#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhu n ALA 2 N 0.00 5.45 -2.50 0.00 0.00 -1.26 -4.86 120.51 117.33 1yhu n ALA 2 Ca 0.00 -3.66 -0.26 0.00 0.00 0.00 0.00 53.44 49.52 1yhu n ALA 2 Cb 0.00 -0.83 -0.09 0.00 0.00 0.00 0.00 19.45 18.53 1yhu n ALA 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1yhu s ASN 3 N -2.96 4.22 0.21 0.00 4.22 -1.26 -4.66 114.94 114.71 1yhu s ASN 3 Ca 0.56 -1.19 -0.11 0.00 -2.14 0.00 0.00 52.86 49.98 1yhu s ASN 3 Cb 0.44 -0.45 -0.01 0.00 1.28 0.00 0.00 41.25 42.52 1yhu s ASN 3 CO 0.02 -0.51 0.39 0.00 -2.04 0.00 0.00 177.10 174.97 1yhu n ALA 5 N -0.32 -2.27 -0.31 0.00 0.00 -1.26 -4.63 120.51 111.72 1yhu n ALA 5 Ca -0.04 0.14 0.05 0.00 0.00 0.00 0.00 53.44 53.59 1yhu n ALA 5 Cb 0.63 -1.62 0.21 0.00 0.00 0.00 0.00 19.45 18.66 1yhu n ALA 5 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1yhu h ASP 6 N 0.54 0.71 0.12 0.00 -0.00 -1.99 0.22 116.42 116.01 1yhu h ASP 6 Ca -0.39 0.06 -0.19 0.00 -0.00 0.00 0.00 57.03 56.51 1yhu h ASP 6 Cb 1.42 -0.07 0.02 0.00 -0.00 0.00 0.00 39.33 40.70 1yhu h ASP 6 CO 0.49 0.37 -0.82 0.00 -0.00 0.00 0.00 179.24 179.27 1yhu h ALA 7 N 1.51 -0.06 -0.54 -0.78 0.00 -1.99 -1.92 119.26 115.47 1yhu h ALA 7 Ca 0.45 -0.68 0.13 0.00 0.00 0.00 0.00 54.91 54.80 1yhu h ALA 7 Cb 0.49 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1yhu h ALA 7 CO -0.29 0.40 0.38 0.00 0.00 0.00 0.00 179.25 179.74 1yhu h ALA 8 N 0.14 2.29 0.11 0.00 0.00 -1.79 -0.74 119.26 119.27 1yhu h ALA 8 Ca -0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1yhu h ALA 8 Cb 1.62 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1yhu h ALA 8 CO 0.16 -0.43 -0.05 0.00 0.00 0.00 0.00 179.25 178.92 1yhu h ALA 9 N 1.73 -0.15 -0.94 0.00 0.00 -0.53 -3.03 119.26 116.34 1yhu h ALA 9 Ca 0.26 -0.25 0.23 0.00 0.00 0.00 0.00 54.91 55.14 1yhu h ALA 9 Cb 0.80 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.57 1yhu h ALA 9 CO -0.04 -0.29 0.63 0.00 0.00 0.00 0.00 179.25 179.55 1yhu h ALA 10 N 0.02 2.28 0.59 0.00 0.00 -0.35 -1.07 119.26 120.71 1yhu h ALA 10 Ca -0.01 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1yhu h ALA 10 Cb 0.55 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1yhu h ALA 10 CO 0.02 -0.59 -0.28 0.82 0.00 0.00 0.00 179.25 179.22 1yhu h ILE 11 N 0.37 0.37 -0.65 0.00 1.08 -1.20 -2.07 117.51 115.40 1yhu h ILE 11 Ca 0.50 -0.21 0.13 0.00 -0.39 0.00 0.00 64.86 64.89 1yhu h ILE 11 Cb 1.31 0.44 -0.10 0.00 -3.07 0.00 0.00 36.82 35.41 1yhu h ILE 11 CO -0.19 0.03 0.13 0.58 -0.69 0.00 0.00 178.15 178.01 1yhu h VAL 12 N -0.93 0.59 -0.12 1.67 2.07 -1.16 -1.52 116.25 116.84 1yhu h VAL 12 Ca -0.08 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 67.37 1yhu h VAL 12 Cb 0.65 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 1yhu h VAL 12 CO 0.13 0.05 -0.23 1.56 0.02 0.00 0.00 177.57 179.10 1yhu h GLN 13 N 0.25 -0.20 -0.64 1.57 1.08 -1.07 0.80 115.11 116.90 1yhu h GLN 13 Ca 0.35 0.01 0.13 0.00 -1.45 0.00 0.00 58.65 57.69 1yhu h GLN 13 Cb 0.55 0.04 -0.12 0.00 -0.05 0.00 0.00 27.48 27.90 1yhu h GLN 13 CO -0.45 -0.13 -0.10 0.00 -0.95 0.00 0.00 178.83 177.20 1yhu h ALA 14 N -0.86 0.51 -0.00 3.87 0.00 -0.82 0.60 119.26 122.56 1yhu h ALA 14 Ca 0.02 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1yhu h ALA 14 Cb 0.27 0.43 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1yhu h ALA 14 CO -0.22 -0.42 0.00 1.96 0.00 0.00 0.00 179.25 180.57 1yhu h GLN 15 N 0.04 0.01 -0.11 0.00 4.20 -0.59 0.68 115.11 119.34 1yhu h GLN 15 Ca 0.32 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.03 1yhu h GLN 15 Cb 0.51 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1yhu h GLN 15 CO -0.62 0.16 0.07 2.35 -0.67 0.00 0.00 178.83 180.11 1yhu h TRP 16 N -0.15 0.15 -0.79 2.96 2.91 0.16 -1.74 115.95 119.45 1yhu h TRP 16 Ca 0.00 -0.00 0.17 0.00 1.13 0.00 0.00 58.89 60.19 1yhu h TRP 16 Cb 0.15 -0.05 -0.05 0.00 -0.51 0.00 0.00 29.16 28.70 1yhu h TRP 16 CO -0.02 0.14 0.53 0.93 -1.03 0.00 0.00 178.44 178.99 1yhu h GLU 17 N 0.12 0.37 -0.62 2.65 4.39 0.31 0.13 114.58 121.93 1yhu h GLU 17 Ca 0.04 -0.02 0.09 0.00 0.34 0.00 0.00 59.36 59.81 1yhu h GLU 17 Cb 0.03 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.56 1yhu h GLU 17 CO -0.01 0.24 0.41 0.22 -1.16 0.00 0.00 179.01 178.72 1yhu h ASP 18 N 0.38 0.43 0.00 1.42 3.58 0.08 -3.16 116.42 119.16 1yhu h ASP 18 Ca 0.40 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.85 1yhu h ASP 18 Cb 0.98 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.95 1yhu h ASP 18 CO -0.13 0.27 -0.93 1.33 -2.88 0.00 0.00 179.24 176.90 1yhu n VAL 19 N -4.48 0.00 -3.25 2.25 0.24 -0.11 -4.87 118.33 108.12 1yhu n VAL 19 Ca 0.10 -0.24 -0.24 0.00 -2.04 0.00 0.00 64.34 61.92 1yhu n VAL 19 Cb 0.33 0.61 -0.08 0.00 -1.47 0.00 0.00 33.84 33.24 1yhu n VAL 19 CO 0.00 0.00 0.00 1.87 -2.14 0.00 0.00 176.83 176.56 1yhu n TRP 20 N -1.51 -1.01 -4.20 6.34 -0.00 0.28 -4.87 117.44 112.46 1yhu n TRP 20 Ca -0.00 -3.21 -0.23 0.00 -0.00 0.00 0.00 57.50 54.06 1yhu n TRP 20 Cb 0.16 0.17 -0.06 0.00 -0.00 0.00 0.00 31.31 31.58 1yhu n TRP 20 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 177.69 176.15 1yhu s SER 21 N -0.43 5.05 0.57 5.87 1.04 -1.22 -4.60 113.70 119.98 1yhu s SER 21 Ca 0.34 -0.43 0.26 0.00 0.48 0.00 0.00 55.95 56.60 1yhu s SER 21 Cb 0.09 -1.14 1.44 0.00 0.10 0.00 0.00 66.02 66.52 1yhu s SER 21 CO -0.16 -0.01 1.79 0.00 0.98 0.00 0.00 173.24 175.84 1yhu h ALA 22 N 1.74 1.27 -1.98 5.32 0.00 -2.00 -2.87 119.26 120.75 1yhu h ALA 22 Ca -0.46 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 53.76 1yhu h ALA 22 Cb 1.24 0.00 -0.36 0.00 0.00 0.00 0.00 17.79 18.67 1yhu h ALA 22 CO 0.60 -0.27 -0.00 0.00 0.00 0.00 0.00 179.25 179.58 1yhu n ALA 23 N -1.82 4.87 -2.00 0.00 0.00 -1.26 -4.91 120.51 115.39 1yhu n ALA 23 Ca -0.02 -4.73 0.00 0.00 0.00 0.00 0.00 53.44 48.69 1yhu n ALA 23 Cb 0.34 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1yhu n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yhu n ALA 24 N 0.46 0.00 -3.64 0.00 0.00 -1.09 -5.11 120.51 111.13 1yhu n ALA 24 Ca 0.33 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.70 1yhu n ALA 24 Cb 0.36 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.74 1yhu n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yhu s ALA 25 N -2.62 -2.06 0.47 0.00 0.00 -1.26 -5.01 121.76 111.28 1yhu s ALA 25 Ca 0.00 1.97 0.22 0.00 0.00 0.00 0.00 51.96 54.15 1yhu s ALA 25 Cb 0.00 -1.53 1.23 0.00 0.00 0.00 0.00 23.12 22.82 1yhu s ALA 25 CO 0.00 -0.26 1.91 0.00 0.00 0.00 0.00 175.76 177.41 1yhu h ALA 26 N 4.72 2.39 -0.18 0.00 0.00 -2.00 -0.92 119.26 123.26 1yhu h ALA 26 Ca -0.28 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.45 1yhu h ALA 26 Cb 1.18 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1yhu h ALA 26 CO 0.14 -0.61 -0.60 0.00 0.00 0.00 0.00 179.25 178.18 1yhu h ALA 27 N 1.64 0.63 -0.08 0.00 0.00 -2.00 -2.91 119.26 116.53 1yhu h ALA 27 Ca 0.38 -0.53 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1yhu h ALA 27 Cb 1.16 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1yhu h ALA 27 CO -0.08 0.70 -0.07 1.03 0.00 0.00 0.00 179.25 180.82 1yhu h SER 28 N 0.44 0.20 -0.77 0.00 0.87 -1.58 -2.29 113.55 110.42 1yhu h SER 28 Ca -0.00 -0.48 0.09 0.00 -1.23 0.00 0.00 61.79 60.17 1yhu h SER 28 Cb 1.16 -0.06 -0.07 0.00 -0.44 0.00 0.00 62.40 62.99 1yhu h SER 28 CO 0.11 0.64 0.42 0.03 -0.53 0.00 0.00 176.83 177.50 1yhu h ARG 29 N -0.23 0.70 0.50 2.24 3.08 -1.51 -1.06 114.38 118.10 1yhu h ARG 29 Ca 0.01 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1yhu h ARG 29 Cb 0.58 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1yhu h ARG 29 CO 0.02 0.46 -0.24 0.28 -1.07 0.00 0.00 179.97 179.42 1yhu h VAL 30 N 0.72 0.51 -0.80 2.04 2.07 -1.48 -2.42 116.25 116.88 1yhu h VAL 30 Ca 0.37 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.95 1yhu h VAL 30 Cb 0.34 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 30.57 1yhu h VAL 30 CO -0.25 0.00 0.48 0.28 0.02 0.00 0.00 177.57 178.11 1yhu h SER 31 N -0.68 0.73 -0.27 0.57 0.02 -0.85 0.50 113.55 113.58 1yhu h SER 31 Ca -0.07 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 60.95 1yhu h SER 31 Cb 0.52 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.90 1yhu h SER 31 CO 0.11 0.45 0.03 0.00 -1.14 0.00 0.00 176.83 176.29 1yhu h ALA 32 N 1.40 0.26 0.12 3.77 0.00 -1.10 -0.01 119.26 123.70 1yhu h ALA 32 Ca 0.36 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 1yhu h ALA 32 Cb 0.22 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1yhu h ALA 32 CO -0.19 -0.39 -0.06 0.78 0.00 0.00 0.00 179.25 179.39 1yhu h GLY 33 N 0.12 -0.17 -0.29 0.00 0.00 -0.79 -0.41 103.07 101.53 1yhu h GLY 33 Ca 0.12 0.06 0.06 0.00 0.00 0.00 0.00 47.33 47.58 1yhu h GLY 33 CO -0.19 -0.06 -0.47 -2.09 0.00 0.00 0.00 176.54 173.74 1yhu h GLU 34 N -0.32 -0.36 -0.48 4.80 4.22 0.26 -0.54 114.58 122.16 1yhu h GLU 34 Ca -0.02 0.02 0.05 0.00 0.08 0.00 0.00 59.36 59.50 1yhu h GLU 34 Cb 0.26 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.55 1yhu h GLU 34 CO 0.03 -0.24 0.22 0.93 -2.18 0.00 0.00 179.01 177.76 1yhu h GLU 35 N -0.38 0.42 -0.26 1.92 4.39 -0.94 0.47 114.58 120.20 1yhu h GLU 35 Ca 0.11 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.84 1yhu h GLU 35 Cb 0.60 -0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 29.09 1yhu h GLU 35 CO -0.56 0.28 -0.14 0.28 -1.16 0.00 0.00 179.01 177.71 1yhu h VAL 36 N 0.43 0.58 -0.05 3.13 2.07 -0.01 -0.99 116.25 121.41 1yhu h VAL 36 Ca 0.22 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.72 1yhu h VAL 36 Cb 0.16 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1yhu h VAL 36 CO -0.17 0.00 -0.05 -0.26 0.02 0.00 0.00 177.57 177.11 1yhu h PHE 37 N -0.11 0.14 -0.85 1.57 -1.00 -0.78 -0.20 116.94 115.72 1yhu h PHE 37 Ca 0.14 -0.04 0.21 0.00 2.81 0.00 0.00 57.97 61.09 1yhu h PHE 37 Cb 0.32 -0.03 -0.13 0.00 3.61 0.00 0.00 35.95 39.73 1yhu h PHE 37 CO -0.32 0.58 0.27 0.00 -1.61 0.00 0.00 178.31 177.23 1yhu h ALA 38 N 0.54 1.24 -0.33 2.45 0.00 -0.77 0.77 119.26 123.15 1yhu h ALA 38 Ca 0.01 0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.94 1yhu h ALA 38 Cb 0.55 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1yhu h ALA 38 CO 0.01 -0.39 -0.45 0.00 0.00 0.00 0.00 179.25 178.42 1yhu h ALA 39 N 1.71 0.57 0.00 0.00 0.00 -1.13 -0.81 119.26 119.60 1yhu h ALA 39 Ca 0.52 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1yhu h ALA 39 Cb 0.99 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1yhu h ALA 39 CO -0.58 0.68 -0.06 1.25 0.00 0.00 0.00 179.25 180.54 1yhu h LEU 40 N 0.70 0.00 0.04 0.00 7.12 0.21 -2.54 115.31 120.84 1yhu h LEU 40 Ca 0.04 0.00 -0.27 0.00 0.13 0.00 0.00 57.88 57.79 1yhu h LEU 40 Cb 1.04 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 41.14 1yhu h LEU 40 CO 0.10 0.06 -1.45 -0.26 -0.13 0.00 0.00 178.44 176.76 1yhu h PHE 41 N 0.00 0.14 -0.51 1.25 0.05 0.49 -3.19 116.94 115.18 1yhu h PHE 41 Ca -0.00 -0.10 0.13 0.00 3.82 0.00 0.00 57.97 61.82 1yhu h PHE 41 Cb 0.25 -0.01 -0.02 0.00 2.00 0.00 0.00 35.95 38.17 1yhu h PHE 41 CO 0.00 1.57 0.36 -0.22 -0.18 0.00 0.00 178.31 179.84 1yhu h LYS 42 N -0.70 0.08 -0.24 1.51 3.64 -1.05 0.18 116.57 119.99 1yhu h LYS 42 Ca -0.37 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 58.91 1yhu h LYS 42 Cb 1.51 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.30 1yhu h LYS 42 CO -0.13 0.05 -0.25 1.98 -2.27 0.00 0.00 179.45 178.84 1yhu h MET 43 N 0.09 0.59 -2.15 1.90 4.05 -1.59 -3.40 114.93 114.42 1yhu h MET 43 Ca 0.24 -0.32 -0.50 0.00 -0.28 0.00 0.00 59.70 58.84 1yhu h MET 43 Cb 0.85 0.01 -0.34 0.00 -0.80 0.00 0.00 31.60 31.32 1yhu h MET 43 CO -0.02 0.91 -0.86 0.08 0.23 0.00 0.00 176.91 177.25 1yhu s VAL 44 N -4.31 0.04 0.31 -5.77 1.01 0.11 -4.97 120.40 106.81 1yhu s VAL 44 Ca -0.13 -2.09 0.36 0.00 0.00 0.00 0.00 61.98 60.12 1yhu s VAL 44 Cb 0.07 -0.98 0.37 0.00 0.00 0.00 0.00 36.38 35.84 1yhu s VAL 44 CO 0.81 -0.95 2.10 1.55 0.00 0.00 0.00 175.10 178.60 1yhu h PRO 45 N 5.89 0.00 0.00 2.72 0.13 -0.99 -0.14 132.00 139.61 1yhu h PRO 45 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1yhu h PRO 45 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1yhu h PRO 45 CO 0.28 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.05 1yhu n ALA 46 N -1.98 1.55 0.07 -0.56 0.00 -1.26 -1.76 120.51 116.58 1yhu n ALA 46 Ca -0.02 -0.03 0.11 0.00 0.00 0.00 0.00 53.44 53.50 1yhu n ALA 46 Cb 0.09 -1.11 -0.14 0.00 0.00 0.00 0.00 19.45 18.28 1yhu n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yhu n ALA 47 N -1.24 2.91 -0.13 0.00 0.00 -0.06 -4.53 120.51 117.46 1yhu n ALA 47 Ca 0.04 -0.49 -0.04 0.00 0.00 0.00 0.00 53.44 52.94 1yhu n ALA 47 Cb 0.05 -0.79 0.02 0.00 0.00 0.00 0.00 19.45 18.73 1yhu n ALA 47 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1yhu h LYS 48 N 0.00 -0.05 0.00 0.00 1.57 -1.52 -0.44 116.57 116.12 1yhu h LYS 48 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1yhu h LYS 48 Cb 0.96 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1yhu h LYS 48 CO 0.00 -0.04 0.00 0.27 -0.57 0.00 0.00 179.45 179.11 1yhu n ASN 49 N -5.36 0.00 0.01 0.86 0.23 -1.26 -1.25 115.26 108.50 1yhu n ASN 49 Ca 0.03 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 54.19 1yhu n ASN 49 Cb 0.27 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 37.84 1yhu n ASN 49 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 1yhu n LEU 50 N -0.54 0.21 -1.23 -4.53 7.94 -0.17 -4.19 117.00 114.49 1yhu n LEU 50 Ca 0.00 0.05 -0.05 0.00 -1.11 0.00 0.00 56.01 54.91 1yhu n LEU 50 Cb 0.00 -0.01 0.20 0.00 0.53 0.00 0.00 43.42 44.14 1yhu n LEU 50 CO 0.00 -0.03 0.75 0.49 -1.11 0.00 0.00 177.39 177.48 1yhu n PHE 51 N -2.32 1.25 -0.27 1.96 3.01 -0.38 -4.69 117.46 116.03 1yhu n PHE 51 Ca -0.03 -1.56 0.04 0.00 1.01 0.00 0.00 57.45 56.92 1yhu n PHE 51 Cb 0.56 -0.52 0.27 0.00 -0.01 0.00 0.00 39.48 39.78 1yhu n PHE 51 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1yhu h THR 52 N 1.08 1.06 0.00 4.37 1.03 -1.73 -1.88 112.91 116.85 1yhu h THR 52 Ca 0.24 -0.33 -0.00 0.00 -0.01 0.00 0.00 66.41 66.31 1yhu h THR 52 Cb 1.75 0.02 -0.00 0.00 -1.07 0.00 0.00 68.15 68.84 1yhu h THR 52 CO 0.44 0.18 -0.00 -0.09 -0.01 0.00 0.00 175.52 176.03 1yhu h ARG 53 N 0.96 0.00 -1.25 0.00 2.43 -1.92 -3.00 114.38 111.60 1yhu h ARG 53 Ca 0.36 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.87 1yhu h ARG 53 Cb 0.20 0.00 -0.32 0.00 -0.42 0.00 0.00 29.97 29.42 1yhu h ARG 53 CO -0.13 0.00 0.45 1.33 -1.51 0.00 0.00 179.97 180.11 1yhu n VAL 54 N -4.42 3.30 -3.96 0.20 0.24 -0.73 -4.91 118.33 108.04 1yhu n VAL 54 Ca -0.03 -3.71 -0.32 0.00 -2.04 0.00 0.00 64.34 58.24 1yhu n VAL 54 Cb 0.09 -1.19 -0.00 0.00 -1.47 0.00 0.00 33.84 31.27 1yhu n VAL 54 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1yhu n ASN 55 N -0.74 -4.04 0.22 -1.34 4.13 -1.13 -2.38 115.26 109.97 1yhu n ASN 55 Ca 0.55 -0.81 0.15 0.00 1.68 0.00 0.00 54.58 56.14 1yhu n ASN 55 Cb 0.61 -3.27 0.78 0.00 -1.54 0.00 0.00 39.78 36.36 1yhu n ASN 55 CO 0.00 0.00 0.00 1.62 0.28 0.00 0.00 177.26 179.16 1yhu h VAL 56 N -1.65 0.00 -1.00 2.41 3.04 -1.66 -0.02 116.25 117.38 1yhu h VAL 56 Ca -0.56 -0.04 0.16 0.00 -1.01 0.00 0.00 66.70 65.25 1yhu h VAL 56 Cb 1.37 0.72 -0.09 0.00 -2.01 0.00 0.00 31.29 31.27 1yhu h VAL 56 CO 0.70 0.00 0.62 0.00 -1.01 0.00 0.00 177.57 177.88 1yhu h ALA 57 N 2.02 1.63 -3.10 3.17 0.00 -1.86 -3.24 119.26 117.89 1yhu h ALA 57 Ca 0.00 0.05 -0.62 0.00 0.00 0.00 0.00 54.91 54.34 1yhu h ALA 57 Cb 0.05 -0.14 -0.41 0.00 0.00 0.00 0.00 17.79 17.29 1yhu h ALA 57 CO 0.00 0.06 -0.69 0.34 0.00 0.00 0.00 179.25 178.96 1yhu s ASP 58 N -5.57 3.95 0.48 0.00 3.68 -0.02 -4.99 116.67 114.20 1yhu s ASP 58 Ca -0.11 -3.01 0.31 0.00 2.13 0.00 0.00 52.55 51.86 1yhu s ASP 58 Cb 0.24 -1.31 1.41 0.00 -1.45 0.00 0.00 42.92 41.80 1yhu s ASP 58 CO 0.80 -0.21 1.72 0.40 0.13 0.00 0.00 175.17 178.01 1yhu h ILE 59 N 5.14 0.32 -0.20 4.11 2.04 -1.70 0.67 117.51 127.89 1yhu h ILE 59 Ca 0.01 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1yhu h ILE 59 Cb 0.88 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1yhu h ILE 59 CO 0.59 0.03 0.00 -0.46 0.00 0.00 0.00 178.15 178.30 1yhu n ASN 60 N -4.41 1.15 -4.79 1.72 0.23 -1.26 -3.97 115.26 103.92 1yhu n ASN 60 Ca 0.31 -1.94 -0.33 0.00 -0.53 0.00 0.00 54.58 52.09 1yhu n ASN 60 Cb 1.28 -0.13 0.02 0.00 -2.08 0.00 0.00 39.78 38.86 1yhu n ASN 60 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1yhu s SER 61 N -1.09 5.63 0.11 0.53 1.04 0.23 -4.83 113.70 115.32 1yhu s SER 61 Ca 0.17 1.89 -0.21 0.00 0.48 0.00 0.00 55.95 58.28 1yhu s SER 61 Cb 0.09 -2.54 -0.09 0.00 0.10 0.00 0.00 66.02 63.57 1yhu s SER 61 CO 0.12 -1.27 1.75 1.55 0.98 0.00 0.00 173.24 176.37 1yhu h PRO 62 N 0.43 0.12 -0.67 4.02 0.13 -1.90 0.11 132.00 134.24 1yhu h PRO 62 Ca -0.47 -0.01 0.14 0.00 -0.87 0.00 0.00 66.00 64.79 1yhu h PRO 62 Cb 1.23 -0.03 -0.12 0.00 0.13 0.00 0.00 31.00 32.21 1yhu h PRO 62 CO 0.57 0.08 -0.05 0.93 -0.23 0.00 0.00 178.00 179.29 1yhu h GLU 63 N 0.12 0.07 -0.03 0.86 3.07 -1.93 0.52 114.58 117.26 1yhu h GLU 63 Ca 0.05 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.86 1yhu h GLU 63 Cb 0.01 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1yhu h GLU 63 CO -0.04 0.05 -0.13 0.35 -1.40 0.00 0.00 179.01 177.84 1yhu h PHE 64 N 0.07 0.20 -0.87 4.33 3.57 -1.15 -2.23 116.94 120.86 1yhu h PHE 64 Ca 0.35 -0.08 0.19 0.00 3.53 0.00 0.00 57.97 61.95 1yhu h PHE 64 Cb 0.57 -0.03 -0.11 0.00 2.79 0.00 0.00 35.95 39.17 1yhu h PHE 64 CO -0.44 0.77 0.40 1.96 -2.23 0.00 0.00 178.31 178.77 1yhu h GLN 65 N -0.43 0.47 -0.75 1.11 4.20 -0.06 0.53 115.11 120.18 1yhu h GLN 65 Ca -0.01 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.69 1yhu h GLN 65 Cb 0.78 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.41 1yhu h GLN 65 CO 0.03 0.31 0.49 0.78 -0.67 0.00 0.00 178.83 179.77 1yhu h GLY 66 N 0.48 1.06 0.92 3.46 0.00 0.08 -1.39 103.07 107.69 1yhu h GLY 66 Ca 0.51 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.44 1yhu h GLY 66 CO -0.46 0.37 -0.18 0.84 0.00 0.00 0.00 176.54 177.11 1yhu h HIS 67 N 0.99 -0.47 -0.57 5.60 -0.00 0.52 -2.16 115.15 119.07 1yhu h HIS 67 Ca 0.28 -0.01 0.11 0.00 -0.00 0.00 0.00 60.37 60.75 1yhu h HIS 67 Cb -0.09 0.15 -0.11 0.00 -0.00 0.00 0.00 27.41 27.37 1yhu h HIS 67 CO -0.02 -0.24 -0.24 0.28 -0.00 0.00 0.00 177.93 177.70 1yhu h VAL 68 N -0.59 0.28 -0.60 5.26 2.07 -0.38 0.62 116.25 122.92 1yhu h VAL 68 Ca -0.05 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.55 1yhu h VAL 68 Cb 0.44 0.28 -0.06 0.00 -1.52 0.00 0.00 31.29 30.43 1yhu h VAL 68 CO 0.08 0.00 0.26 0.58 0.02 0.00 0.00 177.57 178.51 1yhu h VAL 69 N -0.10 0.84 -0.99 2.57 2.07 -1.12 -0.15 116.25 119.37 1yhu h VAL 69 Ca 0.25 -0.16 0.15 0.00 0.82 0.00 0.00 66.70 67.76 1yhu h VAL 69 Cb 0.51 0.33 -0.09 0.00 -1.52 0.00 0.00 31.29 30.51 1yhu h VAL 69 CO -0.63 0.09 0.62 0.03 0.02 0.00 0.00 177.57 177.69 1yhu h ARG 70 N 0.47 0.86 -0.06 1.57 3.08 -0.23 0.62 114.38 120.70 1yhu h ARG 70 Ca 0.29 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.28 1yhu h ARG 70 Cb 0.30 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 1yhu h ARG 70 CO -0.25 0.57 0.02 0.28 -1.07 0.00 0.00 179.97 179.52 1yhu h VAL 71 N 0.89 1.16 0.02 2.04 2.07 -0.25 -1.94 116.25 120.24 1yhu h VAL 71 Ca 0.52 -0.49 0.03 0.00 0.82 0.00 0.00 66.70 67.58 1yhu h VAL 71 Cb 0.65 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.77 1yhu h VAL 71 CO -0.29 0.14 -0.20 0.24 0.02 0.00 0.00 177.57 177.47 1yhu h MET 72 N -0.10 -0.32 -0.74 1.57 2.86 -0.38 -0.13 114.93 117.70 1yhu h MET 72 Ca 0.02 0.02 0.17 0.00 -2.06 0.00 0.00 59.70 57.85 1yhu h MET 72 Cb 0.20 0.07 -0.12 0.00 0.06 0.00 0.00 31.60 31.81 1yhu h MET 72 CO -0.00 -0.21 0.08 0.78 1.06 0.00 0.00 176.91 178.61 1yhu h GLY 73 N -0.33 0.92 0.97 8.32 0.00 -0.86 0.15 103.07 112.23 1yhu h GLY 73 Ca 0.05 0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.40 1yhu h GLY 73 CO -0.17 -0.26 -0.31 -1.33 0.00 0.00 0.00 176.54 174.47 1yhu h GLY 74 N 0.16 -0.88 0.22 4.60 0.00 -0.47 0.14 103.07 106.84 1yhu h GLY 74 Ca 0.41 0.34 0.15 0.00 0.00 0.00 0.00 47.33 48.23 1yhu h GLY 74 CO -0.60 -0.32 0.47 -2.00 0.00 0.00 0.00 176.54 174.09 1yhu h LEU 75 N -0.84 0.58 0.76 3.11 5.85 -0.17 -0.36 115.31 124.24 1yhu h LEU 75 Ca -0.08 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1yhu h LEU 75 Cb 0.66 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 1yhu h LEU 75 CO 0.12 0.24 -0.46 -0.78 -0.34 0.00 0.00 178.44 177.22 1yhu h ASP 76 N 0.66 -1.16 -0.97 1.25 -0.00 -0.35 0.11 116.42 115.95 1yhu h ASP 76 Ca 0.48 0.06 0.19 0.00 -0.00 0.00 0.00 57.03 57.77 1yhu h ASP 76 Cb 0.68 0.34 -0.18 0.00 -0.00 0.00 0.00 39.33 40.17 1yhu h ASP 76 CO -0.36 -0.71 -0.25 -0.38 -0.00 0.00 0.00 179.24 177.53 1yhu n ILE 77 N -5.37 -0.41 0.05 2.25 5.41 0.47 -0.49 119.36 121.27 1yhu n ILE 77 Ca -0.14 2.23 -0.02 0.00 1.00 0.00 0.00 62.75 65.81 1yhu n ILE 77 Cb 0.47 -3.07 -0.01 0.00 -0.71 0.00 0.00 39.64 36.32 1yhu n ILE 77 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1yhu h LEU 78 N 0.00 -0.12 -0.97 1.39 3.38 -0.70 -0.95 115.31 117.35 1yhu h LEU 78 Ca 0.46 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.64 1yhu h LEU 78 Cb 0.70 0.03 -0.18 0.00 0.09 0.00 0.00 40.66 41.30 1yhu h LEU 78 CO -1.00 -0.07 -0.20 -0.38 0.09 0.00 0.00 178.44 176.87 1yhu n ILE 79 N -2.43 -0.41 0.04 1.22 5.41 0.33 -0.03 119.36 123.49 1yhu n ILE 79 Ca -0.02 2.20 -0.04 0.00 1.00 0.00 0.00 62.75 65.89 1yhu n ILE 79 Cb 0.06 -3.07 0.19 0.00 -0.71 0.00 0.00 39.64 36.10 1yhu n ILE 79 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 1yhu h ASN 80 N 0.00 0.44 -0.30 4.38 4.21 -0.80 -2.56 115.58 120.94 1yhu h ASN 80 Ca 0.48 -0.17 0.00 0.00 1.21 0.00 0.00 56.30 57.82 1yhu h ASN 80 Cb 0.78 -0.12 0.00 0.00 -1.12 0.00 0.00 38.32 37.86 1yhu h ASN 80 CO -0.98 0.75 0.00 0.00 -1.29 0.00 0.00 177.43 175.91 1yhu n ALA 81 N -2.49 3.19 0.28 -0.83 0.00 0.96 -4.19 120.51 117.43 1yhu n ALA 81 Ca -0.01 -0.97 0.15 0.00 0.00 0.00 0.00 53.44 52.61 1yhu n ALA 81 Cb 0.45 -1.06 0.82 0.00 0.00 0.00 0.00 19.45 19.66 1yhu n ALA 81 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1yhu h LEU 82 N 2.05 0.00 0.00 0.00 3.38 -0.90 -2.51 115.31 117.33 1yhu h LEU 82 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1yhu h LEU 82 Cb 1.24 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 1yhu h LEU 82 CO 0.24 0.08 -0.68 -0.78 0.09 0.00 0.00 178.44 177.39 1yhu h ASP 83 N 0.00 0.00 -3.28 -0.43 3.58 -1.83 -3.38 116.42 111.07 1yhu h ASP 83 Ca -0.00 0.00 -0.79 0.00 0.42 0.00 0.00 57.03 56.66 1yhu h ASP 83 Cb 0.25 0.00 -0.29 0.00 1.72 0.00 0.00 39.33 41.01 1yhu h ASP 83 CO 0.01 0.56 0.50 -0.67 -2.88 0.00 0.00 179.24 176.76 1yhu n ASP 84 N -3.19 5.68 -0.35 2.28 -0.08 -0.95 -4.94 116.55 115.01 1yhu n ASP 84 Ca 0.00 -3.19 0.10 0.00 -1.51 0.00 0.00 54.79 50.20 1yhu n ASP 84 Cb 0.77 -1.30 0.22 0.00 2.34 0.00 0.00 41.12 43.15 1yhu n ASP 84 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1yhu h ILE 85 N 3.59 0.02 0.00 5.18 2.10 -1.75 -1.12 117.51 125.53 1yhu h ILE 85 Ca 0.19 -0.00 -0.05 0.00 1.08 0.00 0.00 64.86 66.08 1yhu h ILE 85 Cb 0.77 0.02 -0.01 0.00 -1.09 0.00 0.00 36.82 36.51 1yhu h ILE 85 CO 1.11 0.00 -0.23 1.55 -1.08 0.00 0.00 178.15 179.50 1yhu h PRO 86 N 0.01 0.00 0.17 2.19 0.13 -1.92 -2.64 132.00 129.93 1yhu h PRO 86 Ca 0.54 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 65.34 1yhu h PRO 86 Cb 0.98 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.12 1yhu h PRO 86 CO -0.96 0.23 -1.57 1.15 -0.23 0.00 0.00 178.00 176.62 1yhu h THR 87 N 0.00 1.14 -0.06 1.56 2.02 -1.57 -3.18 112.91 112.82 1yhu h THR 87 Ca -0.00 -2.71 0.02 0.00 0.77 0.00 0.00 66.41 64.48 1yhu h THR 87 Cb 0.50 2.83 -0.00 0.00 -1.74 0.00 0.00 68.15 69.74 1yhu h THR 87 CO 0.03 0.84 0.05 0.25 0.37 0.00 0.00 175.52 177.06 1yhu h LEU 88 N 0.10 0.00 0.48 2.58 5.85 -1.18 -0.50 115.31 122.64 1yhu h LEU 88 Ca -0.27 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.43 1yhu h LEU 88 Cb 2.07 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 43.09 1yhu h LEU 88 CO 0.19 0.00 -0.33 -0.33 -0.34 0.00 0.00 178.44 177.63 1yhu h GLU 89 N 0.00 -0.74 -0.79 1.25 4.39 -1.45 0.97 114.58 118.20 1yhu h GLU 89 Ca 0.03 0.05 0.16 0.00 0.34 0.00 0.00 59.36 59.93 1yhu h GLU 89 Cb 0.13 0.17 -0.10 0.00 -0.10 0.00 0.00 28.75 28.85 1yhu h GLU 89 CO -0.00 -0.49 0.33 0.77 -1.16 0.00 0.00 179.01 178.45 1yhu h SER 90 N -0.77 0.31 -0.35 1.42 0.02 -1.40 0.20 113.55 112.98 1yhu h SER 90 Ca -0.06 0.12 0.05 0.00 -0.84 0.00 0.00 61.79 61.05 1yhu h SER 90 Cb 0.63 0.09 -0.08 0.00 0.14 0.00 0.00 62.40 63.18 1yhu h SER 90 CO 0.04 0.10 -0.55 0.24 -1.14 0.00 0.00 176.83 175.52 1yhu h MET 91 N 0.45 -0.42 0.49 3.45 2.07 -0.66 -0.44 114.93 119.87 1yhu h MET 91 Ca 0.44 0.03 -0.02 0.00 -2.07 0.00 0.00 59.70 58.08 1yhu h MET 91 Cb 0.70 0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 30.52 1yhu h MET 91 CO -0.42 -0.28 -0.37 -0.07 1.07 0.00 0.00 176.91 176.84 1yhu h LEU 92 N -0.44 -0.96 -0.77 1.22 3.38 0.11 -2.27 115.31 115.58 1yhu h LEU 92 Ca 0.07 0.06 0.12 0.00 0.09 0.00 0.00 57.88 58.22 1yhu h LEU 92 Cb 0.62 0.30 -0.12 0.00 0.09 0.00 0.00 40.66 41.54 1yhu h LEU 92 CO -0.56 -0.53 -0.30 0.47 0.09 0.00 0.00 178.44 177.61 1yhu n ASP 93 N -4.65 -0.50 0.11 -0.43 10.43 0.50 0.43 116.55 122.44 1yhu n ASP 93 Ca -0.10 1.34 -0.07 0.00 2.57 0.00 0.00 54.79 58.53 1yhu n ASP 93 Cb 0.36 -0.31 -0.04 0.00 1.84 0.00 0.00 41.12 42.97 1yhu n ASP 93 CO 0.00 0.00 0.00 -0.74 -1.07 0.00 0.00 177.20 175.39 1yhu h HIS 94 N 0.00 -0.55 -0.93 1.24 2.76 -0.95 -0.52 115.15 116.20 1yhu h HIS 94 Ca 0.27 0.00 0.26 0.00 -2.20 0.00 0.00 60.37 58.70 1yhu h HIS 94 Cb 0.46 0.21 -0.14 0.00 1.55 0.00 0.00 27.41 29.49 1yhu h HIS 94 CO -0.67 -0.26 0.42 -0.07 -1.30 0.00 0.00 177.93 176.04 1yhu h LEU 95 N -0.39 0.32 0.36 0.26 3.38 -0.24 0.54 115.31 119.54 1yhu h LEU 95 Ca -0.02 0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1yhu h LEU 95 Cb 0.34 0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1yhu h LEU 95 CO -0.02 -0.08 -0.42 0.00 0.09 0.00 0.00 178.44 178.01 1yhu h ALA 96 N 1.78 -1.06 -0.64 1.53 0.00 0.39 -0.68 119.26 120.58 1yhu h ALA 96 Ca 0.62 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 55.52 1yhu h ALA 96 Cb 1.28 0.67 -0.12 0.00 0.00 0.00 0.00 17.79 19.62 1yhu h ALA 96 CO -0.58 -1.09 -0.12 0.78 0.00 0.00 0.00 179.25 178.23 1yhu h GLY 97 N -0.79 0.52 1.48 0.00 0.00 0.62 0.86 103.07 105.76 1yhu h GLY 97 Ca -0.04 0.18 0.06 0.00 0.00 0.00 0.00 47.33 47.53 1yhu h GLY 97 CO -0.08 -0.24 0.20 1.46 0.00 0.00 0.00 176.54 177.88 1yhu h GLN 98 N 0.02 0.00 0.04 4.80 4.20 -0.47 -2.34 115.11 121.36 1yhu h GLN 98 Ca 0.32 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.64 1yhu h GLN 98 Cb 0.50 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.22 1yhu h GLN 98 CO -0.64 0.00 -2.34 0.72 -0.67 0.00 0.00 178.83 175.91 1yhu n HIS 99 N -3.98 0.37 -0.07 2.96 8.25 0.93 -4.07 115.22 119.61 1yhu n HIS 99 Ca 0.02 0.08 0.20 0.00 -0.26 0.00 0.00 57.72 57.76 1yhu n HIS 99 Cb 0.34 -1.05 0.64 0.00 1.12 0.00 0.00 29.99 31.04 1yhu n HIS 99 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yhu h ALA 100 N 0.00 2.43 0.00 -1.41 0.00 0.82 0.74 119.26 121.84 1yhu h ALA 100 Ca -0.54 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.33 1yhu h ALA 100 Cb 1.93 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.73 1yhu h ALA 100 CO -0.05 -0.61 -0.12 -0.24 0.00 0.00 0.00 179.25 178.24 1yhu h VAL 101 N 0.12 0.22 -2.61 0.00 3.04 -1.60 -3.41 116.25 112.01 1yhu h VAL 101 Ca 0.31 -1.15 -0.56 0.00 -1.01 0.00 0.00 66.70 64.29 1yhu h VAL 101 Cb 1.05 1.96 -0.09 0.00 -2.01 0.00 0.00 31.29 32.20 1yhu h VAL 101 CO -0.04 0.11 0.93 -0.13 -1.01 0.00 0.00 177.57 177.44 1yhu s ARG 102 N -3.30 3.24 -0.07 4.17 1.81 0.25 -4.96 118.95 120.09 1yhu s ARG 102 Ca 0.05 -0.25 -0.29 0.00 -1.72 0.00 0.00 55.73 53.51 1yhu s ARG 102 Cb 0.07 -4.15 -0.07 0.00 -0.45 0.00 0.00 34.95 30.35 1yhu s ARG 102 CO 0.66 -1.97 2.03 -0.51 -0.68 0.00 0.00 175.30 174.82 1yhu s ASP 103 N 3.54 6.09 0.00 0.23 1.01 -1.26 -2.62 116.67 123.65 1yhu s ASP 103 Ca 0.34 2.31 0.00 0.00 0.71 0.00 0.00 52.55 55.91 1yhu s ASP 103 Cb -0.10 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.31 1yhu s ASP 103 CO 0.16 -1.40 0.00 0.61 0.21 0.00 0.00 175.17 174.76 1yhu n GLY 104 N 4.99 1.69 3.66 0.21 0.00 -1.26 -5.08 105.19 109.40 1yhu n GLY 104 Ca 0.23 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1yhu n GLY 104 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yhu s VAL 105 N -0.40 3.40 0.08 1.61 -7.23 -1.08 -4.99 120.40 111.80 1yhu s VAL 105 Ca 0.00 0.52 -0.01 0.00 -1.81 0.00 0.00 61.98 60.68 1yhu s VAL 105 Cb 0.00 -3.34 -0.04 0.00 0.56 0.00 0.00 36.38 33.56 1yhu s VAL 105 CO 0.00 -0.04 0.25 0.28 -0.31 0.00 0.00 175.10 175.28 1yhu s THR 106 N 4.00 5.33 -1.84 5.32 -1.32 -1.26 -4.90 115.64 120.98 1yhu s THR 106 Ca 0.77 -0.30 0.06 0.00 -1.21 0.00 0.00 61.69 61.00 1yhu s THR 106 Cb -0.36 -3.63 0.14 0.00 -1.51 0.00 0.00 72.50 67.14 1yhu s THR 106 CO 0.33 0.10 0.86 0.61 -2.21 0.00 0.00 174.62 174.31 1yhu n GLY 107 N 0.19 -0.25 0.03 6.08 0.00 -1.26 -0.18 105.19 109.80 1yhu n GLY 107 Ca -0.04 -0.03 0.03 0.00 0.00 0.00 0.00 46.02 45.97 1yhu n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yhu n ALA 108 N -1.08 2.67 -0.18 4.61 0.00 -1.26 -4.20 120.51 121.07 1yhu n ALA 108 Ca 0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 53.44 53.25 1yhu n ALA 108 Cb 0.03 -0.19 0.18 0.00 0.00 0.00 0.00 19.45 19.46 1yhu n ALA 108 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1yhu h GLY 109 N 1.24 1.00 0.89 0.00 0.00 -0.95 -1.98 103.07 103.26 1yhu h GLY 109 Ca 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 47.33 46.75 1yhu h GLY 109 CO 0.00 0.50 -0.01 0.74 0.00 0.00 0.00 176.54 177.77 1yhu h PHE 110 N 0.91 0.60 -0.81 5.60 -1.00 -1.75 -2.10 116.94 118.39 1yhu h PHE 110 Ca 0.21 -0.11 0.19 0.00 2.81 0.00 0.00 57.97 61.07 1yhu h PHE 110 Cb 0.21 -0.16 -0.12 0.00 3.61 0.00 0.00 35.95 39.49 1yhu h PHE 110 CO 0.01 0.69 0.22 1.96 -1.61 0.00 0.00 178.31 179.59 1yhu h GLN 111 N 0.35 0.27 0.24 1.51 7.50 -1.55 0.10 115.11 123.53 1yhu h GLN 111 Ca 0.09 -0.02 -0.01 0.00 0.50 0.00 0.00 58.65 59.21 1yhu h GLN 111 Cb 0.45 -0.06 0.00 0.00 0.05 0.00 0.00 27.48 27.92 1yhu h GLN 111 CO 0.02 0.18 -0.11 -0.07 -1.50 0.00 0.00 178.83 177.34 1yhu h LEU 112 N 0.28 -0.27 -0.56 1.46 3.38 -0.99 -2.13 115.31 116.47 1yhu h LEU 112 Ca 0.48 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.55 1yhu h LEU 112 Cb 0.87 0.07 -0.11 0.00 0.09 0.00 0.00 40.66 41.58 1yhu h LEU 112 CO -0.56 -0.18 -0.28 -0.03 0.09 0.00 0.00 178.44 177.48 1yhu h MET 113 N -0.33 -0.13 -0.04 1.13 4.05 -0.24 -0.80 114.93 118.56 1yhu h MET 113 Ca -0.03 0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.41 1yhu h MET 113 Cb 0.25 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 31.05 1yhu h MET 113 CO 0.05 -0.09 -0.31 0.00 0.23 0.00 0.00 176.91 176.80 1yhu h ALA 114 N 1.14 -0.72 -1.09 0.39 0.00 -0.64 0.23 119.26 118.57 1yhu h ALA 114 Ca 0.24 -0.04 0.35 0.00 0.00 0.00 0.00 54.91 55.47 1yhu h ALA 114 Cb 0.53 0.80 -0.14 0.00 0.00 0.00 0.00 17.79 18.97 1yhu h ALA 114 CO -0.64 -0.82 0.65 1.15 0.00 0.00 0.00 179.25 179.58 1yhu h THR 115 N -0.35 0.25 0.41 0.00 2.02 -0.69 0.36 112.91 114.91 1yhu h THR 115 Ca 0.01 -0.08 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 1yhu h THR 115 Cb 0.40 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1yhu h THR 115 CO -0.23 0.04 -0.20 0.58 0.37 0.00 0.00 175.52 176.09 1yhu h VAL 116 N 0.24 0.55 -0.66 3.16 2.07 0.41 -0.30 116.25 121.72 1yhu h VAL 116 Ca 0.75 -0.44 0.10 0.00 0.82 0.00 0.00 66.70 67.93 1yhu h VAL 116 Cb 1.93 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 32.38 1yhu h VAL 116 CO -0.54 0.08 0.28 -0.07 0.02 0.00 0.00 177.57 177.34 1yhu h LEU 117 N -0.82 0.32 -0.60 2.57 3.38 0.19 -1.06 115.31 119.28 1yhu h LEU 117 Ca -0.06 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1yhu h LEU 117 Cb 0.54 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 1yhu h LEU 117 CO 0.09 0.18 0.39 0.24 0.09 0.00 0.00 178.44 179.43 1yhu h MET 118 N 0.48 0.76 0.00 1.13 2.86 -0.91 0.52 114.93 119.78 1yhu h MET 118 Ca 0.33 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.92 1yhu h MET 118 Cb 0.40 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1yhu h MET 118 CO -0.30 0.51 0.00 1.05 1.06 0.00 0.00 176.91 179.23 1yhu h GLU 119 N 0.79 0.00 0.00 1.72 4.11 -0.29 -3.35 114.58 117.56 1yhu h GLU 119 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.65 1yhu h GLU 119 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1yhu h GLU 119 CO -0.06 0.00 -0.24 -1.13 0.07 0.00 0.00 179.01 177.65 1yhu n SER 120 N -2.30 1.15 -0.08 3.06 3.41 -0.47 -4.71 113.62 113.68 1yhu n SER 120 Ca 0.04 -0.39 -0.10 0.00 -0.26 0.00 0.00 58.87 58.16 1yhu n SER 120 Cb 0.36 1.00 -0.03 0.00 -0.26 0.00 0.00 64.21 65.28 1yhu n SER 120 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1yhu h LEU 121 N 0.00 0.35 -1.47 1.04 5.85 -0.10 -2.24 115.31 118.74 1yhu h LEU 121 Ca 0.00 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1yhu h LEU 121 Cb 0.00 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.94 1yhu h LEU 121 CO 0.00 0.42 0.13 1.55 -0.34 0.00 0.00 178.44 180.20 1yhu h PRO 122 N 0.26 0.00 -0.21 5.25 0.13 -1.81 0.42 132.00 136.04 1yhu h PRO 122 Ca 0.08 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.05 1yhu h PRO 122 Cb 0.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.31 1yhu h PRO 122 CO -0.01 0.00 -0.51 1.96 -0.23 0.00 0.00 178.00 179.21 1yhu h GLN 123 N 0.00 0.71 0.04 0.86 1.08 -1.69 -3.36 115.11 112.75 1yhu h GLN 123 Ca 0.00 -0.49 -0.37 0.00 -1.45 0.00 0.00 58.65 56.34 1yhu h GLN 123 Cb 0.26 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 27.71 1yhu h GLN 123 CO 0.00 1.11 -2.25 1.33 -0.95 0.00 0.00 178.83 178.07 1yhu n VAL 124 N -4.13 1.59 -1.67 -0.54 0.24 0.33 -4.98 118.33 109.17 1yhu n VAL 124 Ca -0.06 -0.64 -0.33 0.00 -2.04 0.00 0.00 64.34 61.26 1yhu n VAL 124 Cb 0.60 -1.41 0.06 0.00 -1.47 0.00 0.00 33.84 31.62 1yhu n VAL 124 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1yhu s VAL 125 N -2.54 2.96 0.00 3.34 1.01 0.12 -4.97 120.40 120.33 1yhu s VAL 125 Ca -0.26 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1yhu s VAL 125 Cb 0.08 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.47 1yhu s VAL 125 CO 0.70 -0.27 0.00 -0.62 0.00 0.00 0.00 175.10 174.91 1yhu n GLU 126 N -2.48 0.00 -1.26 2.72 -0.58 -1.26 -4.46 120.64 113.31 1yhu n GLU 126 Ca 0.11 0.00 -0.22 0.00 -0.42 0.00 0.00 57.16 56.64 1yhu n GLU 126 Cb 0.51 -0.04 -0.06 0.00 -0.57 0.00 0.00 31.44 31.29 1yhu n GLU 126 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1yhu n GLY 127 N 2.46 4.02 2.52 0.62 0.00 -1.26 -4.99 105.19 108.56 1yhu n GLY 127 Ca 0.00 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 1yhu n GLY 127 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1yhu n PHE 128 N 1.06 0.36 -3.96 1.61 7.35 -1.26 -4.96 117.46 117.66 1yhu n PHE 128 Ca 0.43 0.76 -0.32 0.00 -0.76 0.00 0.00 57.45 57.56 1yhu n PHE 128 Cb 0.62 -1.50 -0.14 0.00 0.35 0.00 0.00 39.48 38.81 1yhu n PHE 128 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1yhu s ASN 129 N -0.09 4.78 0.35 -2.13 3.84 -1.26 -4.97 114.94 115.45 1yhu s ASN 129 Ca 0.63 -2.33 0.03 0.00 0.21 0.00 0.00 52.86 51.40 1yhu s ASN 129 Cb -0.88 -1.67 0.66 0.00 -0.55 0.00 0.00 41.25 38.80 1yhu s ASN 129 CO 0.41 -0.38 1.97 1.55 -2.79 0.00 0.00 177.10 177.87 1yhu h PRO 130 N 7.44 0.83 0.84 0.43 0.13 -1.98 -1.73 132.00 137.96 1yhu h PRO 130 Ca -0.06 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 64.98 1yhu h PRO 130 Cb 1.00 -0.19 0.01 0.00 0.13 0.00 0.00 31.00 31.95 1yhu h PRO 130 CO 0.59 0.55 -0.41 -0.44 -0.23 0.00 0.00 178.00 178.06 1yhu h ASP 131 N 0.85 -0.96 -0.79 1.44 5.19 -1.98 0.55 116.42 120.72 1yhu h ASP 131 Ca 0.29 0.03 0.12 0.00 -0.62 0.00 0.00 57.03 56.85 1yhu h ASP 131 Cb 0.09 0.25 -0.09 0.00 0.18 0.00 0.00 39.33 39.76 1yhu h ASP 131 CO -0.09 -0.61 0.39 0.00 -3.12 0.00 0.00 179.24 175.81 1yhu h ALA 132 N -1.25 1.14 -0.26 3.45 0.00 -1.88 0.18 119.26 120.64 1yhu h ALA 132 Ca -0.12 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1yhu h ALA 132 Cb 0.87 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1yhu h ALA 132 CO 0.19 -0.08 0.10 -1.49 0.00 0.00 0.00 179.25 177.96 1yhu h TRP 133 N 0.60 0.40 -0.39 0.00 4.06 -1.12 -1.46 115.95 118.04 1yhu h TRP 133 Ca 0.41 -0.03 -0.01 0.00 2.06 0.00 0.00 58.89 61.32 1yhu h TRP 133 Cb 0.54 -0.12 -0.02 0.00 -1.00 0.00 0.00 29.16 28.56 1yhu h TRP 133 CO -0.11 0.42 0.22 0.00 -3.56 0.00 0.00 178.44 175.41 1yhu h ALA 134 N 0.93 0.50 -0.75 1.49 0.00 0.11 0.41 119.26 121.95 1yhu h ALA 134 Ca 0.08 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.99 1yhu h ALA 134 Cb 0.20 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 1yhu h ALA 134 CO -0.01 0.02 0.43 0.77 0.00 0.00 0.00 179.25 180.46 1yhu h SER 135 N 0.50 0.64 0.21 0.00 0.02 -0.46 -2.14 113.55 112.32 1yhu h SER 135 Ca 0.14 0.03 -0.35 0.00 -0.84 0.00 0.00 61.79 60.77 1yhu h SER 135 Cb 0.05 -0.09 0.02 0.00 0.14 0.00 0.00 62.40 62.51 1yhu h SER 135 CO -0.02 0.39 -1.69 0.00 -1.14 0.00 0.00 176.83 174.37 1yhu h LEU 137 N 0.12 -0.69 -2.01 0.00 6.46 -0.15 -2.74 115.31 116.30 1yhu h LEU 137 Ca -0.33 -0.02 0.12 0.00 -0.12 0.00 0.00 57.88 57.54 1yhu h LEU 137 Cb 2.12 0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 42.21 1yhu h LEU 137 CO 0.20 -0.41 0.31 0.00 -0.62 0.00 0.00 178.44 177.93 1yhu h ALA 138 N -0.64 2.39 -0.45 1.25 0.00 -1.58 0.42 119.26 120.66 1yhu h ALA 138 Ca -0.08 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1yhu h ALA 138 Cb 0.67 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 1yhu h ALA 138 CO 0.14 -0.53 0.22 0.78 0.00 0.00 0.00 179.25 179.86 1yhu h GLY 139 N 0.00 0.62 0.53 0.00 0.00 -1.56 -2.39 103.07 100.26 1yhu h GLY 139 Ca 0.20 -0.15 -0.16 0.00 0.00 0.00 0.00 47.33 47.22 1yhu h GLY 139 CO -0.00 0.10 -1.74 0.29 0.00 0.00 0.00 176.54 175.19 1yhu n ILE 140 N -4.91 0.90 0.03 2.60 -5.35 0.09 -3.42 119.36 109.30 1yhu n ILE 140 Ca 0.03 -0.67 0.04 0.00 -0.27 0.00 0.00 62.75 61.87 1yhu n ILE 140 Cb 0.12 -0.47 0.42 0.00 -1.74 0.00 0.00 39.64 37.97 1yhu n ILE 140 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1yhu h ALA 141 N 1.52 1.67 -0.06 -1.28 0.00 -0.28 -0.48 119.26 120.34 1yhu h ALA 141 Ca -0.20 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.50 1yhu h ALA 141 Cb 1.54 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1yhu h ALA 141 CO 0.03 0.28 -0.62 0.00 0.00 0.00 0.00 179.25 178.94 1yhu h ALA 142 N 1.72 0.84 0.17 0.00 0.00 -1.53 -2.87 119.26 117.59 1yhu h ALA 142 Ca 0.12 -0.55 -0.30 0.00 0.00 0.00 0.00 54.91 54.19 1yhu h ALA 142 Cb 0.03 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 17.77 1yhu h ALA 142 CO -0.02 0.74 -1.26 0.00 0.00 0.00 0.00 179.25 178.71 1yhu h ALA 143 N 1.19 -0.08 -0.36 0.00 0.00 -1.30 -3.32 119.26 115.39 1yhu h ALA 143 Ca -0.01 -0.79 -0.00 0.00 0.00 0.00 0.00 54.91 54.11 1yhu h ALA 143 Cb 1.12 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1yhu h ALA 143 CO 0.09 0.64 0.21 0.82 0.00 0.00 0.00 179.25 181.01 1yhu h ILE 144 N 0.14 1.13 -1.56 0.00 2.04 -1.19 -3.24 117.51 114.84 1yhu h ILE 144 Ca -0.21 -0.33 -0.75 0.00 1.00 0.00 0.00 64.86 64.58 1yhu h ILE 144 Cb 1.96 0.70 -0.15 0.00 -0.74 0.00 0.00 36.82 38.59 1yhu h ILE 144 CO 0.24 0.14 1.86 -1.54 0.00 0.00 0.00 178.15 178.85 1yhu n SER 145 N -4.78 5.08 -3.21 1.72 3.41 -1.08 -3.79 113.62 110.97 1yhu n SER 145 Ca -0.00 -3.06 -0.34 0.00 -0.26 0.00 0.00 58.87 55.21 1yhu n SER 145 Cb 0.07 -1.52 -0.01 0.00 -0.26 0.00 0.00 64.21 62.49 1yhu n SER 145 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1yhu n SER 146 N 4.60 5.92 0.00 4.04 2.88 -1.22 -4.88 113.62 124.96 1yhu n SER 146 Ca 0.40 -3.70 0.00 0.00 -1.33 0.00 0.00 58.87 54.23 1yhu n SER 146 Cb 0.39 -0.85 0.00 0.00 -0.75 0.00 0.00 64.21 63.00 1yhu n SER 146 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yhu n ALA 147 N -0.20 0.00 -0.79 -1.46 0.00 -1.26 -5.04 120.51 111.76 1yhu n ALA 147 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1yhu n ALA 147 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.79 1yhu n ALA 147 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39