#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pd5 n GLY 7 N 0.00 1.47 3.33 1.09 0.00 -1.26 -4.88 105.19 104.94 1pd5 n GLY 7 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1pd5 n GLY 7 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1pd5 s TYR 8 N -0.33 -0.29 -0.07 1.61 -0.85 -1.26 0.76 117.35 116.93 1pd5 s TYR 8 Ca 0.00 0.29 -0.00 0.00 -0.52 0.00 0.00 57.07 56.84 1pd5 s TYR 8 Cb 0.00 0.22 -0.03 0.00 0.38 0.00 0.00 41.96 42.53 1pd5 s TYR 8 CO 0.00 -0.56 -0.04 -0.08 -1.52 0.00 0.00 175.55 173.35 1pd5 s THR 9 N -2.30 3.96 -0.29 -3.49 -1.32 0.11 -4.92 115.64 107.39 1pd5 s THR 9 Ca -0.06 -0.41 -0.06 0.00 -1.21 0.00 0.00 61.69 59.95 1pd5 s THR 9 Cb -0.01 -2.65 0.01 0.00 -1.51 0.00 0.00 72.50 68.34 1pd5 s THR 9 CO -0.01 0.58 0.07 0.28 -2.21 0.00 0.00 174.62 173.33 1pd5 s THR 10 N -0.86 3.91 0.39 5.08 -1.32 -1.26 0.12 115.64 121.70 1pd5 s THR 10 Ca 0.13 -0.69 -0.22 0.00 -1.21 0.00 0.00 61.69 59.70 1pd5 s THR 10 Cb -0.11 -3.01 -0.11 0.00 -1.51 0.00 0.00 72.50 67.77 1pd5 s THR 10 CO 0.02 0.10 0.94 -0.69 -2.21 0.00 0.00 174.62 172.78 1pd5 s VAL 11 N 1.49 4.35 -0.81 5.08 1.01 -0.65 -5.00 120.40 125.87 1pd5 s VAL 11 Ca 0.03 1.58 -0.15 0.00 0.00 0.00 0.00 61.98 63.43 1pd5 s VAL 11 Cb -0.17 -3.73 0.20 0.00 0.00 0.00 0.00 36.38 32.68 1pd5 s VAL 11 CO 0.02 -0.17 0.78 -0.62 0.00 0.00 0.00 175.10 175.11 1pd5 s ASP 12 N -2.01 6.69 0.24 3.32 3.68 -1.26 -4.76 116.67 122.58 1pd5 s ASP 12 Ca 0.58 -2.53 0.12 0.00 2.13 0.00 0.00 52.55 52.86 1pd5 s ASP 12 Cb -0.12 -2.23 0.85 0.00 -1.45 0.00 0.00 42.92 39.97 1pd5 s ASP 12 CO 0.16 -0.66 1.06 -0.38 0.13 0.00 0.00 175.17 175.49 1pd5 n ILE 13 N 4.26 -0.28 0.29 4.11 5.41 -1.26 -3.80 119.36 128.08 1pd5 n ILE 13 Ca 0.12 1.38 0.15 0.00 1.00 0.00 0.00 62.75 65.41 1pd5 n ILE 13 Cb 0.47 -2.22 0.88 0.00 -0.71 0.00 0.00 39.64 38.05 1pd5 n ILE 13 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1pd5 h SER 14 N 0.00 0.00 0.00 4.38 4.64 -2.00 -0.39 113.55 120.17 1pd5 h SER 14 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 1pd5 h SER 14 Cb 1.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 1pd5 h SER 14 CO -0.54 0.05 -0.12 0.00 -0.87 0.00 0.00 176.83 175.35 1pd5 n GLN 15 N -3.66 0.99 -2.20 4.77 6.02 -1.25 -5.01 117.38 117.04 1pd5 n GLN 15 Ca -0.02 -2.18 -0.42 0.00 -0.01 0.00 0.00 57.00 54.37 1pd5 n GLN 15 Cb 0.15 -1.25 -0.03 0.00 1.02 0.00 0.00 30.24 30.13 1pd5 n GLN 15 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 1pd5 s TRP 16 N -2.15 2.75 0.60 1.08 -0.00 -0.16 -4.94 118.94 116.12 1pd5 s TRP 16 Ca 0.24 0.75 0.29 0.00 -0.00 0.00 0.00 56.10 57.37 1pd5 s TRP 16 Cb 0.21 -3.69 1.33 0.00 -0.00 0.00 0.00 33.47 31.31 1pd5 s TRP 16 CO 0.02 -2.60 1.72 0.45 -0.00 0.00 0.00 176.95 176.54 1pd5 h HIS 17 N 8.04 0.00 -0.52 5.86 3.86 -1.95 -1.38 115.15 129.06 1pd5 h HIS 17 Ca -0.37 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.84 1pd5 h HIS 17 Cb 1.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.64 1pd5 h HIS 17 CO 0.77 0.00 0.00 0.54 0.86 0.00 0.00 177.93 180.10 1pd5 n ARG 18 N -3.56 2.66 0.10 2.45 1.74 -1.26 -4.64 116.66 114.15 1pd5 n ARG 18 Ca 0.13 -2.06 -0.13 0.00 -0.77 0.00 0.00 57.85 55.02 1pd5 n ARG 18 Cb 0.95 -1.58 -0.06 0.00 -1.02 0.00 0.00 32.46 30.75 1pd5 n ARG 18 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1pd5 h LYS 19 N 3.15 -0.50 0.50 5.56 1.63 -1.51 0.13 116.57 125.54 1pd5 h LYS 19 Ca 0.00 0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.82 1pd5 h LYS 19 Cb 0.94 0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.67 1pd5 h LYS 19 CO 0.09 -0.33 -0.38 0.93 -3.45 0.00 0.00 179.45 176.31 1pd5 h GLU 20 N -0.52 -0.83 -0.49 1.90 5.08 -1.83 -2.52 114.58 115.36 1pd5 h GLU 20 Ca 0.04 0.06 0.08 0.00 -1.00 0.00 0.00 59.36 58.53 1pd5 h GLU 20 Cb 0.56 0.19 -0.10 0.00 0.50 0.00 0.00 28.75 29.90 1pd5 h GLU 20 CO -0.20 -0.55 -0.45 0.45 -1.00 0.00 0.00 179.01 177.25 1pd5 h HIS 21 N -0.86 -1.33 -0.72 4.33 3.86 -1.84 0.15 115.15 118.74 1pd5 h HIS 21 Ca -0.05 0.08 0.15 0.00 -1.16 0.00 0.00 60.37 59.38 1pd5 h HIS 21 Cb 0.73 0.65 -0.13 0.00 1.06 0.00 0.00 27.41 29.72 1pd5 h HIS 21 CO -0.15 -0.44 -0.13 0.35 0.86 0.00 0.00 177.93 178.42 1pd5 h PHE 22 N -0.29 -0.29 -0.21 2.45 3.04 -0.67 0.72 116.94 121.70 1pd5 h PHE 22 Ca 0.15 0.06 -0.18 0.00 3.98 0.00 0.00 57.97 61.98 1pd5 h PHE 22 Cb 0.57 0.24 0.00 0.00 2.56 0.00 0.00 35.95 39.33 1pd5 h PHE 22 CO -0.68 -0.29 -0.56 0.93 -2.02 0.00 0.00 178.31 175.69 1pd5 h GLU 23 N 0.03 0.76 0.10 1.11 5.08 -0.54 1.71 114.58 122.83 1pd5 h GLU 23 Ca 0.36 -0.53 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1pd5 h GLU 23 Cb 0.57 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1pd5 h GLU 23 CO -0.71 1.15 -0.05 0.00 -1.00 0.00 0.00 179.01 178.41 1pd5 h ALA 24 N 0.60 -0.13 0.00 3.43 0.00 -0.14 -2.78 119.26 120.24 1pd5 h ALA 24 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1pd5 h ALA 24 Cb 1.18 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1pd5 h ALA 24 CO 0.12 -0.50 0.00 1.19 0.00 0.00 0.00 179.25 180.06 1pd5 n PHE 25 N -5.08 0.80 0.52 0.00 3.01 0.25 -1.72 117.46 115.24 1pd5 n PHE 25 Ca -0.08 0.28 0.12 0.00 1.01 0.00 0.00 57.45 58.78 1pd5 n PHE 25 Cb 0.14 -0.95 0.46 0.00 -0.01 0.00 0.00 39.48 39.11 1pd5 n PHE 25 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1pd5 n GLN 26 N -2.20 0.18 0.00 -1.08 1.13 0.58 -3.45 117.38 112.55 1pd5 n GLN 26 Ca 0.04 0.31 0.00 0.00 -1.94 0.00 0.00 57.00 55.41 1pd5 n GLN 26 Cb 0.30 -1.79 0.00 0.00 0.11 0.00 0.00 30.24 28.87 1pd5 n GLN 26 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1pd5 n SER 27 N -2.12 0.00 0.18 1.08 3.41 -0.70 -4.77 113.62 110.69 1pd5 n SER 27 Ca 0.04 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.77 1pd5 n SER 27 Cb 0.29 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.40 1pd5 n SER 27 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1pd5 h VAL 28 N 0.00 0.00 -0.05 -3.33 2.07 -1.82 -3.25 116.25 109.87 1pd5 h VAL 28 Ca 0.00 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.58 1pd5 h VAL 28 Cb 0.00 1.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1pd5 h VAL 28 CO 0.00 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.59 1pd5 n ALA 29 N -2.08 2.23 -1.32 1.67 0.00 -1.13 -5.06 120.51 114.82 1pd5 n ALA 29 Ca 0.03 -0.82 -0.52 0.00 0.00 0.00 0.00 53.44 52.14 1pd5 n ALA 29 Cb 0.52 -0.09 -0.07 0.00 0.00 0.00 0.00 19.45 19.81 1pd5 n ALA 29 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1pd5 n GLN 30 N -0.10 0.00 -3.62 0.00 7.27 -1.22 -4.73 117.38 114.98 1pd5 n GLN 30 Ca 0.02 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 56.99 1pd5 n GLN 30 Cb 0.19 -1.27 -0.04 0.00 2.41 0.00 0.00 30.24 31.54 1pd5 n GLN 30 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1pd5 s THR 32 N -3.82 2.66 0.13 0.00 -1.32 -1.26 -2.54 115.64 109.50 1pd5 s THR 32 Ca 0.05 -1.71 -0.09 0.00 -1.21 0.00 0.00 61.69 58.73 1pd5 s THR 32 Cb 0.00 -2.96 -0.00 0.00 -1.51 0.00 0.00 72.50 68.02 1pd5 s THR 32 CO -0.09 -0.10 0.25 -0.72 -2.21 0.00 0.00 174.62 171.75 1pd5 s TYR 33 N -2.51 0.29 -0.04 9.09 -0.85 0.13 -4.90 117.35 118.57 1pd5 s TYR 33 Ca 0.39 -0.68 -0.00 0.00 -0.52 0.00 0.00 57.07 56.26 1pd5 s TYR 33 Cb 0.00 -0.05 0.03 0.00 0.38 0.00 0.00 41.96 42.32 1pd5 s TYR 33 CO 0.23 -0.65 0.02 -0.80 -1.52 0.00 0.00 175.55 172.83 1pd5 s ASN 34 N -2.92 0.70 -0.02 -0.18 0.02 -1.26 -0.35 114.94 110.93 1pd5 s ASN 34 Ca 0.12 -0.00 -0.02 0.00 -1.02 0.00 0.00 52.86 51.94 1pd5 s ASN 34 Cb 0.04 -0.21 0.01 0.00 0.02 0.00 0.00 41.25 41.11 1pd5 s ASN 34 CO -0.05 -0.15 0.06 -1.58 0.02 0.00 0.00 177.10 175.40 1pd5 s GLN 35 N 1.43 0.05 -0.23 -0.60 0.74 -1.08 -5.02 119.66 114.94 1pd5 s GLN 35 Ca -0.04 0.12 -0.04 0.00 0.05 0.00 0.00 55.36 55.45 1pd5 s GLN 35 Cb -0.13 -0.04 -0.01 0.00 1.10 0.00 0.00 33.01 33.93 1pd5 s GLN 35 CO -0.03 -0.05 -0.03 0.99 -0.55 0.00 0.00 175.29 175.62 1pd5 s THR 36 N 0.33 3.47 0.08 -0.34 2.01 -1.26 -1.91 115.64 118.02 1pd5 s THR 36 Ca -0.03 -0.49 0.05 0.00 0.31 0.00 0.00 61.69 61.54 1pd5 s THR 36 Cb -0.04 -2.60 -0.04 0.00 0.01 0.00 0.00 72.50 69.83 1pd5 s THR 36 CO -0.01 0.39 -0.03 0.54 -0.69 0.00 0.00 174.62 174.82 1pd5 s VAL 37 N 1.49 3.84 -0.86 3.82 0.11 0.18 -4.93 120.40 124.05 1pd5 s VAL 37 Ca 0.06 -1.03 -0.17 0.00 -2.93 0.00 0.00 61.98 57.91 1pd5 s VAL 37 Cb -0.15 -2.81 0.16 0.00 -1.53 0.00 0.00 36.38 32.06 1pd5 s VAL 37 CO -0.02 0.15 0.97 -1.10 -3.33 0.00 0.00 175.10 171.76 1pd5 s GLN 38 N -2.19 3.54 0.23 1.54 -1.52 -1.26 0.17 119.66 120.17 1pd5 s GLN 38 Ca 0.24 -1.94 -0.30 0.00 -1.95 0.00 0.00 55.36 51.40 1pd5 s GLN 38 Cb -0.11 -4.68 -0.09 0.00 -0.22 0.00 0.00 33.01 27.90 1pd5 s GLN 38 CO 0.16 -1.59 1.34 -1.17 -0.25 0.00 0.00 175.29 173.78 1pd5 s LEU 39 N 1.85 4.41 -0.69 2.90 0.20 -0.44 -4.80 118.68 122.12 1pd5 s LEU 39 Ca 0.26 2.51 -0.25 0.00 0.69 0.00 0.00 54.13 57.33 1pd5 s LEU 39 Cb -0.08 -3.62 0.05 0.00 -0.43 0.00 0.00 46.19 42.11 1pd5 s LEU 39 CO -0.08 -0.57 1.11 -0.62 -0.29 0.00 0.00 176.35 175.91 1pd5 s ASP 40 N 0.24 6.18 -0.28 3.68 3.68 -1.26 -1.64 116.67 127.27 1pd5 s ASP 40 Ca 0.56 -0.68 0.12 0.00 2.13 0.00 0.00 52.55 54.69 1pd5 s ASP 40 Cb -0.38 -2.49 0.77 0.00 -1.45 0.00 0.00 42.92 39.37 1pd5 s ASP 40 CO 0.41 -1.62 1.76 2.30 0.13 0.00 0.00 175.17 178.16 1pd5 n ILE 41 N 6.17 2.83 0.18 4.11 -5.35 -0.85 -4.76 119.36 121.69 1pd5 n ILE 41 Ca -0.00 -1.56 -0.15 0.00 -0.27 0.00 0.00 62.75 60.77 1pd5 n ILE 41 Cb 0.47 -0.32 -0.07 0.00 -1.74 0.00 0.00 39.64 37.99 1pd5 n ILE 41 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1pd5 h THR 42 N 3.25 0.28 0.00 7.28 1.03 -1.86 -1.68 112.91 121.21 1pd5 h THR 42 Ca 0.13 0.00 -0.10 0.00 -0.01 0.00 0.00 66.41 66.43 1pd5 h THR 42 Cb 2.13 0.28 -0.01 0.00 -1.07 0.00 0.00 68.15 69.48 1pd5 h THR 42 CO 0.60 0.00 -0.48 0.00 -0.01 0.00 0.00 175.52 175.63 1pd5 h ALA 43 N -0.13 0.98 -0.20 0.00 0.00 -1.86 -2.27 119.26 115.78 1pd5 h ALA 43 Ca -0.00 -0.44 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 1pd5 h ALA 43 Cb 0.63 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1pd5 h ALA 43 CO -0.12 0.60 -0.44 0.35 0.00 0.00 0.00 179.25 179.64 1pd5 h PHE 44 N 0.00 0.83 -0.50 0.00 3.57 -1.48 0.77 116.94 120.13 1pd5 h PHE 44 Ca -0.00 -0.31 -0.10 0.00 3.53 0.00 0.00 57.97 61.09 1pd5 h PHE 44 Cb 0.99 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.56 1pd5 h PHE 44 CO 0.00 1.08 -0.06 1.25 -2.23 0.00 0.00 178.31 178.35 1pd5 h LEU 45 N 0.34 0.92 -1.72 0.59 6.46 -1.31 0.71 115.31 121.30 1pd5 h LEU 45 Ca 0.00 -0.34 -0.01 0.00 -0.12 0.00 0.00 57.88 57.41 1pd5 h LEU 45 Cb 1.05 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 40.72 1pd5 h LEU 45 CO 0.10 1.03 0.02 0.11 -0.62 0.00 0.00 178.44 179.09 1pd5 h LYS 46 N 0.78 0.20 0.03 1.25 1.57 -0.91 0.44 116.57 119.93 1pd5 h LYS 46 Ca 0.13 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1pd5 h LYS 46 Cb 0.60 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1pd5 h LYS 46 CO 0.04 0.20 -0.01 1.15 -0.57 0.00 0.00 179.45 180.25 1pd5 h THR 47 N 0.20 1.40 -0.78 -0.16 2.02 0.10 -2.83 112.91 112.86 1pd5 h THR 47 Ca 0.05 -1.51 0.06 0.00 0.77 0.00 0.00 66.41 65.78 1pd5 h THR 47 Cb 0.10 2.38 -0.06 0.00 -1.74 0.00 0.00 68.15 68.83 1pd5 h THR 47 CO -0.00 0.38 0.46 0.58 0.37 0.00 0.00 175.52 177.31 1pd5 h VAL 48 N -0.72 1.00 -0.15 3.16 2.07 0.91 -2.94 116.25 119.58 1pd5 h VAL 48 Ca -0.00 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 1pd5 h VAL 48 Cb 0.65 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1pd5 h VAL 48 CO 0.01 0.15 -0.01 0.11 0.02 0.00 0.00 177.57 177.85 1pd5 h LYS 49 N 0.84 0.27 0.00 1.57 1.79 -0.23 -2.80 116.57 118.01 1pd5 h LYS 49 Ca 0.34 -0.09 -0.05 0.00 -2.18 0.00 0.00 60.65 58.67 1pd5 h LYS 49 Cb 0.19 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1pd5 h LYS 49 CO -0.18 0.52 -0.26 1.57 -1.08 0.00 0.00 179.45 180.02 1pd5 h LYS 50 N -0.00 0.00 -7.00 3.15 2.10 -1.32 -3.37 116.57 110.12 1pd5 h LYS 50 Ca 0.04 0.00 -0.47 0.00 -2.00 0.00 0.00 60.65 58.22 1pd5 h LYS 50 Cb 0.41 0.00 0.07 0.00 -0.90 0.00 0.00 32.23 31.81 1pd5 h LYS 50 CO 0.01 0.26 0.05 -0.80 -2.00 0.00 0.00 179.45 176.97 1pd5 s ASN 51 N -6.62 4.59 -0.63 7.07 0.01 -1.17 -5.03 114.94 113.16 1pd5 s ASN 51 Ca -0.03 -0.39 0.01 0.00 -0.71 0.00 0.00 52.86 51.75 1pd5 s ASN 51 Cb 0.14 -0.09 0.16 0.00 0.41 0.00 0.00 41.25 41.87 1pd5 s ASN 51 CO 0.67 -1.68 0.42 -0.54 -1.51 0.00 0.00 177.10 174.46 1pd5 s LYS 52 N -5.01 2.42 -0.06 -0.60 1.02 -1.26 -4.85 119.74 111.39 1pd5 s LYS 52 Ca 0.64 -2.80 0.05 0.00 0.02 0.00 0.00 55.97 53.88 1pd5 s LYS 52 Cb -0.06 -3.55 -0.02 0.00 -0.52 0.00 0.00 37.83 33.68 1pd5 s LYS 52 CO 0.43 -1.18 -0.20 -1.01 -0.92 0.00 0.00 175.35 172.47 1pd5 s HIS 53 N -0.54 2.57 -0.10 3.18 3.76 -1.06 -5.09 115.29 118.00 1pd5 s HIS 53 Ca 0.20 -0.50 -0.29 0.00 -0.15 0.00 0.00 55.06 54.31 1pd5 s HIS 53 Cb -0.18 -1.64 -0.05 0.00 1.11 0.00 0.00 32.58 31.82 1pd5 s HIS 53 CO -0.05 -0.07 1.71 0.15 -0.85 0.00 0.00 174.74 175.63 1pd5 s LYS 54 N -0.31 4.01 0.10 1.40 1.02 -1.26 -4.79 119.74 119.91 1pd5 s LYS 54 Ca 0.02 2.08 -0.20 0.00 0.02 0.00 0.00 55.97 57.88 1pd5 s LYS 54 Cb -0.13 -4.04 -0.05 0.00 -0.52 0.00 0.00 37.83 33.10 1pd5 s LYS 54 CO 0.02 -1.05 1.24 0.34 -0.92 0.00 0.00 175.35 174.98 1pd5 n PHE 55 N 7.81 -0.28 0.12 3.18 7.35 -1.26 -3.02 117.46 131.35 1pd5 n PHE 55 Ca 0.19 0.81 -0.16 0.00 -0.76 0.00 0.00 57.45 57.52 1pd5 n PHE 55 Cb 0.43 -0.54 -0.10 0.00 0.35 0.00 0.00 39.48 39.63 1pd5 n PHE 55 CO 0.00 0.00 0.00 -0.92 -0.76 0.00 0.00 176.76 175.08 1pd5 h TYR 56 N 0.00 -1.49 -0.14 -5.13 3.20 -1.99 -1.49 116.97 109.93 1pd5 h TYR 56 Ca 0.10 0.04 -0.18 0.00 3.14 0.00 0.00 58.73 61.84 1pd5 h TYR 56 Cb 0.27 0.63 -0.00 0.00 1.54 0.00 0.00 36.73 39.16 1pd5 h TYR 56 CO -0.90 -0.59 -0.64 -1.00 -1.64 0.00 0.00 178.16 173.40 1pd5 h PRO 57 N -0.75 0.53 -0.56 1.82 0.13 -1.98 0.64 132.00 131.82 1pd5 h PRO 57 Ca -0.01 -0.37 0.08 0.00 -0.87 0.00 0.00 66.00 64.83 1pd5 h PRO 57 Cb 0.74 0.06 -0.10 0.00 0.13 0.00 0.00 31.00 31.83 1pd5 h PRO 57 CO -0.27 0.99 -0.47 0.00 -0.23 0.00 0.00 178.00 178.03 1pd5 h ALA 58 N 0.92 -0.42 -0.43 -0.56 0.00 -1.35 0.13 119.26 117.55 1pd5 h ALA 58 Ca -0.01 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1pd5 h ALA 58 Cb 1.20 1.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.99 1pd5 h ALA 58 CO 0.12 -0.88 -0.07 0.35 0.00 0.00 0.00 179.25 178.77 1pd5 h PHE 59 N -0.25 0.89 -0.99 0.00 3.57 -0.64 -2.01 116.94 117.51 1pd5 h PHE 59 Ca 0.16 -0.18 0.28 0.00 3.53 0.00 0.00 57.97 61.76 1pd5 h PHE 59 Cb 0.56 -0.22 -0.14 0.00 2.79 0.00 0.00 35.95 38.94 1pd5 h PHE 59 CO -0.73 0.90 0.54 0.82 -2.23 0.00 0.00 178.31 177.62 1pd5 h ILE 60 N 0.63 0.39 0.02 1.41 2.04 0.94 -1.03 117.51 121.91 1pd5 h ILE 60 Ca 0.11 -0.14 -0.21 0.00 1.00 0.00 0.00 64.86 65.62 1pd5 h ILE 60 Cb 0.60 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 1pd5 h ILE 60 CO 0.04 0.07 -0.96 -0.74 0.00 0.00 0.00 178.15 176.57 1pd5 h HIS 61 N 0.41 0.33 0.24 1.37 2.76 -0.03 -0.41 115.15 119.80 1pd5 h HIS 61 Ca 0.68 -0.19 -0.01 0.00 -2.20 0.00 0.00 60.37 58.64 1pd5 h HIS 61 Cb 1.44 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 30.37 1pd5 h HIS 61 CO -0.04 1.04 -0.11 0.82 -1.30 0.00 0.00 177.93 178.34 1pd5 h ILE 62 N 0.10 0.82 -0.80 6.26 2.04 -0.80 0.18 117.51 125.32 1pd5 h ILE 62 Ca -0.06 -0.38 0.11 0.00 1.00 0.00 0.00 64.86 65.53 1pd5 h ILE 62 Cb 1.61 1.04 -0.12 0.00 -0.74 0.00 0.00 36.82 38.61 1pd5 h ILE 62 CO 0.15 0.08 -0.46 -0.07 0.00 0.00 0.00 178.15 177.85 1pd5 h LEU 63 N -0.51 -1.66 -0.57 1.44 3.38 -1.00 0.30 115.31 116.69 1pd5 h LEU 63 Ca -0.03 0.29 -0.12 0.00 0.09 0.00 0.00 57.88 58.11 1pd5 h LEU 63 Cb 0.38 0.77 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 1pd5 h LEU 63 CO 0.05 -0.30 -0.11 0.00 0.09 0.00 0.00 178.44 178.17 1pd5 h ALA 64 N 0.79 0.77 -0.19 1.53 0.00 -0.94 0.36 119.26 121.59 1pd5 h ALA 64 Ca 0.22 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1pd5 h ALA 64 Cb 0.54 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1pd5 h ALA 64 CO -0.84 0.67 -0.38 0.07 0.00 0.00 0.00 179.25 178.77 1pd5 h ARG 65 N 0.91 0.43 -0.71 0.00 0.11 -0.04 0.92 114.38 115.99 1pd5 h ARG 65 Ca 0.14 -0.20 -0.01 0.00 0.10 0.00 0.00 59.98 60.01 1pd5 h ARG 65 Cb 0.68 -0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.72 1pd5 h ARG 65 CO 0.05 0.75 0.40 -0.07 0.10 0.00 0.00 179.97 181.20 1pd5 h LEU 66 N 0.36 0.87 -0.34 0.08 3.38 -0.10 -2.70 115.31 116.86 1pd5 h LEU 66 Ca 0.04 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1pd5 h LEU 66 Cb 0.83 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1pd5 h LEU 66 CO 0.07 0.69 -0.06 0.24 0.09 0.00 0.00 178.44 179.47 1pd5 h MET 67 N 0.99 0.65 0.00 1.13 2.86 0.31 -3.06 114.93 117.82 1pd5 h MET 67 Ca 0.25 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1pd5 h MET 67 Cb 0.01 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.62 1pd5 h MET 67 CO -0.04 0.81 0.00 0.09 1.06 0.00 0.00 176.91 178.82 1pd5 n ASN 68 N -4.44 0.00 -0.48 1.22 3.02 0.26 -2.83 115.26 112.01 1pd5 n ASN 68 Ca -0.02 -0.58 0.10 0.00 -0.03 0.00 0.00 54.58 54.06 1pd5 n ASN 68 Cb 0.32 -0.08 -0.00 0.00 -0.61 0.00 0.00 39.78 39.40 1pd5 n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pd5 n ALA 69 N -1.08 3.45 -3.60 5.41 0.00 -1.02 -4.93 120.51 118.73 1pd5 n ALA 69 Ca 0.17 -0.62 -0.29 0.00 0.00 0.00 0.00 53.44 52.70 1pd5 n ALA 69 Cb 0.12 -0.74 -0.15 0.00 0.00 0.00 0.00 19.45 18.68 1pd5 n ALA 69 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1pd5 s HIS 70 N -2.33 0.65 0.20 0.00 3.76 -1.13 -5.04 115.29 111.39 1pd5 s HIS 70 Ca 0.17 -0.99 0.25 0.00 -0.15 0.00 0.00 55.06 54.35 1pd5 s HIS 70 Cb 0.17 -1.05 1.03 0.00 1.11 0.00 0.00 32.58 33.84 1pd5 s HIS 70 CO 0.53 -0.78 1.88 -1.35 -0.85 0.00 0.00 174.74 174.16 1pd5 h PRO 71 N 8.33 0.00 -0.35 8.40 0.11 -1.92 -0.68 132.00 145.90 1pd5 h PRO 71 Ca -0.18 0.00 0.10 0.00 0.11 0.00 0.00 66.00 66.03 1pd5 h PRO 71 Cb 1.04 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1pd5 h PRO 71 CO 0.42 0.21 0.90 1.05 -0.21 0.00 0.00 178.00 180.36 1pd5 h GLU 72 N 0.00 0.00 -0.03 1.05 9.09 -1.94 0.66 114.58 123.42 1pd5 h GLU 72 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1pd5 h GLU 72 Cb 0.66 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.76 1pd5 h GLU 72 CO 0.03 0.00 -0.02 1.19 0.05 0.00 0.00 179.01 180.25 1pd5 n PHE 73 N -2.91 0.00 -0.42 2.06 3.01 -0.26 -4.25 117.46 114.69 1pd5 n PHE 73 Ca 0.07 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.58 1pd5 n PHE 73 Cb 1.01 -0.00 0.10 0.00 -0.01 0.00 0.00 39.48 40.58 1pd5 n PHE 73 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1pd5 n ARG 74 N 1.21 2.54 -2.86 -1.08 1.74 0.23 -4.62 116.66 113.82 1pd5 n ARG 74 Ca 0.14 -2.04 -0.32 0.00 -0.77 0.00 0.00 57.85 54.86 1pd5 n ARG 74 Cb 0.58 -1.28 -0.05 0.00 -1.02 0.00 0.00 32.46 30.68 1pd5 n ARG 74 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1pd5 s MET 75 N -1.69 4.02 0.06 5.56 -1.94 -1.14 -1.91 119.30 122.26 1pd5 s MET 75 Ca 0.18 0.81 -0.01 0.00 -1.71 0.00 0.00 55.69 54.97 1pd5 s MET 75 Cb 0.14 -2.30 -0.04 0.00 2.01 0.00 0.00 34.83 34.64 1pd5 s MET 75 CO 0.05 -0.01 -0.02 0.00 -0.01 0.00 0.00 175.02 175.02 1pd5 s ALA 76 N -2.23 0.60 -0.29 3.03 0.00 0.06 -4.56 121.76 118.38 1pd5 s ALA 76 Ca 0.57 -1.25 -0.15 0.00 0.00 0.00 0.00 51.96 51.12 1pd5 s ALA 76 Cb -0.10 0.32 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 1pd5 s ALA 76 CO 0.21 -0.37 0.37 -1.64 0.00 0.00 0.00 175.76 174.33 1pd5 s MET 77 N -3.92 3.88 -0.21 0.00 -1.94 -1.26 0.30 119.30 116.15 1pd5 s MET 77 Ca 0.09 -0.11 -0.02 0.00 -1.71 0.00 0.00 55.69 53.95 1pd5 s MET 77 Cb 0.08 -3.70 0.06 0.00 2.01 0.00 0.00 34.83 33.28 1pd5 s MET 77 CO -0.08 -0.35 0.02 0.21 -0.01 0.00 0.00 175.02 174.80 1pd5 s LYS 78 N 2.06 0.89 -1.35 2.03 2.20 -0.92 -4.87 119.74 119.77 1pd5 s LYS 78 Ca 0.14 -0.59 -0.04 0.00 -0.36 0.00 0.00 55.97 55.13 1pd5 s LYS 78 Cb -0.16 -2.22 0.02 0.00 -1.51 0.00 0.00 37.83 33.96 1pd5 s LYS 78 CO 0.11 -0.65 0.84 -0.25 -0.36 0.00 0.00 175.35 175.04 1pd5 n ASP 79 N 4.95 -2.45 0.00 1.43 10.43 -1.26 -1.43 116.55 128.22 1pd5 n ASP 79 Ca -0.09 -0.76 0.00 0.00 2.57 0.00 0.00 54.79 56.50 1pd5 n ASP 79 Cb 0.46 -4.24 0.00 0.00 1.84 0.00 0.00 41.12 39.19 1pd5 n ASP 79 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1pd5 n GLY 80 N -1.58 1.21 3.19 0.44 0.00 -1.26 -4.99 105.19 102.21 1pd5 n GLY 80 Ca -0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 1pd5 n GLY 80 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pd5 s GLU 81 N -0.21 3.04 0.19 1.61 2.02 -0.52 -5.11 118.70 119.73 1pd5 s GLU 81 Ca 0.00 -0.86 -0.32 0.00 0.02 0.00 0.00 54.97 53.81 1pd5 s GLU 81 Cb 0.00 -2.39 -0.11 0.00 0.10 0.00 0.00 34.13 31.74 1pd5 s GLU 81 CO 0.00 0.07 1.62 -1.17 0.02 0.00 0.00 175.26 175.79 1pd5 s LEU 82 N 0.62 4.37 0.14 1.80 2.96 -1.26 -2.16 118.68 125.15 1pd5 s LEU 82 Ca -0.12 2.72 0.02 0.00 -0.22 0.00 0.00 54.13 56.53 1pd5 s LEU 82 Cb -0.17 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.88 1pd5 s LEU 82 CO 0.03 -0.87 -0.03 0.54 -1.32 0.00 0.00 176.35 174.69 1pd5 s VAL 83 N 1.05 0.73 -0.13 1.68 0.11 0.15 -1.64 120.40 122.35 1pd5 s VAL 83 Ca 0.71 -1.97 -0.01 0.00 -2.93 0.00 0.00 61.98 57.78 1pd5 s VAL 83 Cb -0.46 -1.92 0.04 0.00 -1.53 0.00 0.00 36.38 32.50 1pd5 s VAL 83 CO 0.33 -0.65 -0.03 -0.63 -3.33 0.00 0.00 175.10 170.79 1pd5 s ILE 84 N -3.62 0.77 0.29 7.04 1.01 0.31 -0.76 121.20 126.25 1pd5 s ILE 84 Ca 0.19 -0.30 -0.30 0.00 0.00 0.00 0.00 60.65 60.24 1pd5 s ILE 84 Cb 0.05 -0.95 -0.11 0.00 0.01 0.00 0.00 42.46 41.46 1pd5 s ILE 84 CO 0.00 0.17 1.52 0.26 0.00 0.00 0.00 174.94 176.90 1pd5 s TRP 85 N 1.79 2.82 0.31 3.97 0.52 -0.80 0.04 118.94 127.60 1pd5 s TRP 85 Ca 0.03 0.93 0.08 0.00 0.02 0.00 0.00 56.10 57.16 1pd5 s TRP 85 Cb -0.14 -3.97 0.88 0.00 -1.15 0.00 0.00 33.47 29.08 1pd5 s TRP 85 CO -0.07 -3.17 1.68 -0.44 0.02 0.00 0.00 176.95 174.97 1pd5 h ASP 86 N 4.62 0.41 -4.82 2.95 3.45 -0.01 -3.44 116.42 119.59 1pd5 h ASP 86 Ca -0.47 0.17 -0.23 0.00 0.43 0.00 0.00 57.03 56.93 1pd5 h ASP 86 Cb 1.22 0.13 -0.21 0.00 -0.56 0.00 0.00 39.33 39.91 1pd5 h ASP 86 CO 0.76 -0.05 -0.72 -0.55 -1.57 0.00 0.00 179.24 177.12 1pd5 s SER 87 N -5.08 0.56 0.07 6.45 0.15 -1.26 -5.06 113.70 109.52 1pd5 s SER 87 Ca -0.11 -0.50 0.10 0.00 0.70 0.00 0.00 55.95 56.13 1pd5 s SER 87 Cb 0.27 0.06 -0.03 0.00 -1.71 0.00 0.00 66.02 64.61 1pd5 s SER 87 CO 0.79 -0.24 -0.26 0.68 1.20 0.00 0.00 173.24 175.41 1pd5 s VAL 88 N -1.35 2.21 -0.20 4.45 -7.23 -1.26 -4.88 120.40 112.14 1pd5 s VAL 88 Ca -0.12 -1.47 -0.06 0.00 -1.81 0.00 0.00 61.98 58.52 1pd5 s VAL 88 Cb -0.10 -1.90 -0.03 0.00 0.56 0.00 0.00 36.38 34.92 1pd5 s VAL 88 CO -0.00 0.29 0.02 -1.00 -0.31 0.00 0.00 175.10 174.10 1pd5 s HIS 89 N -0.88 3.07 0.02 2.82 3.76 0.92 -4.68 115.29 120.33 1pd5 s HIS 89 Ca 0.13 -0.36 -0.30 0.00 -0.15 0.00 0.00 55.06 54.37 1pd5 s HIS 89 Cb -0.10 -2.10 -0.06 0.00 1.11 0.00 0.00 32.58 31.43 1pd5 s HIS 89 CO 0.03 -0.19 1.38 -1.25 -0.85 0.00 0.00 174.74 173.86 1pd5 s PRO 90 N 0.97 4.30 -0.21 8.40 0.04 -1.24 -1.59 135.00 145.68 1pd5 s PRO 90 Ca 0.02 1.96 -0.02 0.00 0.04 0.00 0.00 61.00 63.00 1pd5 s PRO 90 Cb -0.14 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.91 1pd5 s PRO 90 CO 0.02 -0.52 -0.10 0.00 0.04 0.00 0.00 177.00 176.44 1pd5 s TYR 92 N 1.41 1.49 -0.06 0.00 -0.85 0.08 -0.14 117.35 119.28 1pd5 s TYR 92 Ca 0.05 -1.32 -0.06 0.00 -0.52 0.00 0.00 57.07 55.22 1pd5 s TYR 92 Cb -0.14 -0.80 -0.04 0.00 0.38 0.00 0.00 41.96 41.36 1pd5 s TYR 92 CO -0.07 -0.50 0.18 0.95 -1.52 0.00 0.00 175.55 174.59 1pd5 s THR 93 N -3.77 5.44 0.07 -3.49 -4.23 -1.20 -1.16 115.64 107.30 1pd5 s THR 93 Ca 0.37 0.11 0.07 0.00 -1.18 0.00 0.00 61.69 61.06 1pd5 s THR 93 Cb 0.06 -3.48 -0.03 0.00 1.34 0.00 0.00 72.50 70.39 1pd5 s THR 93 CO 0.16 0.48 -0.19 0.54 -0.54 0.00 0.00 174.62 175.07 1pd5 s VAL 94 N -1.17 1.52 -0.19 2.29 0.11 0.20 -4.86 120.40 118.31 1pd5 s VAL 94 Ca 0.21 -1.32 -0.10 0.00 -2.93 0.00 0.00 61.98 57.85 1pd5 s VAL 94 Cb -0.13 -1.37 -0.05 0.00 -1.53 0.00 0.00 36.38 33.31 1pd5 s VAL 94 CO 0.11 0.01 0.14 0.12 -3.33 0.00 0.00 175.10 172.15 1pd5 s PHE 95 N -1.01 3.44 -1.13 1.54 5.36 -1.26 -0.43 117.98 124.49 1pd5 s PHE 95 Ca 0.05 0.37 -0.09 0.00 -0.96 0.00 0.00 56.93 56.30 1pd5 s PHE 95 Cb -0.09 -2.14 0.27 0.00 -0.34 0.00 0.00 43.02 40.72 1pd5 s PHE 95 CO 0.03 0.35 1.17 0.72 -1.46 0.00 0.00 175.22 176.02 1pd5 n HIS 96 N 3.30 5.13 -0.42 10.12 8.25 0.71 -4.92 115.22 137.40 1pd5 n HIS 96 Ca -0.16 -3.81 0.36 0.00 -0.26 0.00 0.00 57.72 53.84 1pd5 n HIS 96 Cb 0.52 -1.73 0.63 0.00 1.12 0.00 0.00 29.99 30.54 1pd5 n HIS 96 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 1pd5 h GLU 97 N 6.62 0.06 0.00 -0.41 4.81 -1.96 -0.29 114.58 123.42 1pd5 h GLU 97 Ca 0.19 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 1pd5 h GLU 97 Cb 0.86 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.22 1pd5 h GLU 97 CO 1.05 0.04 -0.14 1.96 -0.73 0.00 0.00 179.01 181.20 1pd5 h GLN 98 N 0.07 0.00 0.00 1.92 7.50 -1.93 -3.23 115.11 119.44 1pd5 h GLN 98 Ca 0.84 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.99 1pd5 h GLN 98 Cb 2.51 0.00 0.00 0.00 0.05 0.00 0.00 27.48 30.04 1pd5 h GLN 98 CO -0.52 0.14 0.00 0.25 -1.50 0.00 0.00 178.83 177.20 1pd5 n THR 99 N -3.19 0.21 -3.84 -0.54 -2.24 -0.75 -5.00 114.28 98.92 1pd5 n THR 99 Ca 0.02 -0.44 -0.24 0.00 -2.27 0.00 0.00 64.05 61.11 1pd5 n THR 99 Cb 0.48 1.12 0.01 0.00 -2.10 0.00 0.00 70.33 69.84 1pd5 n THR 99 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1pd5 n GLU 100 N -0.11 -4.33 -4.37 -0.78 1.02 -0.19 -5.00 120.64 106.88 1pd5 n GLU 100 Ca 0.00 0.53 -0.19 0.00 -0.02 0.00 0.00 57.16 57.48 1pd5 n GLU 100 Cb 0.16 -4.98 -0.10 0.00 -0.02 0.00 0.00 31.44 26.50 1pd5 n GLU 100 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1pd5 s THR 101 N -3.71 0.79 0.03 2.62 -4.23 -1.16 -5.04 115.64 104.94 1pd5 s THR 101 Ca 0.11 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.60 1pd5 s THR 101 Cb -0.06 -2.69 -0.02 0.00 1.34 0.00 0.00 72.50 71.07 1pd5 s THR 101 CO 0.85 0.00 0.01 0.72 -0.54 0.00 0.00 174.62 175.66 1pd5 s PHE 102 N -3.57 0.29 0.14 3.99 -0.12 -1.26 -0.20 117.98 117.24 1pd5 s PHE 102 Ca 0.37 -0.62 0.11 0.00 -0.05 0.00 0.00 56.93 56.73 1pd5 s PHE 102 Cb 0.08 -0.22 -0.04 0.00 -0.63 0.00 0.00 43.02 42.21 1pd5 s PHE 102 CO 0.14 -0.28 -0.26 -1.12 -0.05 0.00 0.00 175.22 173.66 1pd5 s SER 103 N -1.94 3.23 -0.53 1.98 0.01 0.43 -4.75 113.70 112.11 1pd5 s SER 103 Ca -0.08 -0.76 -0.16 0.00 1.31 0.00 0.00 55.95 56.25 1pd5 s SER 103 Cb -0.04 -0.21 0.12 0.00 0.21 0.00 0.00 66.02 66.10 1pd5 s SER 103 CO -0.04 0.15 0.49 -0.44 0.41 0.00 0.00 173.24 173.81 1pd5 s SER 104 N -2.16 6.18 0.01 2.44 0.01 -0.31 0.61 113.70 120.49 1pd5 s SER 104 Ca 0.14 -1.71 0.03 0.00 1.31 0.00 0.00 55.95 55.72 1pd5 s SER 104 Cb -0.10 -2.21 -0.04 0.00 0.21 0.00 0.00 66.02 63.89 1pd5 s SER 104 CO 0.06 -0.84 -0.03 -1.48 0.41 0.00 0.00 173.24 171.37 1pd5 s LEU 105 N 1.64 3.34 -0.12 2.44 2.34 -0.31 -4.19 118.68 123.82 1pd5 s LEU 105 Ca 0.03 -0.10 -0.17 0.00 0.06 0.00 0.00 54.13 53.95 1pd5 s LEU 105 Cb -0.29 -1.94 -0.04 0.00 -0.56 0.00 0.00 46.19 43.36 1pd5 s LEU 105 CO 0.04 0.27 0.43 -1.66 -1.06 0.00 0.00 176.35 174.36 1pd5 s TRP 106 N -1.08 3.51 -0.09 3.48 1.48 -1.26 -0.74 118.94 124.24 1pd5 s TRP 106 Ca 0.19 0.82 -0.04 0.00 -1.06 0.00 0.00 56.10 56.01 1pd5 s TRP 106 Cb -0.11 -2.49 -0.04 0.00 -1.16 0.00 0.00 33.47 29.67 1pd5 s TRP 106 CO 0.10 0.21 0.09 -1.12 -4.06 0.00 0.00 176.95 172.17 1pd5 s SER 107 N 0.51 5.92 0.07 -2.66 0.01 -0.91 -4.97 113.70 111.68 1pd5 s SER 107 Ca 0.24 0.32 -0.31 0.00 1.31 0.00 0.00 55.95 57.51 1pd5 s SER 107 Cb -0.15 -1.82 -0.07 0.00 0.21 0.00 0.00 66.02 64.20 1pd5 s SER 107 CO 0.09 0.38 1.41 -0.70 0.41 0.00 0.00 173.24 174.82 1pd5 s GLU 108 N -1.11 4.30 0.22 12.44 2.12 -1.26 -3.71 118.70 131.69 1pd5 s GLU 108 Ca 0.16 2.05 -0.31 0.00 0.36 0.00 0.00 54.97 57.23 1pd5 s GLU 108 Cb -0.12 -3.38 -0.11 0.00 0.26 0.00 0.00 34.13 30.78 1pd5 s GLU 108 CO 0.05 -0.50 1.59 -0.47 -0.54 0.00 0.00 175.26 175.40 1pd5 s TYR 109 N 1.64 2.94 0.03 5.30 5.04 -1.26 -4.86 117.35 126.18 1pd5 s TYR 109 Ca 0.65 0.65 0.05 0.00 -2.44 0.00 0.00 57.07 55.98 1pd5 s TYR 109 Cb -0.35 -4.00 -0.02 0.00 0.35 0.00 0.00 41.96 37.94 1pd5 s TYR 109 CO 0.29 -3.58 -0.14 -1.58 -1.34 0.00 0.00 175.55 169.21 1pd5 s HIS 110 N 0.70 1.21 -0.51 4.97 5.65 -1.26 -5.04 115.29 121.02 1pd5 s HIS 110 Ca 0.68 -0.34 0.24 0.00 0.25 0.00 0.00 55.06 55.89 1pd5 s HIS 110 Cb -0.46 -0.73 0.45 0.00 -1.18 0.00 0.00 32.58 30.66 1pd5 s HIS 110 CO 0.37 0.03 1.63 0.38 -0.65 0.00 0.00 174.74 176.50 1pd5 h ASP 111 N 5.04 0.00 -3.49 9.88 2.03 -2.00 -3.42 116.42 124.47 1pd5 h ASP 111 Ca -0.37 -0.00 -0.61 0.00 -0.73 0.00 0.00 57.03 55.31 1pd5 h ASP 111 Cb 1.18 0.00 -0.11 0.00 -0.83 0.00 0.00 39.33 39.56 1pd5 h ASP 111 CO 0.44 0.00 0.28 -0.62 -1.03 0.00 0.00 179.24 178.32 1pd5 s ASP 112 N -5.74 6.57 0.22 4.15 -1.08 -1.26 -4.93 116.67 114.60 1pd5 s ASP 112 Ca 0.08 0.52 -0.08 0.00 -0.52 0.00 0.00 52.55 52.54 1pd5 s ASP 112 Cb 0.07 -2.37 0.34 0.00 -1.46 0.00 0.00 42.92 39.50 1pd5 s ASP 112 CO 0.66 -0.57 1.71 0.15 0.52 0.00 0.00 175.17 177.64 1pd5 h PHE 113 N 8.19 0.31 -0.97 -5.34 3.57 -1.99 0.92 116.94 121.63 1pd5 h PHE 113 Ca -0.25 0.04 0.17 0.00 3.53 0.00 0.00 57.97 61.45 1pd5 h PHE 113 Cb 1.11 -0.04 -0.10 0.00 2.79 0.00 0.00 35.95 39.71 1pd5 h PHE 113 CO 0.77 0.01 0.57 0.00 -2.23 0.00 0.00 178.31 177.43 1pd5 h ARG 114 N 0.33 0.74 -0.28 1.11 3.08 -1.96 -0.64 114.38 116.76 1pd5 h ARG 114 Ca 0.34 -0.04 -0.19 0.00 0.07 0.00 0.00 59.98 60.16 1pd5 h ARG 114 Cb 0.51 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.39 1pd5 h ARG 114 CO -0.40 0.49 -0.55 1.96 -1.07 0.00 0.00 179.97 180.40 1pd5 h GLN 115 N 0.76 0.86 -0.13 0.04 1.08 -1.26 -2.29 115.11 114.18 1pd5 h GLN 115 Ca 0.54 -0.56 -0.03 0.00 -1.45 0.00 0.00 58.65 57.16 1pd5 h GLN 115 Cb 0.79 0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 28.29 1pd5 h GLN 115 CO -0.36 1.19 -0.02 0.35 -0.95 0.00 0.00 178.83 179.03 1pd5 h PHE 116 N 0.64 0.27 -0.96 2.96 3.57 -0.32 0.74 116.94 123.85 1pd5 h PHE 116 Ca 0.01 -0.06 0.16 0.00 3.53 0.00 0.00 57.97 61.61 1pd5 h PHE 116 Cb 1.17 -0.07 -0.10 0.00 2.79 0.00 0.00 35.95 39.74 1pd5 h PHE 116 CO 0.08 0.53 0.57 1.25 -2.23 0.00 0.00 178.31 178.50 1pd5 h LEU 117 N -0.06 0.75 -0.41 0.59 6.46 -1.18 0.84 115.31 122.30 1pd5 h LEU 117 Ca 0.03 0.08 -0.06 0.00 -0.12 0.00 0.00 57.88 57.82 1pd5 h LEU 117 Cb 0.43 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.30 1pd5 h LEU 117 CO 0.01 0.31 0.04 -0.74 -0.62 0.00 0.00 178.44 177.44 1pd5 h HIS 118 N 0.78 0.75 -0.00 1.25 2.76 -0.91 -1.22 115.15 118.55 1pd5 h HIS 118 Ca 0.53 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 58.59 1pd5 h HIS 118 Cb 0.74 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 29.49 1pd5 h HIS 118 CO -0.03 0.74 -0.01 0.82 -1.30 0.00 0.00 177.93 178.16 1pd5 h ILE 119 N 0.54 0.98 0.05 6.26 2.04 0.62 -2.99 117.51 125.02 1pd5 h ILE 119 Ca 0.12 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.01 1pd5 h ILE 119 Cb 0.42 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.43 1pd5 h ILE 119 CO 0.01 0.00 -0.30 0.22 0.00 0.00 0.00 178.15 178.08 1pd5 h TYR 120 N -0.01 -0.83 -0.92 1.37 3.20 0.63 0.79 116.97 121.20 1pd5 h TYR 120 Ca 0.00 0.02 0.16 0.00 3.14 0.00 0.00 58.73 62.06 1pd5 h TYR 120 Cb 0.02 0.36 -0.10 0.00 1.54 0.00 0.00 36.73 38.55 1pd5 h TYR 120 CO -0.09 -0.40 0.52 0.77 -1.64 0.00 0.00 178.16 177.32 1pd5 h SER 121 N -0.48 0.67 -0.26 -2.11 0.02 -1.31 0.53 113.55 110.61 1pd5 h SER 121 Ca 0.05 0.09 -0.15 0.00 -0.84 0.00 0.00 61.79 60.93 1pd5 h SER 121 Cb 0.55 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 1pd5 h SER 121 CO -0.22 0.28 -0.40 -0.61 -1.14 0.00 0.00 176.83 174.73 1pd5 h GLN 122 N 0.72 0.81 -0.40 3.45 5.75 -1.37 0.20 115.11 124.28 1pd5 h GLN 122 Ca 0.51 -0.43 -0.06 0.00 -0.15 0.00 0.00 58.65 58.52 1pd5 h GLN 122 Cb 0.71 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.26 1pd5 h GLN 122 CO -0.36 1.06 0.03 -0.44 -2.65 0.00 0.00 178.83 176.47 1pd5 h ASP 123 N 0.66 0.68 0.74 -0.69 3.32 -0.25 -2.45 116.42 118.43 1pd5 h ASP 123 Ca 0.05 -0.29 -0.04 0.00 0.02 0.00 0.00 57.03 56.78 1pd5 h ASP 123 Cb 0.96 -0.18 0.01 0.00 0.22 0.00 0.00 39.33 40.34 1pd5 h ASP 123 CO 0.09 0.80 -0.36 0.58 -1.72 0.00 0.00 179.24 178.63 1pd5 h VAL 124 N 0.53 0.23 0.00 -1.35 2.07 0.44 0.22 116.25 118.39 1pd5 h VAL 124 Ca 0.12 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1pd5 h VAL 124 Cb 0.44 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1pd5 h VAL 124 CO 0.02 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.61 1pd5 h ALA 125 N -0.85 1.00 0.00 1.67 0.00 -0.70 0.92 119.26 121.31 1pd5 h ALA 125 Ca -0.10 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.56 1pd5 h ALA 125 Cb 0.78 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 1pd5 h ALA 125 CO 0.17 0.00 -1.65 0.00 0.00 0.00 0.00 179.25 177.77 1pd5 n TYR 127 N -2.97 0.00 0.00 0.00 4.01 0.77 -4.74 117.16 114.23 1pd5 n TYR 127 Ca -0.15 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 1pd5 n TYR 127 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.01 1pd5 n TYR 127 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pd5 n GLY 128 N 0.50 1.05 1.32 2.72 0.00 0.13 -2.26 105.19 108.65 1pd5 n GLY 128 Ca 0.00 -1.10 0.06 0.00 0.00 0.00 0.00 46.02 44.98 1pd5 n GLY 128 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1pd5 n GLU 129 N 1.72 3.23 -1.89 1.61 0.00 -1.26 -4.93 120.64 119.12 1pd5 n GLU 129 Ca 0.00 -2.15 -0.42 0.00 0.00 0.00 0.00 57.16 54.59 1pd5 n GLU 129 Cb 0.00 -1.82 -0.03 0.00 0.00 0.00 0.00 31.44 29.59 1pd5 n GLU 129 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1pd5 s ASN 130 N -0.73 6.54 0.00 -1.84 3.84 -0.96 -4.79 114.94 117.01 1pd5 s ASN 130 Ca 0.38 2.68 0.26 0.00 0.21 0.00 0.00 52.86 56.39 1pd5 s ASN 130 Cb 0.26 -2.60 0.63 0.00 -0.55 0.00 0.00 41.25 39.00 1pd5 s ASN 130 CO 0.16 -0.86 1.49 -0.11 -2.79 0.00 0.00 177.10 175.00 1pd5 n LEU 131 N 3.96 1.43 -4.82 3.21 -0.00 -1.26 -4.84 117.00 114.69 1pd5 n LEU 131 Ca 0.14 -0.45 -0.33 0.00 -0.00 0.00 0.00 56.01 55.37 1pd5 n LEU 131 Cb 0.38 -0.07 -0.07 0.00 -0.00 0.00 0.00 43.42 43.66 1pd5 n LEU 131 CO 0.62 0.26 0.65 0.00 -0.00 0.00 0.00 177.39 178.92 1pd5 s ALA 132 N -2.37 3.04 0.16 1.96 0.00 -1.26 -4.92 121.76 118.37 1pd5 s ALA 132 Ca 0.26 0.42 -0.15 0.00 0.00 0.00 0.00 51.96 52.49 1pd5 s ALA 132 Cb 0.19 -3.16 0.04 0.00 0.00 0.00 0.00 23.12 20.20 1pd5 s ALA 132 CO 0.48 0.11 1.78 -0.92 0.00 0.00 0.00 175.76 177.21 1pd5 h TYR 133 N 1.97 0.65 -3.12 0.00 3.20 -1.91 -3.28 116.97 114.48 1pd5 h TYR 133 Ca -0.49 -0.01 -0.62 0.00 3.14 0.00 0.00 58.73 60.75 1pd5 h TYR 133 Cb 1.18 -0.21 -0.40 0.00 1.54 0.00 0.00 36.73 38.84 1pd5 h TYR 133 CO 0.62 0.46 -0.69 -0.06 -1.64 0.00 0.00 178.16 176.85 1pd5 s PHE 134 N -5.94 2.54 0.10 -3.82 0.40 -1.26 -1.16 117.98 108.83 1pd5 s PHE 134 Ca -0.13 -2.78 -0.24 0.00 -0.60 0.00 0.00 56.93 53.18 1pd5 s PHE 134 Cb 0.12 -2.27 -0.08 0.00 0.51 0.00 0.00 43.02 41.30 1pd5 s PHE 134 CO 0.75 -0.75 1.40 -1.35 0.70 0.00 0.00 175.22 175.97 1pd5 h PRO 135 N 6.47 -0.27 0.00 0.24 0.11 -1.73 -1.20 132.00 135.63 1pd5 h PRO 135 Ca -0.01 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1pd5 h PRO 135 Cb 0.90 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1pd5 h PRO 135 CO 0.58 -0.18 0.00 1.63 -0.21 0.00 0.00 178.00 179.82 1pd5 n LYS 136 N -4.66 0.54 -0.36 1.05 5.02 -1.26 -5.00 118.16 113.48 1pd5 n LYS 136 Ca -0.02 0.01 0.04 0.00 -2.02 0.00 0.00 58.31 56.32 1pd5 n LYS 136 Cb 0.25 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.73 1pd5 n LYS 136 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pd5 n GLY 137 N 0.12 -2.73 3.66 0.72 0.00 -0.46 -4.94 105.19 101.56 1pd5 n GLY 137 Ca 0.13 -1.35 -0.39 0.00 0.00 0.00 0.00 46.02 44.41 1pd5 n GLY 137 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pd5 s PHE 138 N -3.20 3.35 0.57 1.61 -0.00 -1.26 -4.82 117.98 114.23 1pd5 s PHE 138 Ca 0.00 0.67 0.01 0.00 -0.00 0.00 0.00 56.93 57.61 1pd5 s PHE 138 Cb 0.00 -2.62 0.04 0.00 -0.00 0.00 0.00 43.02 40.45 1pd5 s PHE 138 CO 0.00 -0.10 0.80 0.96 -0.00 0.00 0.00 175.22 176.88 1pd5 s ILE 139 N 1.62 2.61 -0.01 -4.49 -4.36 -1.26 -5.04 121.20 110.28 1pd5 s ILE 139 Ca 0.21 -0.65 0.12 0.00 -0.26 0.00 0.00 60.65 60.08 1pd5 s ILE 139 Cb -0.15 -2.96 -0.03 0.00 1.25 0.00 0.00 42.46 40.57 1pd5 s ILE 139 CO 0.09 0.00 1.43 -0.33 0.24 0.00 0.00 174.94 176.37 1pd5 h GLU 140 N 0.00 0.00 -2.26 0.37 5.08 -2.01 -3.37 114.58 112.39 1pd5 h GLU 140 Ca -0.42 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.26 1pd5 h GLU 140 Cb 1.30 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 30.19 1pd5 h GLU 140 CO 0.51 0.67 0.08 0.27 -1.00 0.00 0.00 179.01 179.54 1pd5 n ASN 141 N -3.33 5.73 -4.48 1.42 6.94 -1.26 -5.01 115.26 115.27 1pd5 n ASN 141 Ca 0.01 -3.69 -0.33 0.00 -0.02 0.00 0.00 54.58 50.55 1pd5 n ASN 141 Cb 0.78 -0.82 -0.13 0.00 -2.36 0.00 0.00 39.78 37.25 1pd5 n ASN 141 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1pd5 s MET 142 N -3.85 2.61 0.22 -3.83 -1.94 -1.26 -0.06 119.30 111.19 1pd5 s MET 142 Ca 0.45 -0.68 0.08 0.00 -1.71 0.00 0.00 55.69 53.83 1pd5 s MET 142 Cb 0.25 -2.42 -0.04 0.00 2.01 0.00 0.00 34.83 34.62 1pd5 s MET 142 CO -0.14 0.59 -0.00 -0.59 -0.01 0.00 0.00 175.02 174.87 1pd5 s PHE 143 N -0.64 2.78 -0.07 -0.03 -0.12 -0.62 -4.71 117.98 114.57 1pd5 s PHE 143 Ca 0.10 -0.18 0.01 0.00 -0.05 0.00 0.00 56.93 56.81 1pd5 s PHE 143 Cb -0.11 -1.30 -0.03 0.00 -0.63 0.00 0.00 43.02 40.95 1pd5 s PHE 143 CO 0.01 0.56 -0.09 -0.06 -0.05 0.00 0.00 175.22 175.59 1pd5 s PHE 144 N -1.98 2.88 -0.28 3.49 0.40 0.00 0.58 117.98 123.06 1pd5 s PHE 144 Ca 0.29 -0.07 -0.01 0.00 -0.60 0.00 0.00 56.93 56.55 1pd5 s PHE 144 Cb -0.08 -1.71 0.09 0.00 0.51 0.00 0.00 43.02 41.83 1pd5 s PHE 144 CO 0.19 0.26 0.07 0.08 0.70 0.00 0.00 175.22 176.51 1pd5 s VAL 145 N -0.69 0.98 -0.17 -0.44 1.01 0.80 0.27 120.40 122.17 1pd5 s VAL 145 Ca 0.10 -1.30 -0.18 0.00 0.00 0.00 0.00 61.98 60.61 1pd5 s VAL 145 Cb -0.11 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 1pd5 s VAL 145 CO 0.01 -0.53 0.47 -0.44 0.00 0.00 0.00 175.10 174.61 1pd5 s SER 146 N 1.59 6.58 -0.29 3.32 0.01 0.37 -3.23 113.70 122.04 1pd5 s SER 146 Ca 0.06 0.69 -0.27 0.00 1.31 0.00 0.00 55.95 57.74 1pd5 s SER 146 Cb -0.17 -2.27 0.01 0.00 0.21 0.00 0.00 66.02 63.79 1pd5 s SER 146 CO -0.19 -0.07 0.97 0.00 0.41 0.00 0.00 173.24 174.36 1pd5 s ALA 147 N 1.11 3.56 -0.56 1.44 0.00 -1.26 0.13 121.76 126.18 1pd5 s ALA 147 Ca 0.23 -0.10 0.05 0.00 0.00 0.00 0.00 51.96 52.15 1pd5 s ALA 147 Cb -0.15 -3.52 0.20 0.00 0.00 0.00 0.00 23.12 19.65 1pd5 s ALA 147 CO 0.09 -1.27 0.51 -1.71 0.00 0.00 0.00 175.76 173.38 1pd5 n ASN 148 N 6.51 1.74 -0.63 0.00 4.05 0.17 -4.93 115.26 122.16 1pd5 n ASN 148 Ca 0.09 -2.94 0.11 0.00 0.45 0.00 0.00 54.58 52.29 1pd5 n ASN 148 Cb 0.47 -0.66 0.35 0.00 1.23 0.00 0.00 39.78 41.17 1pd5 n ASN 148 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 1pd5 n PRO 149 N 1.86 1.83 0.02 1.20 -0.04 -1.26 -2.81 135.00 135.80 1pd5 n PRO 149 Ca 0.25 -1.25 -0.08 0.00 -0.04 0.00 0.00 63.50 62.38 1pd5 n PRO 149 Cb 0.43 -1.41 -0.13 0.00 -0.04 0.00 0.00 33.50 32.35 1pd5 n PRO 149 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1pd5 h TRP 150 N 2.54 0.01 -3.60 0.54 6.55 -1.93 -3.40 115.95 116.65 1pd5 h TRP 150 Ca 0.00 -0.01 -0.68 0.00 0.95 0.00 0.00 58.89 59.15 1pd5 h TRP 150 Cb 0.56 -0.00 -0.29 0.00 -0.86 0.00 0.00 29.16 28.57 1pd5 h TRP 150 CO 0.12 1.01 -0.67 0.08 -1.05 0.00 0.00 178.44 177.93 1pd5 s VAL 151 N -2.65 3.49 -0.62 1.49 1.01 -1.16 -4.81 120.40 117.15 1pd5 s VAL 151 Ca -0.02 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 60.97 1pd5 s VAL 151 Cb 0.09 -2.84 -0.08 0.00 0.00 0.00 0.00 36.38 33.55 1pd5 s VAL 151 CO 0.82 0.06 2.08 -0.24 0.00 0.00 0.00 175.10 177.82 1pd5 n SER 152 N 4.77 4.14 -4.73 3.32 2.88 -1.26 -1.16 113.62 121.58 1pd5 n SER 152 Ca -0.15 -2.22 -0.41 0.00 -1.33 0.00 0.00 58.87 54.76 1pd5 n SER 152 Cb 0.47 -0.98 -0.03 0.00 -0.75 0.00 0.00 64.21 62.92 1pd5 n SER 152 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1pd5 s PHE 153 N 3.05 3.46 0.50 0.66 -0.12 -1.26 -4.94 117.98 119.32 1pd5 s PHE 153 Ca 0.37 1.40 0.17 0.00 -0.05 0.00 0.00 56.93 58.82 1pd5 s PHE 153 Cb 0.12 -3.40 1.22 0.00 -0.63 0.00 0.00 43.02 40.33 1pd5 s PHE 153 CO -0.02 -1.13 2.07 1.15 -0.05 0.00 0.00 175.22 177.24 1pd5 h THR 154 N 4.06 0.92 -2.78 -4.49 2.02 -1.99 -3.43 112.91 107.23 1pd5 h THR 154 Ca -0.43 -0.04 -0.13 0.00 0.77 0.00 0.00 66.41 66.58 1pd5 h THR 154 Cb 1.21 0.78 -0.25 0.00 -1.74 0.00 0.00 68.15 68.16 1pd5 h THR 154 CO 0.77 0.02 -0.28 -0.55 0.37 0.00 0.00 175.52 175.86 1pd5 s SER 155 N -6.66 -0.42 -0.03 4.18 0.15 -1.26 -4.80 113.70 104.86 1pd5 s SER 155 Ca -0.06 0.79 0.02 0.00 0.70 0.00 0.00 55.95 57.41 1pd5 s SER 155 Cb 0.18 0.78 0.01 0.00 -1.71 0.00 0.00 66.02 65.27 1pd5 s SER 155 CO 0.71 -0.15 -0.09 0.12 1.20 0.00 0.00 173.24 175.03 1pd5 s PHE 156 N 0.46 1.01 -0.03 3.44 5.36 -1.26 -5.13 117.98 121.83 1pd5 s PHE 156 Ca -0.02 -0.27 -0.02 0.00 -0.96 0.00 0.00 56.93 55.66 1pd5 s PHE 156 Cb -0.04 -0.73 0.02 0.00 -0.34 0.00 0.00 43.02 41.93 1pd5 s PHE 156 CO -0.02 -0.13 0.07 -0.51 -1.46 0.00 0.00 175.22 173.17 1pd5 s ASP 157 N 0.30 -0.04 -0.19 6.13 -0.00 -1.26 -4.75 116.67 116.86 1pd5 s ASP 157 Ca -0.05 0.14 -0.10 0.00 -0.00 0.00 0.00 52.55 52.54 1pd5 s ASP 157 Cb -0.10 0.09 -0.05 0.00 -0.00 0.00 0.00 42.92 42.86 1pd5 s ASP 157 CO 0.01 -0.08 0.16 -0.22 -0.00 0.00 0.00 175.17 175.03 1pd5 s LEU 158 N 0.57 4.22 -0.60 1.23 0.20 -1.26 -5.00 118.68 118.04 1pd5 s LEU 158 Ca -0.04 0.28 0.06 0.00 0.69 0.00 0.00 54.13 55.11 1pd5 s LEU 158 Cb -0.06 -2.13 0.21 0.00 -0.43 0.00 0.00 46.19 43.78 1pd5 s LEU 158 CO -0.02 0.17 0.58 -3.20 -0.29 0.00 0.00 176.35 173.59 1pd5 n ASN 159 N 3.48 2.48 -4.65 3.68 4.05 -1.26 -4.99 115.26 118.05 1pd5 n ASN 159 Ca -0.15 -3.13 -0.50 0.00 0.45 0.00 0.00 54.58 51.25 1pd5 n ASN 159 Cb 0.52 -0.68 -0.05 0.00 1.23 0.00 0.00 39.78 40.80 1pd5 n ASN 159 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 177.26 174.73 1pd5 n VAL 160 N 1.56 0.10 -0.03 3.44 0.31 -1.26 -4.96 118.33 117.49 1pd5 n VAL 160 Ca 0.25 -0.02 -0.13 0.00 -0.01 0.00 0.00 64.34 64.43 1pd5 n VAL 160 Cb 0.41 -1.28 -0.10 0.00 -0.91 0.00 0.00 33.84 31.96 1pd5 n VAL 160 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1pd5 h ALA 161 N 5.93 0.04 -3.47 3.52 0.00 -2.06 -3.40 119.26 119.82 1pd5 h ALA 161 Ca -0.47 -0.30 -0.68 0.00 0.00 0.00 0.00 54.91 53.47 1pd5 h ALA 161 Cb 1.29 -0.01 -0.35 0.00 0.00 0.00 0.00 17.79 18.72 1pd5 h ALA 161 CO 0.86 -0.14 -0.67 1.21 0.00 0.00 0.00 179.25 180.51 1pd5 s ASN 162 N -5.86 4.93 -0.35 0.00 3.04 -1.26 -4.96 114.94 110.47 1pd5 s ASN 162 Ca -0.16 -1.70 0.01 0.00 0.04 0.00 0.00 52.86 51.04 1pd5 s ASN 162 Cb 0.02 -1.71 0.35 0.00 -1.54 0.00 0.00 41.25 38.36 1pd5 s ASN 162 CO 0.70 -0.36 1.81 1.15 -3.04 0.00 0.00 177.10 177.35 1pd5 n MET 163 N 4.51 1.92 -2.34 0.43 0.00 -1.26 -4.82 117.12 115.56 1pd5 n MET 163 Ca -0.06 -1.96 -0.42 0.00 0.00 0.00 0.00 57.70 55.25 1pd5 n MET 163 Cb 0.42 -1.77 -0.03 0.00 0.00 0.00 0.00 33.22 31.85 1pd5 n MET 163 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1pd5 s ASP 164 N -0.40 6.93 -0.17 3.17 1.01 -1.26 -3.77 116.67 122.17 1pd5 s ASP 164 Ca 0.38 1.90 0.00 0.00 0.71 0.00 0.00 52.55 55.53 1pd5 s ASP 164 Cb 0.31 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.69 1pd5 s ASP 164 CO 0.03 -0.71 0.00 0.59 0.21 0.00 0.00 175.17 175.29 1pd5 n ASN 165 N 5.87 -5.36 -4.56 0.27 3.02 -1.26 -4.83 115.26 108.41 1pd5 n ASN 165 Ca 0.13 0.04 -0.39 0.00 -0.03 0.00 0.00 54.58 54.33 1pd5 n ASN 165 Cb 0.45 -3.30 -0.03 0.00 -0.61 0.00 0.00 39.78 36.29 1pd5 n ASN 165 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1pd5 s PHE 166 N -1.04 2.43 -0.69 3.10 5.36 -1.25 -4.50 117.98 121.39 1pd5 s PHE 166 Ca 0.00 -0.67 0.14 0.00 -0.96 0.00 0.00 56.93 55.43 1pd5 s PHE 166 Cb 0.00 -4.59 -0.14 0.00 -0.34 0.00 0.00 43.02 37.96 1pd5 s PHE 166 CO 0.00 -1.87 0.59 1.19 -1.46 0.00 0.00 175.22 173.67 1pd5 n PHE 167 N 9.78 0.00 -2.79 10.12 3.72 -1.26 -4.46 117.46 132.56 1pd5 n PHE 167 Ca 0.36 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.35 1pd5 n PHE 167 Cb 0.50 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.00 1pd5 n PHE 167 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1pd5 s ALA 168 N -2.25 3.20 0.84 4.37 0.00 -1.26 -4.78 121.76 121.89 1pd5 s ALA 168 Ca 0.06 0.44 -0.11 0.00 0.00 0.00 0.00 51.96 52.35 1pd5 s ALA 168 Cb 0.10 -3.25 0.10 0.00 0.00 0.00 0.00 23.12 20.08 1pd5 s ALA 168 CO 0.55 -0.20 1.10 -1.25 0.00 0.00 0.00 175.76 175.96 1pd5 s PRO 169 N 0.94 1.66 -0.10 0.00 0.04 -1.26 -4.91 135.00 131.37 1pd5 s PRO 169 Ca 0.48 1.15 -0.03 0.00 0.04 0.00 0.00 61.00 62.65 1pd5 s PRO 169 Cb -0.20 -1.83 0.04 0.00 0.04 0.00 0.00 34.50 32.55 1pd5 s PRO 169 CO 0.26 -2.06 0.05 0.08 0.04 0.00 0.00 177.00 175.37 1pd5 s VAL 170 N -2.84 0.08 0.00 -0.36 1.01 -1.11 -0.82 120.40 116.36 1pd5 s VAL 170 Ca 0.63 0.08 -0.01 0.00 0.00 0.00 0.00 61.98 62.67 1pd5 s VAL 170 Cb -0.19 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 1pd5 s VAL 170 CO 0.57 0.02 0.14 -0.36 0.00 0.00 0.00 175.10 175.48 1pd5 s PHE 171 N 2.08 3.43 -0.10 5.22 0.40 0.78 -1.42 117.98 128.38 1pd5 s PHE 171 Ca 0.03 0.28 0.01 0.00 -0.60 0.00 0.00 56.93 56.65 1pd5 s PHE 171 Cb -0.14 -1.78 0.02 0.00 0.51 0.00 0.00 43.02 41.63 1pd5 s PHE 171 CO -0.06 0.60 -0.10 0.99 0.70 0.00 0.00 175.22 177.35 1pd5 s THR 172 N -1.29 1.13 -0.14 0.64 2.01 0.57 0.14 115.64 118.69 1pd5 s THR 172 Ca 0.26 -0.40 -0.10 0.00 0.31 0.00 0.00 61.69 61.76 1pd5 s THR 172 Cb -0.12 -1.08 -0.05 0.00 0.01 0.00 0.00 72.50 71.26 1pd5 s THR 172 CO 0.18 0.37 0.19 -0.04 -0.69 0.00 0.00 174.62 174.63 1pd5 s MET 173 N 1.23 3.87 0.45 4.92 -1.94 0.34 -1.11 119.30 127.07 1pd5 s MET 173 Ca -0.04 -0.06 0.05 0.00 -1.71 0.00 0.00 55.69 53.94 1pd5 s MET 173 Cb -0.14 -3.31 0.05 0.00 2.01 0.00 0.00 34.83 33.44 1pd5 s MET 173 CO -0.03 0.52 0.41 0.41 -0.01 0.00 0.00 175.02 176.32 1pd5 n GLY 174 N 2.69 2.60 3.63 -0.03 0.00 -0.15 -0.66 105.19 113.28 1pd5 n GLY 174 Ca -0.17 -2.26 -0.43 0.00 0.00 0.00 0.00 46.02 43.17 1pd5 n GLY 174 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1pd5 s LYS 175 N -3.91 4.05 0.95 1.61 2.20 -0.31 -4.55 119.74 119.78 1pd5 s LYS 175 Ca 0.31 1.00 -0.12 0.00 -0.36 0.00 0.00 55.97 56.80 1pd5 s LYS 175 Cb -0.02 -3.73 0.16 0.00 -1.51 0.00 0.00 37.83 32.72 1pd5 s LYS 175 CO 0.20 -0.85 1.09 1.52 -0.36 0.00 0.00 175.35 176.94 1pd5 s TYR 176 N 3.51 2.12 -0.13 4.03 -0.85 -1.26 -4.13 117.35 120.64 1pd5 s TYR 176 Ca 0.43 1.23 -0.30 0.00 -0.52 0.00 0.00 57.07 57.90 1pd5 s TYR 176 Cb -0.13 -3.18 0.13 0.00 0.38 0.00 0.00 41.96 39.15 1pd5 s TYR 176 CO 0.14 -2.69 1.01 1.52 -1.52 0.00 0.00 175.55 174.02 1pd5 s TYR 177 N -2.87 -0.32 0.20 -3.49 -0.85 -0.34 -4.97 117.35 104.71 1pd5 s TYR 177 Ca 0.65 0.45 0.05 0.00 -0.52 0.00 0.00 57.07 57.69 1pd5 s TYR 177 Cb -0.19 0.48 -0.03 0.00 0.38 0.00 0.00 41.96 42.59 1pd5 s TYR 177 CO 0.58 -0.36 0.26 -0.08 -1.52 0.00 0.00 175.55 174.43 1pd5 s THR 178 N -1.71 4.94 -0.47 -3.49 -1.32 -1.26 0.10 115.64 112.44 1pd5 s THR 178 Ca 0.02 -1.02 0.06 0.00 -1.21 0.00 0.00 61.69 59.54 1pd5 s THR 178 Cb -0.01 -3.61 0.23 0.00 -1.51 0.00 0.00 72.50 67.61 1pd5 s THR 178 CO -0.02 -0.22 0.78 1.67 -2.21 0.00 0.00 174.62 174.61 1pd5 n GLN 179 N -0.91 0.72 0.00 7.08 7.27 0.16 -4.85 117.38 126.85 1pd5 n GLN 179 Ca -0.08 -2.13 0.00 0.00 0.07 0.00 0.00 57.00 54.86 1pd5 n GLN 179 Cb 0.56 -1.42 0.00 0.00 2.41 0.00 0.00 30.24 31.79 1pd5 n GLN 179 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1pd5 n GLY 180 N 1.79 3.81 0.07 1.69 0.00 -1.26 -3.34 105.19 107.95 1pd5 n GLY 180 Ca 0.13 0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1pd5 n GLY 180 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pd5 n ASP 181 N 6.19 0.72 -4.77 1.61 8.00 -1.26 -4.78 116.55 122.26 1pd5 n ASP 181 Ca 0.00 0.12 -0.37 0.00 0.71 0.00 0.00 54.79 55.25 1pd5 n ASP 181 Cb 0.00 0.42 -0.01 0.00 -0.02 0.00 0.00 41.12 41.51 1pd5 n ASP 181 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1pd5 s LYS 182 N -3.25 3.83 -0.12 -1.24 -0.14 -1.21 -5.01 119.74 112.59 1pd5 s LYS 182 Ca 0.03 1.75 0.02 0.00 -1.36 0.00 0.00 55.97 56.41 1pd5 s LYS 182 Cb 0.12 -2.44 -0.00 0.00 -1.68 0.00 0.00 37.83 33.83 1pd5 s LYS 182 CO 0.76 -0.49 -0.19 0.08 -0.76 0.00 0.00 175.35 174.76 1pd5 s VAL 183 N -1.55 2.48 0.10 3.17 1.01 -1.26 0.39 120.40 124.74 1pd5 s VAL 183 Ca 0.62 -0.86 0.08 0.00 0.00 0.00 0.00 61.98 61.82 1pd5 s VAL 183 Cb -0.28 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 1pd5 s VAL 183 CO 0.34 0.54 -0.20 -0.76 0.00 0.00 0.00 175.10 175.02 1pd5 s LEU 184 N 0.48 2.30 -0.08 3.92 1.43 0.12 -2.00 118.68 124.85 1pd5 s LEU 184 Ca -0.13 -0.69 0.03 0.00 -1.03 0.00 0.00 54.13 52.31 1pd5 s LEU 184 Cb -0.17 -0.84 0.01 0.00 0.03 0.00 0.00 46.19 45.22 1pd5 s LEU 184 CO 0.05 0.04 -0.15 -0.32 0.23 0.00 0.00 176.35 176.20 1pd5 s MET 185 N -1.93 2.05 -0.17 1.70 -2.45 -0.65 -1.19 119.30 116.65 1pd5 s MET 185 Ca 0.06 -0.53 -0.37 0.00 -1.25 0.00 0.00 55.69 53.60 1pd5 s MET 185 Cb -0.10 -1.66 -0.13 0.00 1.25 0.00 0.00 34.83 34.19 1pd5 s MET 185 CO 0.04 0.05 1.83 -2.30 1.05 0.00 0.00 175.02 175.70 1pd5 n PRO 186 N 3.80 1.75 -4.04 4.11 -0.02 -1.26 -1.33 135.00 138.02 1pd5 n PRO 186 Ca -0.22 0.64 -0.29 0.00 -2.02 0.00 0.00 63.50 61.62 1pd5 n PRO 186 Cb 0.52 -2.43 -0.17 0.00 -0.02 0.00 0.00 33.50 31.41 1pd5 n PRO 186 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1pd5 s LEU 187 N 3.93 1.57 -0.15 2.45 2.96 0.13 -0.98 118.68 128.59 1pd5 s LEU 187 Ca 0.95 -0.44 -0.07 0.00 -0.22 0.00 0.00 54.13 54.36 1pd5 s LEU 187 Cb -0.85 -1.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 1pd5 s LEU 187 CO 0.58 -0.06 0.11 0.00 -1.32 0.00 0.00 176.35 175.65 1pd5 s ALA 188 N 1.49 3.69 -0.17 5.97 0.00 -0.26 0.51 121.76 132.98 1pd5 s ALA 188 Ca 0.04 -0.69 -0.00 0.00 0.00 0.00 0.00 51.96 51.31 1pd5 s ALA 188 Cb -0.13 -1.97 0.04 0.00 0.00 0.00 0.00 23.12 21.07 1pd5 s ALA 188 CO -0.09 0.42 -0.06 -1.50 0.00 0.00 0.00 175.76 174.53 1pd5 s ILE 189 N -0.40 1.16 -0.17 0.00 1.10 -0.80 0.21 121.20 122.30 1pd5 s ILE 189 Ca 0.11 -0.68 -0.13 0.00 -0.51 0.00 0.00 60.65 59.43 1pd5 s ILE 189 Cb -0.12 -1.34 -0.05 0.00 0.15 0.00 0.00 42.46 41.11 1pd5 s ILE 189 CO 0.01 0.12 0.28 -1.58 -2.11 0.00 0.00 174.94 171.66 1pd5 s GLN 190 N 1.61 4.24 0.22 3.50 -0.44 -0.51 -2.65 119.66 125.62 1pd5 s GLN 190 Ca 0.00 0.05 0.00 0.00 -2.50 0.00 0.00 55.36 52.92 1pd5 s GLN 190 Cb -0.15 -3.44 -0.04 0.00 -1.64 0.00 0.00 33.01 27.73 1pd5 s GLN 190 CO -0.08 0.21 0.10 0.14 0.50 0.00 0.00 175.29 176.17 1pd5 s VAL 191 N 0.57 0.27 -0.12 1.34 -7.23 0.52 -2.77 120.40 112.98 1pd5 s VAL 191 Ca 0.15 -1.99 -0.02 0.00 -1.81 0.00 0.00 61.98 58.31 1pd5 s VAL 191 Cb -0.13 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 1pd5 s VAL 191 CO 0.04 -0.07 -0.04 -2.28 -0.31 0.00 0.00 175.10 172.44 1pd5 s HIS 192 N -3.96 3.03 0.41 2.82 2.46 -1.26 -0.69 115.29 118.09 1pd5 s HIS 192 Ca 0.36 -0.11 0.38 0.00 0.47 0.00 0.00 55.06 56.16 1pd5 s HIS 192 Cb 0.07 -1.85 1.87 0.00 -0.13 0.00 0.00 32.58 32.54 1pd5 s HIS 192 CO 0.11 0.17 2.18 1.25 -2.47 0.00 0.00 174.74 175.98 1pd5 h HIS 193 N 5.98 0.00 -0.43 3.88 2.76 -1.65 -2.76 115.15 122.93 1pd5 h HIS 193 Ca -0.40 0.00 0.13 0.00 -2.20 0.00 0.00 60.37 57.90 1pd5 h HIS 193 Cb 1.19 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.13 1pd5 h HIS 193 CO 0.56 0.02 0.37 0.00 -1.30 0.00 0.00 177.93 177.57 1pd5 h ALA 194 N 1.98 2.27 0.00 5.26 0.00 -1.81 -3.21 119.26 123.75 1pd5 h ALA 194 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1pd5 h ALA 194 Cb 0.25 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1pd5 h ALA 194 CO 0.00 -0.59 -0.02 1.33 0.00 0.00 0.00 179.25 179.97 1pd5 n VAL 195 N -4.09 0.00 -3.70 0.00 0.24 -1.06 -4.21 118.33 105.51 1pd5 n VAL 195 Ca 0.08 -0.28 -0.19 0.00 -2.04 0.00 0.00 64.34 61.91 1pd5 n VAL 195 Cb 0.56 0.97 -0.17 0.00 -1.47 0.00 0.00 33.84 33.73 1pd5 n VAL 195 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1pd5 s ASP 197 N 1.90 5.16 0.22 0.00 -0.00 -1.26 -4.15 116.67 118.53 1pd5 s ASP 197 Ca 0.01 -0.03 -0.08 0.00 -0.00 0.00 0.00 52.55 52.45 1pd5 s ASP 197 Cb -0.12 -0.79 0.28 0.00 -0.00 0.00 0.00 42.92 42.28 1pd5 s ASP 197 CO -0.03 -1.24 1.80 1.23 -0.00 0.00 0.00 175.17 176.93 1pd5 h GLY 198 N -0.02 1.02 -0.39 0.21 0.00 -1.99 -1.78 103.07 100.11 1pd5 h GLY 198 Ca -0.42 -0.25 0.04 0.00 0.00 0.00 0.00 47.33 46.70 1pd5 h GLY 198 CO 0.51 0.13 -0.23 0.33 0.00 0.00 0.00 176.54 177.28 1pd5 n PHE 199 N -4.81 -0.17 -0.30 5.60 -0.00 -1.26 0.17 117.46 116.69 1pd5 n PHE 199 Ca 0.09 0.49 0.07 0.00 -0.00 0.00 0.00 57.45 58.10 1pd5 n PHE 199 Cb 0.21 -0.51 0.22 0.00 -0.00 0.00 0.00 39.48 39.39 1pd5 n PHE 199 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1pd5 h HIS 200 N 0.00 0.80 -0.26 -5.13 -0.00 -1.73 0.69 115.15 109.52 1pd5 h HIS 200 Ca 0.06 0.03 -0.16 0.00 -0.00 0.00 0.00 60.37 60.31 1pd5 h HIS 200 Cb 0.16 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.34 1pd5 h HIS 200 CO -0.92 0.21 -0.47 0.28 -0.00 0.00 0.00 177.93 177.03 1pd5 h VAL 201 N 0.66 1.30 0.00 2.45 2.07 -0.28 -2.40 116.25 120.04 1pd5 h VAL 201 Ca 0.46 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 66.31 1pd5 h VAL 201 Cb 0.62 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1pd5 h VAL 201 CO -0.35 0.53 -0.17 1.23 0.02 0.00 0.00 177.57 178.83 1pd5 h GLY 202 N 0.95 0.00 1.46 2.17 0.00 0.27 -0.09 103.07 107.82 1pd5 h GLY 202 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.24 1pd5 h GLY 202 CO 0.10 0.00 -0.31 -0.09 0.00 0.00 0.00 176.54 176.23 1pd5 h ARG 203 N 0.00 0.62 0.10 4.80 2.43 0.46 -3.17 114.38 119.62 1pd5 h ARG 203 Ca 0.00 -0.27 -0.25 0.00 -0.81 0.00 0.00 59.98 58.65 1pd5 h ARG 203 Cb 0.88 -0.02 0.02 0.00 -0.42 0.00 0.00 29.97 30.44 1pd5 h ARG 203 CO 0.00 0.85 -1.02 1.98 -1.51 0.00 0.00 179.97 180.27 1pd5 h MET 204 N 0.53 0.52 -0.05 0.20 4.05 -0.90 0.25 114.93 119.53 1pd5 h MET 204 Ca 0.06 -0.69 -0.19 0.00 -0.28 0.00 0.00 59.70 58.60 1pd5 h MET 204 Cb 0.80 0.23 -0.01 0.00 -0.80 0.00 0.00 31.60 31.82 1pd5 h MET 204 CO 0.07 1.29 -0.78 -0.07 0.23 0.00 0.00 176.91 177.65 1pd5 h LEU 205 N 0.07 0.42 -0.58 3.39 3.38 -1.18 0.48 115.31 121.29 1pd5 h LEU 205 Ca -0.16 -0.30 -0.12 0.00 0.09 0.00 0.00 57.88 57.40 1pd5 h LEU 205 Cb 1.73 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 42.34 1pd5 h LEU 205 CO 0.20 1.05 -0.13 0.78 0.09 0.00 0.00 178.44 180.43 1pd5 h ASN 206 N 0.22 1.01 -0.59 -0.43 2.35 -1.56 -1.95 115.58 114.63 1pd5 h ASN 206 Ca -0.04 -0.34 0.02 0.00 -0.55 0.00 0.00 56.30 55.39 1pd5 h ASN 206 Cb 1.37 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 39.43 1pd5 h ASN 206 CO 0.13 1.13 0.37 -0.33 -1.65 0.00 0.00 177.43 177.08 1pd5 h GLU 207 N 0.89 0.73 -0.87 0.81 5.08 -0.52 -2.92 114.58 117.78 1pd5 h GLU 207 Ca 0.13 -0.04 0.18 0.00 -1.00 0.00 0.00 59.36 58.63 1pd5 h GLU 207 Cb 0.69 -0.16 -0.11 0.00 0.50 0.00 0.00 28.75 29.67 1pd5 h GLU 207 CO 0.05 0.48 0.42 1.25 -1.00 0.00 0.00 179.01 180.21 1pd5 h LEU 208 N 0.75 0.44 -0.44 1.33 5.85 0.14 0.72 115.31 124.10 1pd5 h LEU 208 Ca 0.23 0.12 -0.18 0.00 0.84 0.00 0.00 57.88 58.89 1pd5 h LEU 208 Cb -0.03 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1pd5 h LEU 208 CO -0.07 0.12 -0.76 -0.61 -0.34 0.00 0.00 178.44 176.78 1pd5 h GLN 209 N 0.52 0.22 0.13 1.25 5.75 -1.17 -0.51 115.11 121.31 1pd5 h GLN 209 Ca 0.51 -0.20 -0.29 0.00 -0.15 0.00 0.00 58.65 58.52 1pd5 h GLN 209 Cb 0.85 0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.44 1pd5 h GLN 209 CO -0.44 0.88 -1.46 0.37 -2.65 0.00 0.00 178.83 175.53 1pd5 h GLN 210 N 0.14 0.28 -0.96 1.69 4.15 -1.28 -3.09 115.11 116.05 1pd5 h GLN 210 Ca -0.03 -0.49 0.01 0.00 0.77 0.00 0.00 58.65 58.92 1pd5 h GLN 210 Cb 1.33 0.18 -0.05 0.00 0.21 0.00 0.00 27.48 29.15 1pd5 h GLN 210 CO 0.12 1.23 0.63 1.88 -1.93 0.00 0.00 178.83 180.76 1pd5 h TYR 211 N -0.21 1.20 0.00 3.99 -1.99 0.55 -2.05 116.97 118.46 1pd5 h TYR 211 Ca -0.30 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.45 1pd5 h TYR 211 Cb 1.84 -0.41 0.00 0.00 2.00 0.00 0.00 36.73 40.16 1pd5 h TYR 211 CO 0.12 0.75 0.05 0.00 -0.00 0.00 0.00 178.16 179.08 1pd5 n ASP 213 N -2.12 4.21 -0.36 0.00 8.00 -0.83 -3.30 116.55 122.14 1pd5 n ASP 213 Ca -0.01 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.63 1pd5 n ASP 213 Cb 0.08 0.66 0.51 0.00 -0.02 0.00 0.00 41.12 42.34 1pd5 n ASP 213 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1pd5 n GLU 214 N -2.05 1.31 -1.85 -1.24 1.02 -0.86 -4.94 120.64 112.03 1pd5 n GLU 214 Ca -0.05 -0.72 -0.42 0.00 -0.02 0.00 0.00 57.16 55.95 1pd5 n GLU 214 Cb 0.53 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.44 1pd5 n GLU 214 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 1pd5 s TRP 215 N -2.19 2.91 0.00 -0.32 -0.00 -0.96 -5.07 118.94 113.32 1pd5 s TRP 215 Ca 0.34 0.68 0.00 0.00 -0.00 0.00 0.00 56.10 57.12 1pd5 s TRP 215 Cb 0.20 -4.01 0.00 0.00 -0.00 0.00 0.00 33.47 29.67 1pd5 s TRP 215 CO 0.40 -3.56 0.13 1.04 -0.00 0.00 0.00 176.95 174.97