 0.00 174.62 172.33 1ccg s PRO 134 N -3.63 0.18 0.55 3.99 0.02 -1.26 -4.85 135.00 130.01 1ccg s PRO 134 Ca 0.31 1.09 0.24 0.00 0.02 0.00 0.00 61.00 62.66 1ccg s PRO 134 Cb -0.06 -1.66 1.49 0.00 0.02 0.00 0.00 34.50 34.28 1ccg s PRO 134 CO 0.19 -3.05 2.09 1.49 -0.33 0.00 0.00 177.00 177.39 1ccg h GLU 135 N -2.15 0.00 0.00 5.54 4.81 -1.98 -0.61 114.58 120.19 1ccg h GLU 135 Ca -0.53 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 1ccg h GLU 135 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1ccg h GLU 135 CO 0.48 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.36 1ccg n ASP 136 N -4.17 0.00 -0.84 1.04 5.75 -1.26 -2.36 116.55 114.72 1ccg n ASP 136 Ca 0.02 -0.68 0.11 0.00 -0.01 0.00 0.00 54.79 54.24 1ccg n ASP 136 Cb 0.33 -0.10 0.29 0.00 -1.03 0.00 0.00 41.12 40.61 1ccg n ASP 136 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1ccg n THR 137 N -1.10 0.38 -2.03 2.12 -2.24 -0.23 -4.95 114.28 106.23 1ccg n THR 137 Ca 0.20 -0.54 -0.42 0.00 -2.27 0.00 0.00 64.05 61.01 1ccg n THR 137 Cb 0.15 0.62 -0.03 0.00 -2.10 0.00 0.00 70.33 68.97 1ccg n THR 137 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1ccg s THR 138 N -1.62 3.61 0.42 4.28 2.01 -1.00 -4.70 115.64 118.64 1ccg s THR 138 Ca 0.35 0.72 -0.26 0.00 0.31 0.00 0.00 61.69 62.81 1ccg s THR 138 Cb 0.19 -3.51 -0.09 0.00 0.01 0.00 0.00 72.50 69.11 1ccg s THR 138 CO 0.28 -0.11 1.37 -2.16 -0.69 0.00 0.00 174.62 173.31 1ccg s PRO 139 N 4.22 3.85 0.73 4.92 0.04 -1.26 -4.97 135.00 142.53 1ccg s PRO 139 Ca 0.73 2.30 -0.14 0.00 0.04 0.00 0.00 61.00 63.92 1ccg s PRO 139 Cb -0.31 -2.72 0.04 0.00 0.04 0.00 0.00 34.50 31.55 1ccg s PRO 139 CO 0.29 -0.64 1.18 -0.51 0.04 0.00 0.00 177.00 177.36 1ccg s ASP 140 N -0.60 4.26 0.52 6.66 1.01 -1.26 -4.69 116.67 122.56 1ccg s ASP 140 Ca 0.58 2.26 -0.21 0.00 0.71 0.00 0.00 52.55 55.89 1ccg s ASP 140 Cb -0.41 -2.58 -0.06 0.00 1.01 0.00 0.00 42.92 40.88 1ccg s ASP 140 CO 0.53 -2.21 1.22 0.20 0.21 0.00 0.00 175.17 175.11 1ccg s ASN 141 N -2.22 5.68 0.00 0.27 0.01 -1.26 -4.27 114.94 113.14 1ccg s ASN 141 Ca 0.72 2.42 0.00 0.00 -0.71 0.00 0.00 52.86 55.29 1ccg s ASN 141 Cb -0.27 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 38.79 1ccg s ASN 141 CO 0.46 -1.26 0.00 0.61 -1.51 0.00 0.00 177.10 175.40 1ccg n GLY 142 N 0.50 1.15 0.63 0.66 0.00 -1.26 -5.00 105.19 101.86 1ccg n GLY 142 Ca 0.10 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.24 1ccg n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ccg n ARG 143 N -0.45 1.61 -3.39 1.61 1.74 -1.26 -4.94 116.66 111.59 1ccg n ARG 143 Ca 0.00 -1.26 -0.28 0.00 -0.77 0.00 0.00 57.85 55.54 1ccg n ARG 143 Cb 0.00 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 29.94 1ccg n ARG 143 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ccg s LEU 144 N -2.26 4.07 0.38 0.55 1.43 -1.26 -4.73 118.68 116.86 1ccg s LEU 144 Ca 0.25 0.63 -0.25 0.00 -1.03 0.00 0.00 54.13 53.73 1ccg s LEU 144 Cb 0.19 -3.44 -0.09 0.00 0.03 0.00 0.00 46.19 42.88 1ccg s LEU 144 CO 0.44 -0.19 1.04 -2.16 0.23 0.00 0.00 176.35 175.71 1ccg s PRO 145 N -3.65 4.25 0.44 1.29 0.04 -1.26 -5.05 135.00 131.06 1ccg s PRO 145 Ca 0.42 1.52 -0.19 0.00 0.04 0.00 0.00 61.00 62.80 1ccg s PRO 145 Cb -0.11 -2.63 -0.10 0.00 0.04 0.00 0.00 34.50 31.71 1ccg s PRO 145 CO 0.31 -0.07 0.93 -0.51 0.04 0.00 0.00 177.00 177.70 1ccg s ASP 146 N -1.50 6.81 0.21 6.66 1.01 -1.26 -5.01 116.67 123.59 1ccg s ASP 146 Ca 0.56 1.59 0.22 0.00 0.71 0.00 0.00 52.55 55.62 1ccg s ASP 146 Cb -0.23 -2.50 0.02 0.00 1.01 0.00 0.00 42.92 41.21 1ccg s ASP 146 CO 0.29 -0.42 1.07 0.00 0.21 0.00 0.00 175.17 176.32 1ccg h ALA 147 N 1.61 0.55 -0.34 5.23 0.00 -1.99 -3.40 119.26 120.92 1ccg h ALA 147 Ca -0.48 -0.08 -0.29 0.00 0.00 0.00 0.00 54.91 54.05 1ccg h ALA 147 Cb 1.18 0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.88 1ccg h ALA 147 CO 0.62 0.09 0.22 -0.40 0.00 0.00 0.00 179.25 179.78 1ccg n ASP 148 N -2.74 6.10 -2.06 0.00 5.75 -1.26 -1.66 116.55 120.68 1ccg n ASP 148 Ca -0.01 -2.90 -0.09 0.00 -0.01 0.00 0.00 54.79 51.78 1ccg n ASP 148 Cb 0.58 -1.17 -0.04 0.00 -1.03 0.00 0.00 41.12 39.46 1ccg n ASP 148 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1ccg n LYS 149 N 1.00 0.20 -3.81 0.11 4.76 -1.26 -4.96 118.16 114.19 1ccg n LYS 149 Ca 0.32 -1.58 -0.26 0.00 -2.87 0.00 0.00 58.31 53.92 1ccg n LYS 149 Cb 0.61 1.30 -0.00 0.00 -1.84 0.00 0.00 35.03 35.10 1ccg n LYS 149 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1ccg n ASP 150 N -2.36 2.75 0.25 4.39 5.75 -1.26 -3.26 116.55 122.81 1ccg n ASP 150 Ca 0.04 -2.86 0.18 0.00 -0.01 0.00 0.00 54.79 52.13 1ccg n ASP 150 Cb 0.29 -0.02 0.90 0.00 -1.03 0.00 0.00 41.12 41.26 1ccg n ASP 150 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ccg h ALA 151 N 0.71 1.60 -0.03 2.12 0.00 -1.89 -2.32 119.26 119.45 1ccg h ALA 151 Ca -0.34 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.42 1ccg h ALA 151 Cb 1.24 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.05 1ccg h ALA 151 CO 0.54 -0.22 -0.53 0.78 0.00 0.00 0.00 179.25 179.82 1ccg h GLY 152 N 0.00 0.47 0.25 0.00 0.00 -1.96 -2.33 103.07 99.49 1ccg h GLY 152 Ca 0.05 -0.76 0.06 0.00 0.00 0.00 0.00 47.33 46.68 1ccg h GLY 152 CO -0.00 0.67 -0.22 -1.82 0.00 0.00 0.00 176.54 175.17 1ccg h TYR 153 N -0.07 -0.57 -0.36 5.60 3.20 -1.85 -2.35 116.97 120.57 1ccg h TYR 153 Ca -0.06 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.90 1ccg h TYR 153 Cb 1.22 0.28 -0.05 0.00 1.54 0.00 0.00 36.73 39.73 1ccg h TYR 153 CO 0.14 -0.29 0.06 0.28 -1.64 0.00 0.00 178.16 176.71 1ccg h VAL 154 N -0.24 0.81 -0.72 1.81 2.07 -1.41 0.92 116.25 119.49 1ccg h VAL 154 Ca 0.12 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.59 1ccg h VAL 154 Cb 0.43 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1ccg h VAL 154 CO -0.34 0.03 0.47 -0.09 0.02 0.00 0.00 177.57 177.66 1ccg h ARG 155 N 0.18 0.93 -0.34 1.57 2.43 -1.30 -1.60 114.38 116.25 1ccg h ARG 155 Ca 0.17 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.17 1ccg h ARG 155 Cb 0.20 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1ccg h ARG 155 CO -0.23 0.61 -0.25 1.15 -1.51 0.00 0.00 179.97 179.74 1ccg h THR 156 N 0.95 1.29 0.12 0.20 2.02 -1.25 -2.50 112.91 113.74 1ccg h THR 156 Ca 0.27 -1.40 -0.01 0.00 0.77 0.00 0.00 66.41 66.04 1ccg h THR 156 Cb -0.08 1.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1ccg h THR 156 CO -0.07 0.46 -0.06 0.15 0.37 0.00 0.00 175.52 176.37 1ccg h PHE 157 N 0.55 -0.15 0.00 3.16 3.57 -0.63 -3.05 116.94 120.39 1ccg h PHE 157 Ca 0.06 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1ccg h PHE 157 Cb 0.82 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.61 1ccg h PHE 157 CO 0.06 -0.02 0.00 0.74 -2.23 0.00 0.00 178.31 176.86 1ccg h PHE 158 N -0.24 0.00 0.00 0.41 0.04 -1.24 -2.19 116.94 113.71 1ccg h PHE 158 Ca -0.02 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.69 1ccg h PHE 158 Cb 0.20 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.34 1ccg h PHE 158 CO -0.04 0.00 -0.29 1.96 -0.60 0.00 0.00 178.31 179.33 1ccg h GLN 159 N 0.00 0.00 0.00 1.51 1.08 -1.33 -0.02 115.11 116.35 1ccg h GLN 159 Ca 0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1ccg h GLN 159 Cb 0.41 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.84 1ccg h GLN 159 CO 0.00 0.29 -0.00 -0.09 -0.95 0.00 0.00 178.83 178.08 1ccg h ARG 160 N 0.00 0.00 -0.38 1.46 2.43 -1.46 -1.69 114.38 114.74 1ccg h ARG 160 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1ccg h ARG 160 Cb 0.70 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 1ccg h ARG 160 CO 0.04 0.00 0.00 1.28 -1.51 0.00 0.00 179.97 179.78 1ccg n LEU 161 N -3.09 3.92 -3.43 3.80 4.77 -0.98 -1.70 117.00 120.30 1ccg n LEU 161 Ca -0.01 -2.61 0.00 0.00 -0.03 0.00 0.00 56.01 53.36 1ccg n LEU 161 Cb 0.20 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1ccg n LEU 161 CO 0.24 0.71 0.00 -0.46 -1.33 0.00 0.00 177.39 176.55 1ccg n ASN 162 N 0.18 0.00 -4.69 -1.43 6.94 -0.63 -4.99 115.26 110.64 1ccg n ASN 162 Ca 0.20 0.00 -0.36 0.00 -0.02 0.00 0.00 54.58 54.40 1ccg n ASN 162 Cb 0.78 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 38.11 1ccg n ASN 162 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1ccg s MET 163 N -4.29 4.11 0.29 -3.83 -1.94 -0.06 -4.99 119.30 108.59 1ccg s MET 163 Ca 0.00 -0.25 -0.01 0.00 -1.71 0.00 0.00 55.69 53.72 1ccg s MET 163 Cb 0.00 -3.49 0.06 0.00 2.01 0.00 0.00 34.83 33.41 1ccg s MET 163 CO 0.00 0.16 0.40 0.27 -0.01 0.00 0.00 175.02 175.83 1ccg n ASN 164 N 3.98 0.43 -0.08 3.03 0.23 -1.26 -4.10 115.26 117.49 1ccg n ASN 164 Ca -0.15 -1.39 -0.08 0.00 -0.53 0.00 0.00 54.58 52.43 1ccg n ASN 164 Cb 0.52 -0.27 -0.01 0.00 -2.08 0.00 0.00 39.78 37.95 1ccg n ASN 164 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1ccg h ASP 165 N -0.30 0.16 -0.63 0.53 3.32 -1.99 -1.20 116.42 116.32 1ccg h ASP 165 Ca -0.13 0.02 0.02 0.00 0.02 0.00 0.00 57.03 56.97 1ccg h ASP 165 Cb 0.46 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.96 1ccg h ASP 165 CO 0.13 0.13 0.39 -0.09 -1.72 0.00 0.00 179.24 178.08 1ccg h ARG 166 N 0.26 0.75 -0.20 3.56 2.43 -1.96 -1.99 114.38 117.24 1ccg h ARG 166 Ca 0.12 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.14 1ccg h ARG 166 Cb 0.07 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1ccg h ARG 166 CO -0.10 0.50 -0.35 0.93 -1.51 0.00 0.00 179.97 179.44 1ccg h GLU 167 N 0.77 0.42 -0.49 0.20 5.08 -1.82 -1.07 114.58 117.67 1ccg h GLU 167 Ca 0.25 -0.18 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 1ccg h GLU 167 Cb 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1ccg h GLU 167 CO -0.10 0.71 -0.19 0.28 -1.00 0.00 0.00 179.01 178.72 1ccg h VAL 168 N 0.36 1.27 -0.03 3.13 2.07 -0.87 -1.53 116.25 120.65 1ccg h VAL 168 Ca 0.04 -1.35 -0.25 0.00 0.82 0.00 0.00 66.70 65.95 1ccg h VAL 168 Cb 0.78 1.10 0.02 0.00 -1.52 0.00 0.00 31.29 31.67 1ccg h VAL 168 CO 0.06 0.47 -0.98 0.58 0.02 0.00 0.00 177.57 177.72 1ccg h VAL 169 N 0.85 1.30 -0.33 2.57 2.07 -1.03 -2.08 116.25 119.61 1ccg h VAL 169 Ca 0.12 -2.23 0.00 0.00 0.82 0.00 0.00 66.70 65.41 1ccg h VAL 169 Cb 0.77 2.31 -0.02 0.00 -1.52 0.00 0.00 31.29 32.84 1ccg h VAL 169 CO 0.06 0.69 0.22 0.00 0.02 0.00 0.00 177.57 178.56 1ccg h ALA 170 N 0.48 0.41 -0.61 1.67 0.00 -1.20 -2.95 119.26 117.06 1ccg h ALA 170 Ca -0.11 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1ccg h ALA 170 Cb 1.63 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.26 1ccg h ALA 170 CO 0.19 -0.12 0.25 1.25 0.00 0.00 0.00 179.25 180.82 1ccg h LEU 171 N 0.44 0.81 -1.65 0.00 5.85 -1.22 -2.52 115.31 117.02 1ccg h LEU 171 Ca 0.12 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1ccg h LEU 171 Cb -0.05 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 1ccg h LEU 171 CO -0.03 0.73 -0.19 -0.03 -0.34 0.00 0.00 178.44 178.58 1ccg h MET 172 N 0.88 0.00 0.00 1.25 4.05 -1.20 -2.55 114.93 117.36 1ccg h MET 172 Ca 0.21 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.63 1ccg h MET 172 Cb 0.16 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.96 1ccg h MET 172 CO -0.02 0.19 0.00 0.41 0.23 0.00 0.00 176.91 177.72 1ccg n GLY 173 N -0.58 -0.70 0.19 1.39 0.00 -0.95 -2.05 105.19 102.49 1ccg n GLY 173 Ca -0.02 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.08 1ccg n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ccg h ALA 174 N 2.34 1.11 -0.10 4.61 0.00 -1.63 -2.19 119.26 123.40 1ccg h ALA 174 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ccg h ALA 174 Cb 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ccg h ALA 174 CO 0.00 -0.11 0.23 0.78 0.00 0.00 0.00 179.25 180.16 1ccg h GLY 175 N 0.00 0.00 0.10 0.00 0.00 -1.69 -0.82 103.07 100.66 1ccg h GLY 175 Ca 0.00 0.00 0.26 0.00 0.00 0.00 0.00 47.33 47.59 1ccg h GLY 175 CO 0.00 0.00 0.70 0.00 0.00 0.00 0.00 176.54 177.24 1ccg h ALA 176 N 1.62 2.80 -2.86 3.60 0.00 -1.69 -3.39 119.26 119.34 1ccg h ALA 176 Ca 0.05 -0.03 -0.61 0.00 0.00 0.00 0.00 54.91 54.31 1ccg h ALA 176 Cb 0.51 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.29 1ccg h ALA 176 CO -0.00 -1.16 -0.32 -0.51 0.00 0.00 0.00 179.25 177.26 1ccg s LEU 177 N -8.15 4.35 0.00 0.00 1.43 -0.32 -3.96 118.68 112.03 1ccg s LEU 177 Ca -0.05 0.65 0.00 0.00 -1.03 0.00 0.00 54.13 53.70 1ccg s LEU 177 Cb 0.20 -2.38 0.00 0.00 0.03 0.00 0.00 46.19 44.04 1ccg s LEU 177 CO 0.72 0.24 0.00 0.61 0.23 0.00 0.00 176.35 178.15 1ccg n GLY 178 N 2.58 -1.06 3.74 -3.19 0.00 0.97 -4.95 105.19 103.28 1ccg n GLY 178 Ca -0.14 -1.22 -0.05 0.00 0.00 0.00 0.00 46.02 44.60 1ccg n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ccg s LYS 179 N 0.00 1.32 0.40 1.61 -2.85 -1.26 -4.26 119.74 114.70 1ccg s LYS 179 Ca 0.00 -0.70 -0.06 0.00 -1.00 0.00 0.00 55.97 54.21 1ccg s LYS 179 Cb 0.00 0.47 -0.05 0.00 -2.06 0.00 0.00 37.83 36.19 1ccg s LYS 179 CO 0.00 -0.60 0.70 0.95 0.10 0.00 0.00 175.35 176.49 1ccg s THR 180 N -3.47 4.92 -0.08 3.79 -4.23 0.03 -4.94 115.64 111.67 1ccg s THR 180 Ca 0.10 0.22 -0.00 0.00 -1.18 0.00 0.00 61.69 60.83 1ccg s THR 180 Cb -0.03 -3.79 0.02 0.00 1.34 0.00 0.00 72.50 70.05 1ccg s THR 180 CO 0.01 -0.59 -0.05 -1.00 -0.54 0.00 0.00 174.62 172.46 1ccg s HIS 181 N -2.42 1.02 0.30 3.99 0.09 -1.10 -2.60 115.29 114.58 1ccg s HIS 181 Ca 0.47 -0.39 0.04 0.00 -0.00 0.00 0.00 55.06 55.17 1ccg s HIS 181 Cb -0.10 -0.93 0.64 0.00 -0.00 0.00 0.00 32.58 32.19 1ccg s HIS 181 CO 0.36 -0.34 1.84 1.25 -0.00 0.00 0.00 174.74 177.85 1ccg h LEU 182 N 7.83 0.85 -0.88 0.89 5.85 -1.61 -1.13 115.31 127.11 1ccg h LEU 182 Ca -0.29 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.48 1ccg h LEU 182 Cb 1.14 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1ccg h LEU 182 CO 0.38 0.43 0.00 0.50 -0.34 0.00 0.00 178.44 179.41 1ccg h LYS 183 N 0.90 0.00 0.00 1.25 3.64 -1.97 -1.42 116.57 118.96 1ccg h LYS 183 Ca 0.49 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.76 1ccg h LYS 183 Cb 0.59 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 1ccg h LYS 183 CO -0.26 0.00 -0.86 -0.91 -2.27 0.00 0.00 179.45 175.14 1ccg h ASN 184 N 0.00 0.00 -0.01 4.20 2.35 -1.56 -3.44 115.58 117.13 1ccg h ASN 184 Ca 0.00 -0.28 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 1ccg h ASN 184 Cb 0.69 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.06 1ccg h ASN 184 CO 0.00 1.13 -0.06 -1.54 -1.65 0.00 0.00 177.43 175.31 1ccg n SER 185 N -4.53 1.47 -0.24 5.81 3.41 -0.90 -4.82 113.62 113.82 1ccg n SER 185 Ca -0.20 -1.24 -0.03 0.00 -0.26 0.00 0.00 58.87 57.14 1ccg n SER 185 Cb 0.47 0.17 -0.01 0.00 -0.26 0.00 0.00 64.21 64.58 1ccg n SER 185 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ccg n GLY 186 N 0.59 0.61 3.30 5.00 0.00 -0.54 -5.04 105.19 109.11 1ccg n GLY 186 Ca 0.04 -0.41 -0.21 0.00 0.00 0.00 0.00 46.02 45.44 1ccg n GLY 186 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ccg s TYR 187 N -1.98 1.67 -0.10 1.61 2.02 -1.26 -4.60 117.35 114.71 1ccg s TYR 187 Ca 0.00 -0.49 -0.04 0.00 -0.37 0.00 0.00 57.07 56.17 1ccg s TYR 187 Cb 0.00 -0.85 0.05 0.00 -0.40 0.00 0.00 41.96 40.76 1ccg s TYR 187 CO 0.00 0.25 0.21 -2.00 -1.57 0.00 0.00 175.55 172.44 1ccg s GLU 188 N -2.66 0.11 0.00 -0.62 2.56 -1.26 -1.42 118.70 115.41 1ccg s GLU 188 Ca 0.12 0.58 0.00 0.00 0.00 0.00 0.00 54.97 55.68 1ccg s GLU 188 Cb -0.06 -0.15 0.00 0.00 2.00 0.00 0.00 34.13 35.92 1ccg s GLU 188 CO 0.05 -0.25 0.00 0.41 -0.56 0.00 0.00 175.26 174.91 1ccg n GLY 189 N 4.94 3.61 3.90 -1.50 0.00 -1.07 -4.88 105.19 110.19 1ccg n GLY 189 Ca -0.13 -1.80 -0.29 0.00 0.00 0.00 0.00 46.02 43.81 1ccg n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ccg s PRO 190 N -2.82 2.91 0.17 1.61 0.04 -1.26 -0.79 135.00 134.87 1ccg s PRO 190 Ca 0.00 0.28 0.23 0.00 0.04 0.00 0.00 61.00 61.55 1ccg s PRO 190 Cb 0.00 -2.13 0.12 0.00 0.04 0.00 0.00 34.50 32.53 1ccg s PRO 190 CO 0.00 -0.87 1.14 -1.49 0.04 0.00 0.00 177.00 175.82 1ccg h TRP 191 N -0.44 0.00 -2.74 0.56 6.55 -1.74 0.79 115.95 118.93 1ccg h TRP 191 Ca -0.45 0.00 -0.02 0.00 0.95 0.00 0.00 58.89 59.37 1ccg h TRP 191 Cb 1.25 0.00 0.01 0.00 -0.86 0.00 0.00 29.16 29.56 1ccg h TRP 191 CO 0.49 0.00 0.21 0.41 -1.05 0.00 0.00 178.44 178.51 1ccg n GLY 192 N 1.24 1.22 0.13 1.49 0.00 -1.26 -4.66 105.19 103.35 1ccg n GLY 192 Ca 0.01 -1.20 -0.20 0.00 0.00 0.00 0.00 46.02 44.64 1ccg n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ccg n ALA 193 N -1.16 0.94 -2.22 4.61 0.00 -1.26 -4.49 120.51 116.92 1ccg n ALA 193 Ca -0.13 -0.59 -0.41 0.00 0.00 0.00 0.00 53.44 52.31 1ccg n ALA 193 Cb 0.45 -0.71 0.00 0.00 0.00 0.00 0.00 19.45 19.19 1ccg n ALA 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ccg n ALA 194 N -2.94 6.15 0.89 0.00 0.00 -1.26 -4.85 120.51 118.49 1ccg n ALA 194 Ca -0.30 -4.25 0.00 0.00 0.00 0.00 0.00 53.44 48.89 1ccg n ALA 194 Cb 1.05 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 17.72 1ccg n ALA 194 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ccg n ASN 195 N 2.35 1.05 -1.53 0.00 2.04 -1.25 -2.74 115.26 115.18 1ccg n ASN 195 Ca 0.51 -1.78 0.02 0.00 -0.44 0.00 0.00 54.58 52.89 1ccg n ASN 195 Cb 0.29 -0.45 0.01 0.00 -2.53 0.00 0.00 39.78 37.11 1ccg n ASN 195 CO 0.00 0.00 0.00 -0.46 -0.44 0.00 0.00 177.26 176.36 1ccg n ASN 196 N 0.10 0.73 -4.07 0.53 0.23 -1.26 -0.02 115.26 111.50 1ccg n ASN 196 Ca 0.00 -2.00 -0.21 0.00 -0.53 0.00 0.00 54.58 51.83 1ccg n ASN 196 Cb 0.24 -0.22 -0.15 0.00 -2.08 0.00 0.00 39.78 37.57 1ccg n ASN 196 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1ccg s VAL 197 N -0.24 0.99 -0.36 3.53 1.01 -1.11 -4.80 120.40 119.42 1ccg s VAL 197 Ca 0.29 -0.51 -0.21 0.00 0.00 0.00 0.00 61.98 61.54 1ccg s VAL 197 Cb 0.33 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.88 1ccg s VAL 197 CO -0.14 0.29 0.67 0.12 0.00 0.00 0.00 175.10 176.04 1ccg s PHE 198 N -0.14 3.14 0.27 5.22 5.36 0.06 -4.67 117.98 127.22 1ccg s PHE 198 Ca 0.02 0.39 0.02 0.00 -0.96 0.00 0.00 56.93 56.39 1ccg s PHE 198 Cb -0.06 -3.20 -0.03 0.00 -0.34 0.00 0.00 43.02 39.39 1ccg s PHE 198 CO 0.00 -0.65 0.25 0.95 -1.46 0.00 0.00 175.22 174.30 1ccg s THR 199 N 2.80 0.00 -0.90 0.12 -4.23 -1.26 -4.60 115.64 107.57 1ccg s THR 199 Ca 0.26 -1.92 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 1ccg s THR 199 Cb -0.14 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.20 1ccg s THR 199 CO 0.15 0.00 0.49 -0.46 -0.54 0.00 0.00 174.62 174.26 1ccg n ASN 200 N -0.92 1.07 -0.34 3.99 6.94 -1.26 -4.50 115.26 120.23 1ccg n ASN 200 Ca 0.04 -1.77 0.08 0.00 -0.02 0.00 0.00 54.58 52.91 1ccg n ASN 200 Cb 0.64 -0.44 0.25 0.00 -2.36 0.00 0.00 39.78 37.86 1ccg n ASN 200 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1ccg h GLU 201 N 0.13 0.84 -0.94 -3.83 4.81 -1.94 -1.91 114.58 111.74 1ccg h GLU 201 Ca 0.00 -0.05 0.17 0.00 -0.13 0.00 0.00 59.36 59.35 1ccg h GLU 201 Cb 0.49 -0.19 -0.08 0.00 0.63 0.00 0.00 28.75 29.60 1ccg h GLU 201 CO 0.00 0.56 0.60 0.35 -0.73 0.00 0.00 179.01 179.79 1ccg h PHE 202 N 0.87 0.87 0.01 0.92 3.57 -1.84 -0.59 116.94 120.74 1ccg h PHE 202 Ca 0.50 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.90 1ccg h PHE 202 Cb 0.59 -0.27 0.01 0.00 2.79 0.00 0.00 35.95 39.08 1ccg h PHE 202 CO -0.02 0.27 -0.52 1.88 -2.23 0.00 0.00 178.31 177.68 1ccg h TYR 203 N 0.69 0.51 -0.50 0.41 0.05 -1.71 -1.61 116.97 114.80 1ccg h TYR 203 Ca 0.50 -0.28 -0.01 0.00 0.05 0.00 0.00 58.73 58.99 1ccg h TYR 203 Cb 0.85 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 38.51 1ccg h TYR 203 CO -0.00 1.10 0.29 -0.07 -1.05 0.00 0.00 178.16 178.43 1ccg h LEU 204 N -0.23 0.62 -0.26 3.88 3.38 -1.37 -1.40 115.31 119.93 1ccg h LEU 204 Ca -0.07 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1ccg h LEU 204 Cb 1.25 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1ccg h LEU 204 CO 0.10 0.51 0.10 0.78 0.09 0.00 0.00 178.44 180.02 1ccg h ASN 205 N 0.67 0.37 -0.70 -0.43 2.35 -1.15 0.17 115.58 116.86 1ccg h ASN 205 Ca 0.18 -0.18 0.06 0.00 -0.55 0.00 0.00 56.30 55.81 1ccg h ASN 205 Cb 0.02 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 38.24 1ccg h ASN 205 CO -0.03 0.45 0.40 0.25 -1.65 0.00 0.00 177.43 176.84 1ccg h LEU 206 N 0.27 0.59 -0.10 1.61 5.85 -1.08 -2.36 115.31 120.09 1ccg h LEU 206 Ca 0.09 0.03 -0.21 0.00 0.84 0.00 0.00 57.88 58.63 1ccg h LEU 206 Cb 0.20 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1ccg h LEU 206 CO -0.01 0.38 -0.98 -0.07 -0.34 0.00 0.00 178.44 177.43 1ccg h LEU 207 N 0.73 0.09 -0.00 2.25 3.38 -1.08 -3.39 115.31 117.29 1ccg h LEU 207 Ca 0.31 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1ccg h LEU 207 Cb 0.19 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1ccg h LEU 207 CO -0.18 1.01 -0.95 0.59 0.09 0.00 0.00 178.44 178.99 1ccg n ASN 208 N -3.46 0.95 -4.90 -0.43 5.03 0.59 -4.97 115.26 108.07 1ccg n ASN 208 Ca -0.02 -0.98 -0.28 0.00 0.87 0.00 0.00 54.58 54.17 1ccg n ASN 208 Cb 0.90 1.00 -0.03 0.00 -1.02 0.00 0.00 39.78 40.63 1ccg n ASN 208 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1ccg s GLU 209 N -2.90 3.64 -0.79 3.52 0.41 -0.90 -5.02 118.70 116.65 1ccg s GLU 209 Ca 0.08 0.05 -0.18 0.00 -0.41 0.00 0.00 54.97 54.51 1ccg s GLU 209 Cb 0.15 -2.60 0.14 0.00 -1.78 0.00 0.00 34.13 30.04 1ccg s GLU 209 CO 0.83 0.16 0.89 0.34 -0.49 0.00 0.00 175.26 176.99 1ccg s ASP 210 N -3.26 6.51 0.16 -0.19 2.15 -1.26 -5.00 116.67 115.77 1ccg s ASP 210 Ca 0.45 -1.99 -0.30 0.00 0.43 0.00 0.00 52.55 51.14 1ccg s ASP 210 Cb -0.11 -2.32 -0.07 0.00 -0.30 0.00 0.00 42.92 40.12 1ccg s ASP 210 CO 0.31 -0.96 0.96 0.26 -0.17 0.00 0.00 175.17 175.57 1ccg s TRP 211 N 2.06 3.86 -0.15 -5.34 0.52 -1.26 -4.20 118.94 114.44 1ccg s TRP 211 Ca 0.22 1.83 0.02 0.00 0.02 0.00 0.00 56.10 58.19 1ccg s TRP 211 Cb -0.13 -3.04 0.01 0.00 -1.15 0.00 0.00 33.47 29.17 1ccg s TRP 211 CO -0.04 0.25 -0.20 0.21 0.02 0.00 0.00 176.95 177.19 1ccg s LYS 212 N -0.47 2.88 0.01 4.98 2.20 0.84 -4.88 119.74 125.30 1ccg s LYS 212 Ca 0.45 -0.80 -0.30 0.00 -0.36 0.00 0.00 55.97 54.96 1ccg s LYS 212 Cb -0.25 -2.40 -0.06 0.00 -1.51 0.00 0.00 37.83 33.61 1ccg s LYS 212 CO 0.31 -0.09 1.57 -1.17 -0.36 0.00 0.00 175.35 175.61 1ccg s LEU 213 N 1.01 4.33 0.07 5.43 2.96 -1.26 -1.20 118.68 130.02 1ccg s LEU 213 Ca -0.03 2.28 -0.04 0.00 -0.22 0.00 0.00 54.13 56.13 1ccg s LEU 213 Cb -0.15 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 1ccg s LEU 213 CO -0.06 -0.84 0.06 -1.61 -1.32 0.00 0.00 176.35 172.58 1ccg s GLU 214 N 2.97 0.73 0.25 1.98 2.02 0.05 -4.95 118.70 121.75 1ccg s GLU 214 Ca 0.70 -1.15 -0.14 0.00 0.02 0.00 0.00 54.97 54.40 1ccg s GLU 214 Cb -0.35 0.26 -0.08 0.00 0.10 0.00 0.00 34.13 34.06 1ccg s GLU 214 CO 0.29 -0.19 0.65 0.15 0.02 0.00 0.00 175.26 176.19 1ccg s LYS 215 N -3.91 3.99 0.49 1.61 1.02 -1.26 -1.00 119.74 120.68 1ccg s LYS 215 Ca 0.08 0.57 0.07 0.00 0.02 0.00 0.00 55.97 56.71 1ccg s LYS 215 Cb 0.07 -2.66 0.07 0.00 -0.52 0.00 0.00 37.83 34.79 1ccg s LYS 215 CO -0.09 0.30 0.59 0.27 -0.92 0.00 0.00 175.35 175.50 1ccg n ASN 216 N 0.11 2.01 0.28 2.83 0.23 -0.12 -4.94 115.26 115.67 1ccg n ASN 216 Ca 0.00 -2.41 0.19 0.00 -0.53 0.00 0.00 54.58 51.83 1ccg n ASN 216 Cb 0.52 -0.27 1.00 0.00 -2.08 0.00 0.00 39.78 38.96 1ccg n ASN 216 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1ccg h ASP 217 N 0.22 0.00 -0.22 0.53 3.32 -1.93 -0.42 116.42 117.92 1ccg h ASP 217 Ca -0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.80 1ccg h ASP 217 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1ccg h ASP 217 CO 0.37 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.89 1ccg n ALA 218 N -1.99 2.50 -1.49 3.45 0.00 -1.26 -4.91 120.51 116.81 1ccg n ALA 218 Ca -0.02 -0.55 -0.11 0.00 0.00 0.00 0.00 53.44 52.75 1ccg n ALA 218 Cb 0.08 -1.05 -0.04 0.00 0.00 0.00 0.00 19.45 18.43 1ccg n ALA 218 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ccg n ASN 219 N 0.39 -4.26 -4.82 0.00 3.02 -0.17 -5.04 115.26 104.38 1ccg n ASN 219 Ca 0.15 0.23 -0.26 0.00 -0.03 0.00 0.00 54.58 54.67 1ccg n ASN 219 Cb 0.32 -2.89 -0.05 0.00 -0.61 0.00 0.00 39.78 36.55 1ccg n ASN 219 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1ccg s ASN 220 N -2.81 5.65 0.10 6.41 0.02 -1.26 -4.83 114.94 118.22 1ccg s ASN 220 Ca 0.00 -0.08 -0.13 0.00 -1.02 0.00 0.00 52.86 51.62 1ccg s ASN 220 Cb 0.00 -1.52 -0.06 0.00 0.02 0.00 0.00 41.25 39.69 1ccg s ASN 220 CO 0.00 0.06 0.48 -1.61 0.02 0.00 0.00 177.10 176.06 1ccg s GLU 221 N -3.15 3.92 0.09 -0.60 2.02 -1.26 -0.95 118.70 118.77 1ccg s GLU 221 Ca 0.32 0.40 -0.14 0.00 0.02 0.00 0.00 54.97 55.56 1ccg s GLU 221 Cb -0.10 -3.02 0.02 0.00 0.10 0.00 0.00 34.13 31.13 1ccg s GLU 221 CO 0.24 0.55 0.34 1.14 0.02 0.00 0.00 175.26 177.55 1ccg s GLN 222 N -1.75 0.95 -0.32 1.61 -2.07 -0.17 -4.50 119.66 113.40 1ccg s GLN 222 Ca 0.34 -0.67 -0.22 0.00 -1.82 0.00 0.00 55.36 52.98 1ccg s GLN 222 Cb -0.15 0.41 -0.00 0.00 -1.09 0.00 0.00 33.01 32.18 1ccg s GLN 222 CO 0.18 -0.34 0.72 -1.58 -1.32 0.00 0.00 175.29 172.95 1ccg s TRP 223 N -3.38 3.19 -0.10 9.60 0.52 -0.62 -0.77 118.94 127.38 1ccg s TRP 223 Ca 0.01 0.66 -0.02 0.00 0.02 0.00 0.00 56.10 56.76 1ccg s TRP 223 Cb 0.02 -3.16 -0.03 0.00 -1.15 0.00 0.00 33.47 29.15 1ccg s TRP 223 CO -0.09 -0.56 -0.02 -0.51 0.02 0.00 0.00 176.95 175.79 1ccg s ASP 224 N 1.67 5.01 0.31 2.95 1.01 -0.34 -0.95 116.67 126.33 1ccg s ASP 224 Ca 0.29 0.03 0.08 0.00 0.71 0.00 0.00 52.55 53.67 1ccg s ASP 224 Cb -0.14 -1.51 -0.04 0.00 1.01 0.00 0.00 42.92 42.24 1ccg s ASP 224 CO 0.13 0.31 0.16 -0.94 0.21 0.00 0.00 175.17 175.04 1ccg s SER 225 N -0.49 4.92 0.43 0.27 1.04 -0.37 -0.11 113.70 119.39 1ccg s SER 225 Ca 0.08 -0.61 0.13 0.00 0.48 0.00 0.00 55.95 56.03 1ccg s SER 225 Cb -0.12 -0.90 1.00 0.00 0.10 0.00 0.00 66.02 66.10 1ccg s SER 225 CO 0.02 -0.22 1.97 0.11 0.98 0.00 0.00 173.24 176.10 1ccg h LYS 226 N 1.53 0.43 0.00 4.02 6.56 -1.89 -1.16 116.57 126.06 1ccg h LYS 226 Ca -0.45 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.12 1ccg h LYS 226 Cb 1.25 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 32.81 1ccg h LYS 226 CO 0.61 0.29 0.00 0.43 -2.06 0.00 0.00 179.45 178.72 1ccg n SER 227 N -4.47 0.00 0.00 0.86 7.64 -1.26 -4.86 113.62 111.52 1ccg n SER 227 Ca 0.10 0.40 0.00 0.00 1.01 0.00 0.00 58.87 60.38 1ccg n SER 227 Cb 0.37 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 1ccg n SER 227 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ccg n GLY 228 N -0.52 0.61 3.91 0.23 0.00 -0.44 -5.07 105.19 103.91 1ccg n GLY 228 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 1ccg n GLY 228 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ccg s TYR 229 N -2.35 3.40 0.10 1.61 2.02 -1.26 -4.56 117.35 116.32 1ccg s TYR 229 Ca 0.00 0.74 0.00 0.00 -0.37 0.00 0.00 57.07 57.44 1ccg s TYR 229 Cb 0.00 -2.54 -0.04 0.00 -0.40 0.00 0.00 41.96 38.97 1ccg s TYR 229 CO 0.00 -0.58 -0.01 0.00 -1.57 0.00 0.00 175.55 173.39 1ccg s MET 230 N -4.89 0.83 -0.01 -0.62 0.23 0.27 -1.23 119.30 113.88 1ccg s MET 230 Ca 0.51 -1.36 -0.00 0.00 -1.03 0.00 0.00 55.69 53.81 1ccg s MET 230 Cb -0.10 0.02 0.02 0.00 -1.53 0.00 0.00 34.83 33.24 1ccg s MET 230 CO 0.45 -0.13 0.02 -1.64 -2.03 0.00 0.00 175.02 171.70 1ccg s MET 231 N -3.93 -0.02 0.61 3.16 -1.94 -0.13 -4.27 119.30 112.79 1ccg s MET 231 Ca 0.15 0.12 -0.16 0.00 -1.71 0.00 0.00 55.69 54.10 1ccg s MET 231 Cb 0.07 -0.16 -0.02 0.00 2.01 0.00 0.00 34.83 36.73 1ccg s MET 231 CO -0.03 -0.11 1.09 -0.51 -0.01 0.00 0.00 175.02 175.45 1ccg s LEU 232 N 0.68 3.50 0.31 -0.03 1.43 -1.26 -1.58 118.68 121.72 1ccg s LEU 232 Ca -0.06 1.96 0.06 0.00 -1.03 0.00 0.00 54.13 55.07 1ccg s LEU 232 Cb -0.08 -4.55 0.83 0.00 0.03 0.00 0.00 46.19 42.42 1ccg s LEU 232 CO -0.02 -1.38 1.66 -0.65 0.23 0.00 0.00 176.35 176.20 1ccg h PRO 233 N 0.40 0.29 0.00 1.29 0.11 -1.78 0.71 132.00 133.02 1ccg h PRO 233 Ca -0.47 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 1ccg h PRO 233 Cb 1.24 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1ccg h PRO 233 CO 0.56 0.19 -0.29 1.79 -0.21 0.00 0.00 178.00 180.04 1ccg h THR 234 N 0.29 0.86 0.01 -1.15 1.35 -1.30 -0.41 112.91 112.56 1ccg h THR 234 Ca 0.61 -1.14 -0.14 0.00 -0.55 0.00 0.00 66.41 65.19 1ccg h THR 234 Cb 1.27 1.69 0.01 0.00 -1.73 0.00 0.00 68.15 69.39 1ccg h THR 234 CO -0.61 0.28 -0.56 0.44 -0.25 0.00 0.00 175.52 174.82 1ccg h ASP 235 N 0.00 0.48 -0.87 5.36 3.32 -1.24 -3.28 116.42 120.19 1ccg h ASP 235 Ca -0.00 -0.78 -0.01 0.00 0.02 0.00 0.00 57.03 56.26 1ccg h ASP 235 Cb 0.66 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 1ccg h ASP 235 CO 0.04 1.19 0.52 0.22 -1.72 0.00 0.00 179.24 179.50 1ccg h TYR 236 N -0.19 1.16 -1.10 4.55 3.20 -0.83 -2.12 116.97 121.63 1ccg h TYR 236 Ca -0.07 -0.00 0.39 0.00 3.14 0.00 0.00 58.73 62.19 1ccg h TYR 236 Cb 1.29 -0.38 -0.12 0.00 1.54 0.00 0.00 36.73 39.06 1ccg h TYR 236 CO 0.16 0.77 0.69 0.43 -1.64 0.00 0.00 178.16 178.57 1ccg n SER 237 N -4.36 0.19 0.31 -2.11 7.64 -0.19 -1.39 113.62 113.72 1ccg n SER 237 Ca 0.10 1.20 0.21 0.00 1.01 0.00 0.00 58.87 61.38 1ccg n SER 237 Cb 0.06 -0.59 1.01 0.00 -1.01 0.00 0.00 64.21 63.69 1ccg n SER 237 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1ccg h LEU 238 N 0.00 0.00 0.00 -3.43 3.38 -1.50 -0.87 115.31 112.89 1ccg h LEU 238 Ca 0.73 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.70 1ccg h LEU 238 Cb 2.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.04 1ccg h LEU 238 CO -0.43 0.00 -1.22 2.30 0.09 0.00 0.00 178.44 179.18 1ccg n ILE 239 N -3.08 0.00 0.10 1.22 -5.35 -0.48 -1.69 119.36 110.08 1ccg n ILE 239 Ca -0.02 -0.13 -0.03 0.00 -0.27 0.00 0.00 62.75 62.30 1ccg n ILE 239 Cb 0.16 0.76 0.01 0.00 -1.74 0.00 0.00 39.64 38.83 1ccg n ILE 239 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 1ccg h GLN 240 N 0.00 0.00 -5.87 6.28 4.20 -1.15 -3.45 115.11 115.12 1ccg h GLN 240 Ca 0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 1ccg h GLN 240 Cb 0.61 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.32 1ccg h GLN 240 CO 0.00 0.78 -0.04 0.34 -0.67 0.00 0.00 178.83 179.25 1ccg s ASP 241 N -6.69 6.82 0.32 1.46 -1.08 -0.69 -4.98 116.67 111.83 1ccg s ASP 241 Ca 0.01 0.98 0.01 0.00 -0.52 0.00 0.00 52.55 53.02 1ccg s ASP 241 Cb 0.10 -2.34 0.53 0.00 -1.46 0.00 0.00 42.92 39.75 1ccg s ASP 241 CO 0.78 -0.06 1.93 1.55 0.52 0.00 0.00 175.17 179.90 1ccg h PRO 242 N 6.75 0.83 -0.10 4.34 0.13 -1.91 -0.57 132.00 141.47 1ccg h PRO 242 Ca -0.41 -0.10 -0.08 0.00 -0.87 0.00 0.00 66.00 64.54 1ccg h PRO 242 Cb 1.19 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1ccg h PRO 242 CO 0.75 0.64 -0.24 0.87 -0.23 0.00 0.00 178.00 179.80 1ccg h LYS 243 N 0.83 0.34 -0.30 0.86 1.57 -1.94 -3.12 116.57 114.81 1ccg h LYS 243 Ca 0.21 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1ccg h LYS 243 Cb 0.08 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1ccg h LYS 243 CO -0.03 0.84 0.11 1.88 -0.57 0.00 0.00 179.45 181.68 1ccg h TYR 244 N -0.11 0.47 -0.92 -1.35 0.05 -1.77 -3.18 116.97 110.16 1ccg h TYR 244 Ca -0.00 -0.04 0.15 0.00 0.05 0.00 0.00 58.73 58.88 1ccg h TYR 244 Cb 0.84 -0.14 -0.08 0.00 1.01 0.00 0.00 36.73 38.37 1ccg h TYR 244 CO 0.11 0.47 0.59 1.25 -1.05 0.00 0.00 178.16 179.53 1ccg h LEU 245 N 0.34 0.70 -0.73 3.88 5.85 -0.19 0.58 115.31 125.73 1ccg h LEU 245 Ca 0.10 0.05 -0.13 0.00 0.84 0.00 0.00 57.88 58.74 1ccg h LEU 245 Cb 0.21 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1ccg h LEU 245 CO -0.01 0.34 -0.45 0.77 -0.34 0.00 0.00 178.44 178.76 1ccg h SER 246 N 0.73 0.45 -0.07 1.25 4.64 -1.52 -2.21 113.55 116.82 1ccg h SER 246 Ca 0.47 -0.21 -0.03 0.00 -0.47 0.00 0.00 61.79 61.55 1ccg h SER 246 Cb 0.72 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1ccg h SER 246 CO -0.23 0.84 -0.06 0.40 -0.87 0.00 0.00 176.83 176.91 1ccg h ILE 247 N 0.34 1.36 -0.81 0.95 2.04 -1.00 -2.65 117.51 117.73 1ccg h ILE 247 Ca 0.02 -1.17 0.18 0.00 1.00 0.00 0.00 64.86 64.89 1ccg h ILE 247 Cb 0.93 1.98 -0.15 0.00 -0.74 0.00 0.00 36.82 38.84 1ccg h ILE 247 CO 0.08 0.32 -0.12 0.58 0.00 0.00 0.00 178.15 179.01 1ccg h VAL 248 N -0.25 0.22 -0.34 1.67 2.07 -0.94 -1.58 116.25 117.09 1ccg h VAL 248 Ca 0.01 -0.01 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1ccg h VAL 248 Cb 0.55 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1ccg h VAL 248 CO 0.02 0.01 -0.04 0.11 0.02 0.00 0.00 177.57 177.68 1ccg h LYS 249 N 0.03 0.55 -0.74 1.57 1.57 -1.31 -1.60 116.57 116.63 1ccg h LYS 249 Ca 0.42 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 59.03 1ccg h LYS 249 Cb 0.69 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.90 1ccg h LYS 249 CO -0.79 0.61 0.35 1.49 -0.57 0.00 0.00 179.45 180.53 1ccg h GLU 250 N 0.52 1.08 0.00 3.15 4.81 -0.94 -2.03 114.58 121.16 1ccg h GLU 250 Ca 0.11 -0.16 -0.19 0.00 -0.13 0.00 0.00 59.36 58.98 1ccg h GLU 250 Cb 0.40 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1ccg h GLU 250 CO 0.02 0.85 -0.92 1.88 -0.73 0.00 0.00 179.01 180.10 1ccg h TYR 251 N 1.05 0.00 -0.02 0.92 0.05 -0.80 -1.63 116.97 116.54 1ccg h TYR 251 Ca 0.25 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.95 1ccg h TYR 251 Cb 0.13 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 1ccg h TYR 251 CO 0.01 0.92 -0.37 0.00 -1.05 0.00 0.00 178.16 177.67 1ccg h ALA 252 N 1.08 1.35 -0.02 3.88 0.00 -1.24 -3.03 119.26 121.29 1ccg h ALA 252 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ccg h ALA 252 Cb 1.65 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1ccg h ALA 252 CO 0.12 0.48 -0.30 0.09 0.00 0.00 0.00 179.25 179.64 1ccg n ASN 253 N -4.09 1.90 -3.17 0.00 3.02 -0.77 -4.76 115.26 107.38 1ccg n ASN 253 Ca -0.02 -1.44 -0.10 0.00 -0.03 0.00 0.00 54.58 52.98 1ccg n ASN 253 Cb 0.41 0.27 -0.04 0.00 -0.61 0.00 0.00 39.78 39.81 1ccg n ASN 253 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ccg s ASP 254 N -2.36 -0.17 0.41 6.41 -1.08 -0.62 -5.00 116.67 114.26 1ccg s ASP 254 Ca 0.23 -1.64 0.12 0.00 -0.52 0.00 0.00 52.55 50.74 1ccg s ASP 254 Cb 0.19 1.12 0.95 0.00 -1.46 0.00 0.00 42.92 43.72 1ccg s ASP 254 CO 0.49 -0.17 1.96 -0.61 0.52 0.00 0.00 175.17 177.36 1ccg h GLN 255 N 6.29 0.50 -0.57 4.34 4.15 -1.84 -2.05 115.11 125.94 1ccg h GLN 255 Ca 0.09 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.41 1ccg h GLN 255 Cb 1.08 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.63 1ccg h GLN 255 CO 0.15 0.33 0.09 -0.44 -1.93 0.00 0.00 178.83 177.03 1ccg h ASP 256 N 0.52 0.90 -0.87 -0.69 3.32 -1.94 0.10 116.42 117.76 1ccg h ASP 256 Ca 0.31 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 1ccg h ASP 256 Cb 0.53 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.80 1ccg h ASP 256 CO -0.10 0.93 0.44 0.50 -1.72 0.00 0.00 179.24 179.30 1ccg h LYS 257 N 0.84 1.23 -0.35 3.56 1.63 -1.83 -1.45 116.57 120.20 1ccg h LYS 257 Ca 0.17 -0.16 -0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1ccg h LYS 257 Cb 0.41 -0.23 -0.02 0.00 -0.60 0.00 0.00 32.23 31.80 1ccg h LYS 257 CO 0.01 0.92 0.21 0.35 -3.45 0.00 0.00 179.45 177.49 1ccg h PHE 258 N 1.22 0.46 -0.42 1.91 3.57 -0.82 -0.71 116.94 122.16 1ccg h PHE 258 Ca 0.30 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.80 1ccg h PHE 258 Cb 0.08 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.65 1ccg h PHE 258 CO 0.01 0.34 0.28 0.74 -2.23 0.00 0.00 178.31 177.45 1ccg h PHE 259 N 0.45 0.53 -0.23 0.41 -1.00 -0.39 0.79 116.94 117.50 1ccg h PHE 259 Ca 0.12 0.01 0.02 0.00 2.81 0.00 0.00 57.97 60.94 1ccg h PHE 259 Cb 0.01 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 39.37 1ccg h PHE 259 CO -0.04 0.34 0.09 -0.22 -1.61 0.00 0.00 178.31 176.87 1ccg h LYS 260 N 0.57 0.20 -0.10 1.51 3.64 -1.15 -1.66 116.57 119.58 1ccg h LYS 260 Ca 0.15 -0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.33 1ccg h LYS 260 Cb -0.06 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1ccg h LYS 260 CO -0.03 0.13 -0.73 -0.44 -2.27 0.00 0.00 179.45 176.11 1ccg h ASP 261 N 0.20 0.61 -0.68 4.20 5.19 -0.99 -2.85 116.42 122.11 1ccg h ASP 261 Ca 0.10 -0.40 0.00 0.00 -0.62 0.00 0.00 57.03 56.11 1ccg h ASP 261 Cb 0.05 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 39.35 1ccg h ASP 261 CO -0.09 1.15 0.43 0.15 -3.12 0.00 0.00 179.24 177.76 1ccg h PHE 262 N 0.35 0.87 0.35 4.55 3.57 -0.76 -0.90 116.94 124.97 1ccg h PHE 262 Ca -0.03 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 1ccg h PHE 262 Cb 1.32 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.75 1ccg h PHE 262 CO 0.05 0.56 -0.33 1.03 -2.23 0.00 0.00 178.31 177.40 1ccg h SER 263 N 0.92 -0.89 -0.64 0.41 0.87 -1.28 0.13 113.55 113.07 1ccg h SER 263 Ca 0.25 0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.88 1ccg h SER 263 Cb -0.08 0.30 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 1ccg h SER 263 CO -0.05 -0.47 0.37 0.11 -0.53 0.00 0.00 176.83 176.26 1ccg h LYS 264 N -0.70 0.87 -0.14 2.24 1.57 -1.46 -2.57 116.57 116.39 1ccg h LYS 264 Ca -0.02 -0.09 -0.14 0.00 -1.87 0.00 0.00 60.65 58.53 1ccg h LYS 264 Cb 0.63 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1ccg h LYS 264 CO -0.05 0.63 -0.51 0.00 -0.57 0.00 0.00 179.45 178.95 1ccg h ALA 265 N 1.19 0.87 -0.11 3.86 0.00 -0.95 -2.66 119.26 121.46 1ccg h ALA 265 Ca 0.23 -0.49 -0.19 0.00 0.00 0.00 0.00 54.91 54.47 1ccg h ALA 265 Cb -0.01 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.70 1ccg h ALA 265 CO -0.04 0.67 -0.66 0.35 0.00 0.00 0.00 179.25 179.57 1ccg h PHE 266 N 0.30 0.88 0.08 0.00 3.57 -0.59 -0.43 116.94 120.75 1ccg h PHE 266 Ca 0.01 -0.40 0.02 0.00 3.53 0.00 0.00 57.97 61.14 1ccg h PHE 266 Cb 1.00 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.57 1ccg h PHE 266 CO 0.03 1.21 -0.28 1.49 -2.23 0.00 0.00 178.31 178.52 1ccg h GLU 267 N 0.30 -0.46 -0.77 1.11 4.81 -1.54 -0.47 114.58 117.57 1ccg h GLU 267 Ca -0.05 0.03 0.15 0.00 -0.13 0.00 0.00 59.36 59.36 1ccg h GLU 267 Cb 1.30 0.10 -0.10 0.00 0.63 0.00 0.00 28.75 30.69 1ccg h GLU 267 CO 0.14 -0.31 0.33 -0.22 -0.73 0.00 0.00 179.01 178.22 1ccg h LYS 268 N -0.48 0.46 -0.84 1.92 3.64 -1.38 0.56 116.57 120.44 1ccg h LYS 268 Ca 0.04 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.43 1ccg h LYS 268 Cb 0.52 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.19 1ccg h LYS 268 CO -0.19 0.30 0.54 1.25 -2.27 0.00 0.00 179.45 179.08 1ccg h LEU 269 N 0.47 0.88 -0.54 5.20 5.85 -0.70 -1.31 115.31 125.18 1ccg h LEU 269 Ca 0.43 -0.00 -0.07 0.00 0.84 0.00 0.00 57.88 59.08 1ccg h LEU 269 Cb 0.65 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1ccg h LEU 269 CO -0.40 0.60 -0.32 -0.07 -0.34 0.00 0.00 178.44 177.91 1ccg h LEU 270 N 1.04 0.00 -0.11 2.25 3.38 0.65 -3.30 115.31 119.21 1ccg h LEU 270 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1ccg h LEU 270 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1ccg h LEU 270 CO -0.13 0.32 -0.66 -0.62 0.09 0.00 0.00 178.44 177.45 1ccg n GLU 271 N -3.30 0.15 -1.70 1.13 1.02 0.00 -4.61 120.64 113.34 1ccg n GLU 271 Ca 0.01 -0.11 -0.44 0.00 -0.02 0.00 0.00 57.16 56.61 1ccg n GLU 271 Cb 0.57 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.47 1ccg n GLU 271 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1ccg n ASN 272 N -1.33 3.17 0.00 1.62 3.02 -0.52 -2.82 115.26 118.41 1ccg n ASN 272 Ca 0.06 1.14 0.00 0.00 -0.03 0.00 0.00 54.58 55.74 1ccg n ASN 272 Cb 0.34 -1.49 0.00 0.00 -0.61 0.00 0.00 39.78 38.03 1ccg n ASN 272 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ccg n GLY 273 N 2.32 0.56 2.97 7.41 0.00 -1.26 -4.46 105.19 112.72 1ccg n GLY 273 Ca 0.11 -0.55 -0.26 0.00 0.00 0.00 0.00 46.02 45.33 1ccg n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ccg s ILE 274 N -2.00 1.08 -0.12 -0.61 1.01 -1.13 -4.37 121.20 115.07 1ccg s ILE 274 Ca 0.00 -0.39 -0.16 0.00 0.00 0.00 0.00 60.65 60.10 1ccg s ILE 274 Cb 0.00 -1.04 -0.05 0.00 0.01 0.00 0.00 42.46 41.39 1ccg s ILE 274 CO 0.00 0.36 0.39 -0.89 0.00 0.00 0.00 174.94 174.80 1ccg s THR 275 N 1.14 5.22 -0.32 2.92 2.01 0.04 -4.96 115.64 121.70 1ccg s THR 275 Ca -0.06 0.77 -0.08 0.00 0.31 0.00 0.00 61.69 62.64 1ccg s THR 275 Cb -0.14 -3.73 0.02 0.00 0.01 0.00 0.00 72.50 68.66 1ccg s THR 275 CO -0.02 0.39 0.11 -0.36 -0.69 0.00 0.00 174.62 174.05 1ccg s PHE 276 N 0.33 3.19 0.86 4.92 0.08 -1.26 -0.75 117.98 125.34 1ccg s PHE 276 Ca 0.22 -1.04 -0.12 0.00 0.12 0.00 0.00 56.93 56.11 1ccg s PHE 276 Cb -0.14 -2.29 0.11 0.00 -0.57 0.00 0.00 43.02 40.12 1ccg s PHE 276 CO 0.08 -0.61 1.14 -2.30 -0.10 0.00 0.00 175.22 173.43 1ccg n PRO 277 N 4.88 -0.12 -0.28 0.24 -0.02 -1.26 -4.89 135.00 133.56 1ccg n PRO 277 Ca -0.14 0.04 0.06 0.00 -2.02 0.00 0.00 63.50 61.44 1ccg n PRO 277 Cb 0.47 -2.38 0.18 0.00 -0.02 0.00 0.00 33.50 31.76 1ccg n PRO 277 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1ccg n LYS 278 N -3.60 2.23 0.14 -0.52 4.81 -1.26 -2.13 118.16 117.84 1ccg n LYS 278 Ca 0.13 -1.48 0.12 0.00 -0.87 0.00 0.00 58.31 56.20 1ccg n LYS 278 Cb 0.51 -1.47 0.24 0.00 0.02 0.00 0.00 35.03 34.33 1ccg n LYS 278 CO 0.00 0.00 0.00 0.38 1.17 0.00 0.00 177.40 178.95 1ccg h ASP 279 N 2.25 0.00 -3.39 3.14 3.04 -2.03 -3.48 116.42 115.96 1ccg h ASP 279 Ca 0.00 -0.03 -0.57 0.00 -3.24 0.00 0.00 57.03 53.19 1ccg h ASP 279 Cb 0.74 0.00 0.13 0.00 -1.04 0.00 0.00 39.33 39.16 1ccg h ASP 279 CO 0.07 0.01 0.34 0.00 -2.04 0.00 0.00 179.24 177.62 1ccg n ALA 280 N -1.96 0.78 -1.62 4.15 0.00 -0.90 -4.94 120.51 116.01 1ccg n ALA 280 Ca 0.04 0.22 -0.44 0.00 0.00 0.00 0.00 53.44 53.26 1ccg n ALA 280 Cb 0.48 -2.19 -0.01 0.00 0.00 0.00 0.00 19.45 17.73 1ccg n ALA 280 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ccg n PRO 281 N -0.08 1.57 -1.21 0.00 -0.04 -1.26 -4.99 135.00 128.98 1ccg n PRO 281 Ca 0.09 0.55 -0.37 0.00 -0.04 0.00 0.00 63.50 63.73 1ccg n PRO 281 Cb 0.40 -1.98 0.05 0.00 -0.04 0.00 0.00 33.50 31.93 1ccg n PRO 281 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1ccg n SER 282 N 1.12 -2.65 -4.74 3.54 7.64 -1.26 -4.91 113.62 112.36 1ccg n SER 282 Ca 0.08 0.54 -0.42 0.00 1.01 0.00 0.00 58.87 60.08 1ccg n SER 282 Cb 0.33 -1.05 -0.01 0.00 -1.01 0.00 0.00 64.21 62.47 1ccg n SER 282 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1ccg n PRO 283 N 0.36 2.64 -2.65 1.43 -0.04 -1.26 -4.94 135.00 130.53 1ccg n PRO 283 Ca 0.07 0.94 -0.41 0.00 -0.04 0.00 0.00 63.50 64.06 1ccg n PRO 283 Cb 0.50 -2.70 -0.04 0.00 -0.04 0.00 0.00 33.50 31.22 1ccg n PRO 283 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1ccg s PHE 284 N -0.12 3.69 -0.45 0.54 0.08 0.11 -4.77 117.98 117.07 1ccg s PHE 284 Ca 0.63 1.68 -0.09 0.00 0.12 0.00 0.00 56.93 59.27 1ccg s PHE 284 Cb -0.51 -3.15 0.10 0.00 -0.57 0.00 0.00 43.02 38.89 1ccg s PHE 284 CO 0.50 -0.17 0.31 0.42 -0.10 0.00 0.00 175.22 176.18 1ccg s ILE 285 N 0.33 4.23 0.20 0.64 -1.09 -1.26 -1.25 121.20 123.00 1ccg s ILE 285 Ca 0.50 -1.60 -0.30 0.00 -2.23 0.00 0.00 60.65 57.02 1ccg s ILE 285 Cb -0.25 -3.69 -0.09 0.00 -1.58 0.00 0.00 42.46 36.86 1ccg s ILE 285 CO 0.30 -0.65 1.27 -0.36 -1.23 0.00 0.00 174.94 174.27 1ccg s PHE 286 N 1.39 3.31 0.47 3.97 0.08 -1.26 -5.04 117.98 120.90 1ccg s PHE 286 Ca 0.04 1.31 -0.22 0.00 0.12 0.00 0.00 56.93 58.18 1ccg s PHE 286 Cb -0.25 -3.54 -0.07 0.00 -0.57 0.00 0.00 43.02 38.59 1ccg s PHE 286 CO 0.01 -1.63 1.13 0.15 -0.10 0.00 0.00 175.22 174.78 1ccg s LYS 287 N -0.27 3.75 0.58 0.44 1.02 -1.26 -5.03 119.74 118.97 1ccg s LYS 287 Ca 0.55 1.68 -0.09 0.00 0.02 0.00 0.00 55.97 58.13 1ccg s LYS 287 Cb -0.35 -2.34 -0.03 0.00 -0.52 0.00 0.00 37.83 34.59 1ccg s LYS 287 CO 0.38 -0.53 0.94 0.95 -0.92 0.00 0.00 175.35 176.17 1ccg s THR 288 N -1.63 4.65 0.26 2.17 -4.23 -1.26 -4.91 115.64 110.70 1ccg s THR 288 Ca 0.64 0.58 -0.06 0.00 -1.18 0.00 0.00 61.69 61.67 1ccg s THR 288 Cb -0.26 -3.83 0.32 0.00 1.34 0.00 0.00 72.50 70.08 1ccg s THR 288 CO 0.31 -0.98 1.61 -0.07 -0.54 0.00 0.00 174.62 174.95 1ccg h LEU 289 N -0.15 -0.46 -0.73 4.79 3.38 -1.97 -0.10 115.31 120.07 1ccg h LEU 289 Ca -0.45 0.22 0.06 0.00 0.09 0.00 0.00 57.88 57.80 1ccg h LEU 289 Cb 1.20 0.41 -0.05 0.00 0.09 0.00 0.00 40.66 42.30 1ccg h LEU 289 CO 0.62 -0.23 0.43 -0.08 0.09 0.00 0.00 178.44 179.26 1ccg h GLU 290 N 0.06 0.77 0.00 1.13 4.81 -1.94 0.58 114.58 119.99 1ccg h GLU 290 Ca 0.44 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.57 1ccg h GLU 290 Cb 0.79 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1ccg h GLU 290 CO -0.75 0.51 -0.29 0.93 -0.73 0.00 0.00 179.01 178.67 1ccg h GLU 291 N 0.79 0.00 -0.00 1.92 5.08 -1.40 -2.76 114.58 118.21 1ccg h GLU 291 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1ccg h GLU 291 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1ccg h GLU 291 CO -0.17 0.29 -0.32 1.04 -1.00 0.00 0.00 179.01 178.86 1ccg n GLN 292 N -3.69 0.53 -1.71 2.33 6.02 0.00 -4.95 117.38 115.91 1ccg n GLN 292 Ca -0.01 -0.30 -0.04 0.00 -0.01 0.00 0.00 57.00 56.64 1ccg n GLN 292 Cb 0.40 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 30.16 1ccg n GLN 292 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ccg n GLY 293 N 1.39 0.39 0.40 1.08 0.00 -0.11 -5.07 105.19 103.27 1ccg n GLY 293 Ca 0.10 -0.78 0.05 0.00 0.00 0.00 0.00 46.02 45.39 1ccg n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36