#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 2.69 0.36 3.38 0.00 -1.26 -5.06 107.32 107.43 1pd5 s GLY 7 Ca 0.00 0.80 0.05 0.00 0.00 0.00 0.00 44.72 45.56 1pd5 s GLY 7 CO 0.00 1.20 0.19 -2.52 0.00 0.00 0.00 173.10 171.97 1pd5 s TYR 8 N -1.70 1.73 0.13 1.90 -0.85 -1.26 -2.85 117.35 114.45 1pd5 s TYR 8 Ca 0.65 -1.44 0.10 0.00 -0.52 0.00 0.00 57.07 55.86 1pd5 s TYR 8 Cb -0.24 -0.94 -0.04 0.00 0.38 0.00 0.00 41.96 41.12 1pd5 s TYR 8 CO 0.29 -0.55 -0.23 0.95 -1.52 0.00 0.00 175.55 174.48 1pd5 s THR 9 N -3.37 2.51 -0.13 -3.49 -4.23 -0.41 -4.89 115.64 101.62 1pd5 s THR 9 Ca 0.32 -1.67 -0.11 0.00 -1.18 0.00 0.00 61.69 59.05 1pd5 s THR 9 Cb 0.03 -2.13 -0.05 0.00 1.34 0.00 0.00 72.50 71.69 1pd5 s THR 9 CO 0.20 0.08 0.23 -0.89 -0.54 0.00 0.00 174.62 173.70 1pd5 s THR 10 N -1.13 5.34 0.23 3.99 2.01 -1.26 -0.57 115.64 124.25 1pd5 s THR 10 Ca 0.16 0.42 -0.16 0.00 0.31 0.00 0.00 61.69 62.42 1pd5 s THR 10 Cb -0.10 -3.54 -0.08 0.00 0.01 0.00 0.00 72.50 68.79 1pd5 s THR 10 CO 0.08 0.51 0.66 -0.69 -0.69 0.00 0.00 174.62 174.49 1pd5 s VAL 11 N -0.34 4.72 -0.97 3.82 1.01 0.26 -4.94 120.40 123.96 1pd5 s VAL 11 Ca 0.16 0.98 -0.12 0.00 0.00 0.00 0.00 61.98 62.99 1pd5 s VAL 11 Cb -0.13 -3.74 0.24 0.00 0.00 0.00 0.00 36.38 32.75 1pd5 s VAL 11 CO 0.05 0.09 0.96 -0.62 0.00 0.00 0.00 175.10 175.58 1pd5 s ASP 12 N -1.90 7.00 0.30 3.32 3.68 -1.26 -4.77 116.67 123.04 1pd5 s ASP 12 Ca 0.45 -3.04 0.09 0.00 2.13 0.00 0.00 52.55 52.17 1pd5 s ASP 12 Cb -0.14 -2.23 0.90 0.00 -1.45 0.00 0.00 42.92 40.01 1pd5 s ASP 12 CO 0.20 -0.49 1.43 -0.38 0.13 0.00 0.00 175.17 176.06 1pd5 n ILE 13 N 3.56 -0.38 -0.02 4.11 -0.00 -1.26 -2.98 119.36 122.39 1pd5 n ILE 13 Ca 0.20 1.95 0.05 0.00 -0.00 0.00 0.00 62.75 64.94 1pd5 n ILE 13 Cb 0.44 -2.96 0.42 0.00 -0.00 0.00 0.00 39.64 37.53 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 0.49 -0.93 4.38 4.64 -2.01 -0.24 113.55 119.88 1pd5 h SER 14 Ca 0.64 -0.01 -0.49 0.00 -0.47 0.00 0.00 61.79 61.46 1pd5 h SER 14 Cb 1.49 -0.12 -0.29 0.00 -0.31 0.00 0.00 62.40 63.18 1pd5 h SER 14 CO -0.80 0.35 0.58 1.67 -0.87 0.00 0.00 176.83 177.76 1pd5 n GLN 15 N -4.47 2.22 -3.28 4.77 -0.06 -1.16 -4.98 117.38 110.42 1pd5 n GLN 15 Ca 0.04 -3.04 -0.40 0.00 -2.00 0.00 0.00 57.00 51.60 1pd5 n GLN 15 Cb 0.09 -2.14 -0.08 0.00 -4.06 0.00 0.00 30.24 24.05 1pd5 n GLN 15 CO 0.00 0.00 0.00 -0.46 -0.20 0.00 0.00 177.06 176.40 1pd5 s TRP 16 N -3.32 3.25 0.56 3.69 -0.00 -0.10 -4.89 118.94 118.13 1pd5 s TRP 16 Ca 0.56 0.53 0.41 0.00 -0.00 0.00 0.00 56.10 57.59 1pd5 s TRP 16 Cb 0.47 -2.70 1.58 0.00 -0.00 0.00 0.00 33.47 32.82 1pd5 s TRP 16 CO 0.09 -0.29 1.68 0.45 -0.00 0.00 0.00 176.95 178.88 1pd5 h HIS 17 N 8.11 0.00 -0.58 5.86 3.86 -1.94 0.92 115.15 131.38 1pd5 h HIS 17 Ca -0.30 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.91 1pd5 h HIS 17 Cb 1.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.62 1pd5 h HIS 17 CO 0.75 0.00 0.00 0.54 0.86 0.00 0.00 177.93 180.08 1pd5 n ARG 18 N -3.99 2.35 0.02 2.45 1.74 -1.26 -4.58 116.66 113.40 1pd5 n ARG 18 Ca 0.32 -2.10 -0.10 0.00 -0.77 0.00 0.00 57.85 55.20 1pd5 n ARG 18 Cb 1.54 -1.46 -0.04 0.00 -1.02 0.00 0.00 32.46 31.49 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 3.44 -0.20 -0.60 5.56 3.64 0.62 -0.85 116.57 128.18 1pd5 h LYS 19 Ca 0.00 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.48 1pd5 h LYS 19 Cb 0.79 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.58 1pd5 h LYS 19 CO 0.00 -0.13 0.23 0.93 -2.27 0.00 0.00 179.45 178.21 1pd5 h GLU 20 N -0.20 0.40 -0.13 1.90 5.08 -1.81 -2.93 114.58 116.89 1pd5 h GLU 20 Ca 0.07 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1pd5 h GLU 20 Cb 0.31 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1pd5 h GLU 20 CO -0.19 0.27 -0.06 0.45 -1.00 0.00 0.00 179.01 178.47 1pd5 h HIS 21 N 0.41 0.32 -0.36 4.33 3.86 -1.57 -1.05 115.15 121.08 1pd5 h HIS 21 Ca 0.30 -0.08 0.06 0.00 -1.16 0.00 0.00 60.37 59.49 1pd5 h HIS 21 Cb 0.35 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.73 1pd5 h HIS 21 CO -0.16 0.61 0.25 0.35 0.86 0.00 0.00 177.93 179.83 1pd5 h PHE 22 N -0.06 0.23 0.03 2.45 3.04 -1.14 0.69 116.94 122.17 1pd5 h PHE 22 Ca 0.03 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 61.98 1pd5 h PHE 22 Cb 0.52 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.96 1pd5 h PHE 22 CO 0.06 0.13 -0.01 0.93 -2.02 0.00 0.00 178.31 177.40 1pd5 h GLU 23 N 0.23 -0.04 -0.52 1.11 5.08 -1.27 0.16 114.58 119.34 1pd5 h GLU 23 Ca 0.16 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.59 1pd5 h GLU 23 Cb 0.34 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.55 1pd5 h GLU 23 CO -0.03 0.61 0.22 0.00 -1.00 0.00 0.00 179.01 178.81 1pd5 h ALA 24 N 0.17 0.65 0.00 3.43 0.00 -0.81 -2.90 119.26 119.79 1pd5 h ALA 24 Ca -0.00 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1pd5 h ALA 24 Cb 0.67 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1pd5 h ALA 24 CO 0.01 -0.16 -0.17 0.74 0.00 0.00 0.00 179.25 179.67 1pd5 h PHE 25 N 0.42 0.00 0.00 0.00 -1.00 -0.90 0.41 116.94 115.87 1pd5 h PHE 25 Ca 0.24 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.02 1pd5 h PHE 25 Cb 0.22 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.78 1pd5 h PHE 25 CO -0.14 0.17 0.00 1.04 -1.61 0.00 0.00 178.31 177.77 1pd5 n GLN 26 N -3.23 0.48 0.00 1.51 1.13 0.55 -3.47 117.38 114.34 1pd5 n GLN 26 Ca 0.01 0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.12 1pd5 n GLN 26 Cb 0.47 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.32 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 -1.16 0.00 -0.28 1.08 3.41 0.14 -4.85 113.62 111.97 1pd5 n SER 27 Ca 0.13 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.81 1pd5 n SER 27 Cb 0.13 0.00 0.19 0.00 -0.26 0.00 0.00 64.21 64.26 1pd5 n SER 27 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 1pd5 h VAL 28 N 0.00 0.28 -0.55 -3.33 -1.51 -1.76 -2.52 116.25 106.86 1pd5 h VAL 28 Ca 0.00 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.44 1pd5 h VAL 28 Cb 0.00 0.18 0.00 0.00 -2.13 0.00 0.00 31.29 29.34 1pd5 h VAL 28 CO 0.00 0.02 0.00 0.00 -1.23 0.00 0.00 177.57 176.36 1pd5 n ALA 29 N -2.98 3.02 -1.57 5.19 0.00 -0.97 -5.00 120.51 118.20 1pd5 n ALA 29 Ca 0.16 -1.68 -0.52 0.00 0.00 0.00 0.00 53.44 51.39 1pd5 n ALA 29 Cb 0.53 -0.90 -0.06 0.00 0.00 0.00 0.00 19.45 19.02 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 0.76 0.98 -3.59 0.00 7.27 -0.95 -4.70 117.38 117.14 1pd5 n GLN 30 Ca 0.24 0.35 -0.11 0.00 0.07 0.00 0.00 57.00 57.55 1pd5 n GLN 30 Cb 0.86 -1.93 -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 -3.69 2.89 0.13 0.00 -1.32 -1.26 -0.82 115.64 111.58 1pd5 s THR 32 Ca 0.02 -1.78 -0.20 0.00 -1.21 0.00 0.00 61.69 58.52 1pd5 s THR 32 Cb 0.01 -2.92 0.05 0.00 -1.51 0.00 0.00 72.50 68.13 1pd5 s THR 32 CO -0.11 -0.19 0.51 -0.72 -2.21 0.00 0.00 174.62 171.90 1pd5 s TYR 33 N -2.46 -0.38 -0.02 9.09 -0.85 0.18 -4.87 117.35 118.03 1pd5 s TYR 33 Ca 0.37 0.15 0.05 0.00 -0.52 0.00 0.00 57.07 57.12 1pd5 s TYR 33 Cb -0.02 0.41 -0.01 0.00 0.38 0.00 0.00 41.96 42.72 1pd5 s TYR 33 CO 0.22 -0.77 -0.18 -0.80 -1.52 0.00 0.00 175.55 172.50 1pd5 s ASN 34 N -2.70 2.12 0.10 -0.18 -0.87 -1.26 0.62 114.94 112.76 1pd5 s ASN 34 Ca 0.01 -0.33 0.03 0.00 -1.57 0.00 0.00 52.86 51.01 1pd5 s ASN 34 Cb 0.00 -0.32 -0.04 0.00 -0.02 0.00 0.00 41.25 40.88 1pd5 s ASN 34 CO -0.11 0.20 -0.10 -1.10 -2.57 0.00 0.00 177.10 173.42 1pd5 s GLN 35 N -0.31 0.83 -0.07 -0.60 -0.21 -0.98 -5.02 119.66 113.30 1pd5 s GLN 35 Ca 0.04 -1.16 0.02 0.00 0.02 0.00 0.00 55.36 54.28 1pd5 s GLN 35 Cb -0.08 -0.49 0.02 0.00 1.00 0.00 0.00 33.01 33.45 1pd5 s GLN 35 CO -0.00 0.07 -0.10 0.99 -2.12 0.00 0.00 175.29 174.13 1pd5 s THR 36 N -2.52 1.05 -0.03 -0.19 2.01 -1.26 -2.29 115.64 112.41 1pd5 s THR 36 Ca 0.05 -0.40 0.07 0.00 0.31 0.00 0.00 61.69 61.72 1pd5 s THR 36 Cb -0.02 -0.99 -0.02 0.00 0.01 0.00 0.00 72.50 71.47 1pd5 s THR 36 CO -0.00 0.35 -0.22 0.54 -0.69 0.00 0.00 174.62 174.59 1pd5 s VAL 37 N 0.92 2.39 -0.91 3.82 0.11 -0.29 -4.97 120.40 121.46 1pd5 s VAL 37 Ca -0.10 -0.98 -0.22 0.00 -2.93 0.00 0.00 61.98 57.75 1pd5 s VAL 37 Cb -0.15 -1.86 0.08 0.00 -1.53 0.00 0.00 36.38 32.92 1pd5 s VAL 37 CO 0.01 0.58 1.24 -1.10 -3.33 0.00 0.00 175.10 172.50 1pd5 s GLN 38 N -0.65 3.49 0.42 1.54 -1.52 -1.26 -0.60 119.66 121.08 1pd5 s GLN 38 Ca 0.10 -1.23 -0.26 0.00 -1.95 0.00 0.00 55.36 52.02 1pd5 s GLN 38 Cb -0.10 -4.92 -0.10 0.00 -0.22 0.00 0.00 33.01 27.67 1pd5 s GLN 38 CO -0.01 -1.98 1.41 -0.11 -0.25 0.00 0.00 175.29 174.35 1pd5 n LEU 39 N 7.89 4.70 -4.36 2.90 0.00 0.17 -4.69 117.00 123.62 1pd5 n LEU 39 Ca 0.21 1.15 -0.45 0.00 0.00 0.00 0.00 56.01 56.93 1pd5 n LEU 39 Cb 0.49 -1.58 -0.04 0.00 0.00 0.00 0.00 43.42 42.29 1pd5 n LEU 39 CO 0.60 -0.19 0.36 -0.62 0.00 0.00 0.00 177.39 177.55 1pd5 s ASP 40 N -0.37 6.21 -0.00 1.96 3.68 -1.26 -0.41 116.67 126.48 1pd5 s ASP 40 Ca 0.58 -1.58 0.13 0.00 2.13 0.00 0.00 52.55 53.82 1pd5 s ASP 40 Cb -0.48 -2.28 0.38 0.00 -1.45 0.00 0.00 42.92 39.10 1pd5 s ASP 40 CO 0.60 -1.04 1.32 2.30 0.13 0.00 0.00 175.17 178.48 1pd5 n ILE 41 N 5.42 1.02 -0.32 4.11 -5.35 -0.49 -4.67 119.36 119.07 1pd5 n ILE 41 Ca -0.09 -1.01 -0.03 0.00 -0.27 0.00 0.00 62.75 61.35 1pd5 n ILE 41 Cb 0.42 0.49 0.01 0.00 -1.74 0.00 0.00 39.64 38.82 1pd5 n ILE 41 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1pd5 n THR 42 N 0.75 -0.46 0.06 7.28 -1.04 -0.82 0.09 114.28 120.14 1pd5 n THR 42 Ca 0.15 1.95 -0.12 0.00 -2.04 0.00 0.00 64.05 63.98 1pd5 n THR 42 Cb 0.47 -2.53 -0.08 0.00 -1.82 0.00 0.00 70.33 66.37 1pd5 n THR 42 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1pd5 h ALA 43 N 0.97 -0.20 -0.38 2.41 0.00 -1.85 -2.16 119.26 118.05 1pd5 h ALA 43 Ca 0.25 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1pd5 h ALA 43 Cb 0.46 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 1pd5 h ALA 43 CO -0.81 -0.34 0.12 0.35 0.00 0.00 0.00 179.25 178.57 1pd5 h PHE 44 N -0.74 0.22 -0.73 0.00 3.57 -1.07 -0.47 116.94 117.72 1pd5 h PHE 44 Ca -0.02 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.50 1pd5 h PHE 44 Cb 0.52 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 1pd5 h PHE 44 CO 0.08 0.08 0.48 1.25 -2.23 0.00 0.00 178.31 177.97 1pd5 h LEU 45 N 0.27 0.85 -0.50 0.59 6.46 -0.40 -1.50 115.31 121.09 1pd5 h LEU 45 Ca 0.17 -0.03 0.10 0.00 -0.12 0.00 0.00 57.88 58.01 1pd5 h LEU 45 Cb 0.16 -0.21 -0.10 0.00 -0.73 0.00 0.00 40.66 39.78 1pd5 h LEU 45 CO -0.19 0.62 -0.16 0.11 -0.62 0.00 0.00 178.44 178.20 1pd5 h LYS 46 N 0.99 -0.05 -0.13 1.25 1.57 -0.43 -0.82 116.57 118.95 1pd5 h LYS 46 Ca 0.27 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.04 1pd5 h LYS 46 Cb -0.10 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1pd5 h LYS 46 CO -0.06 -0.03 0.06 1.15 -0.57 0.00 0.00 179.45 180.00 1pd5 h THR 47 N -0.05 1.14 0.00 -0.16 2.02 -0.59 0.16 112.91 115.44 1pd5 h THR 47 Ca 0.24 -0.43 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 1pd5 h THR 47 Cb 0.42 1.19 -0.00 0.00 -1.74 0.00 0.00 68.15 68.01 1pd5 h THR 47 CO -0.54 0.13 -0.12 0.58 0.37 0.00 0.00 175.52 175.94 1pd5 h VAL 48 N 0.07 0.90 0.09 3.16 2.07 -0.98 -1.75 116.25 119.81 1pd5 h VAL 48 Ca 0.04 -0.44 -0.27 0.00 0.82 0.00 0.00 66.70 66.85 1pd5 h VAL 48 Cb 0.16 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1pd5 h VAL 48 CO -0.00 0.12 -1.42 0.11 0.02 0.00 0.00 177.57 176.39 1pd5 h LYS 49 N 0.00 0.18 0.00 1.57 1.57 -0.84 -0.13 116.57 118.92 1pd5 h LYS 49 Ca -0.00 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 1pd5 h LYS 49 Cb 0.24 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1pd5 h LYS 49 CO 0.02 1.15 0.00 1.17 -0.57 0.00 0.00 179.45 181.21 1pd5 n LYS 50 N -3.99 0.00 -0.30 3.15 4.81 0.53 -4.49 118.16 117.87 1pd5 n LYS 50 Ca -0.27 0.17 -0.29 0.00 -0.87 0.00 0.00 58.31 57.04 1pd5 n LYS 50 Cb 0.86 -1.04 0.28 0.00 0.02 0.00 0.00 35.03 35.15 1pd5 n LYS 50 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1pd5 n ASN 51 N -0.76 -3.58 -3.35 3.14 3.02 -0.67 -4.85 115.26 108.20 1pd5 n ASN 51 Ca 0.00 -0.68 -0.28 0.00 -0.03 0.00 0.00 54.58 53.59 1pd5 n ASN 51 Cb 0.00 -1.04 -0.07 0.00 -0.61 0.00 0.00 39.78 38.06 1pd5 n ASN 51 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1pd5 n LYS 52 N -5.33 2.80 -2.08 3.52 5.02 -1.26 -4.77 118.16 116.05 1pd5 n LYS 52 Ca 0.10 -4.71 -0.31 0.00 -2.02 0.00 0.00 58.31 51.37 1pd5 n LYS 52 Cb 0.57 -2.27 -0.00 0.00 -0.02 0.00 0.00 35.03 33.31 1pd5 n LYS 52 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1pd5 s HIS 53 N -2.72 3.57 -0.17 2.13 3.76 -0.06 -5.03 115.29 116.77 1pd5 s HIS 53 Ca 0.41 1.31 -0.28 0.00 -0.15 0.00 0.00 55.06 56.35 1pd5 s HIS 53 Cb 0.17 -2.72 -0.00 0.00 1.11 0.00 0.00 32.58 31.14 1pd5 s HIS 53 CO -0.03 -0.56 0.99 0.15 -0.85 0.00 0.00 174.74 174.43 1pd5 s LYS 54 N -4.81 4.32 0.18 1.40 -0.14 -1.26 -4.83 119.74 114.62 1pd5 s LYS 54 Ca 0.56 1.30 -0.08 0.00 -1.36 0.00 0.00 55.97 56.39 1pd5 s LYS 54 Cb -0.11 -3.59 0.09 0.00 -1.68 0.00 0.00 37.83 32.54 1pd5 s LYS 54 CO 0.46 -0.46 1.59 0.35 -0.76 0.00 0.00 175.35 176.54 1pd5 h PHE 55 N 7.31 1.06 0.49 3.18 3.57 -1.95 -3.12 116.94 127.47 1pd5 h PHE 55 Ca -0.25 -0.24 -0.02 0.00 3.53 0.00 0.00 57.97 60.99 1pd5 h PHE 55 Cb 1.10 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.60 1pd5 h PHE 55 CO 0.73 1.03 -0.23 -0.92 -2.23 0.00 0.00 178.31 176.69 1pd5 h TYR 56 N 0.81 -0.61 -0.63 0.41 3.20 -1.99 -2.02 116.97 116.15 1pd5 h TYR 56 Ca 0.11 -0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.15 1pd5 h TYR 56 Cb 0.74 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 39.18 1pd5 h TYR 56 CO 0.05 -0.35 0.52 -1.35 -1.64 0.00 0.00 178.16 175.38 1pd5 h PRO 57 N -1.15 0.00 0.06 1.82 0.10 -1.99 0.34 132.00 131.17 1pd5 h PRO 57 Ca -0.07 0.00 -0.15 0.00 0.10 0.00 0.00 66.00 65.88 1pd5 h PRO 57 Cb 0.53 0.00 0.01 0.00 0.10 0.00 0.00 31.00 31.64 1pd5 h PRO 57 CO 0.11 0.00 -0.62 0.00 0.10 0.00 0.00 178.00 177.59 1pd5 h ALA 58 N 1.56 -0.00 -0.45 -0.75 0.00 -1.42 0.27 119.26 118.46 1pd5 h ALA 58 Ca 0.30 -0.61 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 1pd5 h ALA 58 Cb 1.33 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 1pd5 h ALA 58 CO -0.00 0.31 -0.04 0.35 0.00 0.00 0.00 179.25 179.87 1pd5 h PHE 59 N -0.31 0.91 -0.85 0.00 3.57 -0.63 -2.43 116.94 117.21 1pd5 h PHE 59 Ca -0.09 -0.17 0.01 0.00 3.53 0.00 0.00 57.97 61.25 1pd5 h PHE 59 Cb 1.40 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 39.86 1pd5 h PHE 59 CO 0.18 0.89 0.56 0.82 -2.23 0.00 0.00 178.31 178.53 1pd5 h ILE 60 N 0.67 1.20 -0.33 1.41 2.04 -0.26 -2.60 117.51 119.65 1pd5 h ILE 60 Ca 0.12 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 1pd5 h ILE 60 Cb 0.55 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 1pd5 h ILE 60 CO 0.03 0.21 0.18 -0.74 0.00 0.00 0.00 178.15 177.83 1pd5 h HIS 61 N 1.14 0.45 -0.56 1.37 2.76 -0.15 0.43 115.15 120.59 1pd5 h HIS 61 Ca 0.32 -0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.58 1pd5 h HIS 61 Cb -0.10 -0.14 -0.08 0.00 1.55 0.00 0.00 27.41 28.63 1pd5 h HIS 61 CO -0.00 0.36 0.10 0.82 -1.30 0.00 0.00 177.93 177.91 1pd5 h ILE 62 N 0.40 0.65 0.23 6.26 2.04 -1.14 1.40 117.51 127.35 1pd5 h ILE 62 Ca 0.11 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 1pd5 h ILE 62 Cb 0.06 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 1pd5 h ILE 62 CO -0.02 0.04 -0.11 -0.07 0.00 0.00 0.00 178.15 177.99 1pd5 h LEU 63 N 0.23 -0.26 -0.67 1.44 3.38 -1.11 -2.29 115.31 116.03 1pd5 h LEU 63 Ca 0.29 -0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.28 1pd5 h LEU 63 Cb 0.42 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.16 1pd5 h LEU 63 CO -0.39 -0.09 0.31 0.00 0.09 0.00 0.00 178.44 178.36 1pd5 h ALA 64 N 0.35 0.91 -0.90 1.53 0.00 0.50 0.11 119.26 121.74 1pd5 h ALA 64 Ca -0.03 0.06 0.21 0.00 0.00 0.00 0.00 54.91 55.15 1pd5 h ALA 64 Cb 0.31 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 17.96 1pd5 h ALA 64 CO 0.05 -0.09 0.43 0.00 0.00 0.00 0.00 179.25 179.64 1pd5 h ARG 65 N 0.54 0.46 0.02 0.00 3.08 0.23 -1.19 114.38 117.52 1pd5 h ARG 65 Ca 0.33 -0.03 -0.19 0.00 0.07 0.00 0.00 59.98 60.16 1pd5 h ARG 65 Cb 0.36 -0.10 0.02 0.00 0.08 0.00 0.00 29.97 30.32 1pd5 h ARG 65 CO -0.27 0.30 -0.75 -0.07 -1.07 0.00 0.00 179.97 178.11 1pd5 h LEU 66 N 0.47 0.62 -1.42 3.04 3.38 -0.35 -2.91 115.31 118.14 1pd5 h LEU 66 Ca 0.55 -0.78 0.07 0.00 0.09 0.00 0.00 57.88 57.81 1pd5 h LEU 66 Cb 1.00 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 1pd5 h LEU 66 CO -0.49 1.32 0.46 0.24 0.09 0.00 0.00 178.44 180.07 1pd5 h MET 67 N -0.02 0.68 -0.66 1.13 2.86 -0.65 -2.11 114.93 116.17 1pd5 h MET 67 Ca -0.10 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1pd5 h MET 67 Cb 1.46 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.97 1pd5 h MET 67 CO 0.15 0.45 0.00 0.09 1.06 0.00 0.00 176.91 178.65 1pd5 n ASN 68 N -4.48 3.67 -0.00 1.22 3.02 -0.48 -2.89 115.26 115.31 1pd5 n ASN 68 Ca 0.10 -2.00 0.08 0.00 -0.03 0.00 0.00 54.58 52.73 1pd5 n ASN 68 Cb 0.24 -0.44 -0.11 0.00 -0.61 0.00 0.00 39.78 38.86 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 1.52 3.15 -3.78 5.41 0.00 -0.94 -4.97 120.51 120.90 1pd5 n ALA 69 Ca 0.23 -0.40 -0.30 0.00 0.00 0.00 0.00 53.44 52.97 1pd5 n ALA 69 Cb 0.58 -0.56 -0.15 0.00 0.00 0.00 0.00 19.45 19.33 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 -2.86 1.89 0.37 0.00 3.76 -0.84 -5.02 115.29 112.60 1pd5 s HIS 70 Ca -0.01 -1.77 0.19 0.00 -0.15 0.00 0.00 55.06 53.32 1pd5 s HIS 70 Cb 0.11 -1.75 1.23 0.00 1.11 0.00 0.00 32.58 33.28 1pd5 s HIS 70 CO 0.66 -0.85 1.64 -1.35 -0.85 0.00 0.00 174.74 173.98 1pd5 h PRO 71 N 8.05 0.18 -0.06 8.40 0.11 -1.90 -1.68 132.00 145.10 1pd5 h PRO 71 Ca -0.13 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.98 1pd5 h PRO 71 Cb 1.03 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 1pd5 h PRO 71 CO 0.46 0.12 0.25 1.05 -0.21 0.00 0.00 178.00 179.67 1pd5 h GLU 72 N 0.19 0.00 -0.67 1.05 9.09 -1.92 0.19 114.58 122.50 1pd5 h GLU 72 Ca 0.78 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.19 1pd5 h GLU 72 Cb 2.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 29.11 1pd5 h GLU 72 CO -0.61 0.00 0.00 1.19 0.05 0.00 0.00 179.01 179.64 1pd5 n PHE 73 N -3.13 1.02 -1.56 2.06 3.01 -0.63 -4.16 117.46 114.07 1pd5 n PHE 73 Ca -0.01 -0.48 0.07 0.00 1.01 0.00 0.00 57.45 58.04 1pd5 n PHE 73 Cb 0.32 -0.05 0.18 0.00 -0.01 0.00 0.00 39.48 39.92 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 1.39 1.38 -3.28 -1.08 1.74 0.05 -4.55 116.66 112.30 1pd5 n ARG 74 Ca 0.23 -3.01 -0.28 0.00 -0.77 0.00 0.00 57.85 54.01 1pd5 n ARG 74 Cb 0.63 -1.46 -0.03 0.00 -1.02 0.00 0.00 32.46 30.58 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 -2.87 3.64 -0.08 5.56 -1.94 -1.26 -1.00 119.30 121.35 1pd5 s MET 75 Ca 0.36 0.03 -0.19 0.00 -1.71 0.00 0.00 55.69 54.18 1pd5 s MET 75 Cb 0.34 -2.62 0.04 0.00 2.01 0.00 0.00 34.83 34.60 1pd5 s MET 75 CO -0.05 0.18 0.44 0.00 -0.01 0.00 0.00 175.02 175.58 1pd5 s ALA 76 N -2.13 -1.11 -0.63 3.03 0.00 0.40 -4.52 121.76 116.79 1pd5 s ALA 76 Ca 0.44 0.87 -0.28 0.00 0.00 0.00 0.00 51.96 53.00 1pd5 s ALA 76 Cb -0.11 -0.23 0.02 0.00 0.00 0.00 0.00 23.12 22.80 1pd5 s ALA 76 CO 0.31 -0.27 1.35 -1.64 0.00 0.00 0.00 175.76 175.51 1pd5 s MET 77 N -0.75 3.26 -0.21 0.00 -1.94 -1.26 -0.93 119.30 117.46 1pd5 s MET 77 Ca -0.08 0.17 -0.06 0.00 -1.71 0.00 0.00 55.69 54.01 1pd5 s MET 77 Cb -0.03 -4.14 -0.03 0.00 2.01 0.00 0.00 34.83 32.64 1pd5 s MET 77 CO 0.04 -2.02 0.03 0.21 -0.01 0.00 0.00 175.02 173.27 1pd5 s LYS 78 N 5.59 3.66 -1.79 2.03 2.20 0.28 -4.75 119.74 126.96 1pd5 s LYS 78 Ca 0.45 -0.49 -0.18 0.00 -0.36 0.00 0.00 55.97 55.40 1pd5 s LYS 78 Cb -0.09 -3.17 0.18 0.00 -1.51 0.00 0.00 37.83 33.23 1pd5 s LYS 78 CO 0.21 -0.03 0.44 -0.25 -0.36 0.00 0.00 175.35 175.37 1pd5 n ASP 79 N 4.40 -1.10 0.00 1.43 10.43 -1.26 -0.67 116.55 129.77 1pd5 n ASP 79 Ca -0.17 -1.25 0.00 0.00 2.57 0.00 0.00 54.79 55.94 1pd5 n ASP 79 Cb 0.52 -1.59 0.00 0.00 1.84 0.00 0.00 41.12 41.89 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 -1.45 0.86 3.60 0.44 0.00 -1.26 -5.05 105.19 102.33 1pd5 n GLY 80 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.68 2.26 -0.27 1.61 0.41 0.15 -5.09 118.70 117.09 1pd5 s GLU 81 Ca 0.00 -0.95 -0.29 0.00 -0.41 0.00 0.00 54.97 53.32 1pd5 s GLU 81 Cb 0.00 -2.38 -0.00 0.00 -1.78 0.00 0.00 34.13 29.97 1pd5 s GLU 81 CO 0.00 0.52 1.29 -1.17 -0.49 0.00 0.00 175.26 175.41 1pd5 s LEU 82 N -2.15 3.96 0.12 1.80 2.96 -1.26 -0.56 118.68 123.55 1pd5 s LEU 82 Ca 0.22 1.33 0.07 0.00 -0.22 0.00 0.00 54.13 55.52 1pd5 s LEU 82 Cb -0.11 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 1pd5 s LEU 82 CO 0.14 -1.00 -0.16 0.54 -1.32 0.00 0.00 176.35 174.56 1pd5 s VAL 83 N 4.15 1.45 -0.22 1.68 0.11 -0.11 0.92 120.40 128.38 1pd5 s VAL 83 Ca 0.56 -1.69 0.01 0.00 -2.93 0.00 0.00 61.98 57.93 1pd5 s VAL 83 Cb -0.18 -1.55 0.05 0.00 -1.53 0.00 0.00 36.38 33.18 1pd5 s VAL 83 CO 0.21 -0.33 -0.09 -0.63 -3.33 0.00 0.00 175.10 170.92 1pd5 s ILE 84 N -1.90 1.72 0.61 7.04 1.01 0.26 -0.45 121.20 129.49 1pd5 s ILE 84 Ca 0.09 -1.18 -0.19 0.00 0.00 0.00 0.00 60.65 59.36 1pd5 s ILE 84 Cb -0.06 -1.85 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 1pd5 s ILE 84 CO 0.04 0.06 1.28 0.79 0.00 0.00 0.00 174.94 177.11 1pd5 n TRP 85 N 4.63 1.92 1.00 3.97 7.02 -0.17 -1.29 117.44 134.52 1pd5 n TRP 85 Ca -0.14 0.43 0.10 0.00 -1.02 0.00 0.00 57.50 56.87 1pd5 n TRP 85 Cb 0.45 -2.28 0.52 0.00 -2.42 0.00 0.00 31.31 27.58 1pd5 n TRP 85 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1pd5 n ASP 86 N -1.50 0.00 -3.41 -0.99 10.43 -1.13 -4.77 116.55 115.18 1pd5 n ASP 86 Ca 0.14 -0.10 0.01 0.00 2.57 0.00 0.00 54.79 57.41 1pd5 n ASP 86 Cb 0.47 -0.24 -0.04 0.00 1.84 0.00 0.00 41.12 43.14 1pd5 n ASP 86 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 1pd5 s SER 87 N -2.48 -0.46 0.22 -2.24 0.01 -1.26 -5.08 113.70 102.41 1pd5 s SER 87 Ca 0.21 0.65 0.04 0.00 1.31 0.00 0.00 55.95 58.16 1pd5 s SER 87 Cb 0.14 1.48 -0.03 0.00 0.21 0.00 0.00 66.02 67.81 1pd5 s SER 87 CO 0.29 -0.09 0.36 0.68 0.41 0.00 0.00 173.24 174.89 1pd5 s VAL 88 N 2.19 5.26 -0.05 3.43 -7.23 -1.26 -4.81 120.40 117.92 1pd5 s VAL 88 Ca -0.03 -0.84 0.04 0.00 -1.81 0.00 0.00 61.98 59.34 1pd5 s VAL 88 Cb -0.05 -3.82 0.00 0.00 0.56 0.00 0.00 36.38 33.07 1pd5 s VAL 88 CO -0.17 -0.28 -0.16 -1.00 -0.31 0.00 0.00 175.10 173.18 1pd5 s HIS 89 N -1.94 1.66 0.13 2.82 3.76 0.65 -4.69 115.29 117.67 1pd5 s HIS 89 Ca 0.35 -0.51 -0.31 0.00 -0.15 0.00 0.00 55.06 54.45 1pd5 s HIS 89 Cb -0.10 -1.13 -0.07 0.00 1.11 0.00 0.00 32.58 32.39 1pd5 s HIS 89 CO 0.29 -0.19 1.29 -1.25 -0.85 0.00 0.00 174.74 174.03 1pd5 s PRO 90 N 0.17 4.39 -0.19 8.40 0.04 -1.25 -2.55 135.00 144.00 1pd5 s PRO 90 Ca -0.06 1.95 -0.00 0.00 0.04 0.00 0.00 61.00 62.93 1pd5 s PRO 90 Cb -0.12 -3.27 0.01 0.00 0.04 0.00 0.00 34.50 31.16 1pd5 s PRO 90 CO 0.03 -0.30 -0.16 0.00 0.04 0.00 0.00 177.00 176.61 1pd5 s TYR 92 N 1.28 1.03 0.10 0.00 -0.85 0.79 -1.60 117.35 118.09 1pd5 s TYR 92 Ca 0.04 -1.14 -0.07 0.00 -0.52 0.00 0.00 57.07 55.38 1pd5 s TYR 92 Cb -0.14 -0.59 -0.06 0.00 0.38 0.00 0.00 41.96 41.56 1pd5 s TYR 92 CO -0.09 -0.38 0.37 0.95 -1.52 0.00 0.00 175.55 174.88 1pd5 s THR 93 N -3.87 5.16 0.11 -3.49 -4.23 -1.24 -1.90 115.64 106.19 1pd5 s THR 93 Ca 0.24 0.23 0.10 0.00 -1.18 0.00 0.00 61.69 61.08 1pd5 s THR 93 Cb 0.07 -3.62 -0.04 0.00 1.34 0.00 0.00 72.50 70.25 1pd5 s THR 93 CO 0.03 0.19 -0.25 -0.69 -0.54 0.00 0.00 174.62 173.36 1pd5 s VAL 94 N -1.50 2.11 0.05 2.29 1.01 0.21 -4.89 120.40 119.69 1pd5 s VAL 94 Ca 0.36 -1.64 0.09 0.00 0.00 0.00 0.00 61.98 60.79 1pd5 s VAL 94 Cb -0.13 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 1pd5 s VAL 94 CO 0.20 0.11 -0.26 0.12 0.00 0.00 0.00 175.10 175.27 1pd5 s PHE 95 N -1.03 2.32 -0.25 5.22 5.36 -1.26 -0.82 117.98 127.52 1pd5 s PHE 95 Ca 0.12 -0.41 0.02 0.00 -0.96 0.00 0.00 56.93 55.70 1pd5 s PHE 95 Cb -0.10 -1.38 0.05 0.00 -0.34 0.00 0.00 43.02 41.25 1pd5 s PHE 95 CO 0.05 0.14 -0.11 -1.01 -1.46 0.00 0.00 175.22 172.82 1pd5 s HIS 96 N -0.82 3.15 -0.16 10.12 3.76 0.13 -4.94 115.29 126.52 1pd5 s HIS 96 Ca 0.12 -2.08 0.17 0.00 -0.15 0.00 0.00 55.06 53.12 1pd5 s HIS 96 Cb -0.10 -1.95 -0.04 0.00 1.11 0.00 0.00 32.58 31.59 1pd5 s HIS 96 CO 0.02 -0.85 1.07 1.05 -0.85 0.00 0.00 174.74 175.19 1pd5 h GLU 97 N 7.85 0.00 0.00 1.40 4.11 -1.97 0.70 114.58 126.67 1pd5 h GLU 97 Ca -0.26 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.13 1pd5 h GLU 97 Cb 1.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 1pd5 h GLU 97 CO 0.51 0.31 -0.19 1.96 0.07 0.00 0.00 179.01 181.67 1pd5 h GLN 98 N 0.00 0.00 0.00 1.06 4.20 -1.96 -3.31 115.11 115.10 1pd5 h GLN 98 Ca -0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1pd5 h GLN 98 Cb 1.43 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.21 1pd5 h GLN 98 CO 0.04 0.19 -0.48 0.25 -0.67 0.00 0.00 178.83 178.16 1pd5 n THR 99 N -3.73 0.00 -3.07 -0.54 -2.24 -0.93 -4.98 114.28 98.79 1pd5 n THR 99 Ca -0.02 -0.32 -0.21 0.00 -2.27 0.00 0.00 64.05 61.24 1pd5 n THR 99 Cb 0.30 0.83 0.04 0.00 -2.10 0.00 0.00 70.33 69.40 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 -1.25 -5.12 -4.72 -0.78 1.02 0.24 -5.00 120.64 105.03 1pd5 n GLU 100 Ca 0.00 0.83 -0.32 0.00 -0.02 0.00 0.00 57.16 57.66 1pd5 n GLU 100 Cb 0.08 -5.58 -0.08 0.00 -0.02 0.00 0.00 31.44 25.83 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 -3.17 1.36 0.22 2.62 -4.23 -1.12 -4.99 115.64 106.33 1pd5 s THR 101 Ca 0.33 -1.99 0.01 0.00 -1.18 0.00 0.00 61.69 58.86 1pd5 s THR 101 Cb -0.15 -2.35 -0.05 0.00 1.34 0.00 0.00 72.50 71.29 1pd5 s THR 101 CO 0.41 0.00 0.06 0.72 -0.54 0.00 0.00 174.62 175.27 1pd5 s PHE 102 N -2.84 1.40 0.16 3.99 -0.12 -1.26 0.19 117.98 119.49 1pd5 s PHE 102 Ca 0.13 -1.12 0.05 0.00 -0.05 0.00 0.00 56.93 55.94 1pd5 s PHE 102 Cb 0.03 -0.81 -0.04 0.00 -0.63 0.00 0.00 43.02 41.57 1pd5 s PHE 102 CO 0.06 -0.29 -0.11 -1.12 -0.05 0.00 0.00 175.22 173.72 1pd5 s SER 103 N -3.25 1.92 -0.30 1.98 0.01 -0.00 -4.77 113.70 109.27 1pd5 s SER 103 Ca 0.32 -1.01 -0.09 0.00 1.31 0.00 0.00 55.95 56.48 1pd5 s SER 103 Cb 0.07 -0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.26 1pd5 s SER 103 CO 0.10 -0.30 0.13 -0.44 0.41 0.00 0.00 173.24 173.14 1pd5 s SER 104 N -3.19 5.45 0.04 2.44 0.01 -0.63 -0.62 113.70 117.20 1pd5 s SER 104 Ca 0.18 -0.52 0.08 0.00 1.31 0.00 0.00 55.95 57.00 1pd5 s SER 104 Cb 0.02 -1.98 -0.03 0.00 0.21 0.00 0.00 66.02 64.24 1pd5 s SER 104 CO 0.02 -0.18 -0.24 -0.22 0.41 0.00 0.00 173.24 173.03 1pd5 s LEU 105 N 1.60 2.32 0.27 2.44 2.96 -0.80 -4.03 118.68 123.44 1pd5 s LEU 105 Ca 0.04 -0.53 0.10 0.00 -0.22 0.00 0.00 54.13 53.53 1pd5 s LEU 105 Cb -0.17 -1.36 -0.05 0.00 0.50 0.00 0.00 46.19 45.11 1pd5 s LEU 105 CO 0.05 0.26 -0.08 -1.66 -1.32 0.00 0.00 176.35 173.61 1pd5 s TRP 106 N -0.84 2.54 0.03 5.38 1.48 -1.26 -0.15 118.94 126.12 1pd5 s TRP 106 Ca 0.13 -0.26 -0.01 0.00 -1.06 0.00 0.00 56.10 54.90 1pd5 s TRP 106 Cb -0.10 -1.12 -0.03 0.00 -1.16 0.00 0.00 33.47 31.06 1pd5 s TRP 106 CO 0.03 0.66 -0.02 -1.12 -4.06 0.00 0.00 176.95 172.43 1pd5 s SER 107 N -3.61 0.32 -0.02 -2.66 0.01 -1.15 -5.02 113.70 101.57 1pd5 s SER 107 Ca 0.31 -0.67 -0.30 0.00 1.31 0.00 0.00 55.95 56.60 1pd5 s SER 107 Cb -0.06 0.14 -0.03 0.00 0.21 0.00 0.00 66.02 66.28 1pd5 s SER 107 CO 0.18 -0.41 1.04 -0.70 0.41 0.00 0.00 173.24 173.76 1pd5 s GLU 108 N -2.32 4.49 0.42 12.44 2.12 -1.26 -3.85 118.70 130.73 1pd5 s GLU 108 Ca -0.08 1.49 -0.26 0.00 0.36 0.00 0.00 54.97 56.48 1pd5 s GLU 108 Cb -0.04 -3.47 -0.09 0.00 0.26 0.00 0.00 34.13 30.79 1pd5 s GLU 108 CO -0.04 -0.18 1.41 -0.47 -0.54 0.00 0.00 175.26 175.45 1pd5 s TYR 109 N 1.34 2.59 -0.07 5.30 5.04 -1.26 -4.91 117.35 125.39 1pd5 s TYR 109 Ca 0.53 1.27 -0.06 0.00 -2.44 0.00 0.00 57.07 56.37 1pd5 s TYR 109 Cb -0.22 -3.89 0.02 0.00 0.35 0.00 0.00 41.96 38.22 1pd5 s TYR 109 CO 0.25 -2.73 0.19 -1.58 -1.34 0.00 0.00 175.55 170.34 1pd5 s HIS 110 N -1.19 -0.21 0.25 4.97 5.65 -1.26 -5.05 115.29 118.46 1pd5 s HIS 110 Ca 0.57 0.51 -0.04 0.00 0.25 0.00 0.00 55.06 56.35 1pd5 s HIS 110 Cb -0.43 0.06 0.42 0.00 -1.18 0.00 0.00 32.58 31.45 1pd5 s HIS 110 CO 0.57 -0.10 1.79 0.22 -0.65 0.00 0.00 174.74 176.56 1pd5 h ASP 111 N 5.94 0.60 -3.50 9.88 1.82 -2.00 -3.40 116.42 125.76 1pd5 h ASP 111 Ca -0.26 0.06 -0.61 0.00 -0.39 0.00 0.00 57.03 55.82 1pd5 h ASP 111 Cb 1.19 -0.05 -0.12 0.00 0.68 0.00 0.00 39.33 41.04 1pd5 h ASP 111 CO 0.39 0.32 0.19 -0.62 -1.61 0.00 0.00 179.24 177.92 1pd5 s ASP 112 N -5.54 6.54 0.50 2.28 -1.08 -1.26 -4.93 116.67 113.18 1pd5 s ASP 112 Ca -0.12 0.54 0.17 0.00 -0.52 0.00 0.00 52.55 52.62 1pd5 s ASP 112 Cb 0.20 -2.34 1.24 0.00 -1.46 0.00 0.00 42.92 40.55 1pd5 s ASP 112 CO 0.78 -0.47 2.08 0.15 0.52 0.00 0.00 175.17 178.23 1pd5 h PHE 113 N 8.10 0.10 -0.02 -5.34 3.57 -1.86 0.15 116.94 121.63 1pd5 h PHE 113 Ca -0.26 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.24 1pd5 h PHE 113 Cb 1.12 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.82 1pd5 h PHE 113 CO 0.76 0.05 -0.00 -0.09 -2.23 0.00 0.00 178.31 176.80 1pd5 h ARG 114 N 0.10 0.04 -0.66 1.11 9.65 -1.92 0.19 114.38 122.88 1pd5 h ARG 114 Ca 0.11 -0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.03 1pd5 h ARG 114 Cb 0.32 -0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.84 1pd5 h ARG 114 CO -0.01 0.38 0.37 1.96 2.80 0.00 0.00 179.97 185.46 1pd5 h GLN 115 N -0.30 0.66 -0.44 0.20 1.08 -1.80 -2.74 115.11 111.78 1pd5 h GLN 115 Ca 0.01 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.13 1pd5 h GLN 115 Cb 0.36 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 1pd5 h GLN 115 CO 0.00 0.44 0.13 0.35 -0.95 0.00 0.00 178.83 178.80 1pd5 h PHE 116 N 0.68 0.71 -0.89 2.96 3.57 -0.49 -1.69 116.94 121.79 1pd5 h PHE 116 Ca 0.29 -0.07 0.23 0.00 3.53 0.00 0.00 57.97 61.95 1pd5 h PHE 116 Cb 0.18 -0.20 -0.16 0.00 2.79 0.00 0.00 35.95 38.55 1pd5 h PHE 116 CO -0.08 0.65 0.05 1.25 -2.23 0.00 0.00 178.31 177.95 1pd5 h LEU 117 N 0.57 -0.36 -0.56 0.59 6.46 -0.87 0.17 115.31 121.30 1pd5 h LEU 117 Ca 0.14 0.24 -0.11 0.00 -0.12 0.00 0.00 57.88 58.02 1pd5 h LEU 117 Cb 0.28 0.40 -0.02 0.00 -0.73 0.00 0.00 40.66 40.59 1pd5 h LEU 117 CO -0.00 -0.26 -0.10 -0.74 -0.62 0.00 0.00 178.44 176.72 1pd5 h HIS 118 N 0.08 1.17 0.34 1.25 2.76 -1.02 -2.12 115.15 117.60 1pd5 h HIS 118 Ca 0.52 -0.24 -0.02 0.00 -2.20 0.00 0.00 60.37 58.44 1pd5 h HIS 118 Cb 1.02 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.69 1pd5 h HIS 118 CO -0.44 1.07 -0.16 0.82 -1.30 0.00 0.00 177.93 177.92 1pd5 h ILE 119 N 0.93 0.68 -0.96 6.26 2.04 -0.56 0.02 117.51 125.93 1pd5 h ILE 119 Ca 0.15 -0.31 0.15 0.00 1.00 0.00 0.00 64.86 65.84 1pd5 h ILE 119 Cb 0.67 0.85 -0.09 0.00 -0.74 0.00 0.00 36.82 37.51 1pd5 h ILE 119 CO 0.05 0.06 0.57 0.22 0.00 0.00 0.00 178.15 179.05 1pd5 h TYR 120 N -0.63 1.01 0.00 1.37 3.20 -0.76 0.59 116.97 121.76 1pd5 h TYR 120 Ca -0.05 0.03 -0.21 0.00 3.14 0.00 0.00 58.73 61.64 1pd5 h TYR 120 Cb 0.45 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.38 1pd5 h TYR 120 CO -0.01 0.30 -1.14 0.77 -1.64 0.00 0.00 178.16 176.44 1pd5 h SER 121 N 0.81 0.00 -0.06 -2.11 0.02 -0.70 -1.37 113.55 110.14 1pd5 h SER 121 Ca 0.51 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.45 1pd5 h SER 121 Cb 0.67 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.21 1pd5 h SER 121 CO -0.33 0.90 -0.00 1.56 -1.14 0.00 0.00 176.83 177.82 1pd5 h GLN 122 N 0.00 0.11 -0.13 3.45 1.08 -0.09 -1.71 115.11 117.82 1pd5 h GLN 122 Ca -0.09 -0.03 0.05 0.00 -1.45 0.00 0.00 58.65 57.12 1pd5 h GLN 122 Cb 1.77 -0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 29.13 1pd5 h GLN 122 CO 0.10 0.39 -0.25 -0.44 -0.95 0.00 0.00 178.83 177.68 1pd5 h ASP 123 N -0.18 -0.77 -0.53 1.46 3.32 0.43 0.14 116.42 120.29 1pd5 h ASP 123 Ca 0.02 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1pd5 h ASP 123 Cb 0.34 0.34 -0.03 0.00 0.22 0.00 0.00 39.33 40.20 1pd5 h ASP 123 CO 0.00 -0.30 0.34 0.58 -1.72 0.00 0.00 179.24 178.15 1pd5 h VAL 124 N -0.32 1.15 0.09 -1.35 2.07 -1.30 0.29 116.25 116.89 1pd5 h VAL 124 Ca 0.10 -0.30 -0.27 0.00 0.82 0.00 0.00 66.70 67.05 1pd5 h VAL 124 Cb 0.46 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1pd5 h VAL 124 CO -0.31 0.15 -1.16 0.00 0.02 0.00 0.00 177.57 176.27 1pd5 h ALA 125 N 1.64 0.15 -0.11 1.67 0.00 -0.65 0.19 119.26 122.14 1pd5 h ALA 125 Ca 0.20 -0.79 -0.09 0.00 0.00 0.00 0.00 54.91 54.22 1pd5 h ALA 125 Cb -0.06 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1pd5 h ALA 125 CO -0.04 0.83 -0.35 0.00 0.00 0.00 0.00 179.25 179.69 1pd5 n TYR 127 N -4.08 0.00 0.33 0.00 4.01 1.00 -4.71 117.16 113.69 1pd5 n TYR 127 Ca -0.01 0.00 0.21 0.00 -0.16 0.00 0.00 57.90 57.94 1pd5 n TYR 127 Cb 0.43 0.00 1.11 0.00 -0.31 0.00 0.00 39.34 40.57 1pd5 n TYR 127 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1pd5 h GLY 128 N 0.00 0.00 -2.18 2.72 0.00 -0.78 0.91 103.07 103.74 1pd5 h GLY 128 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1pd5 h GLY 128 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.72 1pd5 n GLU 129 N -3.18 2.45 -2.88 4.80 -0.58 -1.26 -4.88 120.64 115.11 1pd5 n GLU 129 Ca -0.03 -2.17 -0.42 0.00 -0.42 0.00 0.00 57.16 54.12 1pd5 n GLU 129 Cb 0.11 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.43 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 -1.59 6.68 0.00 1.62 3.84 0.31 -4.94 114.94 120.86 1pd5 s ASN 130 Ca 0.37 0.63 0.21 0.00 0.21 0.00 0.00 52.86 54.28 1pd5 s ASN 130 Cb 0.22 -2.43 1.24 0.00 -0.55 0.00 0.00 41.25 39.73 1pd5 s ASN 130 CO 0.31 -0.72 1.65 0.18 -2.79 0.00 0.00 177.10 175.74 1pd5 n LEU 131 N 6.44 0.00 -4.67 3.21 4.77 -1.26 -4.87 117.00 120.62 1pd5 n LEU 131 Ca 0.05 0.04 -0.31 0.00 -0.03 0.00 0.00 56.01 55.75 1pd5 n LEU 131 Cb 0.48 -0.04 0.16 0.00 -2.33 0.00 0.00 43.42 41.70 1pd5 n LEU 131 CO 0.54 -0.01 0.69 0.00 -1.33 0.00 0.00 177.39 177.27 1pd5 n ALA 132 N -1.04 -0.73 -0.02 -1.18 0.00 -1.26 -4.89 120.51 111.39 1pd5 n ALA 132 Ca 0.15 -0.53 -0.13 0.00 0.00 0.00 0.00 53.44 52.93 1pd5 n ALA 132 Cb 0.08 -2.20 -0.09 0.00 0.00 0.00 0.00 19.45 17.24 1pd5 n ALA 132 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1pd5 h TYR 133 N -1.79 0.12 -3.11 0.00 3.20 -1.89 -3.38 116.97 110.13 1pd5 h TYR 133 Ca -0.43 -0.03 -0.63 0.00 3.14 0.00 0.00 58.73 60.78 1pd5 h TYR 133 Cb 1.27 -0.03 -0.42 0.00 1.54 0.00 0.00 36.73 39.10 1pd5 h TYR 133 CO 0.49 0.53 -0.54 -0.06 -1.64 0.00 0.00 178.16 176.95 1pd5 s PHE 134 N -4.38 3.60 0.36 -3.82 0.40 -1.26 -1.60 117.98 111.27 1pd5 s PHE 134 Ca -0.15 -3.32 0.08 0.00 -0.60 0.00 0.00 56.93 52.93 1pd5 s PHE 134 Cb 0.03 -2.75 0.79 0.00 0.51 0.00 0.00 43.02 41.60 1pd5 s PHE 134 CO 0.70 -0.56 1.89 -1.35 0.70 0.00 0.00 175.22 176.60 1pd5 h PRO 135 N 5.45 0.70 -0.75 0.24 0.11 -1.74 0.93 132.00 136.95 1pd5 h PRO 135 Ca 0.14 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.14 1pd5 h PRO 135 Cb 0.76 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 31.67 1pd5 h PRO 135 CO 0.73 0.46 0.09 1.63 -0.21 0.00 0.00 178.00 180.70 1pd5 n LYS 136 N -4.54 3.57 0.00 1.05 5.02 -1.26 -5.04 118.16 116.96 1pd5 n LYS 136 Ca 0.16 -2.36 0.00 0.00 -2.02 0.00 0.00 58.31 54.09 1pd5 n LYS 136 Cb 0.41 -2.05 0.00 0.00 -0.02 0.00 0.00 35.03 33.37 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 0.24 0.89 3.10 0.72 0.00 0.32 -4.80 105.19 105.66 1pd5 n GLY 137 Ca 0.26 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.57 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 0.16 0.46 1.61 -0.12 -1.26 -4.81 117.98 114.01 1pd5 s PHE 138 Ca 0.00 -0.39 0.05 0.00 -0.05 0.00 0.00 56.93 56.54 1pd5 s PHE 138 Cb 0.00 -0.12 -0.04 0.00 -0.63 0.00 0.00 43.02 42.23 1pd5 s PHE 138 CO 0.00 -0.32 0.10 0.96 -0.05 0.00 0.00 175.22 175.91 1pd5 s ILE 139 N -2.11 1.80 -0.13 -4.49 -4.36 -1.26 -5.06 121.20 105.59 1pd5 s ILE 139 Ca -0.09 -1.85 0.15 0.00 -0.26 0.00 0.00 60.65 58.59 1pd5 s ILE 139 Cb -0.04 -2.65 0.02 0.00 1.25 0.00 0.00 42.46 41.03 1pd5 s ILE 139 CO -0.02 0.00 1.36 -0.33 0.24 0.00 0.00 174.94 176.19 1pd5 h GLU 140 N 1.43 0.00 -2.19 0.37 5.08 -2.01 -3.36 114.58 113.89 1pd5 h GLU 140 Ca -0.43 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.24 1pd5 h GLU 140 Cb 1.27 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 30.17 1pd5 h GLU 140 CO 0.73 0.52 0.13 0.27 -1.00 0.00 0.00 179.01 179.66 1pd5 n ASN 141 N -3.20 5.86 -4.79 1.42 6.94 -1.26 -5.02 115.26 115.21 1pd5 n ASN 141 Ca 0.01 -3.70 -0.27 0.00 -0.02 0.00 0.00 54.58 50.59 1pd5 n ASN 141 Cb 0.76 -0.83 -0.06 0.00 -2.36 0.00 0.00 39.78 37.30 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 -3.86 2.86 0.22 -3.83 -1.94 -1.26 -0.25 119.30 111.24 1pd5 s MET 142 Ca 0.45 -0.86 0.10 0.00 -1.71 0.00 0.00 55.69 53.66 1pd5 s MET 142 Cb 0.27 -2.63 -0.05 0.00 2.01 0.00 0.00 34.83 34.43 1pd5 s MET 142 CO -0.16 0.49 -0.18 -0.59 -0.01 0.00 0.00 175.02 174.58 1pd5 s PHE 143 N -1.70 1.96 -0.09 -0.03 -0.12 -1.06 -4.75 117.98 112.19 1pd5 s PHE 143 Ca 0.30 -0.46 0.04 0.00 -0.05 0.00 0.00 56.93 56.77 1pd5 s PHE 143 Cb -0.10 -0.90 -0.01 0.00 -0.63 0.00 0.00 43.02 41.38 1pd5 s PHE 143 CO 0.23 0.48 -0.22 -0.06 -0.05 0.00 0.00 175.22 175.61 1pd5 s PHE 144 N -2.55 2.58 -0.34 3.49 0.40 -0.68 -1.22 117.98 119.66 1pd5 s PHE 144 Ca 0.24 -0.82 0.02 0.00 -0.60 0.00 0.00 56.93 55.77 1pd5 s PHE 144 Cb -0.04 -1.70 0.10 0.00 0.51 0.00 0.00 43.02 41.90 1pd5 s PHE 144 CO 0.10 -0.28 0.08 0.08 0.70 0.00 0.00 175.22 175.90 1pd5 s VAL 145 N 0.12 1.73 -0.06 -0.44 1.01 -0.63 0.44 120.40 122.58 1pd5 s VAL 145 Ca -0.11 -2.02 -0.04 0.00 0.00 0.00 0.00 61.98 59.81 1pd5 s VAL 145 Cb -0.16 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 1pd5 s VAL 145 CO 0.06 -0.64 0.12 -0.55 0.00 0.00 0.00 175.10 174.09 1pd5 s SER 146 N 1.12 6.06 -0.22 3.32 0.15 0.42 -3.58 113.70 120.98 1pd5 s SER 146 Ca 0.11 0.32 -0.11 0.00 0.70 0.00 0.00 55.95 56.96 1pd5 s SER 146 Cb -0.19 -1.87 -0.05 0.00 -1.71 0.00 0.00 66.02 62.21 1pd5 s SER 146 CO -0.14 0.33 0.18 0.00 1.20 0.00 0.00 173.24 174.82 1pd5 s ALA 147 N -1.13 3.63 -0.62 5.45 0.00 -1.26 -0.42 121.76 127.41 1pd5 s ALA 147 Ca 0.20 -0.75 0.06 0.00 0.00 0.00 0.00 51.96 51.46 1pd5 s ALA 147 Cb -0.12 -2.31 0.21 0.00 0.00 0.00 0.00 23.12 20.90 1pd5 s ALA 147 CO 0.10 -0.06 0.60 -1.71 0.00 0.00 0.00 175.76 174.68 1pd5 n ASN 148 N 4.00 2.77 0.13 0.00 4.05 0.46 -4.91 115.26 121.76 1pd5 n ASN 148 Ca -0.14 -3.19 0.11 0.00 0.45 0.00 0.00 54.58 51.80 1pd5 n ASN 148 Cb 0.52 -0.69 0.49 0.00 1.23 0.00 0.00 39.78 41.33 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 1.48 0.16 0.13 1.20 -0.04 -1.26 -3.41 135.00 133.25 1pd5 n PRO 149 Ca 0.25 0.48 0.12 0.00 -0.04 0.00 0.00 63.50 64.32 1pd5 n PRO 149 Cb 0.41 -1.86 0.19 0.00 -0.04 0.00 0.00 33.50 32.19 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 -3.59 0.54 6.55 -1.93 -3.38 115.95 114.14 1pd5 h TRP 150 Ca 0.00 0.00 -0.32 0.00 0.95 0.00 0.00 58.89 59.52 1pd5 h TRP 150 Cb 0.23 0.00 -0.32 0.00 -0.86 0.00 0.00 29.16 28.21 1pd5 h TRP 150 CO 0.00 0.00 -0.74 0.08 -1.05 0.00 0.00 178.44 176.73 1pd5 s VAL 151 N -3.21 0.16 -1.26 1.49 1.01 -1.25 -4.92 120.40 112.41 1pd5 s VAL 151 Ca 0.06 0.04 -0.09 0.00 0.00 0.00 0.00 61.98 62.00 1pd5 s VAL 151 Cb 0.10 -0.22 0.18 0.00 0.00 0.00 0.00 36.38 36.44 1pd5 s VAL 151 CO 0.69 0.11 1.85 -1.20 0.00 0.00 0.00 175.10 176.56 1pd5 n SER 152 N 3.81 5.25 -4.77 3.32 7.64 -1.26 -1.56 113.62 126.04 1pd5 n SER 152 Ca -0.23 -3.14 -0.34 0.00 1.01 0.00 0.00 58.87 56.17 1pd5 n SER 152 Cb 0.53 -1.46 0.02 0.00 -1.01 0.00 0.00 64.21 62.29 1pd5 n SER 152 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1pd5 s PHE 153 N 0.05 2.67 -0.75 1.43 -0.12 -1.26 -4.95 117.98 115.05 1pd5 s PHE 153 Ca 0.39 1.55 0.13 0.00 -0.05 0.00 0.00 56.93 58.94 1pd5 s PHE 153 Cb 0.09 -3.24 -0.10 0.00 -0.63 0.00 0.00 43.02 39.14 1pd5 s PHE 153 CO 0.01 -1.58 0.59 -2.37 -0.05 0.00 0.00 175.22 171.82 1pd5 n THR 154 N -1.69 0.00 -4.34 -4.49 5.66 -1.26 -4.69 114.28 103.47 1pd5 n THR 154 Ca 0.11 -0.24 -0.19 0.00 -3.05 0.00 0.00 64.05 60.68 1pd5 n THR 154 Cb 0.51 1.04 -0.14 0.00 -1.55 0.00 0.00 70.33 70.19 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 -2.06 1.24 -0.11 1.09 0.15 -1.26 -4.84 113.70 107.90 1pd5 s SER 155 Ca 0.06 -0.29 -0.04 0.00 0.70 0.00 0.00 55.95 56.38 1pd5 s SER 155 Cb 0.10 -0.10 0.05 0.00 -1.71 0.00 0.00 66.02 64.36 1pd5 s SER 155 CO 0.47 0.06 0.15 0.12 1.20 0.00 0.00 173.24 175.24 1pd5 s PHE 156 N -0.53 -0.12 -0.18 3.44 5.36 -1.26 -5.11 117.98 119.58 1pd5 s PHE 156 Ca 0.02 0.39 0.01 0.00 -0.96 0.00 0.00 56.93 56.39 1pd5 s PHE 156 Cb -0.06 -0.36 0.03 0.00 -0.34 0.00 0.00 43.02 42.30 1pd5 s PHE 156 CO 0.00 -0.35 -0.15 -0.51 -1.46 0.00 0.00 175.22 172.76 1pd5 s ASP 157 N 2.27 3.11 -0.15 6.13 1.01 -1.26 -4.78 116.67 122.98 1pd5 s ASP 157 Ca 0.04 -0.69 -0.26 0.00 0.71 0.00 0.00 52.55 52.34 1pd5 s ASP 157 Cb -0.13 -1.31 -0.01 0.00 1.01 0.00 0.00 42.92 42.47 1pd5 s ASP 157 CO -0.07 -0.07 0.88 -0.22 0.21 0.00 0.00 175.17 175.90 1pd5 s LEU 158 N 1.38 4.19 -0.43 1.23 2.96 -1.26 -5.02 118.68 121.73 1pd5 s LEU 158 Ca 0.03 1.27 0.01 0.00 -0.22 0.00 0.00 54.13 55.22 1pd5 s LEU 158 Cb -0.14 -3.32 0.12 0.00 0.50 0.00 0.00 46.19 43.35 1pd5 s LEU 158 CO -0.10 -0.42 0.18 0.21 -1.32 0.00 0.00 176.35 174.90 1pd5 s ASN 159 N 1.13 4.86 0.08 3.68 3.04 -1.26 -4.97 114.94 121.51 1pd5 s ASN 159 Ca 0.41 -2.37 -0.28 0.00 0.04 0.00 0.00 52.86 50.65 1pd5 s ASN 159 Cb -0.17 -1.71 -0.05 0.00 -1.54 0.00 0.00 41.25 37.78 1pd5 s ASN 159 CO 0.13 -0.39 0.90 0.54 -3.04 0.00 0.00 177.10 175.24 1pd5 s VAL 160 N 0.62 4.61 0.44 -5.21 0.11 -1.26 -4.95 120.40 114.75 1pd5 s VAL 160 Ca 0.12 1.92 0.12 0.00 -2.93 0.00 0.00 61.98 61.21 1pd5 s VAL 160 Cb -0.22 -4.25 0.20 0.00 -1.53 0.00 0.00 36.38 30.58 1pd5 s VAL 160 CO -0.05 0.32 2.01 0.00 -3.33 0.00 0.00 175.10 174.04 1pd5 h ALA 161 N 5.74 1.69 -2.81 1.54 0.00 -2.07 -3.37 119.26 119.98 1pd5 h ALA 161 Ca -0.43 -0.13 -0.60 0.00 0.00 0.00 0.00 54.91 53.76 1pd5 h ALA 161 Cb 1.21 -0.06 -0.40 0.00 0.00 0.00 0.00 17.79 18.54 1pd5 h ALA 161 CO 0.72 0.23 -0.79 -0.80 0.00 0.00 0.00 179.25 178.61 1pd5 s ASN 162 N -6.93 3.33 1.19 0.00 0.01 -1.26 -5.09 114.94 106.19 1pd5 s ASN 162 Ca -0.05 -2.43 -0.18 0.00 -0.71 0.00 0.00 52.86 49.48 1pd5 s ASN 162 Cb 0.16 -0.75 0.28 0.00 0.41 0.00 0.00 41.25 41.35 1pd5 s ASN 162 CO 0.71 -0.28 1.09 0.00 -1.51 0.00 0.00 177.10 177.10 1pd5 s MET 163 N 0.67 -1.10 0.00 -0.60 0.23 -1.26 -4.83 119.30 112.40 1pd5 s MET 163 Ca 0.18 0.09 0.00 0.00 -1.03 0.00 0.00 55.69 54.93 1pd5 s MET 163 Cb -0.23 -1.60 0.00 0.00 -1.53 0.00 0.00 34.83 31.47 1pd5 s MET 163 CO 0.00 -3.66 0.00 -0.25 -2.03 0.00 0.00 175.02 169.08 1pd5 n ASP 164 N -4.76 0.00 -1.53 -1.18 9.92 -1.26 -4.76 116.55 112.98 1pd5 n ASP 164 Ca 0.11 0.00 -0.16 0.00 -0.53 0.00 0.00 54.79 54.21 1pd5 n ASP 164 Cb 0.59 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 41.00 1pd5 n ASP 164 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1pd5 n ASN 165 N 0.00 -4.36 -4.53 -2.24 3.02 -1.26 -4.89 115.26 101.00 1pd5 n ASN 165 Ca 0.00 0.39 -0.43 0.00 -0.03 0.00 0.00 54.58 54.51 1pd5 n ASN 165 Cb 0.00 -3.94 -0.02 0.00 -0.61 0.00 0.00 39.78 35.22 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 -2.42 2.88 -0.35 3.10 5.36 -1.26 -4.69 117.98 120.59 1pd5 s PHE 166 Ca 0.00 -1.39 0.13 0.00 -0.96 0.00 0.00 56.93 54.70 1pd5 s PHE 166 Cb 0.00 -4.57 -0.17 0.00 -0.34 0.00 0.00 43.02 37.94 1pd5 s PHE 166 CO 0.00 -1.72 0.43 1.19 -1.46 0.00 0.00 175.22 173.66 1pd5 n PHE 167 N 7.74 0.00 -1.88 10.12 3.72 -1.26 -4.56 117.46 131.34 1pd5 n PHE 167 Ca 0.36 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.34 1pd5 n PHE 167 Cb 0.48 -0.13 -0.03 0.00 -0.94 0.00 0.00 39.48 38.86 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 -2.50 3.02 0.52 4.37 0.00 -1.26 -4.68 121.76 121.23 1pd5 s ALA 168 Ca 0.01 0.59 -0.22 0.00 0.00 0.00 0.00 51.96 52.34 1pd5 s ALA 168 Cb 0.09 -3.97 -0.06 0.00 0.00 0.00 0.00 23.12 19.19 1pd5 s ALA 168 CO 0.53 -2.36 1.27 -2.14 0.00 0.00 0.00 175.76 173.06 1pd5 s PRO 169 N 5.44 3.36 -0.22 0.00 0.02 -1.26 -4.82 135.00 137.52 1pd5 s PRO 169 Ca 0.84 2.02 0.01 0.00 0.02 0.00 0.00 61.00 63.90 1pd5 s PRO 169 Cb -0.28 -2.29 0.03 0.00 0.02 0.00 0.00 34.50 31.98 1pd5 s PRO 169 CO 0.34 -0.94 -0.15 0.08 -0.33 0.00 0.00 177.00 176.00 1pd5 s VAL 170 N -1.42 2.23 -0.02 3.83 1.01 -1.05 -1.69 120.40 123.28 1pd5 s VAL 170 Ca 0.69 -1.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.46 1pd5 s VAL 170 Cb -0.35 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 1pd5 s VAL 170 CO 0.41 0.29 0.09 -0.36 0.00 0.00 0.00 175.10 175.54 1pd5 s PHE 171 N 1.23 3.34 -0.07 5.22 0.40 0.17 -1.28 117.98 126.99 1pd5 s PHE 171 Ca -0.01 0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.58 1pd5 s PHE 171 Cb -0.16 -1.77 0.02 0.00 0.51 0.00 0.00 43.02 41.62 1pd5 s PHE 171 CO -0.09 0.57 -0.06 0.99 0.70 0.00 0.00 175.22 177.34 1pd5 s THR 172 N -1.17 0.73 -0.19 0.64 2.01 0.21 -0.43 115.64 117.44 1pd5 s THR 172 Ca 0.22 -0.18 -0.09 0.00 0.31 0.00 0.00 61.69 61.95 1pd5 s THR 172 Cb -0.12 -0.76 -0.05 0.00 0.01 0.00 0.00 72.50 71.58 1pd5 s THR 172 CO 0.13 0.29 0.11 -0.04 -0.69 0.00 0.00 174.62 174.42 1pd5 s MET 173 N 1.27 4.07 0.00 4.92 -1.94 0.44 -0.51 119.30 127.55 1pd5 s MET 173 Ca -0.05 -0.24 0.00 0.00 -1.71 0.00 0.00 55.69 53.69 1pd5 s MET 173 Cb -0.14 -3.35 0.00 0.00 2.01 0.00 0.00 34.83 33.36 1pd5 s MET 173 CO -0.02 0.34 0.00 0.41 -0.01 0.00 0.00 175.02 175.73 1pd5 n GLY 174 N 3.39 3.28 3.63 -0.03 0.00 0.09 -0.40 105.19 115.14 1pd5 n GLY 174 Ca -0.16 -2.08 -0.43 0.00 0.00 0.00 0.00 46.02 43.35 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 0.95 3.93 0.64 1.61 2.20 -0.60 -4.54 119.74 123.93 1pd5 s LYS 175 Ca 0.00 1.30 -0.18 0.00 -0.36 0.00 0.00 55.97 56.73 1pd5 s LYS 175 Cb 0.00 -3.88 -0.01 0.00 -1.51 0.00 0.00 37.83 32.43 1pd5 s LYS 175 CO 0.00 -1.10 1.25 1.52 -0.36 0.00 0.00 175.35 176.66 1pd5 s TYR 176 N 4.35 2.20 0.11 4.03 -0.85 -1.26 -4.43 117.35 121.50 1pd5 s TYR 176 Ca 0.57 1.51 -0.08 0.00 -0.52 0.00 0.00 57.07 58.55 1pd5 s TYR 176 Cb -0.17 -3.58 -0.01 0.00 0.38 0.00 0.00 41.96 38.58 1pd5 s TYR 176 CO 0.23 -2.61 0.20 1.52 -1.52 0.00 0.00 175.55 173.37 1pd5 s TYR 177 N -1.55 0.23 0.03 -3.49 -0.85 0.32 -4.96 117.35 107.09 1pd5 s TYR 177 Ca 0.80 -0.65 -0.19 0.00 -0.52 0.00 0.00 57.07 56.50 1pd5 s TYR 177 Cb -0.34 -0.08 -0.06 0.00 0.38 0.00 0.00 41.96 41.87 1pd5 s TYR 177 CO 0.38 -0.58 0.56 0.99 -1.52 0.00 0.00 175.55 175.38 1pd5 s THR 178 N -3.89 4.85 -0.24 -3.49 2.01 -1.26 0.81 115.64 114.42 1pd5 s THR 178 Ca 0.08 1.19 -0.04 0.00 0.31 0.00 0.00 61.69 63.24 1pd5 s THR 178 Cb 0.05 -3.90 0.08 0.00 0.01 0.00 0.00 72.50 68.74 1pd5 s THR 178 CO -0.08 0.49 0.10 -1.58 -0.69 0.00 0.00 174.62 172.86 1pd5 s GLN 179 N -0.66 0.29 1.32 4.92 0.74 -0.75 -4.93 119.66 120.59 1pd5 s GLN 179 Ca 0.29 -0.44 0.00 0.00 0.05 0.00 0.00 55.36 55.27 1pd5 s GLN 179 Cb -0.19 -1.63 0.00 0.00 1.10 0.00 0.00 33.01 32.30 1pd5 s GLN 179 CO 0.17 -0.84 0.00 0.41 -0.55 0.00 0.00 175.29 174.48 1pd5 n GLY 180 N 5.18 0.79 0.02 2.59 0.00 -1.26 -1.30 105.19 111.21 1pd5 n GLY 180 Ca -0.06 0.74 0.11 0.00 0.00 0.00 0.00 46.02 46.81 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 4.90 0.42 -4.91 1.61 10.43 -1.26 -4.97 116.55 122.76 1pd5 n ASP 181 Ca 0.00 -0.24 -0.28 0.00 2.57 0.00 0.00 54.79 56.84 1pd5 n ASP 181 Cb 0.00 1.40 -0.03 0.00 1.84 0.00 0.00 41.12 44.33 1pd5 n ASP 181 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1pd5 s LYS 182 N -3.32 3.60 -0.23 -1.24 -0.14 -0.42 -5.00 119.74 112.99 1pd5 s LYS 182 Ca -0.01 -0.05 -0.07 0.00 -1.36 0.00 0.00 55.97 54.48 1pd5 s LYS 182 Cb 0.14 -2.65 -0.03 0.00 -1.68 0.00 0.00 37.83 33.62 1pd5 s LYS 182 CO 0.87 0.20 0.05 0.08 -0.76 0.00 0.00 175.35 175.78 1pd5 s VAL 183 N -2.13 4.22 -0.08 3.17 1.01 -1.26 -1.80 120.40 123.53 1pd5 s VAL 183 Ca 0.43 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.23 1pd5 s VAL 183 Cb -0.11 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 1pd5 s VAL 183 CO 0.31 0.38 -0.15 -0.76 0.00 0.00 0.00 175.10 174.88 1pd5 s LEU 184 N 1.34 2.66 -0.14 3.92 1.43 0.24 -1.40 118.68 126.73 1pd5 s LEU 184 Ca 0.05 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 1pd5 s LEU 184 Cb -0.15 -1.55 0.02 0.00 0.03 0.00 0.00 46.19 44.54 1pd5 s LEU 184 CO 0.03 0.28 -0.13 -0.32 0.23 0.00 0.00 176.35 176.43 1pd5 s MET 185 N -0.32 2.14 0.18 1.70 1.75 0.45 0.12 119.30 125.32 1pd5 s MET 185 Ca 0.03 -0.50 -0.31 0.00 -1.25 0.00 0.00 55.69 53.66 1pd5 s MET 185 Cb -0.13 -1.99 -0.10 0.00 2.84 0.00 0.00 34.83 35.45 1pd5 s MET 185 CO 0.02 -0.24 1.55 -2.14 -0.65 0.00 0.00 175.02 173.57 1pd5 s PRO 186 N 1.52 4.22 -0.04 4.11 0.02 -1.26 0.44 135.00 144.01 1pd5 s PRO 186 Ca 0.05 2.36 -0.01 0.00 0.02 0.00 0.00 61.00 63.42 1pd5 s PRO 186 Cb -0.13 -3.14 0.03 0.00 0.02 0.00 0.00 34.50 31.28 1pd5 s PRO 186 CO -0.10 -0.58 0.04 -1.17 -0.33 0.00 0.00 177.00 174.85 1pd5 s LEU 187 N 0.89 0.52 0.14 -5.54 2.96 0.24 -0.73 118.68 117.15 1pd5 s LEU 187 Ca 0.68 0.03 0.08 0.00 -0.22 0.00 0.00 54.13 54.70 1pd5 s LEU 187 Cb -0.44 -0.19 -0.04 0.00 0.50 0.00 0.00 46.19 46.03 1pd5 s LEU 187 CO 0.33 -0.20 -0.07 0.00 -1.32 0.00 0.00 176.35 175.09 1pd5 s ALA 188 N 1.78 3.02 -0.16 5.97 0.00 0.34 -1.14 121.76 131.57 1pd5 s ALA 188 Ca 0.00 -1.33 -0.04 0.00 0.00 0.00 0.00 51.96 50.59 1pd5 s ALA 188 Cb -0.12 -0.89 0.08 0.00 0.00 0.00 0.00 23.12 22.19 1pd5 s ALA 188 CO -0.03 0.56 0.26 -1.50 0.00 0.00 0.00 175.76 175.05 1pd5 s ILE 189 N -1.47 -0.40 0.02 0.00 1.10 -0.97 0.66 121.20 120.14 1pd5 s ILE 189 Ca 0.24 0.13 -0.21 0.00 -0.51 0.00 0.00 60.65 60.30 1pd5 s ILE 189 Cb -0.10 -0.54 -0.06 0.00 0.15 0.00 0.00 42.46 41.91 1pd5 s ILE 189 CO 0.15 0.00 0.62 0.00 -2.11 0.00 0.00 174.94 173.61 1pd5 s GLN 190 N 2.40 4.33 0.21 3.50 1.03 -0.40 -2.33 119.66 128.40 1pd5 s GLN 190 Ca 0.04 0.79 0.00 0.00 0.04 0.00 0.00 55.36 56.24 1pd5 s GLN 190 Cb -0.13 -3.33 -0.05 0.00 0.03 0.00 0.00 33.01 29.53 1pd5 s GLN 190 CO -0.10 0.41 0.09 0.14 -2.54 0.00 0.00 175.29 173.28 1pd5 s VAL 191 N -0.35 0.37 -0.20 3.63 -7.23 0.20 -2.53 120.40 114.28 1pd5 s VAL 191 Ca 0.32 -1.99 -0.17 0.00 -1.81 0.00 0.00 61.98 58.34 1pd5 s VAL 191 Cb -0.19 -2.44 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 1pd5 s VAL 191 CO 0.19 -0.14 0.44 -2.28 -0.31 0.00 0.00 175.10 173.00 1pd5 s HIS 192 N -3.89 3.37 0.51 2.82 2.46 -1.26 0.48 115.29 119.78 1pd5 s HIS 192 Ca 0.34 0.66 0.37 0.00 0.47 0.00 0.00 55.06 56.90 1pd5 s HIS 192 Cb 0.07 -2.58 1.97 0.00 -0.13 0.00 0.00 32.58 31.91 1pd5 s HIS 192 CO 0.10 -0.05 2.23 1.25 -2.47 0.00 0.00 174.74 175.80 1pd5 h HIS 193 N 7.44 0.00 -0.58 3.88 2.76 -1.15 -0.33 115.15 127.18 1pd5 h HIS 193 Ca -0.35 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 57.72 1pd5 h HIS 193 Cb 1.16 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.10 1pd5 h HIS 193 CO 0.69 0.02 -0.05 0.00 -1.30 0.00 0.00 177.93 177.30 1pd5 h ALA 194 N 1.98 0.82 0.00 5.26 0.00 -1.81 -3.14 119.26 122.35 1pd5 h ALA 194 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1pd5 h ALA 194 Cb 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1pd5 h ALA 194 CO 0.00 0.67 -1.35 1.33 0.00 0.00 0.00 179.25 179.91 1pd5 n VAL 195 N -4.16 0.00 -4.13 0.00 0.24 -1.00 -4.32 118.33 104.96 1pd5 n VAL 195 Ca 0.02 -0.26 -0.23 0.00 -2.04 0.00 0.00 64.34 61.84 1pd5 n VAL 195 Cb 0.37 0.53 -0.17 0.00 -1.47 0.00 0.00 33.84 33.10 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 1.21 4.84 0.36 0.00 -0.00 -1.26 -4.21 116.67 117.60 1pd5 s ASP 197 Ca -0.06 0.46 0.05 0.00 -0.00 0.00 0.00 52.55 53.00 1pd5 s ASP 197 Cb -0.14 -1.12 0.67 0.00 -0.00 0.00 0.00 42.92 42.33 1pd5 s ASP 197 CO -0.02 -1.58 1.92 1.23 -0.00 0.00 0.00 175.17 176.73 1pd5 h GLY 198 N -0.58 0.56 -0.41 0.21 0.00 -2.00 -1.66 103.07 99.18 1pd5 h GLY 198 Ca -0.44 -0.30 0.08 0.00 0.00 0.00 0.00 47.33 46.67 1pd5 h GLY 198 CO 0.60 0.28 -0.45 -2.75 0.00 0.00 0.00 176.54 174.22 1pd5 h PHE 199 N 0.51 -1.33 -0.81 5.60 3.04 -1.98 -0.07 116.94 121.91 1pd5 h PHE 199 Ca 0.12 0.08 0.06 0.00 3.98 0.00 0.00 57.97 62.20 1pd5 h PHE 199 Cb 0.23 0.65 -0.06 0.00 2.56 0.00 0.00 35.95 39.33 1pd5 h PHE 199 CO 0.01 -0.44 0.49 0.45 -2.02 0.00 0.00 178.31 176.80 1pd5 h HIS 200 N -0.28 0.91 0.00 0.41 -0.00 -1.69 0.29 115.15 114.80 1pd5 h HIS 200 Ca 0.15 0.03 -0.12 0.00 -0.00 0.00 0.00 60.37 60.43 1pd5 h HIS 200 Cb 0.57 -0.29 0.01 0.00 -0.00 0.00 0.00 27.41 27.70 1pd5 h HIS 200 CO -0.68 0.47 -0.45 0.28 -0.00 0.00 0.00 177.93 177.54 1pd5 h VAL 201 N 0.91 1.48 -0.91 2.45 2.07 -1.24 -2.43 116.25 118.58 1pd5 h VAL 201 Ca 0.35 -2.04 0.13 0.00 0.82 0.00 0.00 66.70 65.96 1pd5 h VAL 201 Cb 0.15 2.69 -0.14 0.00 -1.52 0.00 0.00 31.29 32.47 1pd5 h VAL 201 CO -0.17 0.58 -0.42 1.23 0.02 0.00 0.00 177.57 178.81 1pd5 h GLY 202 N -0.29 -0.16 1.27 2.17 0.00 -0.87 0.45 103.07 105.63 1pd5 h GLY 202 Ca -0.06 0.57 -0.00 0.00 0.00 0.00 0.00 47.33 47.84 1pd5 h GLY 202 CO 0.09 -0.15 0.44 -0.09 0.00 0.00 0.00 176.54 176.82 1pd5 h ARG 203 N -0.04 0.97 -0.33 4.80 2.43 -0.41 -0.44 114.38 121.35 1pd5 h ARG 203 Ca 0.28 -0.08 -0.05 0.00 -0.81 0.00 0.00 59.98 59.32 1pd5 h ARG 203 Cb 0.56 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1pd5 h ARG 203 CO -0.92 0.68 0.00 1.98 -1.51 0.00 0.00 179.97 180.21 1pd5 h MET 204 N 0.99 0.58 -0.10 0.20 4.05 -0.67 -0.47 114.93 119.52 1pd5 h MET 204 Ca 0.26 -0.19 -0.17 0.00 -0.28 0.00 0.00 59.70 59.32 1pd5 h MET 204 Cb -0.04 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.70 1pd5 h MET 204 CO -0.05 0.71 -0.66 -0.07 0.23 0.00 0.00 176.91 177.07 1pd5 h LEU 205 N 0.39 0.46 -0.57 3.39 3.38 0.08 0.04 115.31 122.47 1pd5 h LEU 205 Ca 0.09 -0.28 -0.12 0.00 0.09 0.00 0.00 57.88 57.66 1pd5 h LEU 205 Cb 0.45 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1pd5 h LEU 205 CO 0.02 0.99 -0.18 0.78 0.09 0.00 0.00 178.44 180.14 1pd5 h ASN 206 N 0.28 0.96 -0.57 -0.43 2.35 -0.93 -1.88 115.58 115.37 1pd5 h ASN 206 Ca -0.02 -0.35 0.02 0.00 -0.55 0.00 0.00 56.30 55.41 1pd5 h ASN 206 Cb 1.21 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 39.28 1pd5 h ASN 206 CO 0.11 1.12 0.35 -0.33 -1.65 0.00 0.00 177.43 177.03 1pd5 h GLU 207 N 0.83 0.67 -0.89 0.81 5.08 -0.93 -1.81 114.58 118.34 1pd5 h GLU 207 Ca 0.12 -0.04 0.14 0.00 -1.00 0.00 0.00 59.36 58.57 1pd5 h GLU 207 Cb 0.74 -0.15 -0.09 0.00 0.50 0.00 0.00 28.75 29.75 1pd5 h GLU 207 CO 0.06 0.44 0.50 1.25 -1.00 0.00 0.00 179.01 180.26 1pd5 h LEU 208 N 0.69 0.66 -0.28 1.33 5.85 -0.83 0.47 115.31 123.20 1pd5 h LEU 208 Ca 0.23 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.99 1pd5 h LEU 208 Cb 0.01 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1pd5 h LEU 208 CO -0.09 0.31 0.05 -0.61 -0.34 0.00 0.00 178.44 177.75 1pd5 h GLN 209 N 0.74 0.47 0.30 1.25 5.75 -0.95 -1.44 115.11 121.24 1pd5 h GLN 209 Ca 0.47 -0.13 -0.01 0.00 -0.15 0.00 0.00 58.65 58.83 1pd5 h GLN 209 Cb 0.59 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.08 1pd5 h GLN 209 CO -0.32 0.58 -0.15 1.96 -2.65 0.00 0.00 178.83 178.25 1pd5 h GLN 210 N 0.29 -0.39 -0.90 1.69 4.20 -0.50 -2.52 115.11 116.98 1pd5 h GLN 210 Ca 0.09 0.03 0.17 0.00 0.06 0.00 0.00 58.65 58.99 1pd5 h GLN 210 Cb 0.34 0.09 -0.07 0.00 0.30 0.00 0.00 27.48 28.13 1pd5 h GLN 210 CO 0.01 -0.09 0.58 1.88 -0.67 0.00 0.00 178.83 180.54 1pd5 h TYR 211 N -0.71 0.74 0.00 2.96 0.99 -0.04 0.92 116.97 121.82 1pd5 h TYR 211 Ca -0.04 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.67 1pd5 h TYR 211 Cb 0.49 -0.23 -0.01 0.00 1.00 0.00 0.00 36.73 37.98 1pd5 h TYR 211 CO 0.02 0.24 -0.18 0.00 -0.00 0.00 0.00 178.16 178.24 1pd5 n ASP 213 N -3.32 0.55 -0.45 0.00 8.00 0.30 -2.61 116.55 119.02 1pd5 n ASP 213 Ca 0.00 0.02 0.05 0.00 0.71 0.00 0.00 54.79 55.57 1pd5 n ASP 213 Cb 0.41 0.96 0.08 0.00 -0.02 0.00 0.00 41.12 42.55 1pd5 n ASP 213 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1pd5 n GLU 214 N -2.27 1.34 -1.67 -1.24 0.28 -0.15 -4.90 120.64 112.03 1pd5 n GLU 214 Ca -0.00 -1.43 -0.43 0.00 -0.16 0.00 0.00 57.16 55.14 1pd5 n GLU 214 Cb 0.51 -1.20 -0.03 0.00 1.43 0.00 0.00 31.44 32.14 1pd5 n GLU 214 CO 0.00 0.00 0.00 1.87 -0.16 0.00 0.00 177.13 178.84 1pd5 n TRP 215 N 0.47 2.52 -3.09 -1.84 -0.00 -0.91 -4.86 117.44 109.74 1pd5 n TRP 215 Ca 0.07 -0.27 -0.17 0.00 -0.00 0.00 0.00 57.50 57.13 1pd5 n TRP 215 Cb 0.30 -2.77 -0.01 0.00 -0.00 0.00 0.00 31.31 28.83 1pd5 n TRP 215 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 177.69 178.73 1pd5 n GLN 216 N 6.89 0.91 0.00 5.87 6.02 -1.26 -4.91 117.38 130.89 1pd5 n GLN 216 Ca 0.20 -3.00 0.00 0.00 -0.01 0.00 0.00 57.00 54.18 1pd5 n GLN 216 Cb 0.38 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.17 1pd5 n GLN 216 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1pd5 n GLY 217 N 0.62 0.98 0.00 1.08 0.00 -1.26 -5.24 105.19 101.38 1pd5 n GLY 217 Ca 0.20 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1pd5 n GLY 217 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93