#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cad s ILE 10 N 0.00 4.35 0.12 -1.33 -1.09 -1.26 -5.08 121.20 116.91 2cad s ILE 10 Ca 0.00 -0.19 0.07 0.00 -2.23 0.00 0.00 60.65 58.31 2cad s ILE 10 Cb 0.00 -2.95 -0.04 0.00 -1.58 0.00 0.00 42.46 37.89 2cad s ILE 10 CO 0.00 0.46 -0.18 -0.63 -1.23 0.00 0.00 174.94 173.36 2cad s ILE 11 N 0.55 1.56 -0.20 2.92 -1.09 -1.26 -5.13 121.20 118.54 2cad s ILE 11 Ca 0.01 -1.65 0.01 0.00 -2.23 0.00 0.00 60.65 56.79 2cad s ILE 11 Cb -0.13 -1.55 0.05 0.00 -1.58 0.00 0.00 42.46 39.24 2cad s ILE 11 CO 0.02 -0.24 -0.08 -0.60 -1.23 0.00 0.00 174.94 172.81 2cad s ARG 12 N -2.29 1.84 0.33 2.79 3.00 -1.26 -5.11 118.95 118.25 2cad s ARG 12 Ca 0.08 -0.84 0.09 0.00 -1.00 0.00 0.00 55.73 54.07 2cad s ARG 12 Cb -0.08 -2.41 -0.06 0.00 0.00 0.00 0.00 34.95 32.41 2cad s ARG 12 CO 0.04 -0.47 -0.03 -0.59 0.00 0.00 0.00 175.30 174.25 2cad s PHE 13 N 1.43 2.49 -0.11 5.12 -0.12 -1.26 -5.14 117.98 120.38 2cad s PHE 13 Ca -0.02 -0.44 -0.06 0.00 -0.05 0.00 0.00 56.93 56.36 2cad s PHE 13 Cb -0.17 -1.41 -0.04 0.00 -0.63 0.00 0.00 43.02 40.78 2cad s PHE 13 CO -0.08 0.53 0.10 0.45 -0.05 0.00 0.00 175.22 176.18 2cad s SER 14 N -3.67 6.09 0.04 1.98 0.15 -1.26 -5.11 113.70 111.92 2cad s SER 14 Ca 0.34 0.38 0.09 0.00 0.70 0.00 0.00 55.95 57.46 2cad s SER 14 Cb -0.00 -1.92 -0.03 0.00 -1.71 0.00 0.00 66.02 62.36 2cad s SER 14 CO 0.18 0.40 -0.26 -0.69 1.20 0.00 0.00 173.24 174.07 2cad s VAL 15 N -0.95 2.08 -0.16 4.45 1.01 -1.26 -5.14 120.40 120.43 2cad s VAL 15 Ca 0.14 -1.36 -0.01 0.00 0.00 0.00 0.00 61.98 60.75 2cad s VAL 15 Cb -0.12 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.47 2cad s VAL 15 CO 0.03 0.36 -0.11 -0.44 0.00 0.00 0.00 175.10 174.94 2cad s SER 16 N -1.21 4.03 0.05 3.32 0.01 -1.26 -5.13 113.70 113.51 2cad s SER 16 Ca 0.11 -0.36 0.07 0.00 1.31 0.00 0.00 55.95 57.08 2cad s SER 16 Cb -0.10 -1.64 -0.03 0.00 0.21 0.00 0.00 66.02 64.47 2cad s SER 16 CO 0.02 0.11 -0.20 -0.76 0.41 0.00 0.00 173.24 172.81 2cad s LEU 17 N 0.70 2.18 0.60 2.44 1.43 -1.26 -5.13 118.68 119.64 2cad s LEU 17 Ca -0.05 -0.53 -0.18 0.00 -1.03 0.00 0.00 54.13 52.33 2cad s LEU 17 Cb -0.15 -0.95 -0.03 0.00 0.03 0.00 0.00 46.19 45.09 2cad s LEU 17 CO 0.02 0.14 1.19 -1.10 0.23 0.00 0.00 176.35 176.83 2cad s GLN 18 N -1.24 2.98 0.25 1.70 -0.21 -1.26 -4.80 119.66 117.08 2cad s GLN 18 Ca 0.07 1.77 -0.03 0.00 0.02 0.00 0.00 55.36 57.19 2cad s GLN 18 Cb -0.09 -1.94 0.45 0.00 1.00 0.00 0.00 33.01 32.44 2cad s GLN 18 CO 0.02 -1.19 1.80 0.37 -2.12 0.00 0.00 175.29 174.17 2cad h GLN 19 N 0.82 0.73 -0.31 2.91 5.75 -2.00 -1.74 115.11 121.28 2cad h GLN 19 Ca -0.50 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 57.87 2cad h GLN 19 Cb 1.29 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 29.66 2cad h GLN 19 CO 0.55 0.49 -0.18 -2.95 -2.65 0.00 0.00 178.83 174.09 2cad h ASN 20 N 0.76 0.55 0.08 -0.69 -1.07 -1.99 -0.31 115.58 112.91 2cad h ASN 20 Ca 0.43 -0.17 -0.24 0.00 0.07 0.00 0.00 56.30 56.39 2cad h ASN 20 Cb 0.46 -0.15 0.01 0.00 -2.07 0.00 0.00 38.32 36.57 2cad h ASN 20 CO -0.28 0.75 -0.92 -0.07 0.07 0.00 0.00 177.43 176.98 2cad h LEU 21 N 0.51 0.77 -0.43 6.14 3.38 -1.84 -2.90 115.31 120.94 2cad h LEU 21 Ca 0.08 -0.58 -0.02 0.00 0.09 0.00 0.00 57.88 57.46 2cad h LEU 21 Cb 0.60 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2cad h LEU 21 CO 0.04 1.37 0.20 0.25 0.09 0.00 0.00 178.44 180.39 2cad h LEU 22 N 0.38 0.57 -1.36 1.67 5.85 -0.96 -0.48 115.31 120.97 2cad h LEU 22 Ca -0.09 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 2cad h LEU 22 Cb 1.55 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.40 2cad h LEU 22 CO 0.17 0.55 0.34 0.44 -0.34 0.00 0.00 178.44 179.61 2cad h ASP 23 N 0.55 0.68 0.35 1.25 5.19 -1.10 -0.01 116.42 123.33 2cad h ASP 23 Ca 0.15 -0.04 -0.26 0.00 -0.62 0.00 0.00 57.03 56.26 2cad h ASP 23 Cb 0.14 -0.17 0.01 0.00 0.18 0.00 0.00 39.33 39.49 2cad h ASP 23 CO -0.02 0.53 -1.13 -0.08 -3.12 0.00 0.00 179.24 175.42 2cad h GLU 24 N 0.79 0.44 -0.67 3.56 4.57 -1.31 -1.97 114.58 120.00 2cad h GLU 24 Ca 0.21 -0.58 -0.03 0.00 -1.18 0.00 0.00 59.36 57.77 2cad h GLU 24 Cb -0.02 0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.73 2cad h GLU 24 CO -0.04 1.23 0.30 1.25 -1.18 0.00 0.00 179.01 180.57 2cad h LEU 25 N 0.20 0.90 -0.77 1.64 5.85 -0.59 -0.99 115.31 121.55 2cad h LEU 25 Ca -0.13 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 2cad h LEU 25 Cb 1.80 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 42.57 2cad h LEU 25 CO 0.20 0.80 0.38 0.44 -0.34 0.00 0.00 178.44 179.92 2cad h ASP 26 N 0.94 1.01 -0.04 1.25 3.32 -0.97 -0.90 116.42 121.02 2cad h ASP 26 Ca 0.23 -0.13 -0.08 0.00 0.02 0.00 0.00 57.03 57.07 2cad h ASP 26 Cb 0.16 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 2cad h ASP 26 CO -0.02 0.85 -0.20 0.78 -1.72 0.00 0.00 179.24 178.93 2cad h ASN 27 N 1.09 0.41 0.45 6.45 -0.26 -1.02 -2.77 115.58 119.92 2cad h ASN 27 Ca 0.27 -0.12 -0.18 0.00 -0.56 0.00 0.00 56.30 55.71 2cad h ASN 27 Cb 0.11 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.24 2cad h ASN 27 CO -0.04 0.62 -0.76 -0.09 -1.06 0.00 0.00 177.43 176.11 2cad h ARG 28 N 0.38 0.25 -0.43 0.81 9.65 -0.67 -0.15 114.38 124.22 2cad h ARG 28 Ca 0.06 -0.22 0.01 0.00 -1.10 0.00 0.00 59.98 58.73 2cad h ARG 28 Cb 0.56 0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 29.17 2cad h ARG 28 CO 0.04 0.89 0.27 0.82 2.80 0.00 0.00 179.97 184.79 2cad h ILE 29 N 0.16 1.08 0.22 1.20 2.04 -1.04 -1.54 117.51 119.63 2cad h ILE 29 Ca -0.03 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 2cad h ILE 29 Cb 1.33 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.89 2cad h ILE 29 CO 0.12 0.10 -0.10 0.40 0.00 0.00 0.00 178.15 178.66 2cad h ILE 30 N 0.55 0.81 -0.96 -0.67 2.04 -1.38 0.17 117.51 118.07 2cad h ILE 30 Ca 0.17 -0.88 0.13 0.00 1.00 0.00 0.00 64.86 65.28 2cad h ILE 30 Cb -0.03 1.26 -0.08 0.00 -0.74 0.00 0.00 36.82 37.23 2cad h ILE 30 CO -0.06 0.17 0.61 0.11 0.00 0.00 0.00 178.15 178.99 2cad h LYS 31 N -0.79 0.84 -0.02 2.37 1.57 -0.99 -2.92 116.57 116.64 2cad h LYS 31 Ca -0.03 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2cad h LYS 31 Cb 0.51 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2cad h LYS 31 CO 0.05 0.56 -0.40 0.09 -0.57 0.00 0.00 179.45 179.18 2cad n ASN 32 N -4.60 2.01 0.00 0.86 4.13 -0.58 -4.98 115.26 112.09 2cad n ASN 32 Ca 0.19 -1.50 0.00 0.00 1.68 0.00 0.00 54.58 54.95 2cad n ASN 32 Cb 0.41 0.38 0.00 0.00 -1.54 0.00 0.00 39.78 39.03 2cad n ASN 32 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2cad n GLY 33 N 1.40 0.86 3.88 7.41 0.00 -0.80 -5.06 105.19 112.88 2cad n GLY 33 Ca 0.10 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 2cad n GLY 33 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cad s TYR 34 N -2.00 3.43 -0.27 1.61 1.51 0.54 -5.01 117.35 117.17 2cad s TYR 34 Ca 0.00 1.13 0.18 0.00 -1.01 0.00 0.00 57.07 57.38 2cad s TYR 34 Cb 0.00 -2.95 -0.26 0.00 -0.11 0.00 0.00 41.96 38.65 2cad s TYR 34 CO 0.00 -1.01 0.51 0.43 -1.11 0.00 0.00 175.55 174.37 2cad n SER 35 N -2.92 0.82 -3.46 2.29 7.64 -1.26 -4.64 113.62 112.08 2cad n SER 35 Ca 0.07 -0.27 -0.12 0.00 1.01 0.00 0.00 58.87 59.55 2cad n SER 35 Cb 0.56 1.59 -0.03 0.00 -1.01 0.00 0.00 64.21 65.32 2cad n SER 35 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2cad s SER 36 N -3.69 -0.54 0.16 6.43 1.04 -1.26 -5.01 113.70 110.83 2cad s SER 36 Ca -0.03 0.17 -0.19 0.00 0.48 0.00 0.00 55.95 56.38 2cad s SER 36 Cb 0.12 0.53 0.06 0.00 0.10 0.00 0.00 66.02 66.84 2cad s SER 36 CO 0.75 -0.80 1.66 0.03 0.98 0.00 0.00 173.24 175.86 2cad h ARG 37 N 2.23 -0.10 -0.66 4.02 3.08 -1.95 -2.22 114.38 118.78 2cad h ARG 37 Ca -0.30 0.01 0.10 0.00 0.07 0.00 0.00 59.98 59.87 2cad h ARG 37 Cb 1.25 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 31.25 2cad h ARG 37 CO 0.37 -0.06 0.27 1.03 -1.07 0.00 0.00 179.97 180.50 2cad h SER 38 N -0.10 0.28 -0.18 7.04 0.87 -1.99 -0.04 113.55 119.44 2cad h SER 38 Ca 0.16 0.08 -0.05 0.00 -1.23 0.00 0.00 61.79 60.76 2cad h SER 38 Cb 0.35 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2cad h SER 38 CO -0.38 0.15 -0.08 -0.08 -0.53 0.00 0.00 176.83 175.91 2cad h GLU 39 N 0.46 0.37 -0.56 2.24 4.81 -1.91 -0.71 114.58 119.28 2cad h GLU 39 Ca 0.34 -0.16 -0.10 0.00 -0.13 0.00 0.00 59.36 59.31 2cad h GLU 39 Cb 0.43 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 2cad h GLU 39 CO -0.32 0.67 -0.05 1.25 -0.73 0.00 0.00 179.01 179.83 2cad h LEU 40 N 0.06 1.01 -0.30 1.64 5.85 -1.10 -1.46 115.31 121.02 2cad h LEU 40 Ca 0.04 -0.33 -0.07 0.00 0.84 0.00 0.00 57.88 58.36 2cad h LEU 40 Cb 0.56 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2cad h LEU 40 CO 0.03 1.10 -0.10 0.58 -0.34 0.00 0.00 178.44 179.71 2cad h VAL 41 N 0.91 1.29 -0.40 1.05 2.07 -0.97 0.84 116.25 121.03 2cad h VAL 41 Ca 0.15 -1.15 0.08 0.00 0.82 0.00 0.00 66.70 66.60 2cad h VAL 41 Cb 0.61 1.42 -0.08 0.00 -1.52 0.00 0.00 31.29 31.73 2cad h VAL 41 CO 0.04 0.37 -0.12 -0.09 0.02 0.00 0.00 177.57 177.78 2cad h ARG 42 N 0.35 -0.03 -0.22 1.57 2.43 -1.09 0.16 114.38 117.55 2cad h ARG 42 Ca 0.07 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 2cad h ARG 42 Cb 0.59 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2cad h ARG 42 CO 0.03 -0.02 -0.00 -0.44 -1.51 0.00 0.00 179.97 178.03 2cad h ASP 43 N -0.03 0.29 0.20 -3.80 5.19 -0.85 0.18 116.42 117.60 2cad h ASP 43 Ca 0.19 -0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.55 2cad h ASP 43 Cb 0.33 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.77 2cad h ASP 43 CO -0.43 0.35 -0.10 0.24 -3.12 0.00 0.00 179.24 176.19 2cad h MET 44 N 0.31 -0.26 -0.03 3.56 2.86 0.28 -2.54 114.93 119.11 2cad h MET 44 Ca 0.07 0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.76 2cad h MET 44 Cb 0.22 0.06 -0.06 0.00 0.06 0.00 0.00 31.60 31.88 2cad h MET 44 CO 0.01 0.11 -0.43 0.82 1.06 0.00 0.00 176.91 178.47 2cad h ILE 45 N -0.70 0.13 -1.16 -1.22 2.04 -0.54 0.29 117.51 116.35 2cad h ILE 45 Ca -0.03 0.00 0.33 0.00 1.00 0.00 0.00 64.86 66.16 2cad h ILE 45 Cb 0.49 0.13 -0.08 0.00 -0.74 0.00 0.00 36.82 36.63 2cad h ILE 45 CO 0.05 0.00 0.79 -0.09 0.00 0.00 0.00 178.15 178.90 2cad h ARG 46 N -0.57 0.17 0.12 2.37 2.43 -1.05 -0.94 114.38 116.91 2cad h ARG 46 Ca 0.05 -0.01 -0.22 0.00 -0.81 0.00 0.00 59.98 58.99 2cad h ARG 46 Cb 0.66 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 30.18 2cad h ARG 46 CO -0.34 0.11 -1.06 1.49 -1.51 0.00 0.00 179.97 178.67 2cad h GLU 47 N 0.17 0.26 -0.45 0.20 4.81 -0.53 -3.34 114.58 115.71 2cad h GLU 47 Ca 0.62 -0.45 0.09 0.00 -0.13 0.00 0.00 59.36 59.49 2cad h GLU 47 Cb 2.03 0.17 -0.08 0.00 0.63 0.00 0.00 28.75 31.50 2cad h GLU 47 CO -0.18 1.21 -0.06 0.87 -0.73 0.00 0.00 179.01 180.13 2cad h LYS 48 N -0.37 0.04 -3.69 1.92 1.57 0.42 -3.13 116.57 113.33 2cad h LYS 48 Ca -0.21 -0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.06 2cad h LYS 48 Cb 1.67 -0.01 0.02 0.00 0.08 0.00 0.00 32.23 33.99 2cad h LYS 48 CO 0.10 0.03 2.72 1.28 -0.57 0.00 0.00 179.45 183.01 2cad n LEU 49 N -5.28 5.32 -2.68 2.94 4.77 -0.45 -5.11 117.00 116.52 2cad n LEU 49 Ca 0.04 -3.16 -0.05 0.00 -0.03 0.00 0.00 56.01 52.81 2cad n LEU 49 Cb 0.24 -1.20 0.06 0.00 -2.33 0.00 0.00 43.42 40.20 2cad n LEU 49 CO 0.15 0.58 0.61 0.52 -1.33 0.00 0.00 177.39 177.91 2cad n VAL 50 N 4.65 0.00 0.00 4.08 0.31 -1.19 -4.93 118.33 121.25 2cad n VAL 50 Ca 0.50 -0.91 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 2cad n VAL 50 Cb 0.23 0.94 0.00 0.00 -0.91 0.00 0.00 33.84 34.10 2cad n VAL 50 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2cad n ASN 58 N -0.08 0.00 -4.77 4.52 5.15 -1.26 -5.03 115.26 113.80 2cad n ASN 58 Ca -0.12 0.00 -0.40 0.00 -0.60 0.00 0.00 54.58 53.46 2cad n ASN 58 Cb 0.72 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.95 2cad n ASN 58 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2cad s PRO 59 N 0.00 4.41 0.37 1.20 0.04 -1.26 -5.01 135.00 134.75 2cad s PRO 59 Ca 0.00 2.11 -0.09 0.00 0.04 0.00 0.00 61.00 63.06 2cad s PRO 59 Cb 0.00 -3.08 0.03 0.00 0.04 0.00 0.00 34.50 31.48 2cad s PRO 59 CO 0.00 -0.10 0.63 0.54 0.04 0.00 0.00 177.00 178.11 2cad s ASN 60 N -0.60 0.51 0.00 6.66 2.20 -1.26 -5.03 114.94 117.43 2cad s ASN 60 Ca 0.48 -1.34 0.31 0.00 -0.94 0.00 0.00 52.86 51.37 2cad s ASN 60 Cb -0.38 0.76 1.61 0.00 -2.00 0.00 0.00 41.25 41.25 2cad s ASN 60 CO 0.50 -1.50 2.07 0.47 -2.94 0.00 0.00 177.10 175.69 2cad n ASP 61 N -1.46 0.33 -4.77 3.54 9.92 -1.26 -2.09 116.55 120.76 2cad n ASP 61 Ca -0.04 -0.92 -0.39 0.00 -0.53 0.00 0.00 54.79 52.92 2cad n ASP 61 Cb 0.61 -0.04 -0.02 0.00 -0.64 0.00 0.00 41.12 41.02 2cad n ASP 61 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2cad s GLU 62 N -2.14 4.17 0.12 -1.24 0.41 -1.26 -4.72 118.70 114.03 2cad s GLU 62 Ca 0.41 1.84 -0.30 0.00 -0.41 0.00 0.00 54.97 56.51 2cad s GLU 62 Cb 0.21 -2.77 -0.07 0.00 -1.78 0.00 0.00 34.13 29.73 2cad s GLU 62 CO 0.39 -0.22 1.14 0.45 -0.49 0.00 0.00 175.26 176.53 2cad s SER 63 N -1.08 7.17 0.11 -0.19 0.15 -1.26 -4.02 113.70 114.58 2cad s SER 63 Ca 0.55 2.06 0.05 0.00 0.70 0.00 0.00 55.95 59.30 2cad s SER 63 Cb -0.31 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.37 2cad s SER 63 CO 0.39 -0.34 -0.12 -0.54 1.20 0.00 0.00 173.24 173.83 2cad s LYS 64 N 0.28 0.93 0.09 5.44 3.01 0.52 -4.62 119.74 125.39 2cad s LYS 64 Ca 0.54 -1.18 -0.19 0.00 -1.01 0.00 0.00 55.97 54.13 2cad s LYS 64 Cb -0.29 -0.73 -0.07 0.00 -1.01 0.00 0.00 37.83 35.73 2cad s LYS 64 CO 0.33 0.13 0.57 -1.50 0.51 0.00 0.00 175.35 175.39 2cad s ILE 65 N -2.21 4.74 0.11 2.17 1.10 -1.12 -1.57 121.20 124.42 2cad s ILE 65 Ca 0.06 1.18 -0.05 0.00 -0.51 0.00 0.00 60.65 61.33 2cad s ILE 65 Cb -0.04 -3.88 -0.02 0.00 0.15 0.00 0.00 42.46 38.67 2cad s ILE 65 CO 0.02 0.50 0.13 0.00 -2.11 0.00 0.00 174.94 173.48 2cad s ALA 66 N -1.17 0.27 -0.05 1.50 0.00 0.06 -1.25 121.76 121.13 2cad s ALA 66 Ca 0.31 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 51.24 2cad s ALA 66 Cb -0.19 0.63 0.02 0.00 0.00 0.00 0.00 23.12 23.58 2cad s ALA 66 CO 0.19 -0.51 -0.03 0.08 0.00 0.00 0.00 175.76 175.49 2cad s VAL 67 N -3.95 0.51 -0.17 0.00 1.01 0.30 -1.60 120.40 116.50 2cad s VAL 67 Ca 0.13 -0.07 -0.07 0.00 0.00 0.00 0.00 61.98 61.97 2cad s VAL 67 Cb 0.06 -0.56 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 2cad s VAL 67 CO -0.05 0.23 0.06 -0.76 0.00 0.00 0.00 175.10 174.59 2cad s LEU 68 N 1.15 3.85 -0.23 3.92 1.43 -0.23 -0.67 118.68 127.90 2cad s LEU 68 Ca -0.07 0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 53.12 2cad s LEU 68 Cb -0.14 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.12 2cad s LEU 68 CO -0.01 0.22 -0.03 -0.69 0.23 0.00 0.00 176.35 176.07 2cad s VAL 69 N 0.09 3.35 -0.12 -1.59 1.01 -0.49 -0.53 120.40 122.11 2cad s VAL 69 Ca 0.05 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.44 2cad s VAL 69 Cb -0.12 -2.58 0.01 0.00 0.00 0.00 0.00 36.38 33.69 2cad s VAL 69 CO 0.01 0.34 -0.18 -0.69 0.00 0.00 0.00 175.10 174.58 2cad s VAL 70 N 1.45 1.73 -0.19 2.92 1.01 0.33 -1.05 120.40 126.59 2cad s VAL 70 Ca 0.04 -0.77 -0.07 0.00 0.00 0.00 0.00 61.98 61.18 2cad s VAL 70 Cb -0.15 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 2cad s VAL 70 CO -0.03 0.49 0.05 -0.63 0.00 0.00 0.00 175.10 174.97 2cad s ILE 71 N 0.96 4.51 0.04 2.22 1.01 -1.01 -0.40 121.20 128.54 2cad s ILE 71 Ca -0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 60.65 60.46 2cad s ILE 71 Cb -0.15 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 2cad s ILE 71 CO -0.03 0.43 -0.02 -0.72 0.00 0.00 0.00 174.94 174.61 2cad s TYR 72 N 0.69 0.42 -0.08 3.97 -0.85 -0.31 -0.26 117.35 120.93 2cad s TYR 72 Ca 0.02 -0.87 -0.29 0.00 -0.52 0.00 0.00 57.07 55.41 2cad s TYR 72 Cb -0.13 -0.31 -0.06 0.00 0.38 0.00 0.00 41.96 41.84 2cad s TYR 72 CO 0.02 -0.33 1.73 0.34 -1.52 0.00 0.00 175.55 175.79 2cad s ASP 73 N -2.46 6.51 0.39 -0.18 2.15 0.19 -1.13 116.67 122.13 2cad s ASP 73 Ca -0.00 2.18 0.05 0.00 0.43 0.00 0.00 52.55 55.21 2cad s ASP 73 Cb 0.02 -2.53 0.77 0.00 -0.30 0.00 0.00 42.92 40.89 2cad s ASP 73 CO -0.07 -1.07 2.04 -0.74 -0.17 0.00 0.00 175.17 175.16 2cad h HIS 74 N 10.25 0.63 -0.00 -5.34 -0.00 -1.34 -3.05 115.15 116.30 2cad h HIS 74 Ca -0.40 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 59.98 2cad h HIS 74 Cb 1.19 -0.21 0.00 0.00 -0.00 0.00 0.00 27.41 28.38 2cad h HIS 74 CO 0.91 0.39 -0.22 0.72 -0.00 0.00 0.00 177.93 179.73 2cad n HIS 75 N -4.46 0.00 -2.32 5.26 8.25 -1.26 -4.80 115.22 115.89 2cad n HIS 75 Ca 0.05 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.08 2cad n HIS 75 Cb 0.06 -0.28 -0.02 0.00 1.12 0.00 0.00 29.99 30.87 2cad n HIS 75 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2cad s GLN 76 N -2.78 4.06 0.33 -0.41 2.00 -1.16 -4.98 119.66 116.72 2cad s GLN 76 Ca 0.19 1.60 -0.25 0.00 -2.00 0.00 0.00 55.36 54.90 2cad s GLN 76 Cb 0.19 -3.87 -0.10 0.00 0.80 0.00 0.00 33.01 30.03 2cad s GLN 76 CO 0.56 -0.95 0.94 1.03 -0.50 0.00 0.00 175.29 176.37 2cad s ARG 77 N 3.96 4.53 0.00 1.67 0.52 -1.26 -3.55 118.95 124.82 2cad s ARG 77 Ca 0.60 1.28 0.00 0.00 -0.52 0.00 0.00 55.73 57.10 2cad s ARG 77 Cb -0.22 -2.72 0.00 0.00 0.52 0.00 0.00 34.95 32.53 2cad s ARG 77 CO 0.21 0.24 0.00 0.39 0.02 0.00 0.00 175.30 176.17 2cad n GLU 78 N 0.41 -0.23 -0.09 3.54 -0.58 -1.26 -4.89 120.64 117.54 2cad n GLU 78 Ca 0.02 0.06 -0.11 0.00 -0.42 0.00 0.00 57.16 56.71 2cad n GLU 78 Cb 0.51 -4.15 -0.04 0.00 -0.57 0.00 0.00 31.44 27.19 2cad n GLU 78 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2cad h LEU 79 N 0.00 0.44 -0.07 -4.62 5.85 -1.93 -1.52 115.31 113.46 2cad h LEU 79 Ca 0.00 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.46 2cad h LEU 79 Cb 0.11 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2cad h LEU 79 CO 0.00 0.59 0.02 -1.13 -0.34 0.00 0.00 178.44 177.58 2cad h ASN 80 N 0.27 0.02 -0.35 1.25 -0.00 -1.90 -0.50 115.58 114.36 2cad h ASN 80 Ca 0.08 0.01 0.07 0.00 -0.00 0.00 0.00 56.30 56.46 2cad h ASN 80 Cb 0.34 0.01 -0.09 0.00 -0.00 0.00 0.00 38.32 38.58 2cad h ASN 80 CO 0.01 0.02 -0.38 -0.61 -0.00 0.00 0.00 177.43 176.47 2cad h GLN 81 N 0.05 -0.31 -0.87 6.67 5.75 -1.97 0.11 115.11 124.55 2cad h GLN 81 Ca 0.03 0.02 0.12 0.00 -0.15 0.00 0.00 58.65 58.67 2cad h GLN 81 Cb 0.02 0.07 -0.08 0.00 1.07 0.00 0.00 27.48 28.55 2cad h GLN 81 CO -0.03 -0.21 0.49 0.00 -2.65 0.00 0.00 178.83 176.43 2cad h ARG 82 N -0.32 0.75 -0.52 1.69 3.08 -0.84 -0.46 114.38 117.77 2cad h ARG 82 Ca 0.14 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 2cad h ARG 82 Cb 0.57 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 2cad h ARG 82 CO -0.52 0.49 0.13 0.52 -1.07 0.00 0.00 179.97 179.53 2cad h MET 83 N 0.77 0.82 -0.12 0.04 2.86 -0.26 -1.50 114.93 117.54 2cad h MET 83 Ca 0.44 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.88 2cad h MET 83 Cb 0.49 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 2cad h MET 83 CO -0.29 0.78 0.05 0.82 1.06 0.00 0.00 176.91 179.33 2cad h ILE 84 N 0.72 1.15 -0.40 -1.22 2.04 -0.42 -0.29 117.51 119.08 2cad h ILE 84 Ca 0.16 -0.43 0.07 0.00 1.00 0.00 0.00 64.86 65.66 2cad h ILE 84 Cb 0.32 1.21 -0.06 0.00 -0.74 0.00 0.00 36.82 37.55 2cad h ILE 84 CO 0.00 0.13 0.05 0.44 0.00 0.00 0.00 178.15 178.78 2cad h ASP 85 N 0.04 -0.05 -0.64 1.72 3.32 -1.05 0.12 116.42 119.89 2cad h ASP 85 Ca 0.04 0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.17 2cad h ASP 85 Cb 0.16 0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 2cad h ASP 85 CO -0.00 0.01 0.42 0.40 -1.72 0.00 0.00 179.24 178.35 2cad h ILE 86 N 0.17 1.16 -0.32 0.35 2.04 -0.99 0.50 117.51 120.42 2cad h ILE 86 Ca 0.20 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 2cad h ILE 86 Cb 0.25 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 2cad h ILE 86 CO -0.28 0.16 0.18 1.56 0.00 0.00 0.00 178.15 179.76 2cad h GLN 87 N 0.86 0.45 -0.29 2.37 4.20 -0.66 0.11 115.11 122.14 2cad h GLN 87 Ca 0.23 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2cad h GLN 87 Cb -0.10 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 2cad h GLN 87 CO -0.05 0.38 0.18 0.45 -0.67 0.00 0.00 178.83 179.12 2cad h HIS 88 N 0.40 0.37 0.00 2.96 3.86 -0.40 -3.13 115.15 119.21 2cad h HIS 88 Ca 0.11 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.28 2cad h HIS 88 Cb 0.06 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.40 2cad h HIS 88 CO -0.03 0.25 -0.22 0.00 0.86 0.00 0.00 177.93 178.79 2cad h ALA 89 N 1.09 1.14 -2.95 2.45 0.00 0.31 -3.46 119.26 117.84 2cad h ALA 89 Ca 0.11 -0.20 -0.55 0.00 0.00 0.00 0.00 54.91 54.26 2cad h ALA 89 Cb -0.02 -0.04 0.13 0.00 0.00 0.00 0.00 17.79 17.87 2cad h ALA 89 CO -0.02 0.28 0.61 0.45 0.00 0.00 0.00 179.25 180.56 2cad n SER 90 N -3.55 2.86 0.01 0.00 2.88 0.34 -4.91 113.62 111.25 2cad n SER 90 Ca -0.01 1.05 0.11 0.00 -1.33 0.00 0.00 58.87 58.69 2cad n SER 90 Cb 0.37 -1.57 0.47 0.00 -0.75 0.00 0.00 64.21 62.73 2cad n SER 90 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cad n GLY 91 N 0.71 -1.29 3.76 0.46 0.00 -1.26 -4.76 105.19 102.80 2cad n GLY 91 Ca 0.08 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2cad n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cad s THR 92 N -3.02 3.15 -0.45 2.61 -4.23 -1.26 -4.95 115.64 107.49 2cad s THR 92 Ca 0.10 0.41 -0.12 0.00 -1.18 0.00 0.00 61.69 60.91 2cad s THR 92 Cb 0.14 -2.86 0.08 0.00 1.34 0.00 0.00 72.50 71.20 2cad s THR 92 CO 0.42 -0.46 0.33 -2.28 -0.54 0.00 0.00 174.62 172.09 2cad s HIS 93 N -2.74 3.30 -0.26 3.99 5.65 0.73 -4.97 115.29 120.99 2cad s HIS 93 Ca 0.63 -1.32 -0.25 0.00 0.25 0.00 0.00 55.06 54.38 2cad s HIS 93 Cb -0.19 -3.12 -0.00 0.00 -1.18 0.00 0.00 32.58 28.09 2cad s HIS 93 CO 0.53 -0.85 0.84 0.08 -0.65 0.00 0.00 174.74 174.70 2cad s VAL 94 N 1.51 4.80 -0.01 0.89 1.01 -1.26 -0.10 120.40 127.24 2cad s VAL 94 Ca 0.04 1.51 -0.11 0.00 0.00 0.00 0.00 61.98 63.42 2cad s VAL 94 Cb -0.24 -4.15 -0.32 0.00 0.00 0.00 0.00 36.38 31.67 2cad s VAL 94 CO 0.04 -0.14 0.84 -0.07 0.00 0.00 0.00 175.10 175.76 2cad h LEU 95 N 9.31 0.65 -7.17 3.92 3.38 -0.90 -3.48 115.31 121.02 2cad h LEU 95 Ca -0.23 -0.84 0.24 0.00 0.09 0.00 0.00 57.88 57.14 2cad h LEU 95 Cb 1.09 -0.21 -0.14 0.00 0.09 0.00 0.00 40.66 41.48 2cad h LEU 95 CO 0.89 1.68 0.71 0.00 0.09 0.00 0.00 178.44 181.81 2cad s THR 97 N -2.69 0.87 -0.02 0.00 2.01 -1.26 -1.06 115.64 113.50 2cad s THR 97 Ca 0.10 -0.55 0.01 0.00 0.31 0.00 0.00 61.69 61.57 2cad s THR 97 Cb 0.01 -0.74 0.01 0.00 0.01 0.00 0.00 72.50 71.78 2cad s THR 97 CO -0.04 0.18 -0.05 -0.89 -0.69 0.00 0.00 174.62 173.13 2cad s THR 98 N -0.37 0.47 -0.01 -0.82 2.01 -0.66 -5.00 115.64 111.26 2cad s THR 98 Ca 0.03 -0.18 0.03 0.00 0.31 0.00 0.00 61.69 61.89 2cad s THR 98 Cb -0.05 -0.44 -0.01 0.00 0.01 0.00 0.00 72.50 72.01 2cad s THR 98 CO -0.00 0.16 -0.11 -1.00 -0.69 0.00 0.00 174.62 172.98 2cad s HIS 99 N 0.31 1.05 0.19 4.92 3.76 -1.26 -1.46 115.29 122.79 2cad s HIS 99 Ca -0.04 -0.21 0.01 0.00 -0.15 0.00 0.00 55.06 54.68 2cad s HIS 99 Cb -0.07 -0.68 -0.05 0.00 1.11 0.00 0.00 32.58 32.89 2cad s HIS 99 CO -0.00 -0.03 0.04 0.96 -0.85 0.00 0.00 174.74 174.85 2cad s ILE 100 N -0.21 0.56 -0.12 0.60 -4.36 -0.66 -5.01 121.20 112.01 2cad s ILE 100 Ca 0.03 -1.98 -0.18 0.00 -0.26 0.00 0.00 60.65 58.26 2cad s ILE 100 Cb -0.05 -2.26 -0.04 0.00 1.25 0.00 0.00 42.46 41.36 2cad s ILE 100 CO -0.00 -0.33 0.49 -1.00 0.24 0.00 0.00 174.94 174.33 2cad s HIS 101 N -3.74 3.52 -0.16 1.37 3.76 -1.26 -1.29 115.29 117.48 2cad s HIS 101 Ca 0.28 0.91 -0.23 0.00 -0.15 0.00 0.00 55.06 55.87 2cad s HIS 101 Cb 0.07 -2.57 -0.20 0.00 1.11 0.00 0.00 32.58 30.99 2cad s HIS 101 CO 0.07 0.16 0.46 0.52 -0.85 0.00 0.00 174.74 175.09 2cad h MET 102 N 6.73 0.00 0.00 1.40 0.00 -1.43 -3.47 114.93 118.16 2cad h MET 102 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.29 2cad h MET 102 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.78 2cad h MET 102 CO 0.76 0.88 0.00 -0.40 0.00 0.00 0.00 176.91 178.14 2cad n ASP 103 N -4.56 0.00 0.06 1.22 5.68 -1.08 -5.00 116.55 112.87 2cad n ASP 103 Ca -0.17 -0.46 0.13 0.00 -0.50 0.00 0.00 54.79 53.78 2cad n ASP 103 Cb 0.51 0.00 0.38 0.00 -1.14 0.00 0.00 41.12 40.87 2cad n ASP 103 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2cad n GLU 104 N 0.00 0.19 -0.03 0.11 -0.00 -1.26 -3.60 120.64 116.04 2cad n GLU 104 Ca 0.00 0.12 -0.05 0.00 -0.00 0.00 0.00 57.16 57.23 2cad n GLU 104 Cb 0.00 -1.68 -0.13 0.00 -0.00 0.00 0.00 31.44 29.63 2cad n GLU 104 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2cad n HIS 105 N -1.98 0.53 -4.67 -1.84 8.25 -1.26 -4.73 115.22 109.52 2cad n HIS 105 Ca 0.05 0.18 -0.23 0.00 -0.26 0.00 0.00 57.72 57.47 2cad n HIS 105 Cb 0.40 -1.02 -0.15 0.00 1.12 0.00 0.00 29.99 30.34 2cad n HIS 105 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2cad s ASN 106 N -5.62 1.76 0.17 0.41 0.01 -1.24 -0.95 114.94 109.48 2cad s ASN 106 Ca -0.06 -0.29 0.10 0.00 -0.71 0.00 0.00 52.86 51.89 2cad s ASN 106 Cb 0.08 -0.19 -0.04 0.00 0.41 0.00 0.00 41.25 41.51 2cad s ASN 106 CO 0.83 0.17 -0.15 0.00 -1.51 0.00 0.00 177.10 176.44 2cad s LEU 108 N -2.61 2.03 0.02 0.00 0.20 -0.41 -1.16 118.68 116.74 2cad s LEU 108 Ca 0.22 -0.50 0.06 0.00 0.69 0.00 0.00 54.13 54.59 2cad s LEU 108 Cb -0.09 -1.31 -0.02 0.00 -0.43 0.00 0.00 46.19 44.34 2cad s LEU 108 CO 0.13 0.18 -0.17 -0.70 -0.29 0.00 0.00 176.35 175.49 2cad s GLU 109 N 0.18 1.23 -0.09 1.98 2.12 0.47 -1.65 118.70 122.94 2cad s GLU 109 Ca -0.12 -0.72 0.02 0.00 0.36 0.00 0.00 54.97 54.50 2cad s GLU 109 Cb -0.16 -1.24 -0.02 0.00 0.26 0.00 0.00 34.13 32.97 2cad s GLU 109 CO 0.06 0.33 -0.14 0.95 -0.54 0.00 0.00 175.26 175.92 2cad s THR 110 N -0.61 3.05 -0.14 -1.70 -4.23 -0.54 -0.52 115.64 110.95 2cad s THR 110 Ca 0.05 -0.70 0.02 0.00 -1.18 0.00 0.00 61.69 59.88 2cad s THR 110 Cb -0.07 -2.23 0.00 0.00 1.34 0.00 0.00 72.50 71.54 2cad s THR 110 CO 0.01 0.56 -0.19 -0.63 -0.54 0.00 0.00 174.62 173.83 2cad s ILE 111 N -0.22 2.35 -0.17 2.99 1.01 0.31 -1.65 121.20 125.82 2cad s ILE 111 Ca 0.01 -0.88 -0.04 0.00 0.00 0.00 0.00 60.65 59.73 2cad s ILE 111 Cb -0.13 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 2cad s ILE 111 CO 0.03 0.53 -0.02 -0.63 0.00 0.00 0.00 174.94 174.85 2cad s ILE 112 N 0.77 3.89 0.13 2.92 1.01 -0.22 -1.06 121.20 128.63 2cad s ILE 112 Ca -0.07 -0.35 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 2cad s ILE 112 Cb -0.16 -2.73 0.01 0.00 0.01 0.00 0.00 42.46 39.59 2cad s ILE 112 CO -0.00 0.47 0.28 -1.48 0.00 0.00 0.00 174.94 174.21 2cad s LEU 113 N 0.65 0.98 -0.05 2.97 2.34 -0.63 -0.15 118.68 124.80 2cad s LEU 113 Ca -0.02 -0.63 0.05 0.00 0.06 0.00 0.00 54.13 53.59 2cad s LEU 113 Cb -0.14 1.33 -0.01 0.00 -0.56 0.00 0.00 46.19 46.81 2cad s LEU 113 CO 0.02 -0.82 -0.21 -1.10 -1.06 0.00 0.00 176.35 173.18 2cad s GLN 114 N -3.88 2.11 0.00 1.48 -0.21 0.85 -0.76 119.66 119.26 2cad s GLN 114 Ca 0.08 -0.75 -0.20 0.00 0.02 0.00 0.00 55.36 54.52 2cad s GLN 114 Cb 0.03 -1.82 0.07 0.00 1.00 0.00 0.00 33.01 32.29 2cad s GLN 114 CO -0.08 0.32 0.92 0.41 -2.12 0.00 0.00 175.29 174.74 2cad n GLY 115 N 3.02 0.38 3.93 3.09 0.00 -0.61 -0.19 105.19 114.81 2cad n GLY 115 Ca -0.18 -1.00 -0.28 0.00 0.00 0.00 0.00 46.02 44.57 2cad n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cad s ASN 116 N -3.04 4.10 0.37 1.61 2.20 -1.26 -0.36 114.94 118.56 2cad s ASN 116 Ca 0.21 0.37 0.06 0.00 -0.94 0.00 0.00 52.86 52.56 2cad s ASN 116 Cb -0.01 -0.74 0.71 0.00 -2.00 0.00 0.00 41.25 39.21 2cad s ASN 116 CO 0.00 -2.09 1.95 0.28 -2.94 0.00 0.00 177.10 174.30 2cad h SER 117 N -1.06 0.48 -0.02 3.54 0.02 -1.57 -1.68 113.55 113.26 2cad h SER 117 Ca -0.44 -0.06 -0.16 0.00 -0.84 0.00 0.00 61.79 60.29 2cad h SER 117 Cb 1.29 -0.12 0.01 0.00 0.14 0.00 0.00 62.40 63.71 2cad h SER 117 CO 0.52 0.47 -0.61 -0.26 -1.14 0.00 0.00 176.83 175.80 2cad h PHE 118 N 0.52 0.66 -0.45 3.45 -1.00 -1.94 -2.16 116.94 116.02 2cad h PHE 118 Ca 0.13 -0.34 -0.02 0.00 2.81 0.00 0.00 57.97 60.54 2cad h PHE 118 Cb 0.16 -0.08 -0.02 0.00 3.61 0.00 0.00 35.95 39.62 2cad h PHE 118 CO 0.01 1.16 0.21 0.93 -1.61 0.00 0.00 178.31 179.00 2cad h GLU 119 N -0.02 0.65 -0.43 1.51 5.08 -1.91 -2.10 114.58 117.36 2cad h GLU 119 Ca -0.07 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.15 2cad h GLU 119 Cb 1.31 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 2cad h GLU 119 CO 0.12 0.57 0.13 0.82 -1.00 0.00 0.00 179.01 179.65 2cad h ILE 120 N 0.58 1.22 -0.85 3.13 2.04 -1.35 -2.31 117.51 119.96 2cad h ILE 120 Ca 0.15 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 2cad h ILE 120 Cb 0.14 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 2cad h ILE 120 CO -0.02 0.26 0.46 -0.61 0.00 0.00 0.00 178.15 178.24 2cad h GLN 121 N 0.55 1.20 -0.09 2.37 4.15 -1.34 -1.62 115.11 120.34 2cad h GLN 121 Ca 0.14 -0.15 -0.00 0.00 0.77 0.00 0.00 58.65 59.41 2cad h GLN 121 Cb 0.26 -0.23 -0.00 0.00 0.21 0.00 0.00 27.48 27.72 2cad h GLN 121 CO -0.00 0.89 0.05 -0.09 -1.93 0.00 0.00 178.83 177.74 2cad h ARG 122 N 1.19 0.13 -0.36 1.69 2.43 -1.27 -1.87 114.38 116.32 2cad h ARG 122 Ca 0.30 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.52 2cad h ARG 122 Cb 0.05 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.51 2cad h ARG 122 CO -0.05 0.19 -0.04 1.25 -1.51 0.00 0.00 179.97 179.82 2cad h LEU 123 N 0.03 -0.23 -0.56 3.80 5.85 -1.24 0.52 115.31 123.48 2cad h LEU 123 Ca 0.03 0.09 0.06 0.00 0.84 0.00 0.00 57.88 58.91 2cad h LEU 123 Cb 0.10 0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 2cad h LEU 123 CO -0.00 -0.07 0.26 -0.61 -0.34 0.00 0.00 178.44 177.68 2cad h GLN 124 N 0.05 0.48 -0.04 1.25 4.15 -1.10 -1.06 115.11 118.86 2cad h GLN 124 Ca 0.17 -0.03 -0.15 0.00 0.77 0.00 0.00 58.65 59.42 2cad h GLN 124 Cb 0.25 -0.11 0.01 0.00 0.21 0.00 0.00 27.48 27.85 2cad h GLN 124 CO -0.33 0.32 -0.56 -0.07 -1.93 0.00 0.00 178.83 176.26 2cad h LEU 125 N 0.50 0.56 -0.50 -2.39 3.38 -1.03 0.12 115.31 115.95 2cad h LEU 125 Ca 0.26 -0.72 0.10 0.00 0.09 0.00 0.00 57.88 57.62 2cad h LEU 125 Cb 0.22 -0.17 -0.10 0.00 0.09 0.00 0.00 40.66 40.70 2cad h LEU 125 CO -0.21 1.19 -0.17 -0.33 0.09 0.00 0.00 178.44 179.02 2cad h GLU 126 N -0.03 -0.05 -0.30 1.13 5.08 -0.81 0.13 114.58 119.73 2cad h GLU 126 Ca -0.06 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.17 2cad h GLU 126 Cb 1.25 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.51 2cad h GLU 126 CO 0.11 -0.04 -0.34 0.82 -1.00 0.00 0.00 179.01 178.56 2cad h ILE 127 N -0.06 1.29 -0.03 3.13 2.04 -1.16 -3.17 117.51 119.55 2cad h ILE 127 Ca 0.24 -1.52 -0.01 0.00 1.00 0.00 0.00 64.86 64.56 2cad h ILE 127 Cb 0.42 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.07 2cad h ILE 127 CO -0.54 0.49 -0.04 1.23 0.00 0.00 0.00 178.15 179.29 2cad h GLY 128 N 0.52 0.05 0.46 5.37 0.00 -0.25 -2.51 103.07 106.70 2cad h GLY 128 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2cad h GLY 128 CO 0.08 0.02 -0.14 0.61 0.00 0.00 0.00 176.54 177.11 2cad n GLY 129 N -1.36 -0.68 3.76 4.60 0.00 -0.01 -4.84 105.19 106.66 2cad n GLY 129 Ca -0.02 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 2cad n GLY 129 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cad s LEU 130 N -2.39 4.47 0.19 0.99 1.43 -0.95 -4.97 118.68 117.45 2cad s LEU 130 Ca 0.30 2.47 -0.31 0.00 -1.03 0.00 0.00 54.13 55.55 2cad s LEU 130 Cb 0.20 -3.67 -0.11 0.00 0.03 0.00 0.00 46.19 42.65 2cad s LEU 130 CO 0.46 -0.36 1.60 -0.60 0.23 0.00 0.00 176.35 177.68 2cad s ARG 131 N -1.67 4.19 0.00 1.70 3.52 -1.26 -2.22 118.95 123.21 2cad s ARG 131 Ca 0.47 2.43 0.00 0.00 -0.13 0.00 0.00 55.73 58.51 2cad s ARG 131 Cb -0.35 -3.12 0.00 0.00 -1.56 0.00 0.00 34.95 29.91 2cad s ARG 131 CO 0.46 -0.63 0.00 0.41 -0.81 0.00 0.00 175.30 174.73 2cad n GLY 132 N 3.58 2.12 3.63 8.12 0.00 -1.26 -4.96 105.19 116.42 2cad n GLY 132 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 2cad n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cad s VAL 133 N -2.55 4.62 0.09 1.61 1.01 -0.94 0.54 120.40 124.78 2cad s VAL 133 Ca 0.00 1.49 -0.13 0.00 0.00 0.00 0.00 61.98 63.33 2cad s VAL 133 Cb 0.00 -4.31 -0.17 0.00 0.00 0.00 0.00 36.38 31.90 2cad s VAL 133 CO 0.00 -0.40 1.28 0.11 0.00 0.00 0.00 175.10 176.09 2cad h LYS 134 N 8.13 0.77 -2.65 2.72 1.79 -0.96 -3.47 116.57 122.91 2cad h LYS 134 Ca -0.22 -0.66 0.05 0.00 -2.18 0.00 0.00 60.65 57.64 2cad h LYS 134 Cb 1.07 0.15 -0.13 0.00 -1.58 0.00 0.00 32.23 31.74 2cad h LYS 134 CO 0.97 1.26 0.35 -0.59 -1.08 0.00 0.00 179.45 180.37 2cad s PHE 135 N -3.68 -0.41 -0.29 -1.35 -0.12 -1.18 -4.99 117.98 105.96 2cad s PHE 135 Ca -0.10 0.21 -0.00 0.00 -0.05 0.00 0.00 56.93 56.98 2cad s PHE 135 Cb 0.08 0.56 0.09 0.00 -0.63 0.00 0.00 43.02 43.13 2cad s PHE 135 CO 0.90 -0.74 0.07 0.00 -0.05 0.00 0.00 175.22 175.40 2cad s ALA 136 N -3.46 1.67 -0.17 1.99 0.00 -1.26 -2.42 121.76 118.11 2cad s ALA 136 Ca 0.04 -1.60 -0.07 0.00 0.00 0.00 0.00 51.96 50.33 2cad s ALA 136 Cb -0.01 -1.58 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 2cad s ALA 136 CO -0.09 -1.54 0.06 0.15 0.00 0.00 0.00 175.76 174.34 2cad s LYS 137 N 1.54 3.88 -0.14 0.00 1.02 -0.21 -4.90 119.74 120.93 2cad s LYS 137 Ca 0.07 -0.33 -0.08 0.00 0.02 0.00 0.00 55.97 55.65 2cad s LYS 137 Cb -0.18 -3.18 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 2cad s LYS 137 CO -0.19 0.34 0.13 -1.17 -0.92 0.00 0.00 175.35 173.54 2cad s LEU 138 N 0.19 4.29 -0.14 3.17 2.96 -1.26 -1.39 118.68 126.49 2cad s LEU 138 Ca 0.04 0.38 0.01 0.00 -0.22 0.00 0.00 54.13 54.35 2cad s LEU 138 Cb -0.12 -2.06 0.02 0.00 0.50 0.00 0.00 46.19 44.52 2cad s LEU 138 CO 0.00 0.34 -0.18 -0.89 -1.32 0.00 0.00 176.35 174.30 2cad s THR 139 N -0.60 1.83 0.03 3.68 2.01 0.15 -5.00 115.64 117.74 2cad s THR 139 Ca 0.13 -0.82 0.06 0.00 0.31 0.00 0.00 61.69 61.37 2cad s THR 139 Cb -0.12 -1.65 -0.03 0.00 0.01 0.00 0.00 72.50 70.71 2cad s THR 139 CO 0.02 0.50 -0.15 -0.54 -0.69 0.00 0.00 174.62 173.77 2cad s LYS 140 N 1.11 2.22 -0.13 4.92 1.02 -1.26 -0.54 119.74 127.08 2cad s LYS 140 Ca -0.01 -0.90 -0.02 0.00 0.02 0.00 0.00 55.97 55.05 2cad s LYS 140 Cb -0.14 -2.28 0.04 0.00 -0.52 0.00 0.00 37.83 34.93 2cad s LYS 140 CO -0.06 0.56 0.01 0.00 -0.92 0.00 0.00 175.35 174.94 2cad s ALA 141 N -0.94 0.89 0.26 5.17 0.00 -0.38 -5.01 121.76 121.75 2cad s ALA 141 Ca 0.15 -0.43 -0.23 0.00 0.00 0.00 0.00 51.96 51.45 2cad s ALA 141 Cb -0.11 -0.96 -0.09 0.00 0.00 0.00 0.00 23.12 21.96 2cad s ALA 141 CO 0.06 -0.79 0.83 0.45 0.00 0.00 0.00 175.76 176.31 2cad s SER 142 N 1.90 7.25 0.14 0.00 0.15 -1.26 -2.78 113.70 119.10 2cad s SER 142 Ca 0.02 1.64 -0.08 0.00 0.70 0.00 0.00 55.95 58.24 2cad s SER 142 Cb -0.15 -2.50 0.19 0.00 -1.71 0.00 0.00 66.02 61.85 2cad s SER 142 CO -0.07 0.02 0.88 -1.54 1.20 0.00 0.00 173.24 173.74 2cad n SER 143 N 0.81 -0.30 0.10 5.45 3.41 -1.26 0.87 113.62 122.70 2cad n SER 143 Ca -0.01 0.99 0.10 0.00 -0.26 0.00 0.00 58.87 59.68 2cad n SER 143 Cb 0.50 -0.26 0.43 0.00 -0.26 0.00 0.00 64.21 64.63 2cad n SER 143 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2cad n PHE 144 N -4.87 0.56 -1.18 7.33 3.01 -1.26 -2.25 117.46 118.80 2cad n PHE 144 Ca 0.07 0.23 -0.16 0.00 1.01 0.00 0.00 57.45 58.61 2cad n PHE 144 Cb 0.25 -0.88 0.23 0.00 -0.01 0.00 0.00 39.48 39.07 2cad n PHE 144 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 2cad n GLU 145 N -2.03 2.76 0.00 -1.08 0.28 0.25 -5.27 120.64 115.56 2cad n GLU 145 Ca 0.02 -3.05 0.00 0.00 -0.16 0.00 0.00 57.16 53.97 2cad n GLU 145 Cb 0.18 -2.17 0.00 0.00 1.43 0.00 0.00 31.44 30.88 2cad n GLU 145 CO 0.00 0.00 0.00 2.48 -0.16 0.00 0.00 177.13 179.45