#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pd5 s GLY 7 N 0.00 1.69 0.32 3.41 0.00 -1.26 -4.96 107.32 106.52 1pd5 s GLY 7 Ca 0.00 -0.11 -0.16 0.00 0.00 0.00 0.00 44.72 44.45 1pd5 s GLY 7 CO 0.00 0.15 0.69 -2.52 0.00 0.00 0.00 173.10 171.42 1pd5 s TYR 8 N -3.06 0.12 0.11 1.90 -0.85 -1.26 -1.19 117.35 113.11 1pd5 s TYR 8 Ca 0.54 -0.62 0.03 0.00 -0.52 0.00 0.00 57.07 56.50 1pd5 s TYR 8 Cb -0.11 0.61 -0.04 0.00 0.38 0.00 0.00 41.96 42.81 1pd5 s TYR 8 CO 0.50 -1.32 -0.09 -0.08 -1.52 0.00 0.00 175.55 173.04 1pd5 s THR 9 N -3.26 0.92 -0.10 -3.49 -1.32 0.07 -4.83 115.64 103.65 1pd5 s THR 9 Ca 0.16 -1.77 -0.01 0.00 -1.21 0.00 0.00 61.69 58.86 1pd5 s THR 9 Cb -0.04 -1.50 -0.03 0.00 -1.51 0.00 0.00 72.50 69.41 1pd5 s THR 9 CO 0.10 -0.66 -0.04 -0.89 -2.21 0.00 0.00 174.62 170.93 1pd5 s THR 10 N -2.83 3.96 -0.16 5.08 2.01 -1.26 -1.02 115.64 121.42 1pd5 s THR 10 Ca 0.09 -0.37 -0.23 0.00 0.31 0.00 0.00 61.69 61.48 1pd5 s THR 10 Cb -0.00 -2.66 -0.02 0.00 0.01 0.00 0.00 72.50 69.82 1pd5 s THR 10 CO -0.01 0.57 0.73 -0.69 -0.69 0.00 0.00 174.62 174.53 1pd5 s VAL 11 N -0.52 4.97 -0.59 3.82 1.01 -0.92 -4.95 120.40 123.22 1pd5 s VAL 11 Ca 0.08 1.43 -0.26 0.00 0.00 0.00 0.00 61.98 63.23 1pd5 s VAL 11 Cb -0.12 -4.04 0.04 0.00 0.00 0.00 0.00 36.38 32.25 1pd5 s VAL 11 CO 0.02 0.11 1.07 -0.62 0.00 0.00 0.00 175.10 175.68 1pd5 s ASP 12 N 1.09 6.35 0.12 3.32 3.68 -1.26 -4.84 116.67 125.12 1pd5 s ASP 12 Ca 0.35 -0.24 -0.17 0.00 2.13 0.00 0.00 52.55 54.62 1pd5 s ASP 12 Cb -0.17 -2.49 -0.03 0.00 -1.45 0.00 0.00 42.92 38.79 1pd5 s ASP 12 CO 0.13 -1.40 1.64 0.40 0.13 0.00 0.00 175.17 176.08 1pd5 h ILE 13 N 6.07 1.21 0.00 4.11 2.04 -1.96 -1.62 117.51 127.35 1pd5 h ILE 13 Ca -0.26 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 64.93 1pd5 h ILE 13 Cb 1.06 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 1pd5 h ILE 13 CO 1.15 0.23 0.22 0.77 0.00 0.00 0.00 178.15 180.52 1pd5 h SER 14 N 0.43 0.00 -0.13 1.72 4.64 -2.01 -1.15 113.55 117.05 1pd5 h SER 14 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1pd5 h SER 14 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1pd5 h SER 14 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1pd5 n GLN 15 N -2.36 1.45 -3.40 4.77 3.00 -0.61 -5.01 117.38 115.22 1pd5 n GLN 15 Ca -0.01 -1.56 -0.38 0.00 -0.01 0.00 0.00 57.00 55.03 1pd5 n GLN 15 Cb 0.25 -1.29 -0.06 0.00 0.00 0.00 0.00 30.24 29.14 1pd5 n GLN 15 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.06 176.60 1pd5 s TRP 16 N -1.12 3.57 0.40 1.08 -0.00 -0.44 -5.01 118.94 117.42 1pd5 s TRP 16 Ca 0.20 0.87 0.08 0.00 -0.00 0.00 0.00 56.10 57.24 1pd5 s TRP 16 Cb 0.13 -2.44 0.84 0.00 -0.00 0.00 0.00 33.47 31.99 1pd5 s TRP 16 CO 0.18 0.31 2.01 0.45 -0.00 0.00 0.00 176.95 179.90 1pd5 h HIS 17 N 6.14 0.60 -0.24 5.86 3.86 -1.95 -1.15 115.15 128.27 1pd5 h HIS 17 Ca -0.44 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.79 1pd5 h HIS 17 Cb 1.19 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 29.46 1pd5 h HIS 17 CO 0.64 0.34 0.00 0.54 0.86 0.00 0.00 177.93 180.31 1pd5 n ARG 18 N -4.47 2.28 -0.22 2.45 1.74 -1.26 -4.41 116.66 112.77 1pd5 n ARG 18 Ca 0.07 -1.17 -0.03 0.00 -0.77 0.00 0.00 57.85 55.95 1pd5 n ARG 18 Cb 0.17 -1.64 0.03 0.00 -1.02 0.00 0.00 32.46 30.00 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 1.58 -0.10 -0.56 5.56 3.64 -1.47 0.62 116.57 125.84 1pd5 h LYS 19 Ca 0.00 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.32 1pd5 h LYS 19 Cb 0.88 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.71 1pd5 h LYS 19 CO 0.14 -0.07 0.08 0.93 -2.27 0.00 0.00 179.45 178.26 1pd5 h GLU 20 N -0.11 0.93 -0.30 1.90 5.08 -1.85 -1.82 114.58 118.41 1pd5 h GLU 20 Ca 0.27 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 1pd5 h GLU 20 Cb 0.55 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1pd5 h GLU 20 CO -0.71 0.90 0.03 0.45 -1.00 0.00 0.00 179.01 178.68 1pd5 h HIS 21 N 0.83 0.55 0.22 4.33 3.86 -1.68 0.51 115.15 123.77 1pd5 h HIS 21 Ca 0.17 -0.09 0.01 0.00 -1.16 0.00 0.00 60.37 59.30 1pd5 h HIS 21 Cb 0.42 -0.15 -0.04 0.00 1.06 0.00 0.00 27.41 28.71 1pd5 h HIS 21 CO 0.03 0.62 -0.53 0.35 0.86 0.00 0.00 177.93 179.27 1pd5 h PHE 22 N 0.32 -1.51 -0.85 2.45 3.04 0.46 0.98 116.94 121.83 1pd5 h PHE 22 Ca 0.09 0.03 0.06 0.00 3.98 0.00 0.00 57.97 62.13 1pd5 h PHE 22 Cb 0.39 0.63 -0.05 0.00 2.56 0.00 0.00 35.95 39.47 1pd5 h PHE 22 CO 0.03 -0.62 0.56 0.93 -2.02 0.00 0.00 178.31 177.18 1pd5 h GLU 23 N -0.82 0.94 -0.42 1.11 5.08 -0.97 -0.62 114.58 118.89 1pd5 h GLU 23 Ca -0.02 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.15 1pd5 h GLU 23 Cb 0.79 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1pd5 h GLU 23 CO -0.23 0.62 -0.28 0.00 -1.00 0.00 0.00 179.01 178.12 1pd5 h ALA 24 N 1.53 0.72 -0.01 3.43 0.00 0.25 -3.05 119.26 122.13 1pd5 h ALA 24 Ca 0.36 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1pd5 h ALA 24 Cb 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1pd5 h ALA 24 CO -0.13 0.66 -0.18 1.19 0.00 0.00 0.00 179.25 180.80 1pd5 n PHE 25 N -4.09 0.00 1.09 0.00 0.99 0.32 -2.35 117.46 113.42 1pd5 n PHE 25 Ca -0.01 0.00 0.13 0.00 -0.00 0.00 0.00 57.45 57.57 1pd5 n PHE 25 Cb 0.48 -0.05 0.36 0.00 -1.00 0.00 0.00 39.48 39.27 1pd5 n PHE 25 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1pd5 n GLN 26 N -0.05 0.24 0.00 -1.08 1.13 -0.34 -3.73 117.38 113.56 1pd5 n GLN 26 Ca 0.14 -0.13 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 1pd5 n GLN 26 Cb 0.40 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.25 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 -1.27 0.00 0.09 1.08 3.41 -0.99 -4.85 113.62 111.09 1pd5 n SER 27 Ca 0.08 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.65 1pd5 n SER 27 Cb 0.33 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.43 1pd5 n SER 27 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1pd5 h VAL 28 N 0.00 1.38 -0.16 -3.33 3.04 -1.85 -0.40 116.25 114.92 1pd5 h VAL 28 Ca 0.00 -1.90 -0.03 0.00 -1.01 0.00 0.00 66.70 63.76 1pd5 h VAL 28 Cb 0.00 1.95 -0.02 0.00 -2.01 0.00 0.00 31.29 31.22 1pd5 h VAL 28 CO 0.00 0.56 0.04 0.00 -1.01 0.00 0.00 177.57 177.16 1pd5 n ALA 29 N -2.47 2.93 -1.62 3.17 0.00 -1.18 -4.94 120.51 116.40 1pd5 n ALA 29 Ca -0.02 -0.51 -0.51 0.00 0.00 0.00 0.00 53.44 52.39 1pd5 n ALA 29 Cb 0.59 -1.05 -0.06 0.00 0.00 0.00 0.00 19.45 18.93 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 0.14 1.40 -3.89 0.00 7.27 -0.16 -4.75 117.38 117.39 1pd5 n GLN 30 Ca 0.08 0.51 -0.09 0.00 0.07 0.00 0.00 57.00 57.57 1pd5 n GLN 30 Cb 0.55 -2.19 -0.06 0.00 2.41 0.00 0.00 30.24 30.95 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 -3.93 3.54 0.04 0.00 2.01 -1.26 -1.62 115.64 114.43 1pd5 s THR 32 Ca 0.13 -1.61 -0.05 0.00 0.31 0.00 0.00 61.69 60.47 1pd5 s THR 32 Cb 0.03 -2.81 -0.01 0.00 0.01 0.00 0.00 72.50 69.72 1pd5 s THR 32 CO -0.03 -0.19 0.10 -0.72 -0.69 0.00 0.00 174.62 173.09 1pd5 s TYR 33 N -1.89 0.23 0.03 4.92 -0.85 -0.96 -4.95 117.35 113.88 1pd5 s TYR 33 Ca 0.28 -0.57 0.05 0.00 -0.52 0.00 0.00 57.07 56.31 1pd5 s TYR 33 Cb -0.08 -0.16 -0.02 0.00 0.38 0.00 0.00 41.96 42.08 1pd5 s TYR 33 CO 0.18 -0.39 -0.15 -0.80 -1.52 0.00 0.00 175.55 172.88 1pd5 s ASN 34 N -2.29 1.72 -0.00 -0.18 -0.87 -1.26 -1.13 114.94 110.93 1pd5 s ASN 34 Ca -0.03 -0.43 0.01 0.00 -1.57 0.00 0.00 52.86 50.84 1pd5 s ASN 34 Cb 0.00 -0.12 -0.00 0.00 -0.02 0.00 0.00 41.25 41.11 1pd5 s ASN 34 CO -0.06 0.06 -0.02 -1.10 -2.57 0.00 0.00 177.10 173.41 1pd5 s GLN 35 N -1.02 0.15 0.05 -0.60 -0.21 -0.82 -5.00 119.66 112.20 1pd5 s GLN 35 Ca 0.03 -0.07 0.06 0.00 0.02 0.00 0.00 55.36 55.40 1pd5 s GLN 35 Cb -0.08 -0.14 -0.03 0.00 1.00 0.00 0.00 33.01 33.76 1pd5 s GLN 35 CO 0.01 0.04 -0.14 0.99 -2.12 0.00 0.00 175.29 174.07 1pd5 s THR 36 N -0.06 3.06 0.07 -0.19 2.01 -1.26 -1.07 115.64 118.20 1pd5 s THR 36 Ca 0.01 -1.12 0.04 0.00 0.31 0.00 0.00 61.69 60.92 1pd5 s THR 36 Cb -0.01 -2.33 -0.03 0.00 0.01 0.00 0.00 72.50 70.14 1pd5 s THR 36 CO -0.00 0.31 -0.11 0.54 -0.69 0.00 0.00 174.62 174.67 1pd5 s VAL 37 N -0.99 0.88 -0.77 3.82 0.11 0.32 -4.95 120.40 118.82 1pd5 s VAL 37 Ca 0.16 -1.35 -0.20 0.00 -2.93 0.00 0.00 61.98 57.67 1pd5 s VAL 37 Cb -0.11 -1.03 0.11 0.00 -1.53 0.00 0.00 36.38 33.83 1pd5 s VAL 37 CO 0.07 -0.38 0.97 -1.10 -3.33 0.00 0.00 175.10 171.32 1pd5 s GLN 38 N -2.04 3.33 0.13 1.54 -1.52 -1.26 -0.82 119.66 119.01 1pd5 s GLN 38 Ca -0.02 -1.42 -0.31 0.00 -1.95 0.00 0.00 55.36 51.66 1pd5 s GLN 38 Cb -0.08 -4.54 -0.08 0.00 -0.22 0.00 0.00 33.01 28.10 1pd5 s GLN 38 CO 0.01 -1.71 1.31 -1.17 -0.25 0.00 0.00 175.29 173.48 1pd5 s LEU 39 N 2.97 4.39 -0.41 2.90 0.20 0.18 -4.78 118.68 124.13 1pd5 s LEU 39 Ca 0.24 2.26 -0.27 0.00 0.69 0.00 0.00 54.13 57.06 1pd5 s LEU 39 Cb -0.13 -3.59 0.02 0.00 -0.43 0.00 0.00 46.19 42.06 1pd5 s LEU 39 CO -0.00 -0.56 0.98 -0.62 -0.29 0.00 0.00 176.35 175.87 1pd5 s ASP 40 N 0.83 6.65 -0.19 3.68 3.68 -1.26 0.54 116.67 130.60 1pd5 s ASP 40 Ca 0.60 0.49 0.15 0.00 2.13 0.00 0.00 52.55 55.91 1pd5 s ASP 40 Cb -0.35 -2.49 0.40 0.00 -1.45 0.00 0.00 42.92 39.04 1pd5 s ASP 40 CO 0.32 -0.99 1.26 2.30 0.13 0.00 0.00 175.17 178.20 1pd5 n ILE 41 N 6.25 2.15 0.22 4.11 -5.35 0.30 -4.70 119.36 122.34 1pd5 n ILE 41 Ca 0.08 -2.59 -0.13 0.00 -0.27 0.00 0.00 62.75 59.84 1pd5 n ILE 41 Cb 0.48 -0.26 -0.07 0.00 -1.74 0.00 0.00 39.64 38.05 1pd5 n ILE 41 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1pd5 h THR 42 N 0.72 0.00 -0.13 7.28 2.02 -1.84 0.39 112.91 121.35 1pd5 h THR 42 Ca 0.04 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.26 1pd5 h THR 42 Cb 1.17 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.52 1pd5 h THR 42 CO 0.09 0.00 -0.27 0.00 0.37 0.00 0.00 175.52 175.71 1pd5 h ALA 43 N -1.13 -0.28 -0.55 6.16 0.00 -1.89 -2.96 119.26 118.62 1pd5 h ALA 43 Ca -0.05 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.01 1pd5 h ALA 43 Cb 0.65 0.52 -0.09 0.00 0.00 0.00 0.00 17.79 18.87 1pd5 h ALA 43 CO -0.05 -0.74 0.01 0.35 0.00 0.00 0.00 179.25 178.82 1pd5 h PHE 44 N -0.34 -0.03 -0.03 0.00 3.57 -1.46 -0.14 116.94 118.51 1pd5 h PHE 44 Ca 0.10 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.58 1pd5 h PHE 44 Cb 0.49 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 1pd5 h PHE 44 CO -0.36 -0.13 -0.28 1.25 -2.23 0.00 0.00 178.31 176.55 1pd5 h LEU 45 N 0.12 0.05 0.55 0.59 6.46 -0.93 0.11 115.31 122.27 1pd5 h LEU 45 Ca 0.28 -0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 58.00 1pd5 h LEU 45 Cb 0.44 -0.01 0.01 0.00 -0.73 0.00 0.00 40.66 40.36 1pd5 h LEU 45 CO -0.46 0.34 -0.27 0.11 -0.62 0.00 0.00 178.44 177.54 1pd5 h LYS 46 N 0.05 -0.72 -0.82 1.25 1.57 -0.87 -1.82 116.57 115.21 1pd5 h LYS 46 Ca 0.01 0.05 0.20 0.00 -1.87 0.00 0.00 60.65 59.03 1pd5 h LYS 46 Cb 0.53 0.16 -0.13 0.00 0.08 0.00 0.00 32.23 32.87 1pd5 h LYS 46 CO 0.04 -0.41 0.22 1.15 -0.57 0.00 0.00 179.45 179.87 1pd5 h THR 47 N -0.96 0.42 -0.51 -0.16 2.02 -1.20 0.15 112.91 112.67 1pd5 h THR 47 Ca -0.08 -0.09 -0.05 0.00 0.77 0.00 0.00 66.41 66.97 1pd5 h THR 47 Cb 0.64 0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 1pd5 h THR 47 CO 0.12 0.05 0.11 0.58 0.37 0.00 0.00 175.52 176.75 1pd5 h VAL 48 N 0.26 1.22 -0.02 3.16 2.07 -0.61 -2.62 116.25 119.70 1pd5 h VAL 48 Ca 0.49 -0.82 -0.19 0.00 0.82 0.00 0.00 66.70 67.00 1pd5 h VAL 48 Cb 0.91 0.72 0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1pd5 h VAL 48 CO -0.58 0.30 -0.73 0.11 0.02 0.00 0.00 177.57 176.69 1pd5 h LYS 49 N 0.76 0.54 0.03 1.57 1.57 -0.25 0.07 116.57 120.85 1pd5 h LYS 49 Ca 0.17 -0.55 0.02 0.00 -1.87 0.00 0.00 60.65 58.42 1pd5 h LYS 49 Cb 0.30 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 1pd5 h LYS 49 CO 0.00 1.17 -0.18 -0.22 -0.57 0.00 0.00 179.45 179.65 1pd5 h LYS 50 N 0.11 -0.30 -0.66 3.15 1.63 -0.68 -1.19 116.57 118.63 1pd5 h LYS 50 Ca -0.08 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1pd5 h LYS 50 Cb 1.41 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 33.11 1pd5 h LYS 50 CO 0.15 -0.20 0.00 0.09 -3.45 0.00 0.00 179.45 176.03 1pd5 n ASN 51 N -5.31 2.65 -4.38 4.20 3.02 -1.00 -4.91 115.26 109.53 1pd5 n ASN 51 Ca -0.05 -2.28 -0.41 0.00 -0.03 0.00 0.00 54.58 51.81 1pd5 n ASN 51 Cb 0.23 -0.47 -0.08 0.00 -0.61 0.00 0.00 39.78 38.86 1pd5 n ASN 51 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1pd5 n LYS 52 N 0.33 -0.73 -3.37 3.52 3.00 -0.45 -4.96 118.16 115.49 1pd5 n LYS 52 Ca 0.12 0.13 -0.34 0.00 -0.00 0.00 0.00 58.31 58.22 1pd5 n LYS 52 Cb 0.54 -4.45 -0.06 0.00 0.00 0.00 0.00 35.03 31.06 1pd5 n LYS 52 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1pd5 s HIS 53 N -3.14 3.54 0.17 5.64 3.76 -0.01 -5.03 115.29 120.21 1pd5 s HIS 53 Ca 0.79 1.00 -0.30 0.00 -0.15 0.00 0.00 55.06 56.39 1pd5 s HIS 53 Cb -0.46 -2.33 -0.08 0.00 1.11 0.00 0.00 32.58 30.81 1pd5 s HIS 53 CO 0.97 0.37 1.33 0.15 -0.85 0.00 0.00 174.74 176.72 1pd5 s LYS 54 N -2.27 4.37 0.13 1.40 3.01 -1.26 -4.66 119.74 120.46 1pd5 s LYS 54 Ca 0.41 2.06 -0.21 0.00 -1.01 0.00 0.00 55.97 57.22 1pd5 s LYS 54 Cb -0.14 -3.21 -0.02 0.00 -1.01 0.00 0.00 37.83 33.45 1pd5 s LYS 54 CO 0.20 -0.31 1.69 0.35 0.51 0.00 0.00 175.35 177.78 1pd5 h PHE 55 N 5.85 -0.23 0.31 3.18 3.57 -1.97 -3.18 116.94 124.47 1pd5 h PHE 55 Ca -0.44 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.07 1pd5 h PHE 55 Cb 1.21 0.13 0.00 0.00 2.79 0.00 0.00 35.95 40.08 1pd5 h PHE 55 CO 0.63 -0.15 -0.15 -0.92 -2.23 0.00 0.00 178.31 175.49 1pd5 h TYR 56 N -0.08 -0.39 -0.59 0.41 3.20 -1.99 0.82 116.97 118.34 1pd5 h TYR 56 Ca 0.10 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.02 1pd5 h TYR 56 Cb 0.23 0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.59 1pd5 h TYR 56 CO -0.24 -0.20 0.39 -1.00 -1.64 0.00 0.00 178.16 175.47 1pd5 h PRO 57 N -0.49 0.58 -0.09 1.82 0.13 -2.00 0.40 132.00 132.35 1pd5 h PRO 57 Ca -0.04 -0.03 -0.20 0.00 -0.87 0.00 0.00 66.00 64.86 1pd5 h PRO 57 Cb 0.37 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 31.37 1pd5 h PRO 57 CO 0.07 0.38 -0.75 0.00 -0.23 0.00 0.00 178.00 177.47 1pd5 h ALA 58 N 1.67 0.51 0.05 -0.56 0.00 -1.30 -0.60 119.26 119.03 1pd5 h ALA 58 Ca 0.25 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1pd5 h ALA 58 Cb 0.24 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1pd5 h ALA 58 CO -0.07 0.74 -0.02 0.35 0.00 0.00 0.00 179.25 180.25 1pd5 h PHE 59 N 0.34 -0.06 -0.95 0.00 3.57 -0.19 -2.90 116.94 116.74 1pd5 h PHE 59 Ca -0.04 -0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.69 1pd5 h PHE 59 Cb 1.35 0.02 -0.12 0.00 2.79 0.00 0.00 35.95 39.98 1pd5 h PHE 59 CO 0.06 0.43 0.51 0.82 -2.23 0.00 0.00 178.31 177.89 1pd5 h ILE 60 N -0.57 0.53 -0.37 1.41 2.04 -0.15 0.41 117.51 120.80 1pd5 h ILE 60 Ca -0.01 -0.18 0.02 0.00 1.00 0.00 0.00 64.86 65.69 1pd5 h ILE 60 Cb 0.51 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 1pd5 h ILE 60 CO 0.01 0.09 0.25 -0.74 0.00 0.00 0.00 178.15 177.76 1pd5 h HIS 61 N 0.52 0.43 0.01 1.37 2.76 -0.93 0.85 115.15 120.16 1pd5 h HIS 61 Ca 0.60 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.73 1pd5 h HIS 61 Cb 1.12 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 29.94 1pd5 h HIS 61 CO -0.06 0.26 -0.21 0.82 -1.30 0.00 0.00 177.93 177.44 1pd5 h ILE 62 N 0.45 1.59 -0.82 6.26 1.08 -0.09 -0.42 117.51 125.57 1pd5 h ILE 62 Ca 0.14 -2.03 0.18 0.00 -0.39 0.00 0.00 64.86 62.76 1pd5 h ILE 62 Cb 0.02 2.91 -0.11 0.00 -3.07 0.00 0.00 36.82 36.57 1pd5 h ILE 62 CO -0.03 0.55 0.32 -0.07 -0.69 0.00 0.00 178.15 178.23 1pd5 h LEU 63 N -0.61 0.26 -0.62 1.44 3.38 0.03 -0.57 115.31 118.62 1pd5 h LEU 63 Ca -0.03 0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 1pd5 h LEU 63 Cb 1.01 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1pd5 h LEU 63 CO 0.04 0.04 -0.64 0.00 0.09 0.00 0.00 178.44 177.97 1pd5 h ALA 64 N 1.63 0.82 -0.56 1.53 0.00 -0.85 0.61 119.26 122.44 1pd5 h ALA 64 Ca 0.48 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1pd5 h ALA 64 Cb 0.83 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1pd5 h ALA 64 CO -0.48 0.76 0.16 0.00 0.00 0.00 0.00 179.25 179.69 1pd5 h ARG 65 N 0.15 0.88 0.74 0.00 3.08 -0.02 -0.25 114.38 118.97 1pd5 h ARG 65 Ca -0.01 -0.20 -0.04 0.00 0.07 0.00 0.00 59.98 59.80 1pd5 h ARG 65 Cb 1.16 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 31.09 1pd5 h ARG 65 CO 0.10 0.81 -0.36 -0.07 -1.07 0.00 0.00 179.97 179.38 1pd5 h LEU 66 N 0.79 -0.85 -0.94 3.04 3.38 -0.93 -2.15 115.31 117.66 1pd5 h LEU 66 Ca 0.18 0.01 0.25 0.00 0.09 0.00 0.00 57.88 58.41 1pd5 h LEU 66 Cb 0.31 0.22 -0.17 0.00 0.09 0.00 0.00 40.66 41.11 1pd5 h LEU 66 CO -0.00 -0.52 0.06 0.24 0.09 0.00 0.00 178.44 178.30 1pd5 h MET 67 N -1.14 0.05 -0.57 1.13 2.86 -0.94 -0.13 114.93 116.19 1pd5 h MET 67 Ca -0.10 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1pd5 h MET 67 Cb 0.79 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.44 1pd5 h MET 67 CO 0.17 0.03 0.00 0.09 1.06 0.00 0.00 176.91 178.26 1pd5 n ASN 68 N -5.43 0.57 -0.00 1.22 3.02 -0.11 -3.47 115.26 111.06 1pd5 n ASN 68 Ca 0.22 -1.84 0.01 0.00 -0.03 0.00 0.00 54.58 52.94 1pd5 n ASN 68 Cb 0.71 -0.29 -0.01 0.00 -0.61 0.00 0.00 39.78 39.58 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 -0.16 2.12 -3.30 5.41 0.00 -0.06 -5.00 120.51 119.51 1pd5 n ALA 69 Ca 0.00 -0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.19 1pd5 n ALA 69 Cb 0.14 -0.06 -0.16 0.00 0.00 0.00 0.00 19.45 19.37 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 -1.79 0.91 0.20 0.00 3.76 -1.21 -5.06 115.29 112.10 1pd5 s HIS 70 Ca -0.00 -0.25 0.15 0.00 -0.15 0.00 0.00 55.06 54.81 1pd5 s HIS 70 Cb 0.01 -0.70 0.54 0.00 1.11 0.00 0.00 32.58 33.54 1pd5 s HIS 70 CO 0.07 -0.15 1.68 -1.00 -0.85 0.00 0.00 174.74 174.49 1pd5 h PRO 71 N 6.74 0.00 -0.11 8.40 0.13 -1.95 -2.76 132.00 142.46 1pd5 h PRO 71 Ca -0.35 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.81 1pd5 h PRO 71 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1pd5 h PRO 71 CO 0.48 0.47 0.18 1.05 -0.23 0.00 0.00 178.00 179.95 1pd5 h GLU 72 N 0.00 0.00 -0.01 0.86 9.09 -1.93 0.47 114.58 123.06 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 0.99 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.09 1pd5 h GLU 72 CO 0.06 0.00 -0.05 1.19 0.05 0.00 0.00 179.01 180.26 1pd5 n PHE 73 N -3.51 0.00 -1.14 2.06 3.01 -1.04 -4.21 117.46 112.63 1pd5 n PHE 73 Ca -0.00 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.52 1pd5 n PHE 73 Cb 0.27 -0.05 0.21 0.00 -0.01 0.00 0.00 39.48 39.91 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 -0.40 2.21 -2.66 -1.08 1.74 0.16 -4.55 116.66 112.09 1pd5 n ARG 74 Ca 0.18 -2.87 -0.33 0.00 -0.77 0.00 0.00 57.85 54.07 1pd5 n ARG 74 Cb 0.29 -1.74 -0.06 0.00 -1.02 0.00 0.00 32.46 29.93 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 -2.95 4.11 0.14 5.56 -1.94 -1.22 -2.19 119.30 120.82 1pd5 s MET 75 Ca 0.40 1.05 -0.13 0.00 -1.71 0.00 0.00 55.69 55.30 1pd5 s MET 75 Cb 0.34 -2.17 0.01 0.00 2.01 0.00 0.00 34.83 35.03 1pd5 s MET 75 CO 0.05 -0.12 0.34 0.00 -0.01 0.00 0.00 175.02 175.27 1pd5 s ALA 76 N -2.35 -0.51 -0.49 3.03 0.00 -0.23 -4.52 121.76 116.68 1pd5 s ALA 76 Ca 0.61 -0.44 -0.19 0.00 0.00 0.00 0.00 51.96 51.94 1pd5 s ALA 76 Cb -0.09 0.71 0.06 0.00 0.00 0.00 0.00 23.12 23.80 1pd5 s ALA 76 CO 0.20 -0.64 0.58 -1.64 0.00 0.00 0.00 175.76 174.27 1pd5 s MET 77 N -3.87 3.11 -0.24 0.00 -1.94 -1.26 -0.91 119.30 114.18 1pd5 s MET 77 Ca 0.08 -0.93 -0.14 0.00 -1.71 0.00 0.00 55.69 52.99 1pd5 s MET 77 Cb 0.02 -4.09 -0.04 0.00 2.01 0.00 0.00 34.83 32.73 1pd5 s MET 77 CO -0.07 -1.17 0.30 0.21 -0.01 0.00 0.00 175.02 174.29 1pd5 s LYS 78 N 2.47 4.08 -1.58 2.03 2.20 0.11 -4.62 119.74 124.43 1pd5 s LYS 78 Ca 0.14 -0.02 -0.08 0.00 -0.36 0.00 0.00 55.97 55.65 1pd5 s LYS 78 Cb -0.20 -3.58 0.07 0.00 -1.51 0.00 0.00 37.83 32.61 1pd5 s LYS 78 CO 0.11 -0.09 0.42 -0.25 -0.36 0.00 0.00 175.35 175.18 1pd5 n ASP 79 N 4.70 -0.89 0.00 1.43 10.43 -1.26 0.52 116.55 131.48 1pd5 n ASP 79 Ca -0.11 -1.11 0.00 0.00 2.57 0.00 0.00 54.79 56.14 1pd5 n ASP 79 Cb 0.51 -2.40 0.00 0.00 1.84 0.00 0.00 41.12 41.08 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 -1.89 0.45 3.24 0.44 0.00 -1.26 -5.03 105.19 101.14 1pd5 n GLY 80 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.28 1.36 -0.00 1.61 2.02 0.19 -5.11 118.70 118.48 1pd5 s GLU 81 Ca 0.00 -0.93 -0.30 0.00 0.02 0.00 0.00 54.97 53.76 1pd5 s GLU 81 Cb 0.00 -1.47 -0.06 0.00 0.10 0.00 0.00 34.13 32.70 1pd5 s GLU 81 CO 0.00 0.37 1.60 -1.17 0.02 0.00 0.00 175.26 176.08 1pd5 s LEU 82 N -1.17 4.33 0.11 1.80 2.96 -1.26 -0.71 118.68 124.74 1pd5 s LEU 82 Ca 0.07 2.29 0.05 0.00 -0.22 0.00 0.00 54.13 56.32 1pd5 s LEU 82 Cb -0.09 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.02 1pd5 s LEU 82 CO 0.02 -0.87 -0.12 0.54 -1.32 0.00 0.00 176.35 174.60 1pd5 s VAL 83 N 3.21 1.10 -0.29 1.68 0.11 -0.09 -2.17 120.40 123.95 1pd5 s VAL 83 Ca 0.71 -1.69 -0.05 0.00 -2.93 0.00 0.00 61.98 58.03 1pd5 s VAL 83 Cb -0.35 -1.44 0.02 0.00 -1.53 0.00 0.00 36.38 33.08 1pd5 s VAL 83 CO 0.30 -0.51 0.04 -0.63 -3.33 0.00 0.00 175.10 170.96 1pd5 s ILE 84 N -2.36 3.55 0.49 7.04 1.01 -0.18 -1.07 121.20 129.68 1pd5 s ILE 84 Ca 0.07 -0.92 -0.22 0.00 0.00 0.00 0.00 60.65 59.57 1pd5 s ILE 84 Cb -0.03 -2.88 -0.06 0.00 0.01 0.00 0.00 42.46 39.49 1pd5 s ILE 84 CO 0.01 0.05 1.24 0.26 0.00 0.00 0.00 174.94 176.50 1pd5 s TRP 85 N 1.41 2.66 0.54 3.97 0.52 -0.93 -0.75 118.94 126.36 1pd5 s TRP 85 Ca 0.00 1.48 0.23 0.00 0.02 0.00 0.00 56.10 57.83 1pd5 s TRP 85 Cb -0.18 -3.54 1.52 0.00 -1.15 0.00 0.00 33.47 30.13 1pd5 s TRP 85 CO 0.00 -2.02 2.18 -0.44 0.02 0.00 0.00 176.95 176.69 1pd5 h ASP 86 N 1.83 0.00 -4.05 2.95 3.45 -1.47 -3.44 116.42 115.68 1pd5 h ASP 86 Ca -0.50 0.00 0.01 0.00 0.43 0.00 0.00 57.03 56.97 1pd5 h ASP 86 Cb 1.27 0.00 -0.22 0.00 -0.56 0.00 0.00 39.33 39.81 1pd5 h ASP 86 CO 0.59 0.03 0.33 -0.94 -1.57 0.00 0.00 179.24 177.68 1pd5 s SER 87 N -6.54 -0.56 0.20 6.45 1.04 -1.26 -5.07 113.70 107.96 1pd5 s SER 87 Ca -0.05 0.88 0.09 0.00 0.48 0.00 0.00 55.95 57.35 1pd5 s SER 87 Cb 0.16 0.82 -0.04 0.00 0.10 0.00 0.00 66.02 67.06 1pd5 s SER 87 CO 0.61 -0.33 -0.05 0.68 0.98 0.00 0.00 173.24 175.13 1pd5 s VAL 88 N -0.38 3.39 -0.01 5.02 -7.23 -1.26 -4.90 120.40 115.04 1pd5 s VAL 88 Ca -0.02 -1.66 0.07 0.00 -1.81 0.00 0.00 61.98 58.56 1pd5 s VAL 88 Cb -0.03 -2.72 -0.02 0.00 0.56 0.00 0.00 36.38 34.17 1pd5 s VAL 88 CO 0.01 -0.17 -0.21 -1.00 -0.31 0.00 0.00 175.10 173.42 1pd5 s HIS 89 N -1.86 1.92 0.20 2.82 3.76 -0.25 -4.71 115.29 117.17 1pd5 s HIS 89 Ca 0.27 -0.37 -0.30 0.00 -0.15 0.00 0.00 55.06 54.52 1pd5 s HIS 89 Cb -0.08 -1.22 -0.08 0.00 1.11 0.00 0.00 32.58 32.30 1pd5 s HIS 89 CO 0.17 -0.01 1.23 -1.25 -0.85 0.00 0.00 174.74 174.03 1pd5 s PRO 90 N -0.61 4.46 -0.32 8.40 0.04 -1.24 -0.85 135.00 144.89 1pd5 s PRO 90 Ca 0.08 1.94 -0.01 0.00 0.04 0.00 0.00 61.00 63.05 1pd5 s PRO 90 Cb -0.08 -3.22 0.07 0.00 0.04 0.00 0.00 34.50 31.30 1pd5 s PRO 90 CO -0.00 -0.13 0.02 0.00 0.04 0.00 0.00 177.00 176.92 1pd5 s TYR 92 N 1.18 2.60 0.33 0.00 -0.85 -0.52 -0.77 117.35 119.33 1pd5 s TYR 92 Ca -0.02 -0.24 -0.11 0.00 -0.52 0.00 0.00 57.07 56.19 1pd5 s TYR 92 Cb -0.20 -1.25 -0.07 0.00 0.38 0.00 0.00 41.96 40.82 1pd5 s TYR 92 CO -0.03 0.54 0.69 0.95 -1.52 0.00 0.00 175.55 176.18 1pd5 s THR 93 N -1.82 4.82 -0.05 -3.49 -4.23 -0.89 -1.45 115.64 108.53 1pd5 s THR 93 Ca 0.26 0.60 0.01 0.00 -1.18 0.00 0.00 61.69 61.37 1pd5 s THR 93 Cb -0.08 -3.68 0.02 0.00 1.34 0.00 0.00 72.50 70.10 1pd5 s THR 93 CO 0.15 -0.32 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.19 1pd5 s VAL 94 N -2.12 0.52 -0.02 2.29 1.01 0.13 -4.76 120.40 117.44 1pd5 s VAL 94 Ca 0.50 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 62.30 1pd5 s VAL 94 Cb -0.10 -0.56 -0.05 0.00 0.00 0.00 0.00 36.38 35.67 1pd5 s VAL 94 CO 0.25 0.23 0.28 0.12 0.00 0.00 0.00 175.10 175.98 1pd5 s PHE 95 N 1.05 3.62 -0.46 5.22 5.36 -1.26 -1.37 117.98 130.15 1pd5 s PHE 95 Ca -0.09 0.69 -0.09 0.00 -0.96 0.00 0.00 56.93 56.48 1pd5 s PHE 95 Cb -0.14 -2.07 0.11 0.00 -0.34 0.00 0.00 43.02 40.58 1pd5 s PHE 95 CO -0.01 0.65 0.32 -1.01 -1.46 0.00 0.00 175.22 173.72 1pd5 s HIS 96 N -1.18 3.41 0.46 10.12 3.76 0.18 -4.95 115.29 127.09 1pd5 s HIS 96 Ca 0.24 -1.81 0.13 0.00 -0.15 0.00 0.00 55.06 53.46 1pd5 s HIS 96 Cb -0.14 -3.38 1.06 0.00 1.11 0.00 0.00 32.58 31.24 1pd5 s HIS 96 CO 0.12 -0.96 2.05 0.93 -0.85 0.00 0.00 174.74 176.03 1pd5 h GLU 97 N 8.43 0.31 0.00 1.40 4.39 -1.98 0.40 114.58 127.55 1pd5 h GLU 97 Ca -0.21 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.47 1pd5 h GLU 97 Cb 1.07 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.65 1pd5 h GLU 97 CO 0.84 0.21 -0.49 1.96 -1.16 0.00 0.00 179.01 180.37 1pd5 h GLN 98 N 0.32 0.00 0.00 2.33 4.20 -1.95 -3.30 115.11 116.71 1pd5 h GLN 98 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1pd5 h GLN 98 Cb 0.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1pd5 h GLN 98 CO -0.04 0.00 -0.92 0.25 -0.67 0.00 0.00 178.83 177.46 1pd5 n THR 99 N -2.43 0.00 -3.40 -0.54 -2.24 -0.80 -5.02 114.28 99.86 1pd5 n THR 99 Ca 0.03 -0.23 -0.19 0.00 -2.27 0.00 0.00 64.05 61.39 1pd5 n THR 99 Cb 0.48 0.75 0.07 0.00 -2.10 0.00 0.00 70.33 69.53 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 -1.51 -6.65 -4.37 -0.78 1.02 0.14 -5.02 120.64 103.46 1pd5 n GLU 100 Ca 0.01 0.75 -0.19 0.00 -0.02 0.00 0.00 57.16 57.70 1pd5 n GLU 100 Cb 0.25 -5.51 -0.10 0.00 -0.02 0.00 0.00 31.44 26.06 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 -3.30 0.68 0.15 2.62 -4.23 -1.18 -4.98 115.64 105.40 1pd5 s THR 101 Ca 0.32 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.78 1pd5 s THR 101 Cb -0.14 -2.63 -0.02 0.00 1.34 0.00 0.00 72.50 71.05 1pd5 s THR 101 CO 0.65 0.00 0.18 0.72 -0.54 0.00 0.00 174.62 175.63 1pd5 s PHE 102 N -3.56 0.63 0.05 3.99 -0.12 -1.26 0.49 117.98 118.19 1pd5 s PHE 102 Ca 0.36 -0.99 0.00 0.00 -0.05 0.00 0.00 56.93 56.25 1pd5 s PHE 102 Cb 0.07 -0.26 -0.03 0.00 -0.63 0.00 0.00 43.02 42.17 1pd5 s PHE 102 CO 0.15 -0.64 -0.04 -1.12 -0.05 0.00 0.00 175.22 173.52 1pd5 s SER 103 N -3.01 0.59 -0.21 1.98 0.01 -0.47 -4.78 113.70 107.81 1pd5 s SER 103 Ca 0.21 -0.77 -0.05 0.00 1.31 0.00 0.00 55.95 56.65 1pd5 s SER 103 Cb 0.05 0.12 -0.02 0.00 0.21 0.00 0.00 66.02 66.38 1pd5 s SER 103 CO 0.02 -0.41 0.01 -0.44 0.41 0.00 0.00 173.24 172.82 1pd5 s SER 104 N -2.25 4.85 -0.02 2.44 0.01 0.26 -0.69 113.70 118.30 1pd5 s SER 104 Ca -0.02 -0.22 0.06 0.00 1.31 0.00 0.00 55.95 57.08 1pd5 s SER 104 Cb -0.01 -1.84 -0.01 0.00 0.21 0.00 0.00 66.02 64.37 1pd5 s SER 104 CO -0.04 0.04 -0.19 -0.76 0.41 0.00 0.00 173.24 172.69 1pd5 s LEU 105 N 1.15 2.03 0.21 2.44 1.43 -0.53 -3.88 118.68 121.53 1pd5 s LEU 105 Ca 0.03 -0.36 0.05 0.00 -1.03 0.00 0.00 54.13 52.83 1pd5 s LEU 105 Cb -0.14 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.03 1pd5 s LEU 105 CO 0.02 0.23 0.22 -1.66 0.23 0.00 0.00 176.35 175.39 1pd5 s TRP 106 N -0.42 3.25 -0.01 0.29 1.48 -1.26 -1.43 118.94 120.84 1pd5 s TRP 106 Ca 0.07 -0.03 0.01 0.00 -1.06 0.00 0.00 56.10 55.09 1pd5 s TRP 106 Cb -0.08 -1.51 0.00 0.00 -1.16 0.00 0.00 33.47 30.72 1pd5 s TRP 106 CO -0.01 0.50 -0.05 -1.12 -4.06 0.00 0.00 176.95 172.22 1pd5 s SER 107 N -3.55 0.61 0.57 -2.66 0.01 -1.05 -5.01 113.70 102.62 1pd5 s SER 107 Ca 0.33 -0.09 -0.20 0.00 1.31 0.00 0.00 55.95 57.30 1pd5 s SER 107 Cb -0.09 -0.12 -0.05 0.00 0.21 0.00 0.00 66.02 65.97 1pd5 s SER 107 CO 0.26 0.04 1.12 1.21 0.41 0.00 0.00 173.24 176.28 1pd5 n GLU 108 N 3.17 1.20 -3.79 12.44 2.13 -1.26 -3.64 120.64 130.89 1pd5 n GLU 108 Ca -0.15 0.45 -0.35 0.00 0.66 0.00 0.00 57.16 57.77 1pd5 n GLU 108 Cb 0.57 -2.31 -0.09 0.00 0.27 0.00 0.00 31.44 29.88 1pd5 n GLU 108 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1pd5 s TYR 109 N -1.40 3.35 -0.02 4.31 5.04 -1.26 -4.89 117.35 122.48 1pd5 s TYR 109 Ca 0.74 0.24 0.04 0.00 -2.44 0.00 0.00 57.07 55.65 1pd5 s TYR 109 Cb -0.43 -2.16 -0.01 0.00 0.35 0.00 0.00 41.96 39.72 1pd5 s TYR 109 CO 0.48 0.21 -0.14 -1.01 -1.34 0.00 0.00 175.55 173.75 1pd5 s HIS 110 N 0.48 1.30 0.19 4.97 3.76 -1.26 -5.02 115.29 119.70 1pd5 s HIS 110 Ca 0.07 -0.28 0.03 0.00 -0.15 0.00 0.00 55.06 54.73 1pd5 s HIS 110 Cb -0.12 -0.86 0.51 0.00 1.11 0.00 0.00 32.58 33.23 1pd5 s HIS 110 CO -0.00 -0.06 0.90 -0.25 -0.85 0.00 0.00 174.74 174.48 1pd5 n ASP 111 N 2.87 -0.01 -4.64 1.40 9.92 -1.26 -4.48 116.55 120.35 1pd5 n ASP 111 Ca -0.15 0.97 -0.41 0.00 -0.53 0.00 0.00 54.79 54.67 1pd5 n ASP 111 Cb 0.55 -0.38 -0.06 0.00 -0.64 0.00 0.00 41.12 40.59 1pd5 n ASP 111 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1pd5 s ASP 112 N -4.94 6.64 0.10 -2.24 -1.08 -1.26 -4.99 116.67 108.90 1pd5 s ASP 112 Ca -0.07 0.78 -0.21 0.00 -0.52 0.00 0.00 52.55 52.53 1pd5 s ASP 112 Cb 0.17 -2.35 -0.11 0.00 -1.46 0.00 0.00 42.92 39.17 1pd5 s ASP 112 CO 0.45 -0.36 1.72 0.15 0.52 0.00 0.00 175.17 177.65 1pd5 h PHE 113 N 7.76 0.15 -0.72 -5.34 3.57 -1.99 0.18 116.94 120.55 1pd5 h PHE 113 Ca -0.27 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.32 1pd5 h PHE 113 Cb 1.12 -0.05 -0.07 0.00 2.79 0.00 0.00 35.95 39.74 1pd5 h PHE 113 CO 0.74 0.14 0.36 0.00 -2.23 0.00 0.00 178.31 177.32 1pd5 h ARG 114 N 0.12 0.60 0.11 1.11 3.08 -1.95 0.15 114.38 117.61 1pd5 h ARG 114 Ca 0.04 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1pd5 h ARG 114 Cb 0.03 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.94 1pd5 h ARG 114 CO -0.01 0.40 -0.05 1.96 -1.07 0.00 0.00 179.97 181.19 1pd5 h GLN 115 N 0.62 -0.15 -1.11 0.04 4.20 -1.75 -1.64 115.11 115.31 1pd5 h GLN 115 Ca 0.35 0.01 0.34 0.00 0.06 0.00 0.00 58.65 59.41 1pd5 h GLN 115 Cb 0.36 0.03 -0.13 0.00 0.30 0.00 0.00 27.48 28.05 1pd5 h GLN 115 CO -0.26 0.09 0.69 0.35 -0.67 0.00 0.00 178.83 179.02 1pd5 h PHE 116 N -0.37 0.72 0.01 2.96 3.57 -0.00 -2.79 116.94 121.05 1pd5 h PHE 116 Ca -0.02 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.31 1pd5 h PHE 116 Cb 0.30 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 1pd5 h PHE 116 CO -0.00 -0.11 -0.92 1.25 -2.23 0.00 0.00 178.31 176.30 1pd5 h LEU 117 N 0.28 0.10 -1.67 0.59 6.46 0.25 -0.52 115.31 120.80 1pd5 h LEU 117 Ca 0.72 -0.09 -0.03 0.00 -0.12 0.00 0.00 57.88 58.35 1pd5 h LEU 117 Cb 1.89 -0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 41.79 1pd5 h LEU 117 CO -0.45 0.97 -0.17 0.45 -0.62 0.00 0.00 178.44 178.62 1pd5 h HIS 118 N 0.03 0.00 0.08 1.25 3.86 -1.24 -2.03 115.15 117.10 1pd5 h HIS 118 Ca -0.03 0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 58.83 1pd5 h HIS 118 Cb 1.60 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 30.04 1pd5 h HIS 118 CO 0.01 0.17 -2.01 -0.89 0.86 0.00 0.00 177.93 176.07 1pd5 n ILE 119 N -3.61 1.70 -0.06 2.45 5.41 -0.41 -2.48 119.36 122.37 1pd5 n ILE 119 Ca -0.01 -0.68 -0.08 0.00 1.00 0.00 0.00 62.75 62.97 1pd5 n ILE 119 Cb 0.30 -1.52 -0.01 0.00 -0.71 0.00 0.00 39.64 37.70 1pd5 n ILE 119 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 176.55 176.77 1pd5 h TYR 120 N 0.05 0.14 -0.20 1.39 3.20 -1.07 0.43 116.97 120.90 1pd5 h TYR 120 Ca -0.42 0.01 -0.17 0.00 3.14 0.00 0.00 58.73 61.30 1pd5 h TYR 120 Cb 2.02 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 40.27 1pd5 h TYR 120 CO 0.05 0.06 -0.56 0.66 -1.64 0.00 0.00 178.16 176.74 1pd5 h SER 121 N 0.19 0.69 -0.46 -2.11 4.64 -1.53 0.33 113.55 115.30 1pd5 h SER 121 Ca 0.11 -0.38 0.09 0.00 -0.47 0.00 0.00 61.79 61.14 1pd5 h SER 121 Cb 0.09 -0.20 -0.08 0.00 -0.31 0.00 0.00 62.40 61.90 1pd5 h SER 121 CO -0.12 1.11 -0.05 -0.61 -0.87 0.00 0.00 176.83 176.29 1pd5 h GLN 122 N 0.48 0.06 -0.37 4.77 4.15 -1.28 0.29 115.11 123.22 1pd5 h GLN 122 Ca 0.01 -0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.45 1pd5 h GLN 122 Cb 1.12 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.76 1pd5 h GLN 122 CO 0.11 0.04 0.18 -0.44 -1.93 0.00 0.00 178.83 176.79 1pd5 h ASP 123 N 0.06 0.26 -0.28 -0.69 3.32 -0.36 0.44 116.42 119.18 1pd5 h ASP 123 Ca 0.22 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.23 1pd5 h ASP 123 Cb 0.34 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1pd5 h ASP 123 CO -0.42 0.19 -0.07 0.58 -1.72 0.00 0.00 179.24 177.80 1pd5 h VAL 124 N 0.37 1.28 -0.03 -1.35 2.07 -0.16 0.28 116.25 118.72 1pd5 h VAL 124 Ca 0.15 -1.10 0.03 0.00 0.82 0.00 0.00 66.70 66.60 1pd5 h VAL 124 Cb 0.07 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 1pd5 h VAL 124 CO -0.11 0.35 -0.14 0.00 0.02 0.00 0.00 177.57 177.69 1pd5 h ALA 125 N 0.78 -0.14 -0.89 1.67 0.00 -0.14 0.14 119.26 120.67 1pd5 h ALA 125 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1pd5 h ALA 125 Cb 0.55 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1pd5 h ALA 125 CO 0.03 -0.62 0.57 0.00 0.00 0.00 0.00 179.25 179.22 1pd5 n TYR 127 N -4.38 0.00 0.01 0.00 4.01 0.96 -4.84 117.16 112.92 1pd5 n TYR 127 Ca 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 1pd5 n TYR 127 Cb 0.04 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.09 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 1.09 -0.32 0.22 2.72 0.00 0.47 0.10 105.19 109.46 1pd5 n GLY 128 Ca 0.00 0.01 0.04 0.00 0.00 0.00 0.00 46.02 46.07 1pd5 n GLY 128 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pd5 n GLU 129 N -1.35 1.62 -2.91 1.61 -0.58 -1.26 -4.91 120.64 112.86 1pd5 n GLU 129 Ca -0.00 -0.66 -0.42 0.00 -0.42 0.00 0.00 57.16 55.66 1pd5 n GLU 129 Cb 0.20 -1.05 -0.05 0.00 -0.57 0.00 0.00 31.44 29.97 1pd5 n GLU 129 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1pd5 s ASN 130 N -1.01 6.61 0.00 1.62 3.84 0.28 -4.96 114.94 121.33 1pd5 s ASN 130 Ca 0.07 0.47 0.19 0.00 0.21 0.00 0.00 52.86 53.81 1pd5 s ASN 130 Cb 0.06 -2.42 0.97 0.00 -0.55 0.00 0.00 41.25 39.31 1pd5 s ASN 130 CO 0.16 -0.75 1.59 0.18 -2.79 0.00 0.00 177.10 175.50 1pd5 n LEU 131 N 6.50 0.00 -4.72 3.21 4.77 -1.26 -4.79 117.00 120.71 1pd5 n LEU 131 Ca 0.04 0.29 -0.35 0.00 -0.03 0.00 0.00 56.01 55.96 1pd5 n LEU 131 Cb 0.48 -0.29 0.10 0.00 -2.33 0.00 0.00 43.42 41.38 1pd5 n LEU 131 CO 0.55 -0.10 0.83 0.00 -1.33 0.00 0.00 177.39 177.33 1pd5 s ALA 132 N -2.57 2.10 0.16 -1.18 0.00 -1.26 -4.88 121.76 114.13 1pd5 s ALA 132 Ca 0.18 0.99 -0.14 0.00 0.00 0.00 0.00 51.96 52.99 1pd5 s ALA 132 Cb 0.13 -3.51 0.05 0.00 0.00 0.00 0.00 23.12 19.79 1pd5 s ALA 132 CO 0.29 -1.94 1.76 -0.92 0.00 0.00 0.00 175.76 174.96 1pd5 h TYR 133 N -0.22 0.72 -2.99 0.00 3.20 -1.89 -3.29 116.97 112.50 1pd5 h TYR 133 Ca -0.48 -0.02 -0.62 0.00 3.14 0.00 0.00 58.73 60.75 1pd5 h TYR 133 Cb 1.31 -0.23 -0.41 0.00 1.54 0.00 0.00 36.73 38.94 1pd5 h TYR 133 CO 0.45 0.55 -0.68 -0.06 -1.64 0.00 0.00 178.16 176.78 1pd5 s PHE 134 N -5.80 2.84 0.29 -3.82 0.40 -1.26 0.91 117.98 111.54 1pd5 s PHE 134 Ca -0.13 -3.00 0.01 0.00 -0.60 0.00 0.00 56.93 53.21 1pd5 s PHE 134 Cb 0.12 -2.29 0.55 0.00 0.51 0.00 0.00 43.02 41.91 1pd5 s PHE 134 CO 0.76 -0.66 1.85 -1.35 0.70 0.00 0.00 175.22 176.52 1pd5 h PRO 135 N 5.82 0.98 -0.68 0.24 0.11 -1.67 0.24 132.00 137.04 1pd5 h PRO 135 Ca 0.11 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1pd5 h PRO 135 Cb 0.83 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.72 1pd5 h PRO 135 CO 0.62 0.65 0.00 1.63 -0.21 0.00 0.00 178.00 180.69 1pd5 n LYS 136 N -4.59 3.92 0.00 1.05 5.02 -1.26 -5.02 118.16 117.28 1pd5 n LYS 136 Ca 0.18 -2.37 0.00 0.00 -2.02 0.00 0.00 58.31 54.10 1pd5 n LYS 136 Cb 0.33 -2.07 0.00 0.00 -0.02 0.00 0.00 35.03 33.26 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 0.49 -0.53 3.37 0.72 0.00 0.85 -4.90 105.19 105.20 1pd5 n GLY 137 Ca 0.21 -0.70 -0.19 0.00 0.00 0.00 0.00 46.02 45.33 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 0.00 1.75 0.27 1.61 -0.12 -1.26 -4.79 117.98 115.44 1pd5 s PHE 138 Ca 0.00 -0.73 0.04 0.00 -0.05 0.00 0.00 56.93 56.19 1pd5 s PHE 138 Cb 0.00 -0.96 -0.06 0.00 -0.63 0.00 0.00 43.02 41.37 1pd5 s PHE 138 CO 0.00 0.21 0.01 0.96 -0.05 0.00 0.00 175.22 176.34 1pd5 s ILE 139 N -3.12 1.18 0.16 -4.49 -4.36 -1.26 -5.06 121.20 104.25 1pd5 s ILE 139 Ca 0.27 -2.04 0.22 0.00 -0.26 0.00 0.00 60.65 58.84 1pd5 s ILE 139 Cb 0.03 -2.49 0.20 0.00 1.25 0.00 0.00 42.46 41.45 1pd5 s ILE 139 CO 0.09 -0.22 1.81 1.05 0.24 0.00 0.00 174.94 177.90 1pd5 h GLU 140 N 2.34 0.00 -2.14 0.37 4.11 -2.02 -3.34 114.58 113.90 1pd5 h GLU 140 Ca -0.39 0.00 -0.67 0.00 0.07 0.00 0.00 59.36 58.37 1pd5 h GLU 140 Cb 1.23 0.00 -0.37 0.00 0.50 0.00 0.00 28.75 30.12 1pd5 h GLU 140 CO 0.66 0.27 -0.05 0.27 0.07 0.00 0.00 179.01 180.24 1pd5 n ASN 141 N -3.46 5.58 -4.68 3.06 6.94 -1.26 -5.04 115.26 116.40 1pd5 n ASN 141 Ca -0.00 -3.71 -0.30 0.00 -0.02 0.00 0.00 54.58 50.56 1pd5 n ASN 141 Cb 0.45 -0.76 -0.08 0.00 -2.36 0.00 0.00 39.78 37.03 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 -3.78 2.49 0.41 -3.83 -1.94 -1.26 -1.09 119.30 110.32 1pd5 s MET 142 Ca 0.46 -0.89 0.06 0.00 -1.71 0.00 0.00 55.69 53.61 1pd5 s MET 142 Cb 0.29 -2.50 -0.07 0.00 2.01 0.00 0.00 34.83 34.56 1pd5 s MET 142 CO -0.17 0.52 0.02 -0.59 -0.01 0.00 0.00 175.02 174.79 1pd5 s PHE 143 N -1.36 2.34 -0.08 -0.03 -0.12 -0.03 -4.79 117.98 113.91 1pd5 s PHE 143 Ca 0.26 -0.76 0.04 0.00 -0.05 0.00 0.00 56.93 56.42 1pd5 s PHE 143 Cb -0.11 -1.68 -0.01 0.00 -0.63 0.00 0.00 43.02 40.58 1pd5 s PHE 143 CO 0.18 0.35 -0.21 -0.06 -0.05 0.00 0.00 175.22 175.43 1pd5 s PHE 144 N -2.82 2.56 -0.05 3.49 0.40 -0.53 0.54 117.98 121.58 1pd5 s PHE 144 Ca 0.31 -0.67 0.02 0.00 -0.60 0.00 0.00 56.93 55.98 1pd5 s PHE 144 Cb 0.08 -1.66 0.01 0.00 0.51 0.00 0.00 43.02 41.97 1pd5 s PHE 144 CO 0.15 -0.18 -0.08 0.08 0.70 0.00 0.00 175.22 175.89 1pd5 s VAL 145 N -0.09 0.78 -0.02 -0.44 1.01 0.05 -0.24 120.40 121.45 1pd5 s VAL 145 Ca -0.05 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.68 1pd5 s VAL 145 Cb -0.14 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.49 1pd5 s VAL 145 CO 0.04 0.27 -0.14 -0.55 0.00 0.00 0.00 175.10 174.72 1pd5 s SER 146 N 0.64 1.74 -0.11 3.32 0.15 -0.91 -2.10 113.70 116.43 1pd5 s SER 146 Ca -0.11 -0.27 -0.03 0.00 0.70 0.00 0.00 55.95 56.24 1pd5 s SER 146 Cb -0.13 -0.29 -0.03 0.00 -1.71 0.00 0.00 66.02 63.85 1pd5 s SER 146 CO 0.01 0.16 0.00 0.00 1.20 0.00 0.00 173.24 174.62 1pd5 s ALA 147 N -0.19 3.26 -0.40 5.45 0.00 -1.26 -0.74 121.76 127.88 1pd5 s ALA 147 Ca 0.03 -0.80 0.08 0.00 0.00 0.00 0.00 51.96 51.27 1pd5 s ALA 147 Cb -0.07 -1.57 0.25 0.00 0.00 0.00 0.00 23.12 21.73 1pd5 s ALA 147 CO 0.00 0.46 0.55 -1.71 0.00 0.00 0.00 175.76 175.06 1pd5 n ASN 148 N 2.61 -0.17 0.00 0.00 4.05 0.54 -4.89 115.26 117.40 1pd5 n ASN 148 Ca -0.18 -2.74 0.09 0.00 0.45 0.00 0.00 54.58 52.20 1pd5 n ASN 148 Cb 0.53 -0.39 0.49 0.00 1.23 0.00 0.00 39.78 41.65 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 1.49 0.36 0.06 1.20 -0.04 -1.26 -2.61 135.00 134.21 1pd5 n PRO 149 Ca 0.20 0.08 -0.01 0.00 -0.04 0.00 0.00 63.50 63.74 1pd5 n PRO 149 Cb 0.54 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.44 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 0.00 0.00 -4.02 0.54 6.55 -1.92 -3.41 115.95 113.69 1pd5 h TRP 150 Ca 0.00 0.00 -0.48 0.00 0.95 0.00 0.00 58.89 59.36 1pd5 h TRP 150 Cb 0.12 0.00 -0.30 0.00 -0.86 0.00 0.00 29.16 28.12 1pd5 h TRP 150 CO 0.00 0.62 -0.81 0.08 -1.05 0.00 0.00 178.44 177.29 1pd5 s VAL 151 N -2.89 1.05 -0.91 1.49 1.01 -1.22 -4.87 120.40 114.06 1pd5 s VAL 151 Ca -0.01 -0.54 -0.05 0.00 0.00 0.00 0.00 61.98 61.39 1pd5 s VAL 151 Cb 0.08 -0.89 0.23 0.00 0.00 0.00 0.00 36.38 35.80 1pd5 s VAL 151 CO 0.79 0.30 0.82 -0.44 0.00 0.00 0.00 175.10 176.58 1pd5 s SER 152 N -0.10 6.34 0.34 3.32 0.01 -1.26 -0.24 113.70 122.10 1pd5 s SER 152 Ca 0.01 -3.46 -0.05 0.00 1.31 0.00 0.00 55.95 53.76 1pd5 s SER 152 Cb -0.07 -2.02 -0.05 0.00 0.21 0.00 0.00 66.02 64.09 1pd5 s SER 152 CO 0.00 -0.28 0.61 0.72 0.41 0.00 0.00 173.24 174.71 1pd5 s PHE 153 N -0.99 3.49 -1.45 2.43 -0.12 -1.26 -4.95 117.98 115.12 1pd5 s PHE 153 Ca 0.26 0.69 0.12 0.00 -0.05 0.00 0.00 56.93 57.94 1pd5 s PHE 153 Cb -0.10 -2.15 0.10 0.00 -0.63 0.00 0.00 43.02 40.24 1pd5 s PHE 153 CO -0.10 0.07 0.89 -2.37 -0.05 0.00 0.00 175.22 173.66 1pd5 n THR 154 N -1.25 0.04 -3.68 -4.49 5.66 -1.26 -4.66 114.28 104.64 1pd5 n THR 154 Ca -0.01 -0.52 -0.13 0.00 -3.05 0.00 0.00 64.05 60.34 1pd5 n THR 154 Cb 0.54 1.22 -0.08 0.00 -1.55 0.00 0.00 70.33 70.46 1pd5 n THR 154 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1pd5 s SER 155 N -0.98 -0.62 -0.01 1.09 0.15 -1.26 -4.90 113.70 107.16 1pd5 s SER 155 Ca 0.14 1.18 0.00 0.00 0.70 0.00 0.00 55.95 57.97 1pd5 s SER 155 Cb 0.10 1.17 0.01 0.00 -1.71 0.00 0.00 66.02 65.59 1pd5 s SER 155 CO 0.15 -0.20 -0.00 0.12 1.20 0.00 0.00 173.24 174.50 1pd5 s PHE 156 N 0.48 0.07 -0.14 3.44 5.36 -1.26 -5.11 117.98 120.82 1pd5 s PHE 156 Ca -0.01 0.01 -0.05 0.00 -0.96 0.00 0.00 56.93 55.92 1pd5 s PHE 156 Cb -0.04 -0.10 0.07 0.00 -0.34 0.00 0.00 43.02 42.60 1pd5 s PHE 156 CO -0.02 -0.02 0.28 -0.51 -1.46 0.00 0.00 175.22 173.49 1pd5 s ASP 157 N 0.23 0.19 0.08 6.13 1.01 -1.26 -4.74 116.67 118.31 1pd5 s ASP 157 Ca -0.02 0.65 -0.30 0.00 0.71 0.00 0.00 52.55 53.59 1pd5 s ASP 157 Cb -0.03 0.75 -0.05 0.00 1.01 0.00 0.00 42.92 44.60 1pd5 s ASP 157 CO -0.01 -0.23 0.97 -0.76 0.21 0.00 0.00 175.17 175.35 1pd5 s LEU 158 N 2.30 4.46 -0.59 1.23 1.43 -1.26 -5.03 118.68 121.22 1pd5 s LEU 158 Ca -0.01 1.75 0.01 0.00 -1.03 0.00 0.00 54.13 54.86 1pd5 s LEU 158 Cb -0.12 -3.58 0.15 0.00 0.03 0.00 0.00 46.19 42.67 1pd5 s LEU 158 CO -0.09 -0.12 0.37 0.21 0.23 0.00 0.00 176.35 176.95 1pd5 s ASN 159 N 0.30 4.80 0.08 2.29 3.04 -1.26 -4.97 114.94 119.23 1pd5 s ASN 159 Ca 0.48 -3.02 -0.31 0.00 0.04 0.00 0.00 52.86 50.06 1pd5 s ASN 159 Cb -0.23 -1.75 -0.08 0.00 -1.54 0.00 0.00 41.25 37.66 1pd5 s ASN 159 CO 0.29 -0.28 1.46 -0.69 -3.04 0.00 0.00 177.10 174.84 1pd5 s VAL 160 N -0.30 3.28 0.32 -5.21 1.01 -1.26 -4.95 120.40 113.30 1pd5 s VAL 160 Ca 0.18 0.84 0.02 0.00 0.00 0.00 0.00 61.98 63.02 1pd5 s VAL 160 Cb -0.22 -3.54 0.28 0.00 0.00 0.00 0.00 36.38 32.91 1pd5 s VAL 160 CO -0.03 0.04 1.93 0.00 0.00 0.00 0.00 175.10 177.04 1pd5 h ALA 161 N 7.32 1.57 -3.25 5.51 0.00 -2.07 -3.41 119.26 124.93 1pd5 h ALA 161 Ca -0.41 -0.02 -0.48 0.00 0.00 0.00 0.00 54.91 54.00 1pd5 h ALA 161 Cb 1.20 -0.25 -0.39 0.00 0.00 0.00 0.00 17.79 18.36 1pd5 h ALA 161 CO 0.89 0.30 -0.77 1.21 0.00 0.00 0.00 179.25 180.88 1pd5 s ASN 162 N -6.08 2.16 0.00 0.00 2.47 -1.26 -4.98 114.94 107.25 1pd5 s ASN 162 Ca -0.11 -0.39 0.02 0.00 0.42 0.00 0.00 52.86 52.80 1pd5 s ASN 162 Cb 0.20 -0.55 0.04 0.00 -1.45 0.00 0.00 41.25 39.49 1pd5 s ASN 162 CO 0.79 -0.23 0.77 1.15 -3.72 0.00 0.00 177.10 175.86 1pd5 n MET 163 N 5.08 0.79 -1.67 0.43 0.00 -1.26 -4.85 117.12 115.65 1pd5 n MET 163 Ca -0.08 -1.03 -0.48 0.00 0.00 0.00 0.00 57.70 56.10 1pd5 n MET 163 Cb 0.49 -1.05 -0.05 0.00 0.00 0.00 0.00 33.22 32.61 1pd5 n MET 163 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1pd5 n ASP 164 N -0.04 3.00 -1.33 3.17 8.00 -1.26 -0.36 116.55 127.74 1pd5 n ASP 164 Ca 0.02 1.05 -0.06 0.00 0.71 0.00 0.00 54.79 56.51 1pd5 n ASP 164 Cb 0.15 -1.36 -0.02 0.00 -0.02 0.00 0.00 41.12 39.87 1pd5 n ASP 164 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1pd5 n ASN 165 N 4.58 -1.70 -4.56 -2.24 3.02 -1.26 -4.88 115.26 108.23 1pd5 n ASN 165 Ca 0.20 0.17 -0.40 0.00 -0.03 0.00 0.00 54.58 54.52 1pd5 n ASN 165 Cb 0.27 -1.81 -0.03 0.00 -0.61 0.00 0.00 39.78 37.60 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 -1.61 2.37 -0.20 3.10 5.36 0.51 -4.69 117.98 122.82 1pd5 s PHE 166 Ca 0.00 -0.43 0.07 0.00 -0.96 0.00 0.00 56.93 55.61 1pd5 s PHE 166 Cb 0.00 -4.61 -0.08 0.00 -0.34 0.00 0.00 43.02 37.99 1pd5 s PHE 166 CO 0.00 -1.98 0.23 1.19 -1.46 0.00 0.00 175.22 173.20 1pd5 n PHE 167 N 9.57 0.00 -2.39 10.12 3.72 -1.26 -4.48 117.46 132.73 1pd5 n PHE 167 Ca 0.24 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.22 1pd5 n PHE 167 Cb 0.50 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.96 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 -1.93 3.52 0.42 4.37 0.00 -1.26 -4.68 121.76 122.20 1pd5 s ALA 168 Ca 0.01 0.69 -0.26 0.00 0.00 0.00 0.00 51.96 52.40 1pd5 s ALA 168 Cb 0.05 -3.54 -0.10 0.00 0.00 0.00 0.00 23.12 19.53 1pd5 s ALA 168 CO 0.28 -0.82 1.41 -2.30 0.00 0.00 0.00 175.76 174.33 1pd5 n PRO 169 N 5.28 2.31 -4.12 0.00 -0.02 -1.26 -4.82 135.00 132.37 1pd5 n PRO 169 Ca 0.12 0.82 -0.31 0.00 -2.02 0.00 0.00 63.50 62.11 1pd5 n PRO 169 Cb 0.45 -2.58 -0.16 0.00 -0.02 0.00 0.00 33.50 31.19 1pd5 n PRO 169 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pd5 s VAL 170 N -1.17 1.70 -0.02 -1.45 1.01 -0.88 -1.46 120.40 118.13 1pd5 s VAL 170 Ca 0.59 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.84 1pd5 s VAL 170 Cb -0.47 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 1pd5 s VAL 170 CO 0.60 0.48 0.05 -0.36 0.00 0.00 0.00 175.10 175.87 1pd5 s PHE 171 N 1.36 3.23 -0.08 5.22 0.40 0.67 -0.38 117.98 128.40 1pd5 s PHE 171 Ca 0.03 0.19 -0.00 0.00 -0.60 0.00 0.00 56.93 56.56 1pd5 s PHE 171 Cb -0.13 -1.74 0.02 0.00 0.51 0.00 0.00 43.02 41.68 1pd5 s PHE 171 CO -0.10 0.53 -0.06 0.99 0.70 0.00 0.00 175.22 177.28 1pd5 s THR 172 N -1.10 0.80 -0.20 0.64 2.01 0.90 -2.15 115.64 116.53 1pd5 s THR 172 Ca 0.20 -0.18 -0.13 0.00 0.31 0.00 0.00 61.69 61.88 1pd5 s THR 172 Cb -0.12 -0.84 -0.04 0.00 0.01 0.00 0.00 72.50 71.51 1pd5 s THR 172 CO 0.10 0.32 0.28 -0.04 -0.69 0.00 0.00 174.62 174.59 1pd5 s MET 173 N 1.50 4.17 0.06 4.92 -1.94 0.09 -0.04 119.30 128.05 1pd5 s MET 173 Ca -0.00 0.00 0.00 0.00 -1.71 0.00 0.00 55.69 53.98 1pd5 s MET 173 Cb -0.13 -3.50 0.01 0.00 2.01 0.00 0.00 34.83 33.22 1pd5 s MET 173 CO -0.04 0.09 0.08 0.41 -0.01 0.00 0.00 175.02 175.54 1pd5 n GLY 174 N 3.86 0.93 3.68 -0.03 0.00 0.20 -0.33 105.19 113.49 1pd5 n GLY 174 Ca -0.12 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 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 -2.54 4.39 0.48 1.61 2.20 0.67 -4.57 119.74 121.98 1pd5 s LYS 175 Ca 0.05 1.31 -0.19 0.00 -0.36 0.00 0.00 55.97 56.78 1pd5 s LYS 175 Cb -0.00 -3.55 -0.09 0.00 -1.51 0.00 0.00 37.83 32.68 1pd5 s LYS 175 CO 0.03 -0.34 0.99 1.52 -0.36 0.00 0.00 175.35 177.20 1pd5 s TYR 176 N 2.11 3.22 0.14 4.03 -0.85 -1.26 -4.45 117.35 120.29 1pd5 s TYR 176 Ca 0.46 1.56 -0.04 0.00 -0.52 0.00 0.00 57.07 58.52 1pd5 s TYR 176 Cb -0.18 -2.91 -0.03 0.00 0.38 0.00 0.00 41.96 39.22 1pd5 s TYR 176 CO 0.16 -0.48 0.15 1.52 -1.52 0.00 0.00 175.55 175.38 1pd5 s TYR 177 N -2.26 0.66 -0.11 -3.49 -0.85 0.99 -4.95 117.35 107.33 1pd5 s TYR 177 Ca 0.63 -1.04 -0.24 0.00 -0.52 0.00 0.00 57.07 55.90 1pd5 s TYR 177 Cb -0.12 -0.30 -0.03 0.00 0.38 0.00 0.00 41.96 41.89 1pd5 s TYR 177 CO 0.22 -0.60 0.76 0.99 -1.52 0.00 0.00 175.55 175.40 1pd5 s THR 178 N -4.01 4.97 0.05 -3.49 2.01 -1.26 0.09 115.64 114.00 1pd5 s THR 178 Ca 0.21 1.53 0.01 0.00 0.31 0.00 0.00 61.69 63.75 1pd5 s THR 178 Cb 0.06 -4.09 -0.03 0.00 0.01 0.00 0.00 72.50 68.45 1pd5 s THR 178 CO 0.01 0.15 -0.05 -1.58 -0.69 0.00 0.00 174.62 172.45 1pd5 s GLN 179 N 1.42 0.55 0.00 4.92 0.74 -0.33 -4.96 119.66 122.00 1pd5 s GLN 179 Ca 0.38 -0.92 0.00 0.00 0.05 0.00 0.00 55.36 54.87 1pd5 s GLN 179 Cb -0.17 -0.08 0.00 0.00 1.10 0.00 0.00 33.01 33.86 1pd5 s GLN 179 CO 0.16 -0.02 0.00 0.41 -0.55 0.00 0.00 175.29 175.29 1pd5 n GLY 180 N 0.94 1.58 2.12 2.59 0.00 -1.26 0.52 105.19 111.68 1pd5 n GLY 180 Ca -0.19 0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 1pd5 n GLY 180 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1pd5 n ASP 181 N 0.81 4.64 -4.61 1.61 5.68 -1.26 -4.98 116.55 118.44 1pd5 n ASP 181 Ca 0.00 -3.61 -0.34 0.00 -0.50 0.00 0.00 54.79 50.34 1pd5 n ASP 181 Cb 0.00 -0.36 -0.11 0.00 -1.14 0.00 0.00 41.12 39.51 1pd5 n ASP 181 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1pd5 s LYS 182 N -3.61 2.97 -0.30 0.11 1.02 0.18 -5.02 119.74 115.11 1pd5 s LYS 182 Ca 0.49 -0.48 -0.13 0.00 0.02 0.00 0.00 55.97 55.87 1pd5 s LYS 182 Cb 0.40 -2.72 -0.04 0.00 -0.52 0.00 0.00 37.83 34.96 1pd5 s LYS 182 CO 0.02 0.62 0.26 0.08 -0.92 0.00 0.00 175.35 175.41 1pd5 s VAL 183 N -0.68 5.26 0.05 3.17 1.01 -1.26 -1.19 120.40 126.76 1pd5 s VAL 183 Ca 0.11 0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.31 1pd5 s VAL 183 Cb -0.12 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 1pd5 s VAL 183 CO 0.02 0.14 -0.07 -0.76 0.00 0.00 0.00 175.10 174.43 1pd5 s LEU 184 N 1.86 3.15 -0.09 3.92 1.43 0.11 0.11 118.68 129.17 1pd5 s LEU 184 Ca 0.09 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 1pd5 s LEU 184 Cb -0.16 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.21 1pd5 s LEU 184 CO 0.11 0.23 -0.07 -0.32 0.23 0.00 0.00 176.35 176.53 1pd5 s MET 185 N -1.80 1.30 0.19 1.70 1.75 0.19 -0.01 119.30 122.62 1pd5 s MET 185 Ca 0.20 -0.20 -0.31 0.00 -1.25 0.00 0.00 55.69 54.13 1pd5 s MET 185 Cb -0.11 -1.34 -0.09 0.00 2.84 0.00 0.00 34.83 36.13 1pd5 s MET 185 CO 0.11 -0.19 1.41 -2.14 -0.65 0.00 0.00 175.02 173.56 1pd5 s PRO 186 N 1.43 4.31 -0.04 4.11 0.02 -1.26 0.48 135.00 144.05 1pd5 s PRO 186 Ca -0.01 2.19 -0.00 0.00 0.02 0.00 0.00 61.00 63.19 1pd5 s PRO 186 Cb -0.13 -3.17 0.03 0.00 0.02 0.00 0.00 34.50 31.24 1pd5 s PRO 186 CO -0.04 -0.40 0.01 -1.17 -0.33 0.00 0.00 177.00 175.07 1pd5 s LEU 187 N 0.25 0.94 0.10 -5.54 2.96 -0.00 -0.63 118.68 116.75 1pd5 s LEU 187 Ca 0.61 -0.02 0.09 0.00 -0.22 0.00 0.00 54.13 54.58 1pd5 s LEU 187 Cb -0.39 -0.25 -0.03 0.00 0.50 0.00 0.00 46.19 46.01 1pd5 s LEU 187 CO 0.37 -0.13 -0.22 0.00 -1.32 0.00 0.00 176.35 175.05 1pd5 s ALA 188 N 1.32 1.90 -0.07 5.97 0.00 0.94 -0.52 121.76 131.29 1pd5 s ALA 188 Ca -0.06 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.63 1pd5 s ALA 188 Cb -0.13 -0.29 0.03 0.00 0.00 0.00 0.00 23.12 22.73 1pd5 s ALA 188 CO -0.02 0.40 0.01 -1.50 0.00 0.00 0.00 175.76 174.64 1pd5 s ILE 189 N -1.09 0.34 -0.15 0.00 1.10 -0.23 -0.07 121.20 121.10 1pd5 s ILE 189 Ca 0.08 0.12 -0.07 0.00 -0.51 0.00 0.00 60.65 60.26 1pd5 s ILE 189 Cb -0.10 -0.52 -0.04 0.00 0.15 0.00 0.00 42.46 41.95 1pd5 s ILE 189 CO 0.04 0.23 0.11 -1.58 -2.11 0.00 0.00 174.94 171.63 1pd5 s GLN 190 N 1.99 3.68 0.29 3.50 -0.44 0.49 -1.95 119.66 127.21 1pd5 s GLN 190 Ca 0.05 -0.21 -0.06 0.00 -2.50 0.00 0.00 55.36 52.64 1pd5 s GLN 190 Cb -0.12 -3.22 -0.01 0.00 -1.64 0.00 0.00 33.01 28.02 1pd5 s GLN 190 CO -0.05 0.57 0.41 0.14 0.50 0.00 0.00 175.29 176.86 1pd5 s VAL 191 N -0.44 0.00 -0.04 1.34 -7.23 -0.28 -2.06 120.40 111.69 1pd5 s VAL 191 Ca 0.11 -1.61 0.03 0.00 -1.81 0.00 0.00 61.98 58.71 1pd5 s VAL 191 Cb -0.12 -2.47 -0.03 0.00 0.56 0.00 0.00 36.38 34.33 1pd5 s VAL 191 CO 0.02 0.00 -0.11 -2.28 -0.31 0.00 0.00 175.10 172.41 1pd5 s HIS 192 N -3.57 2.78 -0.05 2.82 2.46 -1.26 -2.26 115.29 116.20 1pd5 s HIS 192 Ca 0.29 -0.10 0.26 0.00 0.47 0.00 0.00 55.06 55.98 1pd5 s HIS 192 Cb 0.01 -1.63 0.82 0.00 -0.13 0.00 0.00 32.58 31.65 1pd5 s HIS 192 CO 0.15 0.26 1.78 1.25 -2.47 0.00 0.00 174.74 175.71 1pd5 h HIS 193 N 5.12 0.00 -0.63 3.88 2.76 -1.45 -1.26 115.15 123.57 1pd5 h HIS 193 Ca -0.47 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 57.65 1pd5 h HIS 193 Cb 1.16 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 30.09 1pd5 h HIS 193 CO 0.53 0.13 0.21 0.00 -1.30 0.00 0.00 177.93 177.50 1pd5 h ALA 194 N 1.87 0.82 0.00 5.26 0.00 -1.81 -3.16 119.26 122.25 1pd5 h ALA 194 Ca -0.00 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.55 1pd5 h ALA 194 Cb 0.81 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1pd5 h ALA 194 CO 0.02 0.48 -1.46 1.33 0.00 0.00 0.00 179.25 179.62 1pd5 n VAL 195 N -4.39 1.10 -3.90 0.00 0.24 -1.16 -4.37 118.33 105.85 1pd5 n VAL 195 Ca 0.04 -0.68 -0.27 0.00 -2.04 0.00 0.00 64.34 61.39 1pd5 n VAL 195 Cb 0.20 -0.66 -0.17 0.00 -1.47 0.00 0.00 33.84 31.74 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 1.69 6.31 0.09 0.00 -0.00 -1.26 -4.10 116.67 119.40 1pd5 s ASP 197 Ca 0.04 0.18 -0.03 0.00 -0.00 0.00 0.00 52.55 52.75 1pd5 s ASP 197 Cb -0.13 -1.91 0.14 0.00 -0.00 0.00 0.00 42.92 41.02 1pd5 s ASP 197 CO -0.08 -0.13 0.50 0.61 -0.00 0.00 0.00 175.17 176.07 1pd5 n GLY 198 N -1.49 -0.55 0.22 0.21 0.00 -1.26 0.13 105.19 102.46 1pd5 n GLY 198 Ca -0.08 0.34 -0.13 0.00 0.00 0.00 0.00 46.02 46.16 1pd5 n GLY 198 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1pd5 h PHE 199 N 0.00 0.90 -0.07 1.61 3.04 -1.98 -1.24 116.94 119.19 1pd5 h PHE 199 Ca 0.15 -0.34 -0.01 0.00 3.98 0.00 0.00 57.97 61.75 1pd5 h PHE 199 Cb 0.23 -0.16 -0.00 0.00 2.56 0.00 0.00 35.95 38.58 1pd5 h PHE 199 CO -0.25 1.13 0.01 0.45 -2.02 0.00 0.00 178.31 177.63 1pd5 h HIS 200 N 0.52 0.14 -0.34 0.41 -0.00 -0.70 0.90 115.15 116.07 1pd5 h HIS 200 Ca -0.01 -0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.37 1pd5 h HIS 200 Cb 1.20 -0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 28.56 1pd5 h HIS 200 CO 0.06 0.36 0.23 0.28 -0.00 0.00 0.00 177.93 178.86 1pd5 h VAL 201 N -0.13 1.04 0.17 2.45 2.07 -1.32 0.45 116.25 120.98 1pd5 h VAL 201 Ca 0.02 -0.13 -0.26 0.00 0.82 0.00 0.00 66.70 67.15 1pd5 h VAL 201 Cb 0.30 0.62 0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1pd5 h VAL 201 CO 0.00 0.07 -1.23 1.23 0.02 0.00 0.00 177.57 177.67 1pd5 h GLY 202 N 0.38 0.41 0.37 2.17 0.00 -0.49 0.41 103.07 106.33 1pd5 h GLY 202 Ca 0.14 -1.06 0.06 0.00 0.00 0.00 0.00 47.33 46.46 1pd5 h GLY 202 CO -0.03 0.93 -0.13 -0.09 0.00 0.00 0.00 176.54 177.22 1pd5 h ARG 203 N -0.17 -0.10 -0.37 4.80 2.43 0.91 -0.76 114.38 121.12 1pd5 h ARG 203 Ca -0.23 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 58.97 1pd5 h ARG 203 Cb 1.86 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 31.40 1pd5 h ARG 203 CO 0.17 -0.06 0.17 1.98 -1.51 0.00 0.00 179.97 180.72 1pd5 h MET 204 N -0.10 0.35 -0.21 0.20 4.05 -0.76 -0.55 114.93 117.91 1pd5 h MET 204 Ca 0.13 -0.02 -0.04 0.00 -0.28 0.00 0.00 59.70 59.49 1pd5 h MET 204 Cb 0.30 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.01 1pd5 h MET 204 CO -0.31 0.23 -0.04 -0.07 0.23 0.00 0.00 176.91 176.95 1pd5 h LEU 205 N 0.36 0.30 -0.20 3.39 3.38 0.12 -1.14 115.31 121.51 1pd5 h LEU 205 Ca 0.16 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1pd5 h LEU 205 Cb 0.08 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1pd5 h LEU 205 CO -0.12 0.39 0.01 0.78 0.09 0.00 0.00 178.44 179.59 1pd5 h ASN 206 N 0.31 0.34 -0.84 -0.43 2.35 -0.68 -2.69 115.58 113.94 1pd5 h ASN 206 Ca 0.07 -0.29 0.11 0.00 -0.55 0.00 0.00 56.30 55.64 1pd5 h ASN 206 Cb 0.28 -0.09 -0.06 0.00 0.05 0.00 0.00 38.32 38.50 1pd5 h ASN 206 CO 0.01 0.55 0.55 -0.33 -1.65 0.00 0.00 177.43 176.56 1pd5 h GLU 207 N 0.12 0.71 -0.70 0.81 5.08 -0.67 -1.20 114.58 118.73 1pd5 h GLU 207 Ca 0.06 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1pd5 h GLU 207 Cb 0.37 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 1pd5 h GLU 207 CO 0.01 0.47 0.46 1.25 -1.00 0.00 0.00 179.01 180.20 1pd5 h LEU 208 N 0.73 0.78 0.07 1.33 5.85 -1.08 0.60 115.31 123.60 1pd5 h LEU 208 Ca 0.40 -0.02 -0.29 0.00 0.84 0.00 0.00 57.88 58.82 1pd5 h LEU 208 Cb 0.55 -0.19 0.02 0.00 0.37 0.00 0.00 40.66 41.41 1pd5 h LEU 208 CO -0.17 0.56 -1.19 -0.61 -0.34 0.00 0.00 178.44 176.69 1pd5 h GLN 209 N 0.92 0.59 -0.28 1.25 5.75 -0.92 -1.43 115.11 121.00 1pd5 h GLN 209 Ca 0.26 -0.77 0.07 0.00 -0.15 0.00 0.00 58.65 58.06 1pd5 h GLN 209 Cb -0.07 0.25 -0.07 0.00 1.07 0.00 0.00 27.48 28.66 1pd5 h GLN 209 CO -0.06 1.34 -0.17 1.96 -2.65 0.00 0.00 178.83 179.25 1pd5 h GLN 210 N 0.28 -0.14 -0.24 1.69 4.20 -0.94 -2.53 115.11 117.43 1pd5 h GLN 210 Ca -0.17 0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.46 1pd5 h GLN 210 Cb 1.86 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 29.67 1pd5 h GLN 210 CO 0.23 -0.09 -0.19 1.88 -0.67 0.00 0.00 178.83 179.98 1pd5 h TYR 211 N -0.14 0.66 -0.77 2.96 -1.99 -0.70 -0.50 116.97 116.49 1pd5 h TYR 211 Ca 0.15 -0.19 0.15 0.00 2.00 0.00 0.00 58.73 60.85 1pd5 h TYR 211 Cb 0.37 -0.14 -0.10 0.00 2.00 0.00 0.00 36.73 38.86 1pd5 h TYR 211 CO -0.36 0.86 0.30 0.00 -0.00 0.00 0.00 178.16 178.97 1pd5 h ASP 213 N 0.42 0.00 0.00 0.00 3.32 -0.69 -3.17 116.42 116.30 1pd5 h ASP 213 Ca 0.43 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 57.12 1pd5 h ASP 213 Cb 0.68 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.16 1pd5 h ASP 213 CO -0.43 0.00 -2.34 -0.62 -1.72 0.00 0.00 179.24 174.13 1pd5 n GLU 214 N -2.98 0.74 -0.45 3.56 1.02 -0.44 -4.85 120.64 117.25 1pd5 n GLU 214 Ca 0.03 0.07 -0.18 0.00 -0.02 0.00 0.00 57.16 57.06 1pd5 n GLU 214 Cb 0.45 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.35 1pd5 n GLU 214 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 1pd5 n TRP 215 N -2.98 0.45 0.13 -0.32 -0.00 -0.07 -4.78 117.44 109.87 1pd5 n TRP 215 Ca -0.38 0.29 0.05 0.00 -0.00 0.00 0.00 57.50 57.47 1pd5 n TRP 215 Cb 1.03 -0.61 0.03 0.00 -0.00 0.00 0.00 31.31 31.77 1pd5 n TRP 215 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 177.69 179.65 1pd5 h GLN 216 N 1.54 0.00 0.00 5.87 1.08 -1.93 -3.48 115.11 118.20 1pd5 h GLN 216 Ca -0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.10 1pd5 h GLN 216 Cb 0.37 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 1pd5 h GLN 216 CO 0.27 0.31 0.00 0.41 -0.95 0.00 0.00 178.83 178.87