#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xly h SER 14 N 0.00 0.22 1.23 8.00 0.87 -2.00 -1.59 113.55 120.28 1xly h SER 14 Ca 0.00 -0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.31 1xly h SER 14 Cb 0.00 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1xly h SER 14 CO 0.00 0.42 0.00 -0.08 -0.53 0.00 0.00 176.83 176.64 1xly h GLU 15 N 0.01 0.00 -0.00 2.24 4.81 -1.99 -2.00 114.58 117.65 1xly h GLU 15 Ca 0.04 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.12 1xly h GLU 15 Cb 0.29 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.68 1xly h GLU 15 CO 0.00 0.00 -0.61 1.25 -0.73 0.00 0.00 179.01 178.93 1xly h LEU 16 N 0.00 0.54 -1.55 1.64 5.85 -1.95 -1.97 115.31 117.86 1xly h LEU 16 Ca 0.00 -0.76 -0.04 0.00 0.84 0.00 0.00 57.88 57.93 1xly h LEU 16 Cb 0.62 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1xly h LEU 16 CO 0.00 1.23 -0.11 -0.37 -0.34 0.00 0.00 178.44 178.84 1xly h VAL 17 N -0.09 1.14 -0.10 1.05 -1.51 -0.86 -1.47 116.25 114.41 1xly h VAL 17 Ca -0.07 -0.62 -0.16 0.00 -1.23 0.00 0.00 66.70 64.62 1xly h VAL 17 Cb 1.32 1.19 -0.01 0.00 -2.13 0.00 0.00 31.29 31.66 1xly h VAL 17 CO 0.12 0.19 -0.64 -0.33 -1.23 0.00 0.00 177.57 175.68 1xly h GLU 18 N 0.14 0.36 -0.57 5.19 4.39 -1.37 -1.70 114.58 121.02 1xly h GLU 18 Ca 0.03 -0.26 -0.07 0.00 0.34 0.00 0.00 59.36 59.40 1xly h GLU 18 Cb 0.29 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 1xly h GLU 18 CO 0.02 0.88 0.08 1.96 -1.16 0.00 0.00 179.01 180.78 1xly h GLN 19 N 0.26 0.95 -0.17 2.33 4.20 -0.89 -1.13 115.11 120.67 1xly h GLN 19 Ca -0.01 -0.26 -0.06 0.00 0.06 0.00 0.00 58.65 58.37 1xly h GLN 19 Cb 1.17 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 1xly h GLN 19 CO 0.11 0.92 -0.14 0.82 -0.67 0.00 0.00 178.83 179.86 1xly h ILE 20 N 0.84 1.33 -0.51 2.54 2.04 -1.13 -2.81 117.51 119.82 1xly h ILE 20 Ca 0.17 -1.27 -0.06 0.00 1.00 0.00 0.00 64.86 64.70 1xly h ILE 20 Cb 0.44 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.29 1xly h ILE 20 CO 0.01 0.38 0.09 -0.07 0.00 0.00 0.00 178.15 178.56 1xly h LEU 21 N 0.05 0.74 -1.32 1.44 3.38 -1.32 -2.36 115.31 115.93 1xly h LEU 21 Ca 0.03 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.88 1xly h LEU 21 Cb 0.66 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1xly h LEU 21 CO 0.04 0.76 0.47 0.00 0.09 0.00 0.00 178.44 179.79 1xly h ALA 22 N 1.34 1.54 -0.36 1.53 0.00 -1.12 0.12 119.26 122.30 1xly h ALA 22 Ca 0.16 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1xly h ALA 22 Cb 0.33 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1xly h ALA 22 CO 0.00 0.41 0.21 -0.07 0.00 0.00 0.00 179.25 179.80 1xly h LEU 23 N 0.91 0.44 -0.30 0.00 3.38 -1.16 -1.42 115.31 117.17 1xly h LEU 23 Ca 0.27 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1xly h LEU 23 Cb -0.03 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1xly h LEU 23 CO -0.07 0.38 0.19 0.25 0.09 0.00 0.00 178.44 179.29 1xly h LEU 24 N 0.46 0.35 -1.49 1.67 5.85 -1.21 -1.67 115.31 119.27 1xly h LEU 24 Ca 0.13 -0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.91 1xly h LEU 24 Cb 0.03 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 1xly h LEU 24 CO -0.02 0.27 0.45 -1.28 -0.34 0.00 0.00 178.44 177.52 1xly h SER 25 N 0.39 0.53 -0.39 1.25 0.87 -0.65 -1.36 113.55 114.19 1xly h SER 25 Ca 0.11 0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 60.55 1xly h SER 25 Cb -0.02 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 1xly h SER 25 CO -0.02 0.32 -0.27 0.03 -0.53 0.00 0.00 176.83 176.36 1xly h ARG 26 N 0.59 0.86 0.02 2.24 3.08 -0.63 0.22 114.38 120.75 1xly h ARG 26 Ca 0.31 -0.41 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 1xly h ARG 26 Cb 0.43 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1xly h ARG 26 CO -0.10 1.06 -0.01 -0.92 -1.07 0.00 0.00 179.97 178.92 1xly h TYR 27 N 0.67 -0.02 0.04 3.04 -0.00 -0.98 -1.83 116.97 117.88 1xly h TYR 27 Ca 0.08 -0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.81 1xly h TYR 27 Cb 0.84 0.01 -0.01 0.00 -0.00 0.00 0.00 36.73 37.57 1xly h TYR 27 CO 0.06 0.04 -0.04 -0.07 -0.00 0.00 0.00 178.16 178.15 1xly h LEU 28 N -0.08 -0.12 -1.56 2.82 3.38 -1.25 -2.96 115.31 115.55 1xly h LEU 28 Ca -0.00 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1xly h LEU 28 Cb 0.07 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1xly h LEU 28 CO 0.00 -0.07 0.06 0.28 0.09 0.00 0.00 178.44 178.80 1xly h SER 29 N -0.10 0.31 -0.33 -0.43 0.02 -0.88 -0.88 113.55 111.26 1xly h SER 29 Ca 0.01 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 1xly h SER 29 Cb 0.10 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1xly h SER 29 CO -0.02 0.32 0.14 -1.28 -1.14 0.00 0.00 176.83 174.85 1xly h SER 30 N 0.34 0.44 -0.51 3.07 0.87 -1.27 -1.20 113.55 115.29 1xly h SER 30 Ca 0.08 -0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.43 1xly h SER 30 Cb 0.14 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 1xly h SER 30 CO -0.00 0.47 0.06 1.88 -0.53 0.00 0.00 176.83 178.70 1xly h TYR 31 N 0.38 0.93 -0.44 2.24 0.05 -1.31 -2.39 116.97 116.43 1xly h TYR 31 Ca 0.11 -0.14 0.07 0.00 0.05 0.00 0.00 58.73 58.82 1xly h TYR 31 Cb 0.15 -0.25 -0.06 0.00 1.01 0.00 0.00 36.73 37.59 1xly h TYR 31 CO -0.01 0.85 0.11 0.82 -1.05 0.00 0.00 178.16 178.88 1xly h ILE 32 N 0.74 0.80 0.37 -2.88 2.04 -1.00 -0.73 117.51 116.85 1xly h ILE 32 Ca 0.15 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.91 1xly h ILE 32 Cb 0.44 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1xly h ILE 32 CO 0.01 0.05 -0.20 -0.74 0.00 0.00 0.00 178.15 177.27 1xly h HIS 33 N 0.26 -0.52 -0.12 1.37 2.76 -1.11 0.91 115.15 118.69 1xly h HIS 33 Ca 0.21 -0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 58.22 1xly h HIS 33 Cb 0.25 0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.38 1xly h HIS 33 CO -0.19 -0.32 -0.59 -0.24 -1.30 0.00 0.00 177.93 175.29 1xly h VAL 34 N -0.53 1.35 -0.12 5.26 3.04 -1.21 -2.90 116.25 121.14 1xly h VAL 34 Ca -0.05 -1.90 -0.17 0.00 -1.01 0.00 0.00 66.70 63.57 1xly h VAL 34 Cb 0.42 1.90 -0.01 0.00 -2.01 0.00 0.00 31.29 31.60 1xly h VAL 34 CO 0.06 0.58 -0.65 -0.07 -1.01 0.00 0.00 177.57 176.48 1xly h LEU 35 N 0.31 0.51 -1.11 3.16 3.38 -1.09 -0.95 115.31 119.52 1xly h LEU 35 Ca -0.00 -0.31 0.12 0.00 0.09 0.00 0.00 57.88 57.78 1xly h LEU 35 Cb 1.12 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.65 1xly h LEU 35 CO 0.10 1.02 0.61 0.78 0.09 0.00 0.00 178.44 181.04 1xly h ASN 36 N 0.32 0.85 -0.08 -0.43 2.35 -0.71 0.62 115.58 118.50 1xly h ASN 36 Ca -0.01 0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.70 1xly h ASN 36 Cb 1.20 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.44 1xly h ASN 36 CO 0.11 0.46 -0.25 0.11 -1.65 0.00 0.00 177.43 176.22 1xly h LYS 37 N 0.91 0.32 -0.04 0.81 1.57 -1.29 -2.32 116.57 116.53 1xly h LYS 37 Ca 0.46 -0.23 0.04 0.00 -1.87 0.00 0.00 60.65 59.05 1xly h LYS 37 Cb 0.50 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.80 1xly h LYS 37 CO -0.23 0.85 -0.23 0.35 -0.57 0.00 0.00 179.45 179.61 1xly h PHE 38 N -0.16 -0.62 -0.94 -1.35 -0.00 -0.95 -1.67 116.94 111.25 1xly h PHE 38 Ca -0.01 0.02 0.15 0.00 -0.00 0.00 0.00 57.97 58.14 1xly h PHE 38 Cb 0.87 0.28 -0.08 0.00 -0.00 0.00 0.00 35.95 37.02 1xly h PHE 38 CO 0.12 -0.32 0.60 0.82 -0.00 0.00 0.00 178.31 179.53 1xly h ILE 39 N -0.35 0.82 -0.04 1.41 2.04 -0.92 -1.16 117.51 119.31 1xly h ILE 39 Ca 0.07 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 1xly h ILE 39 Cb 0.45 -0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.52 1xly h ILE 39 CO -0.24 0.14 -0.01 -1.28 0.00 0.00 0.00 178.15 176.76 1xly h SER 40 N 0.76 0.07 0.19 1.72 0.87 -1.10 -2.62 113.55 113.44 1xly h SER 40 Ca 0.49 -0.36 -0.01 0.00 -1.23 0.00 0.00 61.79 60.68 1xly h SER 40 Cb 0.74 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.68 1xly h SER 40 CO -0.25 0.41 -0.04 -0.74 -0.53 0.00 0.00 176.83 175.68 1xly h HIS 41 N -0.27 0.00 0.00 2.24 -0.00 -0.85 -0.33 115.15 115.94 1xly h HIS 41 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 1xly h HIS 41 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.79 1xly h HIS 41 CO 0.05 0.04 -0.44 1.28 -0.00 0.00 0.00 177.93 178.86 1xly n LEU 42 N -3.52 0.47 -0.46 0.26 4.77 -0.48 -4.26 117.00 113.78 1xly n LEU 42 Ca -0.02 0.14 0.39 0.00 -0.03 0.00 0.00 56.01 56.48 1xly n LEU 42 Cb 0.14 -0.28 0.71 0.00 -2.33 0.00 0.00 43.42 41.67 1xly n LEU 42 CO 0.26 0.06 1.33 -0.09 -1.33 0.00 0.00 177.39 177.62 1xly h ARG 43 N 0.00 0.07 -0.02 3.23 1.12 -0.68 -2.12 114.38 115.98 1xly h ARG 43 Ca 0.00 -0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1xly h ARG 43 Cb 0.56 -0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.50 1xly h ARG 43 CO 0.00 0.05 0.00 0.54 -3.11 0.00 0.00 179.97 177.45 1xly n ARG 44 N -4.32 1.60 -3.45 0.20 1.74 -1.26 -4.88 116.66 106.29 1xly n ARG 44 Ca 0.34 -2.48 -0.43 0.00 -0.77 0.00 0.00 57.85 54.50 1xly n ARG 44 Cb 1.46 -1.47 -0.06 0.00 -1.02 0.00 0.00 32.46 31.36 1xly n ARG 44 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1xly s VAL 45 N -2.66 4.73 0.40 1.55 1.01 -0.80 -4.94 120.40 119.69 1xly s VAL 45 Ca 0.29 -1.93 0.12 0.00 0.00 0.00 0.00 61.98 60.46 1xly s VAL 45 Cb 0.25 -4.05 0.15 0.00 0.00 0.00 0.00 36.38 32.73 1xly s VAL 45 CO 0.03 -0.86 1.91 0.00 0.00 0.00 0.00 175.10 176.18 1xly h ALA 46 N 8.33 1.52 0.00 5.51 0.00 -1.90 -0.42 119.26 132.31 1xly h ALA 46 Ca -0.16 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1xly h ALA 46 Cb 1.06 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1xly h ALA 46 CO 0.88 0.35 0.00 0.25 0.00 0.00 0.00 179.25 180.73 1xly n THR 47 N -4.24 0.89 -0.53 0.00 -2.24 -1.26 -2.63 114.28 104.28 1xly n THR 47 Ca -0.02 0.22 0.05 0.00 -2.27 0.00 0.00 64.05 62.04 1xly n THR 47 Cb 0.30 -1.02 0.07 0.00 -2.10 0.00 0.00 70.33 67.58 1xly n THR 47 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1xly n LEU 48 N -1.38 2.19 -0.16 3.22 4.32 -0.17 -4.80 117.00 120.22 1xly n LEU 48 Ca 0.05 -2.53 -0.03 0.00 -0.02 0.00 0.00 56.01 53.48 1xly n LEU 48 Cb 0.12 -0.21 0.07 0.00 -1.62 0.00 0.00 43.42 41.77 1xly n LEU 48 CO 0.10 0.60 0.93 -0.09 -1.22 0.00 0.00 177.39 177.71 1xly h ARG 49 N 0.02 0.26 0.00 3.23 2.43 -1.47 -1.18 114.38 117.68 1xly h ARG 49 Ca 0.00 -0.02 -0.22 0.00 -0.81 0.00 0.00 59.98 58.93 1xly h ARG 49 Cb 0.75 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.20 1xly h ARG 49 CO 0.00 0.17 -1.33 0.74 -1.51 0.00 0.00 179.97 178.04 1xly h PHE 50 N 0.27 0.00 -0.91 2.20 0.05 -1.87 -2.48 116.94 114.21 1xly h PHE 50 Ca 0.25 0.00 0.03 0.00 3.82 0.00 0.00 57.97 62.07 1xly h PHE 50 Cb 0.31 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 38.21 1xly h PHE 50 CO -0.20 0.86 0.60 0.93 -0.18 0.00 0.00 178.31 180.31 1xly h GLU 51 N 0.00 1.12 -0.47 1.51 3.07 -1.87 -1.75 114.58 116.17 1xly h GLU 51 Ca -0.16 -0.07 -0.04 0.00 -0.50 0.00 0.00 59.36 58.60 1xly h GLU 51 Cb 1.79 -0.25 -0.02 0.00 -0.84 0.00 0.00 28.75 29.43 1xly h GLU 51 CO 0.08 0.74 0.14 -0.09 -1.40 0.00 0.00 179.01 178.48 1xly h ARG 52 N 1.15 0.74 -0.68 2.33 2.43 -1.10 -1.32 114.38 117.92 1xly h ARG 52 Ca 0.36 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 59.32 1xly h ARG 52 Cb 0.00 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 1xly h ARG 52 CO -0.11 0.71 0.25 1.79 -1.51 0.00 0.00 179.97 181.10 1xly h THR 53 N 0.63 1.24 -0.51 0.20 1.35 -1.11 -0.08 112.91 114.63 1xly h THR 53 Ca 0.15 -0.79 -0.06 0.00 -0.55 0.00 0.00 66.41 65.16 1xly h THR 53 Cb 0.28 0.45 -0.02 0.00 -1.73 0.00 0.00 68.15 67.13 1xly h THR 53 CO -0.00 0.31 0.06 0.74 -0.25 0.00 0.00 175.52 176.38 1xly h THR 54 N 0.99 1.24 -0.63 6.82 2.02 -0.97 -2.40 112.91 119.98 1xly h THR 54 Ca 0.23 -0.92 -0.03 0.00 0.77 0.00 0.00 66.41 66.46 1xly h THR 54 Cb 0.23 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1xly h THR 54 CO -0.02 0.33 0.28 -0.07 0.37 0.00 0.00 175.52 176.42 1xly h LEU 55 N 0.78 0.84 -0.90 2.58 3.38 -0.82 -2.50 115.31 118.66 1xly h LEU 55 Ca 0.16 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.04 1xly h LEU 55 Cb 0.38 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 1xly h LEU 55 CO 0.01 0.75 0.57 0.40 0.09 0.00 0.00 178.44 180.26 1xly h ILE 56 N 0.87 1.06 -0.08 1.22 2.04 -0.82 -0.27 117.51 121.53 1xly h ILE 56 Ca 0.21 -0.36 0.04 0.00 1.00 0.00 0.00 64.86 65.75 1xly h ILE 56 Cb 0.15 -0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 36.12 1xly h ILE 56 CO -0.02 0.19 -0.17 0.50 0.00 0.00 0.00 178.15 178.65 1xly h LYS 57 N 1.04 -0.23 -0.36 2.37 1.63 -1.23 0.05 116.57 119.84 1xly h LYS 57 Ca 0.39 0.02 0.01 0.00 -0.85 0.00 0.00 60.65 60.21 1xly h LYS 57 Cb 0.16 0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.82 1xly h LYS 57 CO -0.17 -0.15 0.23 0.74 -3.45 0.00 0.00 179.45 176.64 1xly h PHE 58 N -0.24 0.43 -0.78 1.91 -1.00 -1.10 -2.57 116.94 113.59 1xly h PHE 58 Ca 0.08 0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.86 1xly h PHE 58 Cb 0.35 -0.14 -0.04 0.00 3.61 0.00 0.00 35.95 39.73 1xly h PHE 58 CO -0.26 0.26 0.44 0.28 -1.61 0.00 0.00 178.31 177.42 1xly h VAL 59 N 0.46 1.22 -0.65 -0.55 2.07 -0.83 -0.67 116.25 117.31 1xly h VAL 59 Ca 0.14 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 1xly h VAL 59 Cb -0.03 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 29.87 1xly h VAL 59 CO -0.05 0.24 0.39 0.11 0.02 0.00 0.00 177.57 178.28 1xly h LYS 60 N 1.08 0.88 -0.30 1.57 1.57 -0.76 0.98 116.57 121.59 1xly h LYS 60 Ca 0.28 -0.08 -0.18 0.00 -1.87 0.00 0.00 60.65 58.80 1xly h LYS 60 Cb -0.00 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.12 1xly h LYS 60 CO -0.05 0.62 -0.53 -0.22 -0.57 0.00 0.00 179.45 178.71 1xly h LYS 61 N 0.90 0.86 -0.75 3.15 1.63 -0.99 -1.47 116.57 119.90 1xly h LYS 61 Ca 0.23 -0.54 -0.06 0.00 -0.85 0.00 0.00 60.65 59.44 1xly h LYS 61 Cb -0.03 0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1xly h LYS 61 CO -0.04 1.17 0.25 -0.07 -3.45 0.00 0.00 179.45 177.31 1xly h LEU 62 N 0.67 1.09 -0.36 5.20 3.38 -0.54 -0.91 115.31 123.84 1xly h LEU 62 Ca 0.02 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.80 1xly h LEU 62 Cb 1.13 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 1xly h LEU 62 CO 0.12 1.00 0.21 0.03 0.09 0.00 0.00 178.44 179.89 1xly h ARG 63 N 1.12 0.42 -0.20 1.13 3.08 -0.79 -0.34 114.38 118.80 1xly h ARG 63 Ca 0.24 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.31 1xly h ARG 63 Cb 0.29 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.20 1xly h ARG 63 CO -0.01 0.28 -0.08 0.35 -1.07 0.00 0.00 179.97 179.44 1xly h PHE 64 N 0.43 -0.19 -0.93 3.04 3.57 -1.09 0.66 116.94 122.43 1xly h PHE 64 Ca 0.14 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.69 1xly h PHE 64 Cb -0.00 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 1xly h PHE 64 CO -0.07 -0.13 0.61 1.88 -2.23 0.00 0.00 178.31 178.36 1xly h TYR 65 N -0.05 1.14 0.07 0.41 0.99 -0.86 -0.06 116.97 118.61 1xly h TYR 65 Ca 0.11 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.86 1xly h TYR 65 Cb 0.21 -0.38 0.00 0.00 1.00 0.00 0.00 36.73 37.56 1xly h TYR 65 CO -0.24 0.66 -0.03 -0.97 -0.00 0.00 0.00 178.16 177.57 1xly h ASN 66 N 1.18 -0.08 -0.74 3.88 -0.00 -0.76 -0.77 115.58 118.29 1xly h ASN 66 Ca 0.37 -0.22 0.10 0.00 -0.00 0.00 0.00 56.30 56.55 1xly h ASN 66 Cb -0.00 0.02 -0.05 0.00 -0.00 0.00 0.00 38.32 38.29 1xly h ASN 66 CO -0.12 0.17 0.49 0.44 -0.00 0.00 0.00 177.43 178.41 1xly h ASP 67 N -0.33 0.58 -0.20 1.15 3.32 -0.72 -0.43 116.42 119.78 1xly h ASP 67 Ca -0.01 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1xly h ASP 67 Cb 0.29 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1xly h ASP 67 CO 0.02 0.35 0.04 0.28 -1.72 0.00 0.00 179.24 178.20 1xly h SER 68 N 0.65 0.32 -0.24 6.45 0.02 -0.54 -1.07 113.55 119.13 1xly h SER 68 Ca 0.34 -0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1xly h SER 68 Cb 0.47 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1xly h SER 68 CO -0.12 0.48 0.07 0.58 -1.14 0.00 0.00 176.83 176.70 1xly h VAL 69 N 0.14 1.20 -0.81 2.27 2.07 -0.49 -1.74 116.25 118.89 1xly h VAL 69 Ca 0.06 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 1xly h VAL 69 Cb 0.30 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 1xly h VAL 69 CO 0.00 0.21 0.40 -0.07 0.02 0.00 0.00 177.57 178.13 1xly h LEU 70 N 0.22 1.04 -1.48 2.57 3.38 -1.07 -1.25 115.31 118.72 1xly h LEU 70 Ca 0.08 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1xly h LEU 70 Cb 0.26 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1xly h LEU 70 CO -0.00 0.87 -0.13 0.28 0.09 0.00 0.00 178.44 179.55 1xly h SER 71 N 1.14 0.00 -2.71 -0.43 0.02 -1.07 -3.43 113.55 107.07 1xly h SER 71 Ca 0.28 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.67 1xly h SER 71 Cb 0.10 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 1xly h SER 71 CO -0.04 0.13 1.09 -0.47 -1.14 0.00 0.00 176.83 176.41 1xly s TYR 72 N -3.81 2.12 -0.25 3.45 5.04 -0.47 -4.97 117.35 118.45 1xly s TYR 72 Ca -0.00 0.45 -0.04 0.00 -2.44 0.00 0.00 57.07 55.04 1xly s TYR 72 Cb 0.11 -3.90 0.01 0.00 0.35 0.00 0.00 41.96 38.52 1xly s TYR 72 CO 0.59 -3.19 -0.02 -0.80 -1.34 0.00 0.00 175.55 170.79 1xly s ASN 73 N 3.70 4.50 -0.32 4.32 0.02 -1.26 -5.00 114.94 120.91 1xly s ASN 73 Ca 0.71 -0.67 -0.29 0.00 -1.02 0.00 0.00 52.86 51.59 1xly s ASN 73 Cb -0.28 -1.74 -0.01 0.00 0.02 0.00 0.00 41.25 39.24 1xly s ASN 73 CO 0.28 -0.11 1.62 0.00 0.02 0.00 0.00 177.10 178.91 1xly s ALA 74 N 1.42 3.05 0.00 0.60 0.00 -1.26 -4.51 121.76 121.06 1xly s ALA 74 Ca 0.03 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.19 1xly s ALA 74 Cb -0.16 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 19.02 1xly s ALA 74 CO -0.02 -2.33 0.00 -1.13 0.00 0.00 0.00 175.76 172.27 1xly n SER 75 N 9.25 0.00 0.00 0.00 3.41 -1.26 -4.99 113.62 120.04 1xly n SER 75 Ca 0.20 -0.45 0.00 0.00 -0.26 0.00 0.00 58.87 58.36 1xly n SER 75 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1xly n SER 75 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1xly n GLU 76 N 0.00 1.50 0.00 4.33 1.02 -1.26 -5.24 120.64 120.99 1xly n GLU 76 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1xly n GLU 76 Cb 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.53 1xly n GLU 76 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1xly n PHE 92 N 0.00 0.00 0.26 -0.32 3.01 -1.26 -5.06 117.46 114.09 1xly n PHE 92 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.58 1xly n PHE 92 Cb 0.00 0.00 0.78 0.00 -0.01 0.00 0.00 39.48 40.25 1xly n PHE 92 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1xly h ASP 93 N 0.00 0.00 0.07 4.37 3.32 -2.04 -2.62 116.42 119.52 1xly h ASP 93 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1xly h ASP 93 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1xly h ASP 93 CO 0.00 0.00 -0.05 0.29 -1.72 0.00 0.00 179.24 177.76 1xly n LYS 94 N -4.17 1.33 -0.08 3.56 5.02 -1.26 -2.27 118.16 120.30 1xly n LYS 94 Ca -0.02 -0.67 -0.14 0.00 -2.02 0.00 0.00 58.31 55.46 1xly n LYS 94 Cb 0.13 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.61 1xly n LYS 94 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1xly n VAL 95 N -0.25 1.27 -0.10 -0.18 0.31 -1.11 -4.70 118.33 113.56 1xly n VAL 95 Ca 0.18 -0.04 -0.07 0.00 -0.01 0.00 0.00 64.34 64.40 1xly n VAL 95 Cb 0.31 -1.96 -0.00 0.00 -0.91 0.00 0.00 33.84 31.28 1xly n VAL 95 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1xly h ILE 96 N -0.73 0.34 -0.25 2.52 1.08 -1.60 -3.20 117.51 115.67 1xly h ILE 96 Ca -0.26 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.12 1xly h ILE 96 Cb 1.10 0.34 -0.00 0.00 -3.07 0.00 0.00 36.82 35.18 1xly h ILE 96 CO -0.16 0.00 -0.19 -0.07 -0.69 0.00 0.00 178.15 177.04 1xly h LEU 97 N -0.20 0.60 -1.50 1.44 3.38 -1.70 -0.42 115.31 116.89 1xly h LEU 97 Ca 0.18 -0.45 0.06 0.00 0.09 0.00 0.00 57.88 57.75 1xly h LEU 97 Cb 0.48 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 1xly h LEU 97 CO -0.48 0.92 0.40 -0.65 0.09 0.00 0.00 178.44 178.72 1xly h PRO 98 N 0.28 0.60 -0.05 1.13 0.11 -1.78 0.51 132.00 132.79 1xly h PRO 98 Ca 0.05 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.07 1xly h PRO 98 Cb 0.73 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.71 1xly h PRO 98 CO 0.05 0.40 -0.16 0.82 -0.21 0.00 0.00 178.00 178.89 1xly h ILE 99 N 0.62 1.45 -0.90 4.15 2.04 -1.29 -0.50 117.51 123.08 1xly h ILE 99 Ca 0.26 -1.58 0.05 0.00 1.00 0.00 0.00 64.86 64.59 1xly h ILE 99 Cb 0.25 2.36 -0.06 0.00 -0.74 0.00 0.00 36.82 38.63 1xly h ILE 99 CO -0.08 0.44 0.59 0.00 0.00 0.00 0.00 178.15 179.10 1xly h ALA 100 N 0.42 1.47 -0.50 1.87 0.00 -1.09 -1.63 119.26 119.80 1xly h ALA 100 Ca -0.01 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1xly h ALA 100 Cb 0.79 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1xly h ALA 100 CO 0.03 0.42 0.01 1.03 0.00 0.00 0.00 179.25 180.75 1xly h SER 101 N 1.08 0.85 -0.41 0.00 0.87 -0.81 -1.06 113.55 114.07 1xly h SER 101 Ca 0.37 -0.30 -0.05 0.00 -1.23 0.00 0.00 61.79 60.59 1xly h SER 101 Cb 0.11 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 1xly h SER 101 CO -0.13 0.94 0.06 -0.03 -0.53 0.00 0.00 176.83 177.14 1xly h MET 102 N 0.73 0.67 -0.58 2.24 -1.53 -0.65 -1.21 114.93 114.61 1xly h MET 102 Ca 0.14 -0.18 -0.04 0.00 -3.44 0.00 0.00 59.70 56.18 1xly h MET 102 Cb 0.50 -0.08 -0.02 0.00 -0.55 0.00 0.00 31.60 31.44 1xly h MET 102 CO 0.02 0.72 0.20 0.74 0.14 0.00 0.00 176.91 178.74 1xly h PHE 103 N 0.52 0.91 -0.30 1.39 -1.00 -1.03 -1.15 116.94 116.28 1xly h PHE 103 Ca 0.12 -0.08 -0.02 0.00 2.81 0.00 0.00 57.97 60.80 1xly h PHE 103 Cb 0.38 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.66 1xly h PHE 103 CO 0.03 0.75 0.12 0.28 -1.61 0.00 0.00 178.31 177.88 1xly h VAL 104 N 0.81 1.18 -0.58 -0.55 2.07 -0.94 0.12 116.25 118.36 1xly h VAL 104 Ca 0.19 -0.54 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 1xly h VAL 104 Cb 0.25 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1xly h VAL 104 CO -0.01 0.19 0.18 0.50 0.02 0.00 0.00 177.57 178.45 1xly h LYS 105 N 0.34 0.91 -0.16 1.57 3.64 -1.15 -0.91 116.57 120.80 1xly h LYS 105 Ca 0.10 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1xly h LYS 105 Cb 0.18 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1xly h LYS 105 CO -0.01 0.81 0.06 0.77 -2.27 0.00 0.00 179.45 178.81 1xly h SER 106 N 0.82 0.23 -0.92 4.20 0.02 -0.90 -1.91 113.55 115.10 1xly h SER 106 Ca 0.19 -0.18 0.03 0.00 -0.84 0.00 0.00 61.79 60.99 1xly h SER 106 Cb 0.28 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 1xly h SER 106 CO -0.01 0.35 0.60 0.58 -1.14 0.00 0.00 176.83 177.21 1xly h VAL 107 N 0.10 1.16 0.00 2.27 2.07 -0.47 -1.44 116.25 119.94 1xly h VAL 107 Ca 0.05 -0.40 -0.16 0.00 0.82 0.00 0.00 66.70 67.02 1xly h VAL 107 Cb 0.20 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 1xly h VAL 107 CO -0.00 0.21 -0.75 -0.33 0.02 0.00 0.00 177.57 176.72 1xly h GLU 108 N 1.16 0.00 -0.30 1.57 4.39 -1.00 0.34 114.58 120.74 1xly h GLU 108 Ca 0.36 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 60.04 1xly h GLU 108 Cb -0.01 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1xly h GLU 108 CO -0.12 0.75 0.10 1.15 -1.16 0.00 0.00 179.01 179.73 1xly h THR 109 N 0.00 1.20 0.00 1.13 2.02 -0.95 -2.20 112.91 114.11 1xly h THR 109 Ca -0.01 -0.63 -0.03 0.00 0.77 0.00 0.00 66.41 66.51 1xly h THR 109 Cb 1.33 1.05 -0.00 0.00 -1.74 0.00 0.00 68.15 68.78 1xly h THR 109 CO 0.10 0.21 -0.15 -0.26 0.37 0.00 0.00 175.52 175.79 1xly h PHE 110 N 0.33 0.00 -0.22 3.16 -1.00 -0.94 0.60 116.94 118.87 1xly h PHE 110 Ca 0.10 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.87 1xly h PHE 110 Cb 0.23 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.78 1xly h PHE 110 CO 0.00 0.15 0.12 0.22 -1.61 0.00 0.00 178.31 177.20 1xly h ASP 111 N 0.00 0.27 0.19 2.17 3.58 -0.55 0.17 116.42 122.25 1xly h ASP 111 Ca -0.00 -0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.36 1xly h ASP 111 Cb 0.29 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.27 1xly h ASP 111 CO 0.02 0.26 -0.09 -0.07 -2.88 0.00 0.00 179.24 176.48 1xly h LEU 112 N 0.25 -0.22 -1.05 2.28 3.38 -1.08 -2.01 115.31 116.86 1xly h LEU 112 Ca 0.08 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.91 1xly h LEU 112 Cb 0.05 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1xly h LEU 112 CO -0.01 0.04 0.64 0.25 0.09 0.00 0.00 178.44 179.45 1xly h LEU 113 N -0.48 1.10 -0.78 1.67 5.85 -0.82 -2.19 115.31 119.66 1xly h LEU 113 Ca -0.03 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 1xly h LEU 113 Cb 0.37 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1xly h LEU 113 CO 0.04 0.78 0.35 0.78 -0.34 0.00 0.00 178.44 180.05 1xly h ASN 114 N 1.28 1.04 -0.60 1.25 2.35 -0.59 0.12 115.58 120.43 1xly h ASN 114 Ca 0.37 -0.15 -0.04 0.00 -0.55 0.00 0.00 56.30 55.93 1xly h ASN 114 Cb -0.09 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 37.98 1xly h ASN 114 CO -0.09 0.90 0.23 0.22 -1.65 0.00 0.00 177.43 177.03 1xly h TYR 115 N 1.11 0.93 -0.20 1.19 3.20 -1.17 0.23 116.97 122.26 1xly h TYR 115 Ca 0.26 -0.08 -0.07 0.00 3.14 0.00 0.00 58.73 61.99 1xly h TYR 115 Cb 0.15 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.14 1xly h TYR 115 CO 0.01 0.75 -0.15 -0.92 -1.64 0.00 0.00 178.16 176.21 1xly h TYR 116 N 0.84 0.54 -0.13 -3.82 3.20 -0.95 -1.33 116.97 115.31 1xly h TYR 116 Ca 0.20 -0.15 -0.20 0.00 3.14 0.00 0.00 58.73 61.72 1xly h TYR 116 Cb 0.22 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.38 1xly h TYR 116 CO 0.01 0.79 -0.72 1.25 -1.64 0.00 0.00 178.16 177.85 1xly h LEU 117 N 0.14 0.69 0.00 2.82 5.85 -0.71 0.22 115.31 124.32 1xly h LEU 117 Ca 0.04 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.32 1xly h LEU 117 Cb 0.68 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.50 1xly h LEU 117 CO 0.04 1.20 -0.99 0.35 -0.34 0.00 0.00 178.44 178.70 1xly n THR 118 N -3.90 0.00 0.00 1.05 -2.24 0.79 -3.78 114.28 106.21 1xly n THR 118 Ca -0.05 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1xly n THR 118 Cb 0.70 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 1xly n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xly n GLN 119 N -1.54 0.00 -0.03 -0.78 1.13 -0.53 -4.65 117.38 110.98 1xly n GLN 119 Ca 0.02 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.99 1xly n GLN 119 Cb 0.29 -0.04 -0.03 0.00 0.11 0.00 0.00 30.24 30.57 1xly n GLN 119 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 1xly h SER 120 N 0.00 -0.07 -0.32 1.08 0.02 -1.51 -2.10 113.55 110.65 1xly h SER 120 Ca 0.00 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 1xly h SER 120 Cb 0.00 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 1xly h SER 120 CO 0.00 -0.01 0.02 0.25 -1.14 0.00 0.00 176.83 175.95 1xly h LEU 121 N 0.05 0.61 -0.06 5.07 5.85 -0.77 -0.82 115.31 125.25 1xly h LEU 121 Ca 0.08 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 1xly h LEU 121 Cb 0.10 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 1xly h LEU 121 CO -0.14 0.67 0.03 1.56 -0.34 0.00 0.00 178.44 180.23 1xly h GLN 122 N 0.62 0.08 -0.33 1.25 1.08 -1.50 0.48 115.11 116.79 1xly h GLN 122 Ca 0.13 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.34 1xly h GLN 122 Cb 0.36 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.75 1xly h GLN 122 CO 0.01 0.11 0.17 0.87 -0.95 0.00 0.00 178.83 179.04 1xly h LYS 123 N 0.03 0.35 -0.93 1.46 1.57 -1.35 -2.00 116.57 115.70 1xly h LYS 123 Ca 0.02 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1xly h LYS 123 Cb 0.05 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.22 1xly h LYS 123 CO -0.00 0.23 0.60 1.49 -0.57 0.00 0.00 179.45 181.20 1xly h GLU 124 N 0.36 1.11 -0.65 3.15 4.57 -0.59 -0.54 114.58 121.99 1xly h GLU 124 Ca 0.14 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.23 1xly h GLU 124 Cb 0.04 -0.25 -0.03 0.00 -0.16 0.00 0.00 28.75 28.34 1xly h GLU 124 CO -0.08 0.74 0.33 0.82 -1.18 0.00 0.00 179.01 179.64 1xly h ILE 125 N 1.15 1.22 -0.60 2.32 2.04 0.22 -1.12 117.51 122.74 1xly h ILE 125 Ca 0.38 -0.58 -0.07 0.00 1.00 0.00 0.00 64.86 65.59 1xly h ILE 125 Cb 0.05 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 1xly h ILE 125 CO -0.13 0.24 0.09 -0.07 0.00 0.00 0.00 178.15 178.28 1xly h LEU 126 N 0.90 0.92 -0.48 1.44 4.07 -0.92 0.27 115.31 121.51 1xly h LEU 126 Ca 0.23 -0.21 -0.15 0.00 0.08 0.00 0.00 57.88 57.83 1xly h LEU 126 Cb 0.09 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.57 1xly h LEU 126 CO -0.03 0.93 -0.34 -1.28 -1.08 0.00 0.00 178.44 176.64 1xly h SER 127 N 0.91 0.93 0.20 -0.43 0.87 -0.62 -0.19 113.55 115.23 1xly h SER 127 Ca 0.18 -0.40 -0.32 0.00 -1.23 0.00 0.00 61.79 60.02 1xly h SER 127 Cb 0.41 -0.26 0.02 0.00 -0.44 0.00 0.00 62.40 62.13 1xly h SER 127 CO 0.01 1.18 -1.53 0.11 -0.53 0.00 0.00 176.83 176.07 1xly h LYS 128 N 0.74 0.43 0.00 2.24 1.57 -1.01 -3.38 116.57 117.15 1xly h LYS 128 Ca 0.07 -0.73 0.00 0.00 -1.87 0.00 0.00 60.65 58.13 1xly h LYS 128 Cb 0.91 0.27 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1xly h LYS 128 CO 0.08 1.35 -1.51 0.25 -0.57 0.00 0.00 179.45 179.05 1xly n THR 129 N -3.73 0.25 -1.06 -0.16 -2.24 0.07 -4.97 114.28 102.44 1xly n THR 129 Ca -0.21 -0.48 -0.02 0.00 -2.27 0.00 0.00 64.05 61.07 1xly n THR 129 Cb 1.04 -0.09 -0.01 0.00 -2.10 0.00 0.00 70.33 69.18 1xly n THR 129 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1xly n LEU 130 N -2.37 0.41 0.00 3.22 4.77 -0.08 -4.97 117.00 117.98 1xly n LEU 130 Ca -0.02 0.05 -0.12 0.00 -0.03 0.00 0.00 56.01 55.89 1xly n LEU 130 Cb 0.54 -1.84 -0.03 0.00 -2.33 0.00 0.00 43.42 39.76 1xly n LEU 130 CO 0.43 -0.66 0.07 -0.46 -1.33 0.00 0.00 177.39 175.44 1xly n ASN 131 N -0.59 -0.89 -1.08 -1.43 0.23 -1.26 -5.07 115.26 105.18 1xly n ASN 131 Ca -0.02 -2.50 0.08 0.00 -0.53 0.00 0.00 54.58 51.61 1xly n ASN 131 Cb 0.34 1.74 0.27 0.00 -2.08 0.00 0.00 39.78 40.05 1xly n ASN 131 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1xly n GLU 132 N -0.45 3.29 0.24 -3.83 1.02 -1.26 -4.56 120.64 115.09 1xly n GLU 132 Ca 0.02 -2.72 0.13 0.00 -0.02 0.00 0.00 57.16 54.57 1xly n GLU 132 Cb 0.45 -1.78 0.44 0.00 -0.02 0.00 0.00 31.44 30.53 1xly n GLU 132 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1xly h ASP 133 N 2.51 0.00 -0.05 1.62 3.32 -1.97 -3.06 116.42 118.79 1xly h ASP 133 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1xly h ASP 133 Cb 1.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.90 1xly h ASP 133 CO 0.21 0.11 0.00 0.18 -1.72 0.00 0.00 179.24 178.01 1xly n LEU 134 N -3.19 2.13 -4.90 1.55 4.77 -1.26 -4.65 117.00 111.45 1xly n LEU 134 Ca 0.01 -1.09 -0.29 0.00 -0.03 0.00 0.00 56.01 54.62 1xly n LEU 134 Cb 0.43 -0.02 0.07 0.00 -2.33 0.00 0.00 43.42 41.57 1xly n LEU 134 CO 0.32 0.41 0.74 0.42 -1.33 0.00 0.00 177.39 177.95 1xly s THR 135 N -1.04 2.48 0.41 -5.08 -4.23 -1.16 -5.06 115.64 101.96 1xly s THR 135 Ca 0.16 0.08 -0.22 0.00 -1.18 0.00 0.00 61.69 60.52 1xly s THR 135 Cb 0.11 -3.14 -0.11 0.00 1.34 0.00 0.00 72.50 70.70 1xly s THR 135 CO 0.16 -0.17 0.95 -0.76 -0.54 0.00 0.00 174.62 174.25 1xly s LEU 136 N -5.45 4.01 0.65 4.79 1.43 -1.26 -5.02 118.68 117.82 1xly s LEU 136 Ca 0.60 1.71 -0.15 0.00 -1.03 0.00 0.00 54.13 55.26 1xly s LEU 136 Cb -0.11 -4.45 -0.01 0.00 0.03 0.00 0.00 46.19 41.66 1xly s LEU 136 CO 0.49 -0.31 1.11 0.42 0.23 0.00 0.00 176.35 178.29 1xly s THR 137 N -2.08 3.21 0.55 5.49 -4.23 -1.26 -4.91 115.64 112.41 1xly s THR 137 Ca 0.60 0.58 0.29 0.00 -1.18 0.00 0.00 61.69 61.98 1xly s THR 137 Cb -0.11 -3.11 0.34 0.00 1.34 0.00 0.00 72.50 70.95 1xly s THR 137 CO 0.15 -0.33 2.21 0.00 -0.54 0.00 0.00 174.62 176.11 1xly h ALA 138 N 0.15 1.48 0.09 3.99 0.00 -2.00 -1.95 119.26 121.03 1xly h ALA 138 Ca -0.47 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.15 1xly h ALA 138 Cb 1.25 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1xly h ALA 138 CO 0.54 0.04 -1.17 0.93 0.00 0.00 0.00 179.25 179.59 1xly h GLU 139 N 0.00 0.22 -0.26 0.00 3.07 -1.99 -2.20 114.58 113.41 1xly h GLU 139 Ca -0.00 -0.36 -0.11 0.00 -0.50 0.00 0.00 59.36 58.39 1xly h GLU 139 Cb 0.08 0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.11 1xly h GLU 139 CO 0.00 1.16 -0.32 0.66 -1.40 0.00 0.00 179.01 179.12 1xly h SER 140 N 0.07 0.57 -0.41 1.42 4.64 -1.69 -1.78 113.55 116.37 1xly h SER 140 Ca -0.10 -0.22 -0.15 0.00 -0.47 0.00 0.00 61.79 60.85 1xly h SER 140 Cb 1.90 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.82 1xly h SER 140 CO 0.18 0.85 -0.31 0.40 -0.87 0.00 0.00 176.83 177.08 1xly h ILE 141 N 0.47 1.27 -0.62 0.95 2.04 -1.41 -0.71 117.51 119.51 1xly h ILE 141 Ca 0.06 -1.48 -0.07 0.00 1.00 0.00 0.00 64.86 64.37 1xly h ILE 141 Cb 0.78 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 38.16 1xly h ILE 141 CO 0.06 0.50 0.12 -0.07 0.00 0.00 0.00 178.15 178.77 1xly h LEU 142 N 0.76 0.93 -0.36 1.44 4.07 -1.23 -1.39 115.31 119.52 1xly h LEU 142 Ca 0.08 -0.20 -0.08 0.00 0.08 0.00 0.00 57.88 57.76 1xly h LEU 142 Cb 0.90 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.39 1xly h LEU 142 CO 0.08 0.92 -0.09 0.00 -1.08 0.00 0.00 178.44 178.27 1xly h ALA 143 N 1.19 0.50 -0.34 1.53 0.00 -1.19 -0.73 119.26 120.22 1xly h ALA 143 Ca 0.19 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 54.84 1xly h ALA 143 Cb 0.37 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1xly h ALA 143 CO 0.01 0.36 0.09 0.82 0.00 0.00 0.00 179.25 180.53 1xly h ILE 144 N 0.50 0.87 -0.26 0.00 2.04 -0.94 -1.26 117.51 118.47 1xly h ILE 144 Ca 0.09 -0.08 -0.14 0.00 1.00 0.00 0.00 64.86 65.73 1xly h ILE 144 Cb 0.60 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1xly h ILE 144 CO 0.04 0.04 -0.41 0.44 0.00 0.00 0.00 178.15 178.25 1xly h ASP 145 N 0.22 0.67 -0.50 1.72 3.32 -1.20 -2.35 116.42 118.31 1xly h ASP 145 Ca 0.16 -0.31 -0.06 0.00 0.02 0.00 0.00 57.03 56.85 1xly h ASP 145 Cb 0.16 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 1xly h ASP 145 CO -0.19 1.00 0.09 -0.78 -1.72 0.00 0.00 179.24 177.65 1xly h ASP 146 N 0.51 0.78 -0.09 6.45 3.58 -0.94 -1.53 116.42 125.19 1xly h ASP 146 Ca 0.04 -0.25 -0.01 0.00 0.42 0.00 0.00 57.03 57.23 1xly h ASP 146 Cb 0.94 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.78 1xly h ASP 146 CO 0.08 0.83 -0.00 0.74 -2.88 0.00 0.00 179.24 178.02 1xly h THR 147 N 0.70 1.25 -0.60 2.25 2.02 -1.21 -2.45 112.91 114.87 1xly h THR 147 Ca 0.15 -0.80 0.12 0.00 0.77 0.00 0.00 66.41 66.65 1xly h THR 147 Cb 0.38 1.62 -0.10 0.00 -1.74 0.00 0.00 68.15 68.31 1xly h THR 147 CO 0.01 0.23 0.05 0.22 0.37 0.00 0.00 175.52 176.39 1xly h TYR 148 N -0.13 0.06 -0.30 3.16 3.20 -1.41 0.19 116.97 121.73 1xly h TYR 148 Ca 0.02 0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.83 1xly h TYR 148 Cb 0.35 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 1xly h TYR 148 CO 0.03 -0.11 -0.23 -0.91 -1.64 0.00 0.00 178.16 175.30 1xly h ASN 149 N 0.17 0.58 -0.23 -2.11 2.35 -1.04 -0.95 115.58 114.35 1xly h ASN 149 Ca 0.32 -0.20 -0.04 0.00 -0.55 0.00 0.00 56.30 55.82 1xly h ASN 149 Cb 0.50 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1xly h ASN 149 CO -0.47 0.81 -0.03 0.45 -1.65 0.00 0.00 177.43 176.54 1xly h HIS 150 N 0.51 0.47 -0.67 1.19 3.86 -0.96 -1.05 115.15 118.50 1xly h HIS 150 Ca 0.07 -0.09 0.08 0.00 -1.16 0.00 0.00 60.37 59.27 1xly h HIS 150 Cb 0.68 -0.12 -0.04 0.00 1.06 0.00 0.00 27.41 28.99 1xly h HIS 150 CO 0.03 0.63 0.44 0.74 0.86 0.00 0.00 177.93 180.63 1xly h PHE 151 N 0.17 0.62 0.35 2.45 -1.00 -0.65 0.84 116.94 119.71 1xly h PHE 151 Ca 0.06 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.84 1xly h PHE 151 Cb 0.47 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 39.83 1xly h PHE 151 CO 0.04 0.31 -0.17 0.28 -1.61 0.00 0.00 178.31 177.16 1xly h VAL 152 N 0.59 0.65 -0.82 -0.55 2.07 -1.00 -1.23 116.25 115.96 1xly h VAL 152 Ca 0.30 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.39 1xly h VAL 152 Cb 0.41 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1xly h VAL 152 CO -0.10 0.08 0.54 0.11 0.02 0.00 0.00 177.57 178.22 1xly h LYS 153 N -0.73 1.05 -0.40 1.57 1.79 -1.05 0.29 116.57 119.09 1xly h LYS 153 Ca -0.05 -0.06 0.02 0.00 -2.18 0.00 0.00 60.65 58.38 1xly h LYS 153 Cb 0.50 -0.24 -0.03 0.00 -1.58 0.00 0.00 32.23 30.88 1xly h LYS 153 CO 0.08 0.70 0.22 0.35 -1.08 0.00 0.00 179.45 179.71 1xly h PHE 154 N 1.08 0.40 -0.28 -1.35 3.57 -0.84 0.14 116.94 119.66 1xly h PHE 154 Ca 0.31 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.78 1xly h PHE 154 Cb -0.09 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 1xly h PHE 154 CO -0.02 0.22 0.00 0.77 -2.23 0.00 0.00 178.31 177.06 1xly h SER 155 N 0.44 0.48 -0.63 0.41 0.02 -0.92 -0.74 113.55 112.62 1xly h SER 155 Ca 0.16 -0.30 0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1xly h SER 155 Cb 0.04 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.42 1xly h SER 155 CO -0.09 0.67 0.41 -0.61 -1.14 0.00 0.00 176.83 176.07 1xly h GLN 156 N 0.28 0.82 -0.30 3.45 4.15 -0.67 -2.34 115.11 120.52 1xly h GLN 156 Ca 0.08 -0.05 0.04 0.00 0.77 0.00 0.00 58.65 59.48 1xly h GLN 156 Cb 0.42 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.89 1xly h GLN 156 CO 0.01 0.55 0.09 2.35 -1.93 0.00 0.00 178.83 179.90 1xly h TRP 157 N 0.85 0.16 0.20 3.99 7.01 -0.33 -1.51 115.95 126.32 1xly h TRP 157 Ca 0.23 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.23 1xly h TRP 157 Cb -0.10 -0.03 0.00 0.00 -2.10 0.00 0.00 29.16 26.94 1xly h TRP 157 CO -0.03 0.06 -0.10 0.52 -2.79 0.00 0.00 178.44 176.11 1xly h MET 158 N 0.21 -0.26 -0.87 2.65 2.86 -0.97 -0.95 114.93 117.60 1xly h MET 158 Ca 0.13 0.02 0.07 0.00 -2.06 0.00 0.00 59.70 57.86 1xly h MET 158 Cb 0.12 0.06 -0.07 0.00 0.06 0.00 0.00 31.60 31.77 1xly h MET 158 CO -0.15 -0.03 0.54 0.82 1.06 0.00 0.00 176.91 179.15 1xly h ILE 159 N -0.47 1.01 0.00 -1.22 2.04 -1.39 0.78 117.51 118.27 1xly h ILE 159 Ca -0.03 -0.33 -0.23 0.00 1.00 0.00 0.00 64.86 65.27 1xly h ILE 159 Cb 0.35 -0.03 0.01 0.00 -0.74 0.00 0.00 36.82 36.41 1xly h ILE 159 CO 0.05 0.17 -0.96 -0.33 0.00 0.00 0.00 178.15 177.08 1xly h GLU 160 N 0.96 0.45 -0.06 2.37 5.08 -1.12 -1.85 114.58 120.40 1xly h GLU 160 Ca 0.39 -0.48 -0.20 0.00 -1.00 0.00 0.00 59.36 58.06 1xly h GLU 160 Cb 0.23 0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.63 1xly h GLU 160 CO -0.19 1.14 -0.75 0.66 -1.00 0.00 0.00 179.01 178.86 1xly h SER 161 N 0.25 0.77 0.00 1.42 4.64 -0.59 -1.76 113.55 118.28 1xly h SER 161 Ca -0.09 -0.69 0.00 0.00 -0.47 0.00 0.00 61.79 60.54 1xly h SER 161 Cb 1.60 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1xly h SER 161 CO 0.17 1.35 0.00 0.18 -0.87 0.00 0.00 176.83 177.66 1xly n LEU 162 N -4.05 0.00 -3.66 5.97 4.77 0.22 -4.89 117.00 115.35 1xly n LEU 162 Ca -0.09 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.61 1xly n LEU 162 Cb 0.74 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.82 1xly n LEU 162 CO 0.51 0.00 -0.01 0.54 -1.33 0.00 0.00 177.39 177.10 1xly n ARG 163 N -0.81 -3.75 -0.52 3.23 1.74 -0.66 -4.87 116.66 111.01 1xly n ARG 163 Ca 0.10 0.48 0.08 0.00 -0.77 0.00 0.00 57.85 57.74 1xly n ARG 163 Cb 0.05 -5.23 0.29 0.00 -1.02 0.00 0.00 32.46 26.55 1xly n ARG 163 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1xly n ILE 164 N -4.19 2.10 -2.22 0.55 -5.35 -0.73 -5.04 119.36 104.49 1xly n ILE 164 Ca 0.02 -1.53 -0.38 0.00 -0.27 0.00 0.00 62.75 60.59 1xly n ILE 164 Cb 0.53 -0.07 -0.01 0.00 -1.74 0.00 0.00 39.64 38.34 1xly n ILE 164 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1xly s GLY 165 N -1.38 2.87 0.20 3.28 0.00 -1.23 -4.93 107.32 106.12 1xly s GLY 165 Ca 0.43 1.03 -0.22 0.00 0.00 0.00 0.00 44.72 45.96 1xly s GLY 165 CO 0.14 1.56 0.67 -1.35 0.00 0.00 0.00 173.10 174.12 1xly s SER 166 N -1.07 -0.43 0.53 1.64 1.04 -1.26 -4.99 113.70 109.16 1xly s SER 166 Ca 0.58 -0.25 0.35 0.00 0.48 0.00 0.00 55.95 57.11 1xly s SER 166 Cb -0.32 0.64 1.51 0.00 0.10 0.00 0.00 66.02 67.95 1xly s SER 166 CO 0.41 -1.10 1.82 0.78 0.98 0.00 0.00 173.24 176.12 1xly h ASN 167 N 2.00 0.02 0.09 7.02 2.35 -1.98 -0.50 115.58 124.59 1xly h ASN 167 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1xly h ASN 167 Cb 1.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.65 1xly h ASN 167 CO 0.31 0.00 -0.02 0.18 -1.65 0.00 0.00 177.43 176.26 1xly n LEU 168 N -4.22 0.46 -0.03 1.61 4.77 -1.26 -2.96 117.00 115.37 1xly n LEU 168 Ca 0.24 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 1xly n LEU 168 Cb 1.16 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 42.21 1xly n LEU 168 CO 0.39 0.08 0.23 0.18 -1.33 0.00 0.00 177.39 176.94 1xly n LEU 169 N -0.71 0.94 -4.71 2.23 4.32 -0.27 -5.06 117.00 113.72 1xly n LEU 169 Ca 0.20 -0.93 -0.38 0.00 -0.02 0.00 0.00 56.01 54.88 1xly n LEU 169 Cb 0.21 0.00 0.05 0.00 -1.62 0.00 0.00 43.42 42.05 1xly n LEU 169 CO 0.19 0.23 0.88 0.47 -1.22 0.00 0.00 177.39 177.93 1xly n ASP 170 N -0.09 2.21 -4.84 -1.43 8.00 -0.74 -4.90 116.55 114.76 1xly n ASP 170 Ca 0.00 0.94 -0.37 0.00 0.71 0.00 0.00 54.79 56.07 1xly n ASP 170 Cb 0.02 -1.53 -0.06 0.00 -0.02 0.00 0.00 41.12 39.53 1xly n ASP 170 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xly s LEU 171 N -3.14 4.38 0.22 0.64 2.01 -1.26 -5.00 118.68 116.53 1xly s LEU 171 Ca 0.73 0.58 -0.10 0.00 0.01 0.00 0.00 54.13 55.35 1xly s LEU 171 Cb -0.42 -2.23 0.32 0.00 0.01 0.00 0.00 46.19 43.86 1xly s LEU 171 CO 0.48 0.33 1.67 -0.08 1.01 0.00 0.00 176.35 179.76 1xly h GLU 172 N 5.25 0.14 0.00 1.70 4.81 -1.99 -2.73 114.58 121.76 1xly h GLU 172 Ca -0.51 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 58.64 1xly h GLU 172 Cb 1.21 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 1xly h GLU 172 CO 0.62 0.09 -0.30 -0.24 -0.73 0.00 0.00 179.01 178.46 1xly h VAL 173 N 0.15 0.84 0.00 0.32 3.04 -2.01 -1.81 116.25 116.78 1xly h VAL 173 Ca 0.33 -1.21 0.00 0.00 -1.01 0.00 0.00 66.70 64.81 1xly h VAL 173 Cb 0.54 1.74 0.00 0.00 -2.01 0.00 0.00 31.29 31.56 1xly h VAL 173 CO -0.52 0.29 0.00 0.58 -1.01 0.00 0.00 177.57 176.92 1xly h VAL 174 N 0.00 0.00 0.02 1.51 2.07 -1.81 -2.71 116.25 115.33 1xly h VAL 174 Ca -0.00 -0.26 -0.17 0.00 0.82 0.00 0.00 66.70 67.08 1xly h VAL 174 Cb 0.71 1.06 0.02 0.00 -1.52 0.00 0.00 31.29 31.56 1xly h VAL 174 CO 0.04 0.00 -0.70 -0.61 0.02 0.00 0.00 177.57 176.32 1xly h GLN 175 N 0.00 0.44 0.03 1.57 4.15 -1.41 -3.40 115.11 116.49 1xly h GLN 175 Ca 0.00 -0.50 -0.00 0.00 0.77 0.00 0.00 58.65 58.92 1xly h GLN 175 Cb 0.33 0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.17 1xly h GLN 175 CO 0.00 1.15 -0.01 0.35 -1.93 0.00 0.00 178.83 178.39 1xly h PHE 176 N -0.07 -0.03 0.00 3.99 3.04 -1.60 -3.53 116.94 118.74 1xly h PHE 176 Ca -0.09 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.86 1xly h PHE 176 Cb 1.41 0.01 0.00 0.00 2.56 0.00 0.00 35.95 39.93 1xly h PHE 176 CO 0.15 -0.02 0.00 0.00 -2.02 0.00 0.00 178.31 176.42 1xly n ALA 177 N -2.08 0.00 -1.27 2.41 0.00 -1.04 -5.16 120.51 113.37 1xly n ALA 177 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1xly n ALA 177 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.46 1xly n ALA 177 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1xly n SER 204 N 0.00 0.00 -0.09 0.00 3.41 -1.26 -4.86 113.62 110.83 1xly n SER 204 Ca 0.00 -0.48 -0.11 0.00 -0.26 0.00 0.00 58.87 58.02 1xly n SER 204 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 1xly n SER 204 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1xly n GLU 205 N 0.00 0.90 0.04 4.33 1.02 -1.26 -4.27 120.64 121.40 1xly n GLU 205 Ca 0.00 0.06 -0.08 0.00 -0.02 0.00 0.00 57.16 57.13 1xly n GLU 205 Cb 0.24 -1.38 0.09 0.00 -0.02 0.00 0.00 31.44 30.37 1xly n GLU 205 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1xly h GLU 206 N 0.00 0.42 -0.53 3.49 4.57 -2.06 -3.36 114.58 117.11 1xly h GLU 206 Ca -0.42 -0.27 0.05 0.00 -1.18 0.00 0.00 59.36 57.54 1xly h GLU 206 Cb 1.76 0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 30.32 1xly h GLU 206 CO -0.03 0.87 -0.31 0.39 -1.18 0.00 0.00 179.01 178.75 1xly n GLU 207 N -3.93 -0.23 -0.01 1.92 -0.58 -1.26 -1.07 120.64 115.47 1xly n GLU 207 Ca -0.03 0.89 -0.10 0.00 -0.42 0.00 0.00 57.16 57.51 1xly n GLU 207 Cb 0.61 -1.32 -0.04 0.00 -0.57 0.00 0.00 31.44 30.12 1xly n GLU 207 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1xly h PHE 208 N 0.00 -0.01 -0.97 -0.32 3.57 -1.77 -2.00 116.94 115.44 1xly h PHE 208 Ca 0.09 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.68 1xly h PHE 208 Cb 0.22 0.02 -0.07 0.00 2.79 0.00 0.00 35.95 38.91 1xly h PHE 208 CO -0.63 -0.02 0.61 1.96 -2.23 0.00 0.00 178.31 178.00 1xly h GLN 209 N 0.04 1.02 -0.02 1.11 1.08 -1.29 0.20 115.11 117.25 1xly h GLN 209 Ca 0.06 -0.06 -0.07 0.00 -1.45 0.00 0.00 58.65 57.13 1xly h GLN 209 Cb 0.07 -0.23 0.00 0.00 -0.05 0.00 0.00 27.48 27.28 1xly h GLN 209 CO -0.11 0.68 -0.27 1.15 -0.95 0.00 0.00 178.83 179.33 1xly h THR 210 N 1.05 1.50 -0.13 -0.54 2.02 -0.64 -2.57 112.91 113.60 1xly h THR 210 Ca 0.45 -1.85 -0.14 0.00 0.77 0.00 0.00 66.41 65.63 1xly h THR 210 Cb 0.30 2.61 -0.01 0.00 -1.74 0.00 0.00 68.15 69.31 1xly h THR 210 CO -0.21 0.51 -0.52 -0.07 0.37 0.00 0.00 175.52 175.60 1xly h LEU 211 N -0.39 0.41 -0.29 2.58 3.38 -1.25 -2.24 115.31 117.51 1xly h LEU 211 Ca -0.03 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 57.79 1xly h LEU 211 Cb 0.99 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.57 1xly h LEU 211 CO 0.05 0.86 -0.03 0.28 0.09 0.00 0.00 178.44 179.70 1xly h SER 212 N 0.29 -0.17 -0.24 -0.43 0.02 -0.95 0.70 113.55 112.77 1xly h SER 212 Ca 0.01 0.07 0.04 0.00 -0.84 0.00 0.00 61.79 61.07 1xly h SER 212 Cb 1.02 0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.66 1xly h SER 212 CO 0.09 -0.05 -0.01 0.00 -1.14 0.00 0.00 176.83 175.72 1xly h ALA 213 N 1.26 0.21 -0.29 3.77 0.00 -1.17 0.73 119.26 123.77 1xly h ALA 213 Ca 0.14 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1xly h ALA 213 Cb 0.19 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1xly h ALA 213 CO -0.25 -0.43 0.17 0.00 0.00 0.00 0.00 179.25 178.74 1xly h ALA 214 N 1.21 0.37 -0.63 0.00 0.00 -0.97 -2.27 119.26 116.96 1xly h ALA 214 Ca 0.11 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1xly h ALA 214 Cb 0.15 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1xly h ALA 214 CO -0.20 -0.12 0.39 -1.49 0.00 0.00 0.00 179.25 177.83 1xly h TRP 215 N 0.37 0.83 -0.87 0.00 4.06 -0.47 -0.04 115.95 119.83 1xly h TRP 215 Ca 0.10 0.00 0.09 0.00 2.06 0.00 0.00 58.89 61.14 1xly h TRP 215 Cb 0.02 -0.27 -0.06 0.00 -1.00 0.00 0.00 29.16 27.84 1xly h TRP 215 CO -0.04 0.56 0.56 1.25 -3.56 0.00 0.00 178.44 177.21 1xly h HIS 216 N 0.86 0.94 -0.07 0.49 2.76 0.62 0.21 115.15 120.97 1xly h HIS 216 Ca 0.23 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.38 1xly h HIS 216 Cb -0.03 -0.31 -0.00 0.00 1.55 0.00 0.00 27.41 28.62 1xly h HIS 216 CO -0.02 0.46 -0.11 1.03 -1.30 0.00 0.00 177.93 177.99 1xly h SER 217 N 0.89 0.22 -0.38 3.26 0.87 -0.67 -1.90 113.55 115.84 1xly h SER 217 Ca 0.39 -0.54 0.07 0.00 -1.23 0.00 0.00 61.79 60.48 1xly h SER 217 Cb 0.35 -0.06 -0.06 0.00 -0.44 0.00 0.00 62.40 62.19 1xly h SER 217 CO -0.16 0.71 0.03 0.40 -0.53 0.00 0.00 176.83 177.29 1xly h ILE 218 N -0.27 0.75 -0.20 2.23 2.04 -0.81 -2.59 117.51 118.66 1xly h ILE 218 Ca 0.01 -0.05 -0.13 0.00 1.00 0.00 0.00 64.86 65.69 1xly h ILE 218 Cb 0.67 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1xly h ILE 218 CO 0.03 0.03 -0.41 -0.07 0.00 0.00 0.00 178.15 177.72 1xly h LEU 219 N 0.14 0.51 -0.54 1.44 3.38 -0.91 -1.43 115.31 117.90 1xly h LEU 219 Ca 0.19 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1xly h LEU 219 Cb 0.25 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1xly h LEU 219 CO -0.28 0.86 0.30 -0.78 0.09 0.00 0.00 178.44 178.64 1xly h ASP 220 N 0.39 0.67 0.69 -0.43 1.82 -1.24 0.32 116.42 118.64 1xly h ASP 220 Ca 0.03 -0.08 -0.03 0.00 -0.39 0.00 0.00 57.03 56.56 1xly h ASP 220 Cb 0.89 -0.17 -0.01 0.00 0.68 0.00 0.00 39.33 40.73 1xly h ASP 220 CO 0.08 0.56 -0.44 1.23 -1.61 0.00 0.00 179.24 179.06 1xly h GLY 221 N 0.73 -1.17 -0.14 -0.78 0.00 -1.03 -1.84 103.07 98.83 1xly h GLY 221 Ca 0.19 0.49 0.10 0.00 0.00 0.00 0.00 47.33 48.11 1xly h GLY 221 CO -0.03 -0.40 -0.22 0.50 0.00 0.00 0.00 176.54 176.39 1xly h LYS 222 N -1.06 -0.10 -0.82 4.80 1.79 -1.01 0.22 116.57 120.39 1xly h LYS 222 Ca -0.09 0.01 0.11 0.00 -2.18 0.00 0.00 60.65 58.50 1xly h LYS 222 Cb 0.86 0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 31.48 1xly h LYS 222 CO 0.08 -0.07 0.53 -0.07 -1.08 0.00 0.00 179.45 178.84 1xly h LEU 223 N -0.11 0.64 -0.06 2.94 3.38 -0.32 0.12 115.31 121.91 1xly h LEU 223 Ca 0.23 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.15 1xly h LEU 223 Cb 0.47 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1xly h LEU 223 CO -0.56 0.37 -0.25 0.28 0.09 0.00 0.00 178.44 178.37 1xly h SER 224 N 0.70 0.33 -0.56 -0.43 0.02 -0.01 -1.55 113.55 112.05 1xly h SER 224 Ca 0.39 -0.64 0.10 0.00 -0.84 0.00 0.00 61.79 60.80 1xly h SER 224 Cb 0.54 -0.10 -0.08 0.00 0.14 0.00 0.00 62.40 62.90 1xly h SER 224 CO -0.15 0.91 0.11 0.00 -1.14 0.00 0.00 176.83 176.56 1xly h ALA 225 N 0.43 0.65 -0.07 3.77 0.00 -0.20 -2.13 119.26 121.70 1xly h ALA 225 Ca -0.01 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1xly h ALA 225 Cb 0.89 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 1xly h ALA 225 CO 0.05 -0.31 -0.15 1.25 0.00 0.00 0.00 179.25 180.09 1xly h LEU 226 N 0.25 -0.46 -1.66 0.00 6.46 -0.65 -1.58 115.31 117.67 1xly h LEU 226 Ca 0.29 0.08 -0.04 0.00 -0.12 0.00 0.00 57.88 58.09 1xly h LEU 226 Cb 0.42 0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.55 1xly h LEU 226 CO -0.38 -0.20 -0.17 -0.78 -0.62 0.00 0.00 178.44 176.28 1xly h ASP 227 N -0.22 0.00 0.06 1.25 1.82 -1.06 0.36 116.42 118.64 1xly h ASP 227 Ca 0.07 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.71 1xly h ASP 227 Cb 0.32 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.33 1xly h ASP 227 CO -0.20 0.17 -0.03 -0.08 -1.61 0.00 0.00 179.24 177.50 1xly h GLU 228 N 0.00 -0.08 0.00 0.28 4.81 -0.68 -2.01 114.58 116.90 1xly h GLU 228 Ca -0.00 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 1xly h GLU 228 Cb 0.46 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 1xly h GLU 228 CO 0.02 0.12 -0.40 0.93 -0.73 0.00 0.00 179.01 178.95 1xly h GLU 229 N -0.26 0.00 -0.17 1.92 4.39 -0.56 -1.98 114.58 117.91 1xly h GLU 229 Ca -0.01 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 1xly h GLU 229 Cb 0.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1xly h GLU 229 CO 0.01 0.40 0.03 0.74 -1.16 0.00 0.00 179.01 179.04 1xly h PHE 230 N 0.00 0.30 -0.84 4.33 0.05 -0.84 -0.75 116.94 119.20 1xly h PHE 230 Ca -0.00 -0.04 0.08 0.00 3.82 0.00 0.00 57.97 61.82 1xly h PHE 230 Cb 0.78 -0.08 -0.07 0.00 2.00 0.00 0.00 35.95 38.58 1xly h PHE 230 CO 0.00 0.44 0.50 -0.44 -0.18 0.00 0.00 178.31 178.63 1xly h ASP 231 N 0.08 0.76 0.52 2.17 3.32 -1.28 -0.63 116.42 121.36 1xly h ASP 231 Ca 0.05 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 1xly h ASP 231 Cb 0.30 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.72 1xly h ASP 231 CO 0.00 0.46 -0.30 0.58 -1.72 0.00 0.00 179.24 178.26 1xly h VAL 232 N 0.88 0.38 -0.33 -1.35 2.07 -1.00 -2.50 116.25 114.39 1xly h VAL 232 Ca 0.38 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.88 1xly h VAL 232 Cb 0.26 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1xly h VAL 232 CO -0.21 0.00 0.11 -0.37 0.02 0.00 0.00 177.57 177.12 1xly h VAL 233 N -0.78 1.15 -0.02 2.57 -1.51 -1.00 -2.47 116.25 114.19 1xly h VAL 233 Ca -0.06 -0.49 -0.04 0.00 -1.23 0.00 0.00 66.70 64.88 1xly h VAL 233 Cb 0.63 0.78 -0.01 0.00 -2.13 0.00 0.00 31.29 30.56 1xly h VAL 233 CO 0.08 0.18 -0.18 0.00 -1.23 0.00 0.00 177.57 176.42 1xly h ALA 234 N 1.65 1.68 0.00 5.19 0.00 -0.89 -2.00 119.26 124.90 1xly h ALA 234 Ca 0.12 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.67 1xly h ALA 234 Cb 0.14 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1xly h ALA 234 CO -0.01 0.24 -0.85 1.79 0.00 0.00 0.00 179.25 180.42 1xly h THR 235 N 0.02 1.55 -0.71 0.00 1.35 -1.01 -2.98 112.91 111.13 1xly h THR 235 Ca 0.00 -2.75 0.07 0.00 -0.55 0.00 0.00 66.41 63.18 1xly h THR 235 Cb 0.33 2.51 -0.05 0.00 -1.73 0.00 0.00 68.15 69.21 1xly h THR 235 CO 0.02 0.79 0.47 0.50 -0.25 0.00 0.00 175.52 177.06 1xly h LYS 236 N 0.04 0.68 0.00 4.72 3.64 -1.00 -3.52 116.57 121.14 1xly h LYS 236 Ca -0.02 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1xly h LYS 236 Cb 1.49 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 1xly h LYS 236 CO 0.12 0.45 0.00 0.91 -2.27 0.00 0.00 179.45 178.66