#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dng s SER 27 N 0.00 7.49 -0.30 1.61 1.04 -1.26 -5.04 113.70 117.24 2dng s SER 27 Ca 0.00 1.76 -0.17 0.00 0.48 0.00 0.00 55.95 58.03 2dng s SER 27 Cb 0.00 -2.55 0.18 0.00 0.10 0.00 0.00 66.02 63.75 2dng s SER 27 CO 0.00 0.15 1.10 -0.94 0.98 0.00 0.00 173.24 174.53 2dng s SER 28 N -0.99 -0.40 0.00 7.02 1.04 -1.26 -5.04 113.70 114.08 2dng s SER 28 Ca 0.39 0.54 0.00 0.00 0.48 0.00 0.00 55.95 57.36 2dng s SER 28 Cb -0.24 1.45 0.00 0.00 0.10 0.00 0.00 66.02 67.33 2dng s SER 28 CO 0.29 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 175.04 2dng n GLY 29 N 4.83 0.70 3.28 7.32 0.00 -1.26 -5.14 105.19 114.91 2dng n GLY 29 Ca -0.08 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 2dng n GLY 29 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dng s SER 30 N -0.76 -0.49 0.42 1.61 0.15 -1.26 -5.15 113.70 108.22 2dng s SER 30 Ca 0.00 0.92 -0.26 0.00 0.70 0.00 0.00 55.95 57.32 2dng s SER 30 Cb 0.00 0.87 -0.09 0.00 -1.71 0.00 0.00 66.02 65.09 2dng s SER 30 CO 0.00 -0.20 1.33 -0.94 1.20 0.00 0.00 173.24 174.63 2dng s SER 31 N 1.57 6.21 0.13 5.45 1.04 -1.26 -5.00 113.70 121.84 2dng s SER 31 Ca -0.09 2.72 -0.09 0.00 0.48 0.00 0.00 55.95 58.97 2dng s SER 31 Cb -0.09 -2.64 0.03 0.00 0.10 0.00 0.00 66.02 63.42 2dng s SER 31 CO -0.13 -0.93 0.44 0.61 0.98 0.00 0.00 173.24 174.22 2dng n GLY 32 N 0.64 1.18 3.58 7.32 0.00 -1.26 -5.13 105.19 111.53 2dng n GLY 32 Ca 0.04 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 2dng n GLY 32 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dng s LYS 33 N -2.03 3.73 -0.04 1.61 -2.85 -1.26 -4.99 119.74 113.91 2dng s LYS 33 Ca 0.10 0.26 -0.40 0.00 -1.00 0.00 0.00 55.97 54.93 2dng s LYS 33 Cb -0.02 -3.81 -0.19 0.00 -2.06 0.00 0.00 37.83 31.75 2dng s LYS 33 CO 0.04 -0.84 1.26 0.39 0.10 0.00 0.00 175.35 176.29 2dng n GLU 34 N 6.38 0.48 -3.12 1.78 1.02 -1.26 -4.93 120.64 120.98 2dng n GLU 34 Ca 0.02 0.17 -0.29 0.00 -0.02 0.00 0.00 57.16 57.04 2dng n GLU 34 Cb 0.48 -1.74 -0.03 0.00 -0.02 0.00 0.00 31.44 30.14 2dng n GLU 34 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2dng s LEU 35 N 0.70 3.96 0.12 -4.62 1.43 -1.26 -5.01 118.68 113.99 2dng s LEU 35 Ca 0.91 0.90 -0.35 0.00 -1.03 0.00 0.00 54.13 54.55 2dng s LEU 35 Cb -1.17 -3.74 -0.17 0.00 0.03 0.00 0.00 46.19 41.14 2dng s LEU 35 CO 0.56 -0.29 1.18 -2.65 0.23 0.00 0.00 176.35 175.39 2dng n PRO 36 N -1.11 0.95 -0.08 1.29 -0.02 -1.26 -4.89 135.00 129.88 2dng n PRO 36 Ca 0.00 0.34 -0.12 0.00 -2.02 0.00 0.00 63.50 61.70 2dng n PRO 36 Cb 0.54 -1.87 -0.05 0.00 -0.02 0.00 0.00 33.50 32.10 2dng n PRO 36 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2dng h THR 37 N 2.87 1.29 -3.34 3.45 2.02 -1.99 -3.47 112.91 113.75 2dng h THR 37 Ca -0.45 -1.11 -0.08 0.00 0.77 0.00 0.00 66.41 65.54 2dng h THR 37 Cb 1.36 1.55 -0.15 0.00 -1.74 0.00 0.00 68.15 69.17 2dng h THR 37 CO 0.71 0.34 -0.19 -1.61 0.37 0.00 0.00 175.52 175.15 2dng s GLU 38 N -4.68 0.91 1.05 6.66 2.02 -1.26 -5.17 118.70 118.23 2dng s GLU 38 Ca -0.14 -0.60 -0.13 0.00 0.02 0.00 0.00 54.97 54.13 2dng s GLU 38 Cb 0.07 0.39 0.22 0.00 0.10 0.00 0.00 34.13 34.91 2dng s GLU 38 CO 0.76 -0.32 1.08 -1.25 0.02 0.00 0.00 175.26 175.55 2dng s PRO 39 N -3.07 0.03 0.44 0.39 0.04 -1.26 -4.61 135.00 126.96 2dng s PRO 39 Ca -0.01 0.58 -0.24 0.00 0.04 0.00 0.00 61.00 61.37 2dng s PRO 39 Cb 0.01 -1.69 -0.08 0.00 0.04 0.00 0.00 34.50 32.79 2dng s PRO 39 CO -0.07 -3.02 1.17 -1.25 0.04 0.00 0.00 177.00 173.88 2dng s PRO 40 N -4.84 3.83 -0.49 0.56 0.04 -1.26 -5.11 135.00 127.72 2dng s PRO 40 Ca 0.66 1.80 -0.20 0.00 0.04 0.00 0.00 61.00 63.31 2dng s PRO 40 Cb -0.20 -2.48 0.05 0.00 0.04 0.00 0.00 34.50 31.91 2dng s PRO 40 CO 0.59 -0.50 0.66 0.71 0.04 0.00 0.00 177.00 178.50 2dng s TYR 41 N -1.50 3.03 -0.11 0.56 2.02 -1.24 -5.02 117.35 115.07 2dng s TYR 41 Ca 0.62 -0.37 -0.14 0.00 -0.37 0.00 0.00 57.07 56.81 2dng s TYR 41 Cb -0.29 -3.53 -0.05 0.00 -0.40 0.00 0.00 41.96 37.69 2dng s TYR 41 CO 0.36 -1.02 0.35 0.99 -1.57 0.00 0.00 175.55 174.65 2dng s THR 42 N 2.81 5.23 -0.03 -0.71 2.01 -1.26 -1.91 115.64 121.77 2dng s THR 42 Ca 0.18 0.68 0.07 0.00 0.31 0.00 0.00 61.69 62.93 2dng s THR 42 Cb -0.17 -3.67 -0.01 0.00 0.01 0.00 0.00 72.50 68.65 2dng s THR 42 CO 0.14 0.44 -0.24 0.00 -0.69 0.00 0.00 174.62 174.28 2dng s ALA 43 N 0.02 1.99 -0.11 7.40 0.00 0.16 -3.57 121.76 127.65 2dng s ALA 43 Ca 0.20 -1.00 -0.08 0.00 0.00 0.00 0.00 51.96 51.08 2dng s ALA 43 Cb -0.14 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 2dng s ALA 43 CO 0.07 0.44 0.16 -0.47 0.00 0.00 0.00 175.76 175.97 2dng s TYR 44 N -0.38 3.60 -0.03 0.00 6.14 -0.16 0.05 117.35 126.57 2dng s TYR 44 Ca 0.04 0.56 -0.00 0.00 0.64 0.00 0.00 57.07 58.31 2dng s TYR 44 Cb -0.11 -1.99 0.03 0.00 0.42 0.00 0.00 41.96 40.31 2dng s TYR 44 CO 0.01 0.70 0.02 0.08 0.64 0.00 0.00 175.55 176.99 2dng s VAL 45 N -0.94 0.11 0.21 3.14 1.01 -0.44 -1.90 120.40 121.60 2dng s VAL 45 Ca 0.15 0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.31 2dng s VAL 45 Cb -0.12 -0.25 -0.00 0.00 0.00 0.00 0.00 36.38 36.00 2dng s VAL 45 CO 0.04 0.16 0.03 0.61 0.00 0.00 0.00 175.10 175.94 2dng n GLY 46 N 4.46 3.82 2.56 4.51 0.00 -0.20 -1.98 105.19 118.35 2dng n GLY 46 Ca -0.21 -2.16 -0.12 0.00 0.00 0.00 0.00 46.02 43.54 2dng n GLY 46 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2dng n ASN 47 N -1.44 -3.20 -4.83 1.61 4.05 -1.25 -3.14 115.26 107.07 2dng n ASN 47 Ca -0.07 -0.34 -0.30 0.00 0.45 0.00 0.00 54.58 54.32 2dng n ASN 47 Cb 0.29 -3.17 -0.06 0.00 1.23 0.00 0.00 39.78 38.08 2dng n ASN 47 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 2dng s LEU 48 N -4.60 4.00 1.00 1.20 1.43 -1.23 -4.59 118.68 115.89 2dng s LEU 48 Ca 0.16 0.08 -0.15 0.00 -1.03 0.00 0.00 54.13 53.18 2dng s LEU 48 Cb -0.07 -2.65 0.02 0.00 0.03 0.00 0.00 46.19 43.52 2dng s LEU 48 CO 0.42 0.16 0.06 -2.65 0.23 0.00 0.00 176.35 174.58 2dng n PRO 49 N 0.34 -0.56 -0.32 1.29 -0.02 -1.26 -4.88 135.00 129.59 2dng n PRO 49 Ca -0.07 -0.14 -0.03 0.00 -2.02 0.00 0.00 63.50 61.24 2dng n PRO 49 Cb 0.52 -1.67 0.11 0.00 -0.02 0.00 0.00 33.50 32.44 2dng n PRO 49 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2dng h PHE 50 N -1.59 1.20 -2.78 6.00 -1.00 -1.98 -3.26 116.94 113.53 2dng h PHE 50 Ca -0.46 -0.02 -0.70 0.00 2.81 0.00 0.00 57.97 59.60 2dng h PHE 50 Cb 1.31 -0.39 -0.35 0.00 3.61 0.00 0.00 35.95 40.13 2dng h PHE 50 CO 0.29 0.82 0.03 0.09 -1.61 0.00 0.00 178.31 177.93 2dng n ASN 51 N -4.34 4.81 -4.72 2.17 3.02 -1.26 -4.75 115.26 110.19 2dng n ASN 51 Ca 0.09 -3.34 -0.36 0.00 -0.03 0.00 0.00 54.58 50.94 2dng n ASN 51 Cb 0.09 -0.99 -0.07 0.00 -0.61 0.00 0.00 39.78 38.20 2dng n ASN 51 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2dng s THR 52 N -2.26 5.32 0.13 3.41 2.01 -1.23 -5.09 115.64 117.94 2dng s THR 52 Ca 0.33 0.46 0.10 0.00 0.31 0.00 0.00 61.69 62.90 2dng s THR 52 Cb 0.05 -3.60 -0.04 0.00 0.01 0.00 0.00 72.50 68.92 2dng s THR 52 CO -0.01 0.38 -0.21 0.68 -0.69 0.00 0.00 174.62 174.77 2dng s VAL 53 N 0.58 2.61 0.25 3.82 -7.23 -1.26 -4.97 120.40 114.19 2dng s VAL 53 Ca 0.14 -1.64 -0.05 0.00 -1.81 0.00 0.00 61.98 58.63 2dng s VAL 53 Cb -0.13 -2.19 0.39 0.00 0.56 0.00 0.00 36.38 35.01 2dng s VAL 53 CO 0.03 0.07 1.35 1.67 -0.31 0.00 0.00 175.10 177.91 2dng n GLN 54 N 0.77 -0.08 -0.08 4.82 7.27 -1.26 -0.61 117.38 128.21 2dng n GLN 54 Ca -0.16 1.33 -0.12 0.00 0.07 0.00 0.00 57.00 58.12 2dng n GLN 54 Cb 0.53 -2.02 -0.08 0.00 2.41 0.00 0.00 30.24 31.08 2dng n GLN 54 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 2dng h GLY 55 N 0.00 -1.17 -0.87 1.69 0.00 -1.99 -1.11 103.07 99.62 2dng h GLY 55 Ca 0.44 0.72 0.09 0.00 0.00 0.00 0.00 47.33 48.59 2dng h GLY 55 CO -0.87 -0.24 -0.47 1.34 0.00 0.00 0.00 176.54 176.31 2dng n ASP 56 N -4.93 -0.83 -0.07 0.19 2.03 0.23 0.16 116.55 113.33 2dng n ASP 56 Ca -0.04 1.55 -0.07 0.00 0.52 0.00 0.00 54.79 56.75 2dng n ASP 56 Cb 0.29 -0.24 -0.01 0.00 -0.72 0.00 0.00 41.12 40.44 2dng n ASP 56 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2dng h ILE 57 N 0.00 0.73 -0.98 5.18 1.08 -1.37 -0.26 117.51 121.89 2dng h ILE 57 Ca 0.19 -0.00 0.27 0.00 -0.39 0.00 0.00 64.86 64.93 2dng h ILE 57 Cb 0.40 0.72 -0.05 0.00 -3.07 0.00 0.00 36.82 34.83 2dng h ILE 57 CO -0.83 0.00 0.69 -0.78 -0.69 0.00 0.00 178.15 176.53 2dng h ASP 58 N 0.01 0.10 0.02 1.72 3.58 0.96 0.56 116.42 123.36 2dng h ASP 58 Ca 0.13 0.01 -0.15 0.00 0.42 0.00 0.00 57.03 57.44 2dng h ASP 58 Cb 0.20 -0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.26 2dng h ASP 58 CO -0.28 0.03 -0.61 0.00 -2.88 0.00 0.00 179.24 175.50 2dng h ALA 59 N 1.54 0.05 0.44 -0.78 0.00 0.25 -1.20 119.26 119.56 2dng h ALA 59 Ca 0.48 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2dng h ALA 59 Cb 1.74 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.56 2dng h ALA 59 CO -0.06 0.34 -0.37 0.82 0.00 0.00 0.00 179.25 179.98 2dng h ILE 60 N -0.16 0.24 -0.62 0.00 2.04 -0.17 -2.45 117.51 116.39 2dng h ILE 60 Ca -0.08 0.00 -0.24 0.00 1.00 0.00 0.00 64.86 65.54 2dng h ILE 60 Cb 1.34 0.24 -0.14 0.00 -0.74 0.00 0.00 36.82 37.52 2dng h ILE 60 CO 0.12 0.00 0.30 0.49 0.00 0.00 0.00 178.15 179.06 2dng n PHE 61 N -5.48 2.00 -0.09 1.37 3.72 -0.66 -4.45 117.46 113.87 2dng n PHE 61 Ca -0.11 -1.14 0.06 0.00 -0.05 0.00 0.00 57.45 56.22 2dng n PHE 61 Cb 0.38 -0.63 0.41 0.00 -0.94 0.00 0.00 39.48 38.70 2dng n PHE 61 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2dng h LYS 62 N 1.57 0.59 -0.88 -1.08 5.09 -0.70 -1.70 116.57 119.47 2dng h LYS 62 Ca 0.30 -0.04 -0.01 0.00 0.09 0.00 0.00 60.65 60.99 2dng h LYS 62 Cb 2.09 -0.13 -0.04 0.00 0.10 0.00 0.00 32.23 34.25 2dng h LYS 62 CO 0.65 0.39 0.51 0.22 -2.09 0.00 0.00 179.45 179.13 2dng h ASP 63 N 0.61 1.07 -3.93 7.07 3.58 -1.81 -3.44 116.42 119.58 2dng h ASP 63 Ca 0.24 -0.08 -0.47 0.00 0.42 0.00 0.00 57.03 57.14 2dng h ASP 63 Cb 0.17 -0.27 0.07 0.00 1.72 0.00 0.00 39.33 41.02 2dng h ASP 63 CO -0.07 0.84 0.26 -0.76 -2.88 0.00 0.00 179.24 176.64 2dng s LEU 64 N -9.98 2.93 -0.49 2.28 1.43 -0.64 -5.02 118.68 109.20 2dng s LEU 64 Ca -0.13 0.68 -0.25 0.00 -1.03 0.00 0.00 54.13 53.41 2dng s LEU 64 Cb 0.16 -3.40 0.03 0.00 0.03 0.00 0.00 46.19 43.02 2dng s LEU 64 CO 0.82 -1.41 0.93 -0.44 0.23 0.00 0.00 176.35 176.48 2dng s SER 65 N -4.43 6.44 -0.20 2.29 0.01 -1.26 -4.99 113.70 111.57 2dng s SER 65 Ca 0.58 -0.05 -0.16 0.00 1.31 0.00 0.00 55.95 57.63 2dng s SER 65 Cb -0.11 -2.45 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 2dng s SER 65 CO 0.46 -1.12 0.40 -0.63 0.41 0.00 0.00 173.24 172.77 2dng s ILE 66 N 3.84 5.20 -0.20 1.44 1.01 -1.26 -3.97 121.20 127.25 2dng s ILE 66 Ca 0.35 0.72 -0.21 0.00 0.00 0.00 0.00 60.65 61.50 2dng s ILE 66 Cb -0.11 -3.73 -0.19 0.00 0.01 0.00 0.00 42.46 38.44 2dng s ILE 66 CO 0.24 0.26 0.23 -0.09 0.00 0.00 0.00 174.94 175.57 2dng h ARG 67 N 7.33 0.00 -1.77 2.79 2.43 -1.61 -3.49 114.38 120.06 2dng h ARG 67 Ca -0.36 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.82 2dng h ARG 67 Cb 1.16 0.00 -0.22 0.00 -0.42 0.00 0.00 29.97 30.49 2dng h ARG 67 CO 0.72 0.96 0.36 0.45 -1.51 0.00 0.00 179.97 180.95 2dng s SER 68 N -6.77 -0.53 -0.10 -3.80 0.15 -1.21 -5.02 113.70 96.42 2dng s SER 68 Ca -0.28 0.70 0.01 0.00 0.70 0.00 0.00 55.95 57.08 2dng s SER 68 Cb 0.05 0.60 -0.02 0.00 -1.71 0.00 0.00 66.02 64.94 2dng s SER 68 CO 0.58 -0.40 -0.11 -0.69 1.20 0.00 0.00 173.24 173.82 2dng s VAL 69 N -0.77 3.28 -0.33 4.45 1.01 -1.26 -0.00 120.40 126.78 2dng s VAL 69 Ca -0.04 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.30 2dng s VAL 69 Cb -0.01 -2.35 0.06 0.00 0.00 0.00 0.00 36.38 34.07 2dng s VAL 69 CO 0.03 0.55 0.06 -0.13 0.00 0.00 0.00 175.10 175.62 2dng s ARG 70 N -0.17 2.39 0.09 2.72 0.52 0.28 -5.00 118.95 119.78 2dng s ARG 70 Ca 0.00 -1.35 -0.04 0.00 -0.52 0.00 0.00 55.73 53.82 2dng s ARG 70 Cb -0.13 -3.32 -0.05 0.00 0.52 0.00 0.00 34.95 31.97 2dng s ARG 70 CO 0.03 -0.72 0.32 -0.51 0.02 0.00 0.00 175.30 174.44 2dng s LEU 71 N 1.26 4.31 -0.06 2.53 1.43 -1.26 -1.50 118.68 125.39 2dng s LEU 71 Ca -0.02 0.53 -0.02 0.00 -1.03 0.00 0.00 54.13 53.59 2dng s LEU 71 Cb -0.20 -3.07 -0.04 0.00 0.03 0.00 0.00 46.19 42.91 2dng s LEU 71 CO -0.01 0.13 0.06 -0.69 0.23 0.00 0.00 176.35 176.07 2dng s VAL 72 N -1.53 4.71 0.07 -1.59 1.01 -1.26 -5.02 120.40 116.79 2dng s VAL 72 Ca 0.36 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.14 2dng s VAL 72 Cb -0.13 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 2dng s VAL 72 CO 0.23 0.50 -0.09 -0.13 0.00 0.00 0.00 175.10 175.61 2dng s ARG 73 N -1.27 0.70 1.20 2.72 1.81 -1.26 -2.97 118.95 119.88 2dng s ARG 73 Ca 0.18 -0.99 -0.20 0.00 -1.72 0.00 0.00 55.73 53.00 2dng s ARG 73 Cb -0.12 -0.40 0.29 0.00 -0.45 0.00 0.00 34.95 34.28 2dng s ARG 73 CO 0.07 0.06 1.13 0.34 -0.68 0.00 0.00 175.30 176.23 2dng s ASP 74 N -2.10 0.95 -0.18 0.23 -1.08 -0.64 -4.84 116.67 109.02 2dng s ASP 74 Ca -0.01 0.54 -0.02 0.00 -0.52 0.00 0.00 52.55 52.54 2dng s ASP 74 Cb -0.05 -0.72 -0.22 0.00 -1.46 0.00 0.00 42.92 40.47 2dng s ASP 74 CO -0.00 -4.09 0.09 1.17 0.52 0.00 0.00 175.17 172.85 2dng n LYS 75 N -4.73 0.71 0.00 4.34 0.00 -1.26 -3.63 118.16 113.59 2dng n LYS 75 Ca 0.14 0.21 0.00 0.00 0.00 0.00 0.00 58.31 58.66 2dng n LYS 75 Cb 0.60 -1.62 0.00 0.00 0.00 0.00 0.00 35.03 34.00 2dng n LYS 75 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2dng n ASP 76 N -3.37 0.00 0.19 3.14 8.00 -1.26 -4.36 116.55 118.88 2dng n ASP 76 Ca -0.38 0.26 0.14 0.00 0.71 0.00 0.00 54.79 55.52 2dng n ASP 76 Cb 1.02 -0.49 0.63 0.00 -0.02 0.00 0.00 41.12 42.26 2dng n ASP 76 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2dng h THR 77 N 0.00 0.00 -6.93 -3.53 1.35 -2.00 -3.46 112.91 98.34 2dng h THR 77 Ca 0.00 -0.19 -0.59 0.00 -0.55 0.00 0.00 66.41 65.08 2dng h THR 77 Cb 0.00 0.93 -0.21 0.00 -1.73 0.00 0.00 68.15 67.14 2dng h THR 77 CO 0.00 0.00 -0.92 0.47 -0.25 0.00 0.00 175.52 174.82 2dng n ASP 78 N -2.48 -0.41 -4.59 5.36 8.00 -1.24 -4.89 116.55 116.31 2dng n ASP 78 Ca 0.00 -1.18 -0.27 0.00 0.71 0.00 0.00 54.79 54.06 2dng n ASP 78 Cb 0.17 -2.08 -0.11 0.00 -0.02 0.00 0.00 41.12 39.09 2dng n ASP 78 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2dng s LYS 79 N -7.11 1.91 0.41 -1.24 -2.85 -1.26 -4.62 119.74 104.96 2dng s LYS 79 Ca 0.26 -2.07 -0.24 0.00 -1.00 0.00 0.00 55.97 52.92 2dng s LYS 79 Cb -0.15 -1.56 -0.11 0.00 -2.06 0.00 0.00 37.83 33.95 2dng s LYS 79 CO 0.97 -0.04 0.90 0.34 0.10 0.00 0.00 175.35 177.62 2dng n PHE 80 N -0.92 0.80 -0.10 1.78 7.35 -1.26 -1.62 117.46 123.49 2dng n PHE 80 Ca -0.05 0.59 -0.15 0.00 -0.76 0.00 0.00 57.45 57.08 2dng n PHE 80 Cb 0.67 -2.17 -0.06 0.00 0.35 0.00 0.00 39.48 38.26 2dng n PHE 80 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 2dng n LYS 81 N 0.28 0.53 0.00 -4.13 4.76 -1.16 -4.80 118.16 113.64 2dng n LYS 81 Ca 0.10 0.42 0.00 0.00 -2.87 0.00 0.00 58.31 55.96 2dng n LYS 81 Cb 0.38 -1.61 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 2dng n LYS 81 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dng n GLY 82 N 1.46 0.35 3.09 0.72 0.00 -1.26 -5.08 105.19 104.46 2dng n GLY 82 Ca -0.25 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.60 2dng n GLY 82 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2dng s PHE 83 N 0.00 0.93 0.16 1.61 -0.71 -1.26 -3.50 117.98 115.21 2dng s PHE 83 Ca 0.00 -0.34 -0.05 0.00 -1.04 0.00 0.00 56.93 55.50 2dng s PHE 83 Cb 0.00 -0.56 -0.02 0.00 -1.21 0.00 0.00 43.02 41.23 2dng s PHE 83 CO 0.00 -0.01 0.20 0.00 -1.34 0.00 0.00 175.22 174.07 2dng s TYR 85 N -4.02 2.51 -0.12 0.00 1.51 -0.56 -1.33 117.35 115.34 2dng s TYR 85 Ca 0.22 -1.15 -0.06 0.00 -1.01 0.00 0.00 57.07 55.07 2dng s TYR 85 Cb 0.05 -1.70 -0.04 0.00 -0.11 0.00 0.00 41.96 40.16 2dng s TYR 85 CO 0.02 -0.50 0.10 0.08 -1.11 0.00 0.00 175.55 174.14 2dng s VAL 86 N 0.62 5.16 -0.14 0.71 1.01 0.11 -0.56 120.40 127.30 2dng s VAL 86 Ca -0.12 0.08 -0.07 0.00 0.00 0.00 0.00 61.98 61.87 2dng s VAL 86 Cb -0.17 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 2dng s VAL 86 CO 0.03 0.60 0.10 -0.70 0.00 0.00 0.00 175.10 175.13 2dng s GLU 87 N -0.86 3.62 0.24 2.72 2.56 1.00 -0.67 118.70 127.31 2dng s GLU 87 Ca 0.14 -0.24 0.11 0.00 0.00 0.00 0.00 54.97 54.98 2dng s GLU 87 Cb -0.12 -3.17 -0.05 0.00 2.00 0.00 0.00 34.13 32.80 2dng s GLU 87 CO 0.03 0.57 -0.21 -0.06 -0.56 0.00 0.00 175.26 175.03 2dng s PHE 88 N -0.45 2.24 -0.02 5.30 0.40 -0.80 -1.56 117.98 123.09 2dng s PHE 88 Ca 0.11 -0.36 -0.00 0.00 -0.60 0.00 0.00 56.93 56.07 2dng s PHE 88 Cb -0.12 -1.02 -0.00 0.00 0.51 0.00 0.00 43.02 42.39 2dng s PHE 88 CO 0.02 0.61 -0.01 0.22 0.70 0.00 0.00 175.22 176.76 2dng h ASP 89 N 2.62 0.00 -2.94 1.36 1.82 -1.87 -3.30 116.42 114.11 2dng h ASP 89 Ca -0.42 0.00 -0.47 0.00 -0.39 0.00 0.00 57.03 55.75 2dng h ASP 89 Cb 1.24 0.00 0.03 0.00 0.68 0.00 0.00 39.33 41.28 2dng h ASP 89 CO 0.56 0.10 -0.07 -1.61 -1.61 0.00 0.00 179.24 176.60 2dng s GLU 90 N -1.13 3.24 0.37 0.28 2.02 -1.26 -4.65 118.70 117.57 2dng s GLU 90 Ca -0.01 -0.31 0.18 0.00 0.02 0.00 0.00 54.97 54.85 2dng s GLU 90 Cb 0.00 -2.54 0.67 0.00 0.10 0.00 0.00 34.13 32.36 2dng s GLU 90 CO 0.01 -0.18 1.73 -0.24 0.02 0.00 0.00 175.26 176.61 2dng h VAL 91 N 0.43 0.93 -0.05 2.63 3.04 -1.99 -3.22 116.25 118.02 2dng h VAL 91 Ca -0.47 -1.54 0.03 0.00 -1.01 0.00 0.00 66.70 63.70 2dng h VAL 91 Cb 1.24 1.93 -0.03 0.00 -2.01 0.00 0.00 31.29 32.41 2dng h VAL 91 CO 0.59 0.38 -0.12 -0.78 -1.01 0.00 0.00 177.57 176.63 2dng h ASP 92 N 0.00 -0.36 -0.16 3.17 1.82 -1.98 0.67 116.42 119.58 2dng h ASP 92 Ca -0.00 0.06 0.04 0.00 -0.39 0.00 0.00 57.03 56.73 2dng h ASP 92 Cb 0.90 0.16 -0.07 0.00 0.68 0.00 0.00 39.33 41.00 2dng h ASP 92 CO 0.05 -0.17 -0.51 0.28 -1.61 0.00 0.00 179.24 177.28 2dng h SER 93 N -0.18 -1.62 0.60 2.28 0.02 -1.95 -0.83 113.55 111.87 2dng h SER 93 Ca 0.06 0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 61.19 2dng h SER 93 Cb 0.26 0.64 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 2dng h SER 93 CO -0.15 -0.46 -0.41 0.25 -1.14 0.00 0.00 176.83 174.91 2dng h LEU 94 N -0.54 -1.06 -1.06 5.07 5.85 -1.64 0.61 115.31 122.54 2dng h LEU 94 Ca 0.05 0.07 0.41 0.00 0.84 0.00 0.00 57.88 59.25 2dng h LEU 94 Cb 0.66 0.32 -0.17 0.00 0.37 0.00 0.00 40.66 41.85 2dng h LEU 94 CO -0.44 -0.62 0.59 0.50 -0.34 0.00 0.00 178.44 178.13 2dng h LYS 95 N -0.97 0.05 0.01 1.25 3.64 -0.57 0.34 116.57 120.32 2dng h LYS 95 Ca -0.07 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 2dng h LYS 95 Cb 0.80 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 2dng h LYS 95 CO 0.04 0.04 -0.14 1.49 -2.27 0.00 0.00 179.45 178.61 2dng h GLU 96 N 0.06 0.08 -0.55 1.90 4.81 -0.59 -3.24 114.58 117.04 2dng h GLU 96 Ca 0.83 -0.10 0.16 0.00 -0.13 0.00 0.00 59.36 60.13 2dng h GLU 96 Cb 2.23 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 31.62 2dng h GLU 96 CO -0.70 0.91 0.52 0.00 -0.73 0.00 0.00 179.01 179.01 2dng h ALA 97 N 0.17 2.34 0.00 2.92 0.00 0.19 0.41 119.26 125.29 2dng h ALA 97 Ca -0.02 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2dng h ALA 97 Cb 0.97 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2dng h ALA 97 CO 0.03 -0.80 -0.20 -0.07 0.00 0.00 0.00 179.25 178.20 2dng h LEU 98 N 0.00 0.00 -1.67 0.00 3.38 -1.02 -1.89 115.31 114.11 2dng h LEU 98 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2dng h LEU 98 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2dng h LEU 98 CO -0.00 0.20 0.00 0.71 0.09 0.00 0.00 178.44 179.44 2dng h THR 99 N 0.00 0.00 0.00 0.22 1.35 -0.31 -0.72 112.91 113.45 2dng h THR 99 Ca -0.00 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2dng h THR 99 Cb 0.40 0.72 0.00 0.00 -1.73 0.00 0.00 68.15 67.54 2dng h THR 99 CO 0.03 0.00 0.00 -1.22 -0.25 0.00 0.00 175.52 174.08 2dng n TYR 100 N -2.48 0.00 -2.26 4.73 4.02 -0.71 -4.56 117.16 115.90 2dng n TYR 100 Ca -0.01 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.54 2dng n TYR 100 Cb 0.09 -0.01 -0.04 0.00 -0.02 0.00 0.00 39.34 39.36 2dng n TYR 100 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 2dng s ASP 101 N -2.02 5.72 0.00 7.72 -4.77 -0.28 -2.28 116.67 120.76 2dng s ASP 101 Ca 0.36 -1.83 0.00 0.00 -3.30 0.00 0.00 52.55 47.78 2dng s ASP 101 Cb 0.17 -2.58 0.00 0.00 -1.09 0.00 0.00 42.92 39.41 2dng s ASP 101 CO 0.28 -2.33 0.00 0.61 0.70 0.00 0.00 175.17 174.43 2dng n GLY 102 N 5.82 -0.34 3.93 2.12 0.00 -1.26 -5.01 105.19 110.44 2dng n GLY 102 Ca 0.45 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.22 2dng n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dng s ALA 103 N 0.00 3.31 -0.10 4.61 0.00 -0.97 -4.97 121.76 123.64 2dng s ALA 103 Ca 0.00 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.07 2dng s ALA 103 Cb 0.00 -2.53 -0.02 0.00 0.00 0.00 0.00 23.12 20.57 2dng s ALA 103 CO 0.00 -1.05 -0.13 -0.51 0.00 0.00 0.00 175.76 174.07 2dng s LEU 104 N -5.09 2.73 -0.56 0.00 1.43 -1.26 -2.58 118.68 113.35 2dng s LEU 104 Ca 0.57 -0.28 -0.06 0.00 -1.03 0.00 0.00 54.13 53.34 2dng s LEU 104 Cb -0.11 -1.59 0.14 0.00 0.03 0.00 0.00 46.19 44.67 2dng s LEU 104 CO 0.44 0.23 0.39 -0.22 0.23 0.00 0.00 176.35 177.42 2dng s LEU 105 N -0.04 5.52 0.00 1.79 2.96 0.56 -4.93 118.68 124.53 2dng s LEU 105 Ca -0.03 -2.40 0.00 0.00 -0.22 0.00 0.00 54.13 51.48 2dng s LEU 105 Cb -0.14 -1.93 0.00 0.00 0.50 0.00 0.00 46.19 44.62 2dng s LEU 105 CO 0.04 -0.52 0.00 0.61 -1.32 0.00 0.00 176.35 175.16 2dng n GLY 106 N 4.16 3.56 1.95 7.98 0.00 -1.26 -1.47 105.19 120.12 2dng n GLY 106 Ca 0.02 0.11 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 2dng n GLY 106 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dng n ASP 107 N 9.52 4.48 -2.95 1.61 5.75 -1.26 -4.94 116.55 128.77 2dng n ASP 107 Ca 0.00 -3.17 -0.14 0.00 -0.01 0.00 0.00 54.79 51.47 2dng n ASP 107 Cb 0.00 -0.74 -0.03 0.00 -1.03 0.00 0.00 41.12 39.31 2dng n ASP 107 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2dng n ARG 108 N -0.24 0.67 -3.92 0.11 1.74 -0.54 -5.18 116.66 109.30 2dng n ARG 108 Ca 0.40 -2.75 -0.23 0.00 -0.77 0.00 0.00 57.85 54.51 2dng n ARG 108 Cb 1.35 2.62 -0.06 0.00 -1.02 0.00 0.00 32.46 35.36 2dng n ARG 108 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2dng s SER 109 N -3.12 4.65 -0.04 0.55 0.15 -1.26 -0.33 113.70 114.31 2dng s SER 109 Ca 0.29 -0.96 0.06 0.00 0.70 0.00 0.00 55.95 56.03 2dng s SER 109 Cb -0.01 -0.50 -0.02 0.00 -1.71 0.00 0.00 66.02 63.78 2dng s SER 109 CO 0.21 -0.59 -0.20 -0.76 1.20 0.00 0.00 173.24 173.10 2dng s LEU 110 N -3.99 2.41 -0.32 3.45 1.43 -1.07 -4.60 118.68 115.99 2dng s LEU 110 Ca 0.44 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 2dng s LEU 110 Cb 0.01 -1.45 0.10 0.00 0.03 0.00 0.00 46.19 44.88 2dng s LEU 110 CO 0.24 0.33 0.09 -0.60 0.23 0.00 0.00 176.35 176.64 2dng s ARG 111 N -0.63 0.93 -0.16 1.70 3.00 -1.19 -4.17 118.95 118.43 2dng s ARG 111 Ca 0.10 -1.31 -0.03 0.00 -1.00 0.00 0.00 55.73 53.48 2dng s ARG 111 Cb -0.11 -2.31 -0.02 0.00 0.00 0.00 0.00 34.95 32.51 2dng s ARG 111 CO 0.00 -0.98 -0.06 0.08 0.00 0.00 0.00 175.30 174.34 2dng s VAL 112 N 1.39 3.60 0.16 7.11 1.01 -1.26 -1.03 120.40 131.37 2dng s VAL 112 Ca 0.10 -0.45 -0.14 0.00 0.00 0.00 0.00 61.98 61.49 2dng s VAL 112 Cb -0.18 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.64 2dng s VAL 112 CO -0.20 0.48 0.39 -0.62 0.00 0.00 0.00 175.10 175.15 2dng s ASP 113 N 0.61 -0.13 0.01 3.32 -1.08 -0.80 -4.71 116.67 113.88 2dng s ASP 113 Ca -0.04 -0.55 -0.30 0.00 -0.52 0.00 0.00 52.55 51.14 2dng s ASP 113 Cb -0.15 0.49 -0.04 0.00 -1.46 0.00 0.00 42.92 41.76 2dng s ASP 113 CO 0.03 -0.92 1.13 -0.63 0.52 0.00 0.00 175.17 175.30 2dng s ILE 114 N -3.88 4.35 -0.28 4.11 1.01 -1.26 -0.98 121.20 124.26 2dng s ILE 114 Ca 0.09 1.68 -0.20 0.00 0.00 0.00 0.00 60.65 62.22 2dng s ILE 114 Cb 0.02 -4.08 -0.02 0.00 0.01 0.00 0.00 42.46 38.39 2dng s ILE 114 CO -0.06 0.10 0.60 0.00 0.00 0.00 0.00 174.94 175.58 2dng s ALA 115 N 1.33 3.56 -0.57 9.38 0.00 -1.23 -4.83 121.76 129.41 2dng s ALA 115 Ca 0.56 -0.60 -0.14 0.00 0.00 0.00 0.00 51.96 51.78 2dng s ALA 115 Cb -0.26 -3.03 0.14 0.00 0.00 0.00 0.00 23.12 19.98 2dng s ALA 115 CO 0.27 -0.93 0.50 -2.00 0.00 0.00 0.00 175.76 173.60 2dng s GLU 116 N 2.50 2.96 -0.44 0.00 -6.30 -1.26 -4.84 118.70 111.32 2dng s GLU 116 Ca 0.24 -1.85 0.07 0.00 -2.50 0.00 0.00 54.97 50.93 2dng s GLU 116 Cb -0.15 -4.22 0.27 0.00 0.00 0.00 0.00 34.13 30.03 2dng s GLU 116 CO 0.10 -1.29 0.82 0.41 0.02 0.00 0.00 175.26 175.32 2dng n GLY 117 N 4.95 1.38 2.75 -1.50 0.00 -1.26 -5.09 105.19 106.42 2dng n GLY 117 Ca -0.08 -0.58 -0.28 0.00 0.00 0.00 0.00 46.02 45.08 2dng n GLY 117 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2dng s ARG 118 N -0.31 0.73 -0.09 1.61 1.70 -1.26 -5.11 118.95 116.21 2dng s ARG 118 Ca 0.32 -0.56 -0.30 0.00 -0.47 0.00 0.00 55.73 54.72 2dng s ARG 118 Cb 0.24 -2.11 -0.02 0.00 -0.57 0.00 0.00 34.95 32.49 2dng s ARG 118 CO -0.15 -0.70 1.15 0.15 -1.08 0.00 0.00 175.30 174.68 2dng s LYS 119 N 1.79 4.35 -0.14 3.89 -0.14 -1.26 -5.01 119.74 123.22 2dng s LYS 119 Ca 0.00 1.58 -0.05 0.00 -1.36 0.00 0.00 55.97 56.14 2dng s LYS 119 Cb -0.17 -3.58 0.07 0.00 -1.68 0.00 0.00 37.83 32.46 2dng s LYS 119 CO -0.11 -0.45 0.29 -1.14 -0.76 0.00 0.00 175.35 173.18 2dng s GLN 120 N 2.37 0.19 0.76 1.68 0.74 -1.26 -5.15 119.66 118.99 2dng s GLN 120 Ca 0.53 0.78 -0.15 0.00 0.05 0.00 0.00 55.36 56.57 2dng s GLN 120 Cb -0.22 0.02 0.01 0.00 1.10 0.00 0.00 33.01 33.92 2dng s GLN 120 CO 0.19 -0.26 0.86 -0.25 -0.55 0.00 0.00 175.29 175.28 2dng n ASP 121 N 5.21 -0.04 -4.06 6.67 9.92 -1.26 -4.88 116.55 128.11 2dng n ASP 121 Ca -0.09 0.60 -0.43 0.00 -0.53 0.00 0.00 54.79 54.34 2dng n ASP 121 Cb 0.50 -1.36 0.00 0.00 -0.64 0.00 0.00 41.12 39.62 2dng n ASP 121 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2dng n LYS 122 N -1.88 3.60 -1.63 -1.24 4.01 -1.26 -4.99 118.16 114.77 2dng n LYS 122 Ca 0.12 -3.70 -0.55 0.00 -0.51 0.00 0.00 58.31 53.67 2dng n LYS 122 Cb 0.50 -2.93 -0.07 0.00 -0.51 0.00 0.00 35.03 32.03 2dng n LYS 122 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2dng n SER 123 N 4.21 1.68 -1.24 4.39 2.88 -1.26 -4.18 113.62 120.10 2dng n SER 123 Ca 0.38 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 59.03 2dng n SER 123 Cb 0.38 -1.13 0.00 0.00 -0.75 0.00 0.00 64.21 62.71 2dng n SER 123 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dng n GLY 124 N 3.00 -2.38 3.71 0.46 0.00 -1.26 -4.70 105.19 104.03 2dng n GLY 124 Ca 0.22 -0.40 -0.59 0.00 0.00 0.00 0.00 46.02 45.24 2dng n GLY 124 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dng n PRO 125 N 0.09 1.00 -3.43 1.61 -0.02 -1.26 -1.15 135.00 131.84 2dng n PRO 125 Ca 0.00 0.37 -0.17 0.00 -2.02 0.00 0.00 63.50 61.68 2dng n PRO 125 Cb 0.00 -2.03 0.09 0.00 -0.02 0.00 0.00 33.50 31.54 2dng n PRO 125 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2dng n SER 126 N 5.13 -2.06 -4.70 2.55 7.64 -1.26 -4.92 113.62 116.00 2dng n SER 126 Ca 0.27 -0.62 -0.42 0.00 1.01 0.00 0.00 58.87 59.11 2dng n SER 126 Cb 0.11 -5.13 -0.03 0.00 -1.01 0.00 0.00 64.21 58.15 2dng n SER 126 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dng s SER 127 N -4.36 6.77 0.00 6.43 0.15 -0.30 -5.23 113.70 117.15 2dng s SER 127 Ca 0.00 2.32 0.07 0.00 0.70 0.00 0.00 55.95 59.04 2dng s SER 127 Cb -0.00 -2.57 0.05 0.00 -1.71 0.00 0.00 66.02 61.79 2dng s SER 127 CO 0.73 -0.74 0.71 0.61 1.20 0.00 0.00 173.24 175.76