#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sd7 n TYR 6 N 0.00 -0.49 -0.74 -1.42 4.02 -1.26 -5.09 117.16 112.19 1sd7 n TYR 6 Ca 0.00 -0.78 0.00 0.00 -0.01 0.00 0.00 57.90 57.11 1sd7 n TYR 6 Cb 0.00 1.19 0.00 0.00 -0.02 0.00 0.00 39.34 40.51 1sd7 n TYR 6 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1sd7 n GLU 7 N 0.09 -0.28 -3.53 -0.72 -0.58 -1.26 -4.97 120.64 109.39 1sd7 n GLU 7 Ca -0.14 0.27 -0.25 0.00 -0.42 0.00 0.00 57.16 56.62 1sd7 n GLU 7 Cb 0.72 -0.19 -0.02 0.00 -0.57 0.00 0.00 31.44 31.37 1sd7 n GLU 7 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 1sd7 s ILE 8 N 0.00 5.14 0.71 -3.67 -4.36 -1.26 -5.12 121.20 112.64 1sd7 s ILE 8 Ca 0.00 -0.48 -0.06 0.00 -0.26 0.00 0.00 60.65 59.85 1sd7 s ILE 8 Cb 0.00 -3.82 0.06 0.00 1.25 0.00 0.00 42.46 39.95 1sd7 s ILE 8 CO 0.00 -0.43 1.02 -0.94 0.24 0.00 0.00 174.94 174.83 1sd7 s SER 9 N -3.78 4.78 0.44 4.36 1.04 -1.26 -4.87 113.70 114.41 1sd7 s SER 9 Ca 0.39 0.42 0.10 0.00 0.48 0.00 0.00 55.95 57.34 1sd7 s SER 9 Cb -0.10 -1.06 0.96 0.00 0.10 0.00 0.00 66.02 65.92 1sd7 s SER 9 CO 0.33 -1.62 2.06 0.77 0.98 0.00 0.00 173.24 175.76 1sd7 h SER 10 N -0.61 0.31 -0.03 7.02 4.64 -2.00 0.17 113.55 123.06 1sd7 h SER 10 Ca -0.44 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 60.84 1sd7 h SER 10 Cb 1.31 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1sd7 h SER 10 CO 0.59 0.26 -0.06 0.00 -0.87 0.00 0.00 176.83 176.75 1sd7 h ALA 11 N 1.80 0.04 -0.89 5.18 0.00 -2.00 -2.00 119.26 121.40 1sd7 h ALA 11 Ca 0.09 -0.32 0.12 0.00 0.00 0.00 0.00 54.91 54.81 1sd7 h ALA 11 Cb 0.02 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.72 1sd7 h ALA 11 CO -0.02 -0.11 0.51 0.93 0.00 0.00 0.00 179.25 180.56 1sd7 h GLU 12 N -0.46 0.76 -0.66 0.00 5.08 -1.75 -0.24 114.58 117.30 1sd7 h GLU 12 Ca -0.00 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1sd7 h GLU 12 Cb 0.65 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1sd7 h GLU 12 CO 0.01 0.50 0.44 -1.49 -1.00 0.00 0.00 179.01 177.48 1sd7 h TRP 13 N 0.78 0.81 -0.71 4.33 4.06 -0.53 -1.86 115.95 122.82 1sd7 h TRP 13 Ca 0.46 0.02 -0.05 0.00 2.06 0.00 0.00 58.89 61.37 1sd7 h TRP 13 Cb 0.53 -0.27 -0.03 0.00 -1.00 0.00 0.00 29.16 28.38 1sd7 h TRP 13 CO -0.05 0.50 0.24 1.49 -3.56 0.00 0.00 178.44 177.06 1sd7 h GLU 14 N 0.87 1.09 -1.00 0.49 4.57 -0.28 -1.68 114.58 118.64 1sd7 h GLU 14 Ca 0.25 -0.22 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1sd7 h GLU 14 Cb -0.06 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.37 1sd7 h GLU 14 CO -0.06 0.92 0.00 0.28 -1.18 0.00 0.00 179.01 178.97 1sd7 n VAL 15 N -4.26 0.33 0.00 0.32 0.31 -0.70 -3.57 118.33 110.75 1sd7 n VAL 15 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1sd7 n VAL 15 Cb 0.21 -0.58 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 1sd7 n VAL 15 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1sd7 n ASN 17 N 0.42 0.00 -0.08 4.52 3.02 -0.63 -2.13 115.26 120.37 1sd7 n ASN 17 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.40 1sd7 n ASN 17 Cb 0.25 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.28 1sd7 n ASN 17 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1sd7 n ILE 18 N 0.00 1.52 -0.04 2.41 5.41 -1.23 -4.18 119.36 123.24 1sd7 n ILE 18 Ca 0.00 -0.71 -0.06 0.00 1.00 0.00 0.00 62.75 62.98 1sd7 n ILE 18 Cb 0.00 -1.11 0.13 0.00 -0.71 0.00 0.00 39.64 37.95 1sd7 n ILE 18 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1sd7 h ILE 19 N 0.01 1.27 0.00 1.39 1.08 -1.76 -2.73 117.51 116.78 1sd7 h ILE 19 Ca -0.51 -1.32 0.00 0.00 -0.39 0.00 0.00 64.86 62.64 1sd7 h ILE 19 Cb 2.05 1.28 0.00 0.00 -3.07 0.00 0.00 36.82 37.08 1sd7 h ILE 19 CO -0.00 0.43 0.00 0.79 -0.69 0.00 0.00 178.15 178.68 1sd7 n TRP 20 N -4.11 0.00 0.00 1.37 8.01 -1.26 -1.07 117.44 120.38 1sd7 n TRP 20 Ca -0.00 -0.28 0.00 0.00 -1.31 0.00 0.00 57.50 55.91 1sd7 n TRP 20 Cb 0.43 -0.21 0.00 0.00 -2.01 0.00 0.00 31.31 29.52 1sd7 n TRP 20 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1sd7 n LYS 22 N 0.98 0.00 0.00 -0.99 5.02 -1.03 -5.01 118.16 117.14 1sd7 n LYS 22 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1sd7 n LYS 22 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.24 1sd7 n LYS 22 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1sd7 n LYS 23 N 0.00 0.00 -4.32 1.97 4.81 -0.23 -4.44 118.16 115.95 1sd7 n LYS 23 Ca 0.00 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.24 1sd7 n LYS 23 Cb 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 35.03 34.89 1sd7 n LYS 23 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1sd7 s TYR 24 N 0.00 0.87 -0.26 5.64 2.02 -1.26 -3.98 117.35 120.39 1sd7 s TYR 24 Ca 0.00 -0.22 -0.25 0.00 -0.37 0.00 0.00 57.07 56.23 1sd7 s TYR 24 Cb 0.00 -0.65 0.07 0.00 -0.40 0.00 0.00 41.96 40.98 1sd7 s TYR 24 CO 0.00 -0.12 0.70 0.00 -1.57 0.00 0.00 175.55 174.56 1sd7 s ALA 25 N 0.35 -1.74 0.49 3.71 0.00 -0.05 -4.91 121.76 119.61 1sd7 s ALA 25 Ca -0.05 1.96 -0.01 0.00 0.00 0.00 0.00 51.96 53.85 1sd7 s ALA 25 Cb -0.10 -1.11 0.00 0.00 0.00 0.00 0.00 23.12 21.91 1sd7 s ALA 25 CO 0.00 -0.33 0.73 -1.54 0.00 0.00 0.00 175.76 174.62 1sd7 s SER 26 N 0.32 5.76 0.11 0.00 1.04 -1.26 0.25 113.70 119.92 1sd7 s SER 26 Ca -0.00 0.39 -0.26 0.00 0.48 0.00 0.00 55.95 56.55 1sd7 s SER 26 Cb -0.05 -1.57 -0.08 0.00 0.10 0.00 0.00 66.02 64.42 1sd7 s SER 26 CO 0.01 -0.80 1.44 0.00 0.98 0.00 0.00 173.24 174.87 1sd7 h ALA 27 N 0.25 -0.64 -0.96 5.32 0.00 -1.99 0.21 119.26 121.45 1sd7 h ALA 27 Ca -0.46 0.02 0.27 0.00 0.00 0.00 0.00 54.91 54.75 1sd7 h ALA 27 Cb 1.25 1.11 -0.14 0.00 0.00 0.00 0.00 17.79 20.02 1sd7 h ALA 27 CO 0.58 -0.88 0.48 -0.91 0.00 0.00 0.00 179.25 178.51 1sd7 h ASN 28 N -0.25 0.41 0.60 0.00 2.35 -1.93 0.64 115.58 117.40 1sd7 h ASN 28 Ca 0.08 0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.97 1sd7 h ASN 28 Cb 0.45 0.14 0.01 0.00 0.05 0.00 0.00 38.32 38.97 1sd7 h ASN 28 CO -0.55 -0.07 -0.29 0.78 -1.65 0.00 0.00 177.43 175.65 1sd7 h ASN 29 N 0.36 -0.68 -0.41 5.81 4.21 -1.05 -2.80 115.58 121.01 1sd7 h ASN 29 Ca 0.65 -0.01 0.09 0.00 1.21 0.00 0.00 56.30 58.24 1sd7 h ASN 29 Cb 1.38 0.18 -0.09 0.00 -1.12 0.00 0.00 38.32 38.66 1sd7 h ASN 29 CO -0.58 -0.42 -0.25 0.40 -1.29 0.00 0.00 177.43 175.29 1sd7 h ILE 30 N -0.90 0.33 -1.03 2.81 2.04 0.21 -0.90 117.51 120.07 1sd7 h ILE 30 Ca -0.08 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.04 1sd7 h ILE 30 Cb 0.65 0.33 -0.08 0.00 -0.74 0.00 0.00 36.82 36.97 1sd7 h ILE 30 CO 0.13 0.00 0.68 0.40 0.00 0.00 0.00 178.15 179.36 1sd7 h ILE 31 N -0.18 0.53 0.00 -0.67 2.04 0.08 -1.21 117.51 118.10 1sd7 h ILE 31 Ca 0.19 -0.12 -0.23 0.00 1.00 0.00 0.00 64.86 65.71 1sd7 h ILE 31 Cb 0.48 0.16 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 1sd7 h ILE 31 CO -0.52 0.06 -1.60 -1.84 0.00 0.00 0.00 178.15 174.26 1sd7 n GLU 32 N -4.56 0.63 0.00 2.37 0.28 -0.42 -1.49 120.64 117.45 1sd7 n GLU 32 Ca 0.24 0.24 -0.03 0.00 -0.16 0.00 0.00 57.16 57.46 1sd7 n GLU 32 Cb 0.90 -1.79 0.22 0.00 1.43 0.00 0.00 31.44 32.21 1sd7 n GLU 32 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1sd7 h GLU 33 N 0.00 0.52 0.00 3.44 4.39 -0.66 -3.06 114.58 119.21 1sd7 h GLU 33 Ca -0.23 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.30 1sd7 h GLU 33 Cb 1.80 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.40 1sd7 h GLU 33 CO 0.06 0.67 -0.00 0.82 -1.16 0.00 0.00 179.01 179.39 1sd7 h ILE 34 N 0.47 1.49 0.00 3.13 1.08 -1.32 -3.40 117.51 118.96 1sd7 h ILE 34 Ca 0.08 -1.45 -0.14 0.00 -0.39 0.00 0.00 64.86 62.96 1sd7 h ILE 34 Cb 0.56 2.47 0.00 0.00 -3.07 0.00 0.00 36.82 36.78 1sd7 h ILE 34 CO 0.04 0.38 1.53 0.00 -0.69 0.00 0.00 178.15 179.40 1sd7 n GLN 35 N -4.79 0.81 0.00 2.37 6.02 -0.56 -1.91 117.38 119.32 1sd7 n GLN 35 Ca -0.09 -0.83 0.00 0.00 -0.01 0.00 0.00 57.00 56.07 1sd7 n GLN 35 Cb 0.31 -2.13 0.00 0.00 1.02 0.00 0.00 30.24 29.44 1sd7 n GLN 35 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1sd7 n GLN 37 N 4.50 0.00 -4.60 -1.09 10.64 -1.26 -4.85 117.38 120.72 1sd7 n GLN 37 Ca 0.17 0.00 -0.23 0.00 -1.83 0.00 0.00 57.00 55.12 1sd7 n GLN 37 Cb 0.07 -0.80 -0.15 0.00 -0.86 0.00 0.00 30.24 28.49 1sd7 n GLN 37 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 1sd7 s LYS 38 N -0.67 1.24 -1.30 2.61 -0.14 -0.80 -5.05 119.74 115.63 1sd7 s LYS 38 Ca 0.00 -0.46 -0.08 0.00 -1.36 0.00 0.00 55.97 54.07 1sd7 s LYS 38 Cb 0.00 -1.15 0.15 0.00 -1.68 0.00 0.00 37.83 35.15 1sd7 s LYS 38 CO 0.00 0.22 2.07 -3.47 -0.76 0.00 0.00 175.35 173.41 1sd7 n ASP 39 N 3.05 6.20 -4.56 2.83 2.03 -1.26 -4.93 116.55 119.91 1sd7 n ASP 39 Ca -0.17 -3.12 -0.32 0.00 0.52 0.00 0.00 54.79 51.71 1sd7 n ASP 39 Cb 0.54 -1.44 -0.11 0.00 -0.72 0.00 0.00 41.12 39.40 1sd7 n ASP 39 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 1sd7 s TRP 40 N -0.16 2.82 0.91 -0.67 0.51 -1.26 -5.13 118.94 115.96 1sd7 s TRP 40 Ca 0.45 -0.08 -0.15 0.00 -2.12 0.00 0.00 56.10 54.20 1sd7 s TRP 40 Cb 0.13 -1.60 0.16 0.00 -0.81 0.00 0.00 33.47 31.35 1sd7 s TRP 40 CO -0.03 0.33 1.26 -1.54 -0.51 0.00 0.00 176.95 176.45 1sd7 s SER 41 N -1.27 3.54 0.12 2.95 1.04 -1.26 -4.83 113.70 113.99 1sd7 s SER 41 Ca 0.15 0.49 -0.14 0.00 0.48 0.00 0.00 55.95 56.93 1sd7 s SER 41 Cb -0.11 -0.71 -0.03 0.00 0.10 0.00 0.00 66.02 65.27 1sd7 s SER 41 CO 0.06 -2.49 1.54 -0.65 0.98 0.00 0.00 173.24 172.68 1sd7 h PRO 42 N -1.47 0.73 -0.03 4.02 0.11 -2.00 -2.78 132.00 130.59 1sd7 h PRO 42 Ca -0.45 -0.27 -0.10 0.00 0.11 0.00 0.00 66.00 65.29 1sd7 h PRO 42 Cb 1.27 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1sd7 h PRO 42 CO 0.49 0.86 -0.43 -0.22 -0.21 0.00 0.00 178.00 178.49 1sd7 h LYS 43 N 0.54 0.05 0.15 1.05 3.64 -1.98 -0.72 116.57 119.30 1sd7 h LYS 43 Ca 0.10 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1sd7 h LYS 43 Cb 0.58 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1sd7 h LYS 43 CO 0.03 0.48 -0.07 1.15 -2.27 0.00 0.00 179.45 178.77 1sd7 h THR 44 N 0.05 0.94 -0.46 1.00 2.02 -1.91 -1.24 112.91 113.31 1sd7 h THR 44 Ca 0.00 -0.37 -0.04 0.00 0.77 0.00 0.00 66.41 66.77 1sd7 h THR 44 Cb 0.78 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 1sd7 h THR 44 CO 0.06 0.09 0.10 0.40 0.37 0.00 0.00 175.52 176.54 1sd7 h ILE 45 N -0.37 1.21 0.00 3.11 2.04 -1.37 -1.01 117.51 121.11 1sd7 h ILE 45 Ca -0.02 -0.75 -0.06 0.00 1.00 0.00 0.00 64.86 65.03 1sd7 h ILE 45 Cb 0.29 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1sd7 h ILE 45 CO 0.03 0.27 -0.29 0.03 0.00 0.00 0.00 178.15 178.19 1sd7 h ARG 46 N 0.68 0.00 0.01 2.37 3.08 -0.96 -0.99 114.38 118.56 1sd7 h ARG 46 Ca 0.15 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.97 1sd7 h ARG 46 Cb 0.27 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.32 1sd7 h ARG 46 CO -0.00 0.29 -0.97 1.15 -1.07 0.00 0.00 179.97 179.37 1sd7 h THR 47 N 0.00 1.39 -0.24 2.04 2.02 0.02 -0.74 112.91 117.39 1sd7 h THR 47 Ca -0.00 -2.44 -0.05 0.00 0.77 0.00 0.00 66.41 64.69 1sd7 h THR 47 Cb 0.63 2.44 -0.01 0.00 -1.74 0.00 0.00 68.15 69.47 1sd7 h THR 47 CO 0.04 0.73 -0.04 -0.07 0.37 0.00 0.00 175.52 176.55 1sd7 h LEU 48 N 0.25 0.45 0.03 2.58 3.38 -1.00 0.23 115.31 121.22 1sd7 h LEU 48 Ca -0.09 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.54 1sd7 h LEU 48 Cb 1.61 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.23 1sd7 h LEU 48 CO 0.17 0.69 -0.08 0.40 0.09 0.00 0.00 178.44 179.71 1sd7 h ILE 49 N 0.20 0.80 -0.46 1.22 2.04 -1.18 -1.54 117.51 118.59 1sd7 h ILE 49 Ca 0.06 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.96 1sd7 h ILE 49 Cb 0.48 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 1sd7 h ILE 49 CO 0.02 0.00 0.31 0.74 0.00 0.00 0.00 178.15 179.22 1sd7 h THR 50 N -0.16 1.02 -0.26 -0.27 2.02 -0.99 -1.07 112.91 113.20 1sd7 h THR 50 Ca 0.02 -0.16 -0.14 0.00 0.77 0.00 0.00 66.41 66.91 1sd7 h THR 50 Cb 0.18 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1sd7 h THR 50 CO -0.07 0.09 -0.37 -0.09 0.37 0.00 0.00 175.52 175.45 1sd7 h ARG 51 N 0.47 0.72 -0.08 6.66 2.43 -0.27 -1.56 114.38 122.75 1sd7 h ARG 51 Ca 0.19 -0.42 -0.12 0.00 -0.81 0.00 0.00 59.98 58.82 1sd7 h ARG 51 Cb 0.17 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1sd7 h ARG 51 CO -0.05 1.04 -0.49 -0.07 -1.51 0.00 0.00 179.97 178.89 1sd7 h LEU 52 N 0.45 0.21 -0.04 3.80 3.38 -0.93 -1.55 115.31 120.62 1sd7 h LEU 52 Ca 0.03 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1sd7 h LEU 52 Cb 0.96 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 1sd7 h LEU 52 CO 0.09 0.66 0.01 0.22 0.09 0.00 0.00 178.44 179.51 1sd7 h TYR 53 N 0.15 0.08 0.00 1.13 3.20 -1.06 -1.77 116.97 118.70 1sd7 h TYR 53 Ca 0.01 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1sd7 h TYR 53 Cb 0.92 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.16 1sd7 h TYR 53 CO 0.01 0.27 -0.11 0.87 -1.64 0.00 0.00 178.16 177.57 1sd7 h LYS 54 N -0.14 0.00 -0.01 1.82 1.57 -1.14 -2.71 116.57 115.95 1sd7 h LYS 54 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1sd7 h LYS 54 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1sd7 h LYS 54 CO 0.00 0.11 0.00 1.63 -0.57 0.00 0.00 179.45 180.62 1sd7 n LYS 55 N -3.32 1.27 -1.04 3.15 5.02 -0.60 -4.90 118.16 117.75 1sd7 n LYS 55 Ca -0.00 -0.40 0.00 0.00 -2.02 0.00 0.00 58.31 55.89 1sd7 n LYS 55 Cb 0.32 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 1sd7 n LYS 55 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1sd7 n GLY 56 N 1.05 0.40 0.08 0.72 0.00 -1.02 -4.89 105.19 101.53 1sd7 n GLY 56 Ca 0.21 -1.05 0.05 0.00 0.00 0.00 0.00 46.02 45.23 1sd7 n GLY 56 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1sd7 n PHE 57 N -3.04 0.70 -4.07 1.61 3.01 -0.70 -4.75 117.46 110.22 1sd7 n PHE 57 Ca 0.00 0.22 -0.10 0.00 1.01 0.00 0.00 57.45 58.58 1sd7 n PHE 57 Cb 0.03 -0.93 -0.08 0.00 -0.01 0.00 0.00 39.48 38.50 1sd7 n PHE 57 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 1sd7 s ILE 58 N -3.13 0.02 0.33 4.37 -4.36 -1.21 -1.55 121.20 115.67 1sd7 s ILE 58 Ca -0.04 -1.65 0.00 0.00 -0.26 0.00 0.00 60.65 58.70 1sd7 s ILE 58 Cb 0.10 -2.21 -0.01 0.00 1.25 0.00 0.00 42.46 41.59 1sd7 s ILE 58 CO 0.83 -0.11 0.41 -0.62 0.24 0.00 0.00 174.94 175.68 1sd7 s ASP 59 N -3.06 1.08 -0.02 4.36 3.68 -0.24 -4.55 116.67 117.91 1sd7 s ASP 59 Ca 0.27 -1.55 -0.03 0.00 2.13 0.00 0.00 52.55 53.38 1sd7 s ASP 59 Cb 0.04 0.62 0.00 0.00 -1.45 0.00 0.00 42.92 42.14 1sd7 s ASP 59 CO 0.07 -1.22 0.07 0.00 0.13 0.00 0.00 175.17 174.23 1sd7 s ARG 60 N -3.21 0.14 -0.04 4.34 1.70 -1.26 -1.89 118.95 118.73 1sd7 s ARG 60 Ca 0.33 -0.01 0.07 0.00 -0.47 0.00 0.00 55.73 55.65 1sd7 s ARG 60 Cb 0.01 0.06 -0.02 0.00 -0.57 0.00 0.00 34.95 34.43 1sd7 s ARG 60 CO 0.22 -0.02 -0.25 -1.59 -1.08 0.00 0.00 175.30 172.58 1sd7 s LYS 61 N -0.23 2.35 -0.66 3.89 -2.85 -0.88 -4.91 119.74 116.45 1sd7 s LYS 61 Ca -0.03 -0.91 -0.25 0.00 -1.00 0.00 0.00 55.97 53.79 1sd7 s LYS 61 Cb -0.02 -2.12 0.05 0.00 -2.06 0.00 0.00 37.83 33.68 1sd7 s LYS 61 CO 0.00 0.47 1.08 0.15 0.10 0.00 0.00 175.35 177.15 1sd7 s LYS 62 N -0.39 3.21 -0.22 1.78 1.02 -1.26 -1.74 119.74 122.13 1sd7 s LYS 62 Ca 0.03 -0.45 -0.07 0.00 0.02 0.00 0.00 55.97 55.50 1sd7 s LYS 62 Cb -0.12 -4.16 -0.03 0.00 -0.52 0.00 0.00 37.83 33.00 1sd7 s LYS 62 CO 0.01 -1.85 0.06 0.34 -0.92 0.00 0.00 175.35 173.00 1sd7 s ASP 63 N 3.48 5.32 0.35 2.83 -1.08 -0.96 -4.84 116.67 121.76 1sd7 s ASP 63 Ca 0.29 -0.09 0.00 0.00 -0.52 0.00 0.00 52.55 52.23 1sd7 s ASP 63 Cb -0.12 -1.93 0.00 0.00 -1.46 0.00 0.00 42.92 39.40 1sd7 s ASP 63 CO 0.15 0.05 0.00 0.59 0.52 0.00 0.00 175.17 176.48 1sd7 n ASN 64 N 4.33 -0.05 -1.47 -0.34 3.02 -1.26 -2.50 115.26 117.00 1sd7 n ASN 64 Ca -0.16 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.34 1sd7 n ASN 64 Cb 0.52 0.00 0.24 0.00 -0.61 0.00 0.00 39.78 39.93 1sd7 n ASN 64 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1sd7 n LYS 65 N 0.00 2.63 -5.04 3.52 3.00 -1.26 -4.94 118.16 116.07 1sd7 n LYS 65 Ca 0.00 -3.06 -0.32 0.00 -0.00 0.00 0.00 58.31 54.93 1sd7 n LYS 65 Cb 0.00 -1.98 -0.16 0.00 0.00 0.00 0.00 35.03 32.90 1sd7 n LYS 65 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1sd7 s ILE 66 N -3.10 2.50 0.15 3.15 1.09 -1.04 -5.08 121.20 118.88 1sd7 s ILE 66 Ca 0.49 -0.88 -0.31 0.00 -1.10 0.00 0.00 60.65 58.85 1sd7 s ILE 66 Cb 0.41 -1.99 -0.09 0.00 -1.06 0.00 0.00 42.46 39.73 1sd7 s ILE 66 CO 0.07 0.55 1.48 -0.36 -0.10 0.00 0.00 174.94 176.58 1sd7 s PHE 67 N 0.13 3.14 -0.20 3.97 2.99 -1.26 -2.28 117.98 124.47 1sd7 s PHE 67 Ca -0.10 0.80 0.01 0.00 0.00 0.00 0.00 56.93 57.65 1sd7 s PHE 67 Cb -0.16 -3.82 0.03 0.00 0.00 0.00 0.00 43.02 39.08 1sd7 s PHE 67 CO 0.06 -2.92 -0.17 -0.65 -0.00 0.00 0.00 175.22 171.55 1sd7 s GLN 68 N 0.96 2.69 0.11 0.44 -1.52 -0.71 -4.21 119.66 117.42 1sd7 s GLN 68 Ca 0.67 -0.94 -0.15 0.00 -1.95 0.00 0.00 55.36 52.99 1sd7 s GLN 68 Cb -0.41 -2.61 -0.07 0.00 -0.22 0.00 0.00 33.01 29.71 1sd7 s GLN 68 CO 0.32 -0.32 0.52 0.71 -0.25 0.00 0.00 175.29 176.28 1sd7 s TYR 69 N 1.26 3.66 0.08 0.91 1.51 0.14 -2.08 117.35 122.83 1sd7 s TYR 69 Ca 0.01 1.07 -0.08 0.00 -1.01 0.00 0.00 57.07 57.06 1sd7 s TYR 69 Cb -0.15 -2.36 -0.00 0.00 -0.11 0.00 0.00 41.96 39.33 1sd7 s TYR 69 CO -0.11 0.50 0.17 1.52 -1.11 0.00 0.00 175.55 176.52 1sd7 s TYR 70 N -1.34 0.17 0.33 2.71 1.13 -0.79 -0.87 117.35 118.69 1sd7 s TYR 70 Ca 0.34 -0.58 -0.27 0.00 -1.41 0.00 0.00 57.07 55.15 1sd7 s TYR 70 Cb -0.16 -0.09 -0.09 0.00 -1.10 0.00 0.00 41.96 40.52 1sd7 s TYR 70 CO 0.18 -0.51 1.07 0.45 -2.51 0.00 0.00 175.55 174.23 1sd7 s SER 71 N -2.73 7.08 0.00 -0.18 0.15 -1.26 -1.08 113.70 115.68 1sd7 s SER 71 Ca 0.03 2.15 0.17 0.00 0.70 0.00 0.00 55.95 59.00 1sd7 s SER 71 Cb 0.04 -2.61 0.10 0.00 -1.71 0.00 0.00 66.02 61.85 1sd7 s SER 71 CO -0.10 -0.27 0.99 0.18 1.20 0.00 0.00 173.24 175.24 1sd7 n LEU 72 N 0.67 2.23 -4.28 3.45 4.77 -0.60 -4.84 117.00 118.40 1sd7 n LEU 72 Ca 0.01 -0.95 -0.22 0.00 -0.03 0.00 0.00 56.01 54.82 1sd7 n LEU 72 Cb 0.47 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.44 1sd7 n LEU 72 CO 0.50 0.40 -0.50 0.54 -1.33 0.00 0.00 177.39 177.00 1sd7 s VAL 73 N -1.51 1.65 -0.79 4.08 0.11 -1.24 -4.98 120.40 117.72 1sd7 s VAL 73 Ca 0.18 -1.64 -0.24 0.00 -2.93 0.00 0.00 61.98 57.34 1sd7 s VAL 73 Cb 0.14 -1.59 0.05 0.00 -1.53 0.00 0.00 36.38 33.45 1sd7 s VAL 73 CO 0.25 -0.18 1.23 -0.70 -3.33 0.00 0.00 175.10 172.37 1sd7 s GLU 74 N -2.22 3.29 0.02 1.54 2.56 -1.26 -4.95 118.70 117.68 1sd7 s GLU 74 Ca 0.08 -0.69 -0.04 0.00 0.00 0.00 0.00 54.97 54.32 1sd7 s GLU 74 Cb -0.08 -4.50 -0.01 0.00 2.00 0.00 0.00 34.13 31.54 1sd7 s GLU 74 CO 0.05 -2.05 0.42 -1.91 -0.56 0.00 0.00 175.26 171.21 1sd7 n GLU 75 N 8.65 -0.06 0.29 4.30 2.13 -1.26 0.14 120.64 134.83 1sd7 n GLU 75 Ca 0.09 0.42 0.16 0.00 0.66 0.00 0.00 57.16 58.49 1sd7 n GLU 75 Cb 0.49 -0.62 0.86 0.00 0.27 0.00 0.00 31.44 32.43 1sd7 n GLU 75 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1sd7 h SER 76 N 0.00 0.00 -0.07 4.31 4.64 -1.98 0.11 113.55 120.55 1sd7 h SER 76 Ca 0.02 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.10 1sd7 h SER 76 Cb 0.06 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1sd7 h SER 76 CO -0.13 0.06 -0.87 0.44 -0.87 0.00 0.00 176.83 175.46 1sd7 h ASP 77 N 0.00 0.91 0.29 4.97 3.32 0.79 -1.99 116.42 124.71 1sd7 h ASP 77 Ca -0.00 -0.65 -0.28 0.00 0.02 0.00 0.00 57.03 56.12 1sd7 h ASP 77 Cb 0.25 -0.27 0.02 0.00 0.22 0.00 0.00 39.33 39.55 1sd7 h ASP 77 CO 0.01 1.45 -1.20 -0.29 -1.72 0.00 0.00 179.24 177.49 1sd7 h ILE 78 N 0.48 1.35 -0.27 0.35 6.09 -0.61 -2.09 117.51 122.81 1sd7 h ILE 78 Ca -0.08 -2.60 -0.16 0.00 -1.37 0.00 0.00 64.86 60.66 1sd7 h ILE 78 Cb 1.51 2.71 -0.01 0.00 0.47 0.00 0.00 36.82 41.50 1sd7 h ILE 78 CO 0.18 0.78 -0.46 0.11 -3.07 0.00 0.00 178.15 175.68 1sd7 h LYS 79 N 0.22 0.71 0.50 2.19 1.57 -0.89 -0.77 116.57 120.09 1sd7 h LYS 79 Ca -0.16 -0.40 -0.02 0.00 -1.87 0.00 0.00 60.65 58.20 1sd7 h LYS 79 Cb 1.87 0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.21 1sd7 h LYS 79 CO 0.22 1.02 -0.26 -0.92 -0.57 0.00 0.00 179.45 178.94 1sd7 h TYR 80 N 0.57 -0.69 -0.45 -1.35 3.20 -1.38 0.63 116.97 117.51 1sd7 h TYR 80 Ca 0.03 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.98 1sd7 h TYR 80 Cb 1.01 0.23 -0.08 0.00 1.54 0.00 0.00 36.73 39.44 1sd7 h TYR 80 CO 0.05 -0.42 -0.02 -0.22 -1.64 0.00 0.00 178.16 175.92 1sd7 h LYS 81 N -0.70 0.09 -0.46 1.82 1.63 -1.30 -0.22 116.57 117.42 1sd7 h LYS 81 Ca -0.06 -0.01 0.05 0.00 -0.85 0.00 0.00 60.65 59.78 1sd7 h LYS 81 Cb 0.55 -0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 32.12 1sd7 h LYS 81 CO 0.09 0.06 0.19 1.15 -3.45 0.00 0.00 179.45 177.49 1sd7 h THR 82 N 0.09 0.89 -0.96 1.00 2.02 -1.00 -1.69 112.91 113.27 1sd7 h THR 82 Ca 0.22 -0.13 0.02 0.00 0.77 0.00 0.00 66.41 67.30 1sd7 h THR 82 Cb 0.33 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.17 1sd7 h THR 82 CO -0.39 0.07 0.63 0.28 0.37 0.00 0.00 175.52 176.48 1sd7 h SER 83 N 0.38 1.07 -0.71 4.18 0.02 0.63 -1.16 113.55 117.96 1sd7 h SER 83 Ca 0.21 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.08 1sd7 h SER 83 Cb 0.18 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.43 1sd7 h SER 83 CO -0.19 0.75 0.20 0.11 -1.14 0.00 0.00 176.83 176.56 1sd7 h LYS 84 N 1.25 1.14 -0.36 3.45 1.79 -0.53 -1.91 116.57 121.39 1sd7 h LYS 84 Ca 0.37 -0.26 -0.11 0.00 -2.18 0.00 0.00 60.65 58.46 1sd7 h LYS 84 Cb -0.07 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.41 1sd7 h LYS 84 CO -0.10 0.98 -0.24 -0.91 -1.08 0.00 0.00 179.45 178.11 1sd7 h ASN 85 N 1.08 0.74 -0.38 0.86 2.35 -0.65 -1.60 115.58 117.99 1sd7 h ASN 85 Ca 0.23 -0.27 -0.09 0.00 -0.55 0.00 0.00 56.30 55.62 1sd7 h ASN 85 Cb 0.34 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 1sd7 h ASN 85 CO -0.00 0.96 -0.12 0.15 -1.65 0.00 0.00 177.43 176.77 1sd7 h PHE 86 N 0.63 0.84 -0.48 1.19 3.57 -0.99 -1.99 116.94 119.71 1sd7 h PHE 86 Ca 0.09 -0.19 -0.09 0.00 3.53 0.00 0.00 57.97 61.31 1sd7 h PHE 86 Cb 0.74 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 1sd7 h PHE 86 CO 0.04 0.90 -0.06 0.82 -2.23 0.00 0.00 178.31 177.78 1sd7 h ILE 87 N 0.54 1.25 0.00 1.41 2.04 -1.27 -1.41 117.51 120.07 1sd7 h ILE 87 Ca 0.09 -1.12 -0.11 0.00 1.00 0.00 0.00 64.86 64.72 1sd7 h ILE 87 Cb 0.64 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1sd7 h ILE 87 CO 0.04 0.39 -0.52 -1.13 0.00 0.00 0.00 178.15 176.93 1sd7 h ASN 88 N 0.77 0.00 0.07 1.72 -0.73 -1.17 -0.16 115.58 116.08 1sd7 h ASN 88 Ca 0.14 0.00 -0.20 0.00 1.87 0.00 0.00 56.30 58.11 1sd7 h ASN 88 Cb 0.54 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.15 1sd7 h ASN 88 CO 0.03 0.52 -0.82 0.50 -0.37 0.00 0.00 177.43 177.29 1sd7 h LYS 89 N 0.00 0.44 0.03 6.67 3.64 -1.00 -3.41 116.57 122.94 1sd7 h LYS 89 Ca -0.01 -0.56 -0.39 0.00 -1.27 0.00 0.00 60.65 58.43 1sd7 h LYS 89 Cb 0.97 0.18 -0.05 0.00 -0.41 0.00 0.00 32.23 32.91 1sd7 h LYS 89 CO 0.07 1.21 -2.29 0.28 -2.27 0.00 0.00 179.45 176.45 1sd7 n VAL 90 N -4.09 1.57 -3.95 2.00 0.31 -0.56 -5.00 118.33 108.61 1sd7 n VAL 90 Ca -0.12 -0.52 -0.32 0.00 -0.01 0.00 0.00 64.34 63.36 1sd7 n VAL 90 Cb 0.79 -1.62 -0.05 0.00 -0.91 0.00 0.00 33.84 32.06 1sd7 n VAL 90 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1sd7 s TYR 91 N -2.52 3.47 -0.17 3.52 2.02 -0.07 -5.01 117.35 118.59 1sd7 s TYR 91 Ca -0.32 0.28 -0.01 0.00 -0.37 0.00 0.00 57.07 56.65 1sd7 s TYR 91 Cb 0.09 -1.78 -0.22 0.00 -0.40 0.00 0.00 41.96 39.65 1sd7 s TYR 91 CO 0.62 0.61 0.15 1.63 -1.57 0.00 0.00 175.55 176.99 1sd7 n LYS 92 N 0.75 0.71 0.00 -0.62 4.01 -1.26 -4.50 118.16 117.25 1sd7 n LYS 92 Ca -0.09 0.21 0.00 0.00 -0.51 0.00 0.00 58.31 57.92 1sd7 n LYS 92 Cb 0.52 -1.63 0.00 0.00 -0.51 0.00 0.00 35.03 33.41 1sd7 n LYS 92 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1sd7 n GLY 93 N 2.06 -2.72 0.00 0.72 0.00 -1.26 -5.05 105.19 98.93 1sd7 n GLY 93 Ca -0.36 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1sd7 n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sd7 n GLY 94 N -0.74 -0.36 0.43 -0.02 0.00 -1.26 -4.89 105.19 98.35 1sd7 n GLY 94 Ca 0.00 -1.22 0.27 0.00 0.00 0.00 0.00 46.02 45.07 1sd7 n GLY 94 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1sd7 h PHE 95 N 0.00 0.56 -0.47 1.61 3.57 -1.97 -0.66 116.94 119.59 1sd7 h PHE 95 Ca 0.00 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.60 1sd7 h PHE 95 Cb 0.00 -0.16 -0.10 0.00 2.79 0.00 0.00 35.95 38.48 1sd7 h PHE 95 CO 0.00 0.00 -0.40 -0.97 -2.23 0.00 0.00 178.31 174.72 1sd7 h ASN 96 N 0.29 -1.33 0.80 0.41 -0.00 -1.99 -1.21 115.58 112.55 1sd7 h ASN 96 Ca 0.64 0.22 -0.08 0.00 -0.00 0.00 0.00 56.30 57.08 1sd7 h ASN 96 Cb 1.79 0.61 -0.01 0.00 -0.00 0.00 0.00 38.32 40.71 1sd7 h ASN 96 CO -0.29 -0.34 -0.38 0.28 -0.00 0.00 0.00 177.43 176.70 1sd7 h SER 97 N -0.27 0.00 -0.07 1.15 0.02 -1.46 0.28 113.55 113.21 1sd7 h SER 97 Ca 0.17 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.03 1sd7 h SER 97 Cb 0.57 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.11 1sd7 h SER 97 CO -0.61 0.38 -0.30 0.25 -1.14 0.00 0.00 176.83 175.41 1sd7 h LEU 98 N 0.00 0.38 -0.03 5.07 6.46 -1.28 0.82 115.31 126.73 1sd7 h LEU 98 Ca -0.00 -0.64 -0.00 0.00 -0.12 0.00 0.00 57.88 57.11 1sd7 h LEU 98 Cb 0.87 -0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 40.69 1sd7 h LEU 98 CO 0.05 0.96 0.01 0.58 -0.62 0.00 0.00 178.44 179.42 1sd7 h VAL 99 N -0.18 1.19 -0.40 1.05 2.07 -1.09 0.21 116.25 119.10 1sd7 h VAL 99 Ca -0.02 -0.56 0.07 0.00 0.82 0.00 0.00 66.70 67.01 1sd7 h VAL 99 Cb 0.95 1.50 -0.09 0.00 -1.52 0.00 0.00 31.29 32.13 1sd7 h VAL 99 CO 0.06 0.15 -0.44 0.25 0.02 0.00 0.00 177.57 177.61 1sd7 h LEU 100 N -0.17 -1.46 -1.16 2.57 5.85 -0.45 0.33 115.31 120.82 1sd7 h LEU 100 Ca 0.01 0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.98 1sd7 h LEU 100 Cb 0.24 0.63 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 1sd7 h LEU 100 CO 0.00 -0.37 0.57 -1.13 -0.34 0.00 0.00 178.44 177.17 1sd7 h ASN 101 N -0.34 0.94 -0.02 1.25 -0.73 -0.60 -2.42 115.58 113.66 1sd7 h ASN 101 Ca 0.13 -0.01 -0.17 0.00 1.87 0.00 0.00 56.30 58.12 1sd7 h ASN 101 Cb 0.59 -0.22 0.01 0.00 0.27 0.00 0.00 38.32 38.97 1sd7 h ASN 101 CO -0.57 0.65 -0.67 0.15 -0.37 0.00 0.00 177.43 176.62 1sd7 h PHE 102 N 1.09 0.71 0.00 0.67 3.04 0.21 -2.84 116.94 119.82 1sd7 h PHE 102 Ca 0.35 -0.37 0.00 0.00 3.98 0.00 0.00 57.97 61.92 1sd7 h PHE 102 Cb 0.02 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 38.45 1sd7 h PHE 102 CO -0.00 1.19 0.00 0.28 -2.02 0.00 0.00 178.31 177.76 1sd7 n VAL 103 N -4.15 0.36 0.27 1.41 0.31 0.11 -2.33 118.33 114.31 1sd7 n VAL 103 Ca -0.10 0.09 0.03 0.00 -0.01 0.00 0.00 64.34 64.35 1sd7 n VAL 103 Cb 0.70 -0.90 -0.02 0.00 -0.91 0.00 0.00 33.84 32.70 1sd7 n VAL 103 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1sd7 n GLU 104 N -1.14 4.33 0.00 5.55 1.02 -0.93 -4.64 120.64 124.82 1sd7 n GLU 104 Ca 0.07 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 1sd7 n GLU 104 Cb 0.07 -0.83 0.00 0.00 -0.02 0.00 0.00 31.44 30.66 1sd7 n GLU 104 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1sd7 n LYS 105 N -0.92 -0.50 -3.96 3.49 4.01 -1.09 -4.89 118.16 114.30 1sd7 n LYS 105 Ca 0.01 -0.37 -0.33 0.00 -0.51 0.00 0.00 58.31 57.12 1sd7 n LYS 105 Cb 0.10 -0.87 -0.14 0.00 -0.51 0.00 0.00 35.03 33.61 1sd7 n LYS 105 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 1sd7 s GLU 106 N -0.04 1.74 0.37 1.97 2.12 -0.98 -4.98 118.70 118.91 1sd7 s GLU 106 Ca 0.00 -1.77 0.32 0.00 0.36 0.00 0.00 54.97 53.88 1sd7 s GLU 106 Cb 0.00 -3.26 1.17 0.00 0.26 0.00 0.00 34.13 32.30 1sd7 s GLU 106 CO 0.00 -0.91 1.09 -3.47 -0.54 0.00 0.00 175.26 171.43 1sd7 n ASP 107 N 4.37 0.04 -1.72 -1.70 2.03 -1.26 -4.80 116.55 113.51 1sd7 n ASP 107 Ca -0.01 0.78 0.00 0.00 0.52 0.00 0.00 54.79 56.08 1sd7 n ASP 107 Cb 0.42 -0.39 0.00 0.00 -0.72 0.00 0.00 41.12 40.43 1sd7 n ASP 107 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1sd7 n LEU 108 N -3.56 -0.15 -4.27 -2.67 4.77 -1.26 -4.87 117.00 104.99 1sd7 n LEU 108 Ca 0.30 1.05 -0.30 0.00 -0.03 0.00 0.00 56.01 57.04 1sd7 n LEU 108 Cb 1.32 -1.54 0.20 0.00 -2.33 0.00 0.00 43.42 41.07 1sd7 n LEU 108 CO 0.26 -0.95 -0.26 -1.54 -1.33 0.00 0.00 177.39 173.57 1sd7 n SER 109 N 1.71 -2.50 0.09 -1.43 3.41 -1.26 -4.84 113.62 108.80 1sd7 n SER 109 Ca 0.00 -0.23 0.13 0.00 -0.26 0.00 0.00 58.87 58.51 1sd7 n SER 109 Cb 0.00 -0.98 0.45 0.00 -0.26 0.00 0.00 64.21 63.42 1sd7 n SER 109 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sd7 n GLN 110 N -2.78 0.21 0.05 4.33 6.02 -1.26 -3.24 117.38 120.70 1sd7 n GLN 110 Ca 0.02 0.18 -0.22 0.00 -0.01 0.00 0.00 57.00 56.97 1sd7 n GLN 110 Cb 0.58 -1.75 -0.15 0.00 1.02 0.00 0.00 30.24 29.95 1sd7 n GLN 110 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1sd7 h ASP 111 N 0.00 0.54 -0.87 1.08 -0.00 -1.98 -2.99 116.42 112.20 1sd7 h ASP 111 Ca 0.00 -0.92 0.19 0.00 -0.00 0.00 0.00 57.03 56.29 1sd7 h ASP 111 Cb 0.68 -0.18 -0.11 0.00 -0.00 0.00 0.00 39.33 39.72 1sd7 h ASP 111 CO 0.00 1.76 0.40 -0.33 -0.00 0.00 0.00 179.24 181.07 1sd7 h GLU 112 N 0.00 0.48 -0.87 0.28 4.39 -1.90 1.60 114.58 118.56 1sd7 h GLU 112 Ca -0.34 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.30 1sd7 h GLU 112 Cb 2.01 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 30.51 1sd7 h GLU 112 CO 0.14 0.32 0.44 0.82 -1.16 0.00 0.00 179.01 179.57 1sd7 h ILE 113 N 0.49 1.26 -0.28 3.13 1.08 -1.62 0.26 117.51 121.83 1sd7 h ILE 113 Ca 0.51 -0.68 -0.02 0.00 -0.39 0.00 0.00 64.86 64.27 1sd7 h ILE 113 Cb 0.87 0.12 -0.01 0.00 -3.07 0.00 0.00 36.82 34.73 1sd7 h ILE 113 CO -0.45 0.30 0.08 -0.08 -0.69 0.00 0.00 178.15 177.31 1sd7 h GLU 114 N 1.22 0.43 -0.48 2.37 4.57 0.13 -0.71 114.58 122.11 1sd7 h GLU 114 Ca 0.30 -0.10 -0.03 0.00 -1.18 0.00 0.00 59.36 58.36 1sd7 h GLU 114 Cb 0.08 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.58 1sd7 h GLU 114 CO -0.04 0.50 0.20 1.49 -1.18 0.00 0.00 179.01 179.98 1sd7 h GLU 115 N 0.28 0.72 -0.51 1.92 4.81 0.23 -0.97 114.58 121.06 1sd7 h GLU 115 Ca 0.09 -0.12 0.09 0.00 -0.13 0.00 0.00 59.36 59.29 1sd7 h GLU 115 Cb 0.25 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1sd7 h GLU 115 CO -0.00 0.63 0.35 -0.07 -0.73 0.00 0.00 179.01 179.19 1sd7 h LEU 116 N 0.64 0.27 -0.49 1.64 3.38 -0.31 0.12 115.31 120.57 1sd7 h LEU 116 Ca 0.16 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 1sd7 h LEU 116 Cb 0.17 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1sd7 h LEU 116 CO -0.02 0.17 -0.08 0.03 0.09 0.00 0.00 178.44 178.63 1sd7 h ARG 117 N 0.30 0.92 -0.22 1.13 3.08 -0.06 -2.99 114.38 116.54 1sd7 h ARG 117 Ca 0.23 -0.33 0.03 0.00 0.07 0.00 0.00 59.98 59.98 1sd7 h ARG 117 Cb 0.53 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.48 1sd7 h ARG 117 CO -0.05 0.98 -0.28 -0.97 -1.07 0.00 0.00 179.97 178.58 1sd7 h ASN 118 N 0.77 -0.94 -0.27 7.04 -0.00 0.50 0.27 115.58 122.96 1sd7 h ASN 118 Ca 0.13 0.12 0.03 0.00 -0.00 0.00 0.00 56.30 56.58 1sd7 h ASN 118 Cb 0.62 0.38 -0.04 0.00 -0.00 0.00 0.00 38.32 39.29 1sd7 h ASN 118 CO 0.04 -0.20 -0.24 0.40 -0.00 0.00 0.00 177.43 177.43 1sd7 h ILE 119 N -0.19 0.00 -0.90 2.57 1.08 -1.54 0.35 117.51 118.88 1sd7 h ILE 119 Ca 0.04 0.00 0.20 0.00 -0.39 0.00 0.00 64.86 64.70 1sd7 h ILE 119 Cb 0.29 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 33.93 1sd7 h ILE 119 CO -0.30 0.00 0.46 -0.07 -0.69 0.00 0.00 178.15 177.54 1sd7 h LEU 120 N -0.10 0.49 0.00 1.44 3.38 -1.33 -3.36 115.31 115.83 1sd7 h LEU 120 Ca 0.05 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1sd7 h LEU 120 Cb 0.22 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1sd7 h LEU 120 CO -0.31 0.12 0.00 0.59 0.09 0.00 0.00 178.44 178.92 1sd7 n ASN 121 N -4.94 0.00 0.00 -0.43 3.02 0.94 -5.11 115.26 108.74 1sd7 n ASN 121 Ca 0.21 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.87 1sd7 n ASN 121 Cb 0.58 0.00 0.66 0.00 -0.61 0.00 0.00 39.78 40.41 1sd7 n ASN 121 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93