#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d45 s TYR 6 N 0.00 3.34 0.33 -1.42 2.02 -1.26 -5.10 117.35 115.26 2d45 s TYR 6 Ca 0.00 0.22 0.09 0.00 -0.37 0.00 0.00 57.07 57.01 2d45 s TYR 6 Cb 0.00 -2.08 -0.05 0.00 -0.40 0.00 0.00 41.96 39.43 2d45 s TYR 6 CO 0.00 0.28 0.06 -1.21 -1.57 0.00 0.00 175.55 173.11 2d45 s GLU 7 N 0.16 2.21 -0.31 -0.62 2.02 -1.26 -5.12 118.70 115.78 2d45 s GLU 7 Ca 0.07 -1.64 -0.07 0.00 0.02 0.00 0.00 54.97 53.34 2d45 s GLU 7 Cb -0.12 -2.05 0.02 0.00 0.10 0.00 0.00 34.13 32.08 2d45 s GLU 7 CO -0.00 0.15 0.10 -1.50 0.02 0.00 0.00 175.26 174.02 2d45 s ILE 8 N -2.46 4.00 0.41 -1.63 2.07 -1.26 -5.08 121.20 117.25 2d45 s ILE 8 Ca 0.36 -0.77 -0.26 0.00 -1.41 0.00 0.00 60.65 58.57 2d45 s ILE 8 Cb -0.02 -3.11 -0.08 0.00 0.13 0.00 0.00 42.46 39.38 2d45 s ILE 8 CO 0.21 0.01 1.27 -0.55 -1.91 0.00 0.00 174.94 173.97 2d45 s SER 9 N 1.49 6.33 0.51 4.50 0.15 -1.26 -4.76 113.70 120.66 2d45 s SER 9 Ca 0.02 2.58 0.27 0.00 0.70 0.00 0.00 55.95 59.52 2d45 s SER 9 Cb -0.18 -2.63 1.38 0.00 -1.71 0.00 0.00 66.02 62.88 2d45 s SER 9 CO 0.03 -0.83 1.91 0.77 1.20 0.00 0.00 173.24 176.32 2d45 h SER 10 N 2.64 0.09 -0.16 5.45 4.64 -1.99 1.08 113.55 125.30 2d45 h SER 10 Ca -0.49 0.01 -0.19 0.00 -0.47 0.00 0.00 61.79 60.65 2d45 h SER 10 Cb 1.24 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 63.33 2d45 h SER 10 CO 0.62 0.04 -0.64 0.00 -0.87 0.00 0.00 176.83 175.98 2d45 h ALA 11 N 1.61 0.29 -0.37 5.18 0.00 -2.03 -3.21 119.26 120.72 2d45 h ALA 11 Ca 0.40 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2d45 h ALA 11 Cb 1.44 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 2d45 h ALA 11 CO -0.04 0.56 0.17 0.93 0.00 0.00 0.00 179.25 180.88 2d45 h GLU 12 N 0.40 0.54 -1.54 0.00 5.08 0.61 -2.73 114.58 116.93 2d45 h GLU 12 Ca -0.04 -0.08 0.50 0.00 -1.00 0.00 0.00 59.36 58.74 2d45 h GLU 12 Cb 1.27 -0.10 -0.12 0.00 0.50 0.00 0.00 28.75 30.30 2d45 h GLU 12 CO 0.13 0.49 1.04 -1.49 -1.00 0.00 0.00 179.01 178.18 2d45 h TRP 13 N 0.46 0.36 -0.12 4.33 4.06 -0.30 1.41 115.95 126.14 2d45 h TRP 13 Ca 0.13 0.02 0.05 0.00 2.06 0.00 0.00 58.89 61.14 2d45 h TRP 13 Cb 0.13 -0.08 -0.06 0.00 -1.00 0.00 0.00 29.16 28.15 2d45 h TRP 13 CO -0.01 -0.19 -0.25 0.93 -3.56 0.00 0.00 178.44 175.36 2d45 h GLU 14 N 0.02 -0.32 0.00 0.49 4.39 -1.59 -2.58 114.58 114.99 2d45 h GLU 14 Ca 0.89 0.02 0.00 0.00 0.34 0.00 0.00 59.36 60.61 2d45 h GLU 14 Cb 3.06 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 31.79 2d45 h GLU 14 CO -0.32 -0.21 0.00 0.28 -1.16 0.00 0.00 179.01 177.60 2d45 n VAL 15 N -5.37 0.00 0.00 3.13 0.31 0.48 -2.94 118.33 113.94 2d45 n VAL 15 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 2d45 n VAL 15 Cb 0.29 -0.13 0.00 0.00 -0.91 0.00 0.00 33.84 33.09 2d45 n VAL 15 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2d45 n ASN 17 N 0.19 0.00 -0.03 4.52 3.02 -0.97 -1.30 115.26 120.69 2d45 n ASN 17 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.53 2d45 n ASN 17 Cb 0.00 0.00 0.25 0.00 -0.61 0.00 0.00 39.78 39.42 2d45 n ASN 17 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2d45 h ILE 18 N 0.00 1.22 0.01 2.41 1.08 -1.80 -2.67 117.51 117.75 2d45 h ILE 18 Ca 0.00 -0.89 -0.02 0.00 -0.39 0.00 0.00 64.86 63.56 2d45 h ILE 18 Cb 0.00 0.95 0.00 0.00 -3.07 0.00 0.00 36.82 34.70 2d45 h ILE 18 CO 0.00 0.30 -0.10 0.40 -0.69 0.00 0.00 178.15 178.07 2d45 h ILE 19 N 0.57 1.68 0.00 -0.67 2.04 -1.50 -3.02 117.51 116.61 2d45 h ILE 19 Ca 0.12 -2.12 0.00 0.00 1.00 0.00 0.00 64.86 63.86 2d45 h ILE 19 Cb 0.39 3.10 0.00 0.00 -0.74 0.00 0.00 36.82 39.57 2d45 h ILE 19 CO 0.02 0.56 0.00 0.79 0.00 0.00 0.00 178.15 179.51 2d45 n TRP 20 N -4.59 0.00 0.00 1.37 8.01 -1.01 0.14 117.44 121.36 2d45 n TRP 20 Ca -0.10 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.09 2d45 n TRP 20 Cb 0.47 -0.07 0.00 0.00 -2.01 0.00 0.00 31.31 29.70 2d45 n TRP 20 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 2d45 n LYS 22 N 0.85 0.00 0.00 -0.99 5.02 -1.14 -4.99 118.16 116.91 2d45 n LYS 22 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2d45 n LYS 22 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2d45 n LYS 22 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2d45 n LYS 23 N 0.00 0.00 -4.20 1.97 4.76 0.12 -4.48 118.16 116.33 2d45 n LYS 23 Ca 0.00 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.17 2d45 n LYS 23 Cb 0.00 0.00 -0.08 0.00 -1.84 0.00 0.00 35.03 33.11 2d45 n LYS 23 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2d45 s TYR 24 N 0.00 2.86 -0.26 2.13 4.12 -1.26 -4.11 117.35 120.83 2d45 s TYR 24 Ca 0.00 -0.12 -0.27 0.00 0.02 0.00 0.00 57.07 56.70 2d45 s TYR 24 Cb 0.00 -1.40 0.15 0.00 -1.52 0.00 0.00 41.96 39.20 2d45 s TYR 24 CO 0.00 0.51 1.20 0.00 0.02 0.00 0.00 175.55 177.28 2d45 s ALA 25 N -1.68 -2.06 0.44 3.71 0.00 -0.69 -4.95 121.76 116.54 2d45 s ALA 25 Ca 0.27 1.76 0.08 0.00 0.00 0.00 0.00 51.96 54.07 2d45 s ALA 25 Cb -0.10 -1.39 0.02 0.00 0.00 0.00 0.00 23.12 21.65 2d45 s ALA 25 CO 0.19 -0.21 0.60 -1.54 0.00 0.00 0.00 175.76 174.80 2d45 s SER 26 N -0.33 5.58 0.00 0.00 1.04 -1.26 0.34 113.70 119.07 2d45 s SER 26 Ca 0.04 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.04 2d45 s SER 26 Cb -0.03 -0.58 0.00 0.00 0.10 0.00 0.00 66.02 65.51 2d45 s SER 26 CO -0.07 -0.84 0.75 0.00 0.98 0.00 0.00 173.24 174.05 2d45 n ALA 27 N -1.92 -0.10 -0.15 5.32 0.00 -1.26 -1.03 120.51 121.37 2d45 n ALA 27 Ca 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.52 2d45 n ALA 27 Cb 0.59 0.23 0.25 0.00 0.00 0.00 0.00 19.45 20.52 2d45 n ALA 27 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2d45 h ASN 28 N 0.00 0.78 -1.03 0.00 2.35 -1.95 -2.49 115.58 113.22 2d45 h ASN 28 Ca 0.00 -0.07 0.26 0.00 -0.55 0.00 0.00 56.30 55.95 2d45 h ASN 28 Cb 0.00 -0.20 -0.10 0.00 0.05 0.00 0.00 38.32 38.07 2d45 h ASN 28 CO 0.00 0.64 0.65 -1.13 -1.65 0.00 0.00 177.43 175.94 2d45 h ASN 29 N 0.87 0.51 0.08 5.81 -0.00 -1.83 -0.79 115.58 120.23 2d45 h ASN 29 Ca 0.22 0.10 -0.00 0.00 -0.00 0.00 0.00 56.30 56.62 2d45 h ASN 29 Cb 0.05 0.02 0.00 0.00 -0.00 0.00 0.00 38.32 38.39 2d45 h ASN 29 CO -0.03 0.09 -0.04 0.40 -0.00 0.00 0.00 177.43 177.85 2d45 h ILE 30 N 0.45 0.64 -0.86 2.57 2.04 -0.62 -3.31 117.51 118.41 2d45 h ILE 30 Ca 0.61 -1.31 0.13 0.00 1.00 0.00 0.00 64.86 65.29 2d45 h ILE 30 Cb 1.44 1.16 -0.14 0.00 -0.74 0.00 0.00 36.82 38.54 2d45 h ILE 30 CO -0.35 0.20 -0.40 0.40 0.00 0.00 0.00 178.15 178.00 2d45 h ILE 31 N -0.98 0.05 -0.86 -0.67 2.04 -1.20 0.33 117.51 116.22 2d45 h ILE 31 Ca -0.01 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.03 2d45 h ILE 31 Cb 0.41 0.05 -0.11 0.00 -0.74 0.00 0.00 36.82 36.43 2d45 h ILE 31 CO 0.02 0.00 0.40 -0.33 0.00 0.00 0.00 178.15 178.24 2d45 h GLU 32 N -0.06 0.49 0.00 2.37 5.08 -1.33 0.76 114.58 121.88 2d45 h GLU 32 Ca 0.28 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2d45 h GLU 32 Cb 0.57 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2d45 h GLU 32 CO -0.89 0.33 0.00 0.93 -1.00 0.00 0.00 179.01 178.38 2d45 h GLU 33 N 0.51 0.00 0.01 2.33 4.39 -0.51 -3.29 114.58 118.02 2d45 h GLU 33 Ca 0.50 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.84 2d45 h GLU 33 Cb 0.82 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.42 2d45 h GLU 33 CO -0.44 0.00 -1.96 -0.89 -1.16 0.00 0.00 179.01 174.56 2d45 n ILE 34 N -2.76 1.55 -0.26 3.13 5.41 -0.04 -4.54 119.36 121.85 2d45 n ILE 34 Ca 0.03 -0.28 -0.14 0.00 1.00 0.00 0.00 62.75 63.36 2d45 n ILE 34 Cb 0.37 -1.89 -0.03 0.00 -0.71 0.00 0.00 39.64 37.38 2d45 n ILE 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2d45 n GLN 35 N -4.16 0.39 0.00 0.38 6.02 0.25 -1.39 117.38 118.87 2d45 n GLN 35 Ca -0.42 -0.80 0.00 0.00 -0.01 0.00 0.00 57.00 55.76 2d45 n GLN 35 Cb 0.83 -2.20 0.00 0.00 1.02 0.00 0.00 30.24 29.89 2d45 n GLN 35 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2d45 n GLN 37 N 5.52 0.00 -4.14 -1.09 7.27 -1.26 -4.92 117.38 118.76 2d45 n GLN 37 Ca 0.18 0.00 -0.13 0.00 0.07 0.00 0.00 57.00 57.12 2d45 n GLN 37 Cb 0.12 0.00 -0.08 0.00 2.41 0.00 0.00 30.24 32.69 2d45 n GLN 37 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 2d45 s LYS 38 N 0.00 1.47 -0.44 3.69 -0.14 -0.49 -5.12 119.74 118.71 2d45 s LYS 38 Ca 0.00 -1.60 0.03 0.00 -1.36 0.00 0.00 55.97 53.03 2d45 s LYS 38 Cb 0.00 0.35 0.15 0.00 -1.68 0.00 0.00 37.83 36.66 2d45 s LYS 38 CO 0.00 -0.55 0.30 0.34 -0.76 0.00 0.00 175.35 174.68 2d45 s ASP 39 N -3.16 2.92 0.28 2.83 2.15 -1.26 -5.01 116.67 115.42 2d45 s ASP 39 Ca 0.34 -2.81 0.03 0.00 0.43 0.00 0.00 52.55 50.53 2d45 s ASP 39 Cb 0.03 -0.76 -0.06 0.00 -0.30 0.00 0.00 42.92 41.83 2d45 s ASP 39 CO 0.15 -0.22 0.06 0.26 -0.17 0.00 0.00 175.17 175.25 2d45 s TRP 40 N 0.21 1.74 0.44 -5.34 0.51 -1.26 -5.13 118.94 110.10 2d45 s TRP 40 Ca 0.23 -1.04 -0.22 0.00 -2.12 0.00 0.00 56.10 52.96 2d45 s TRP 40 Cb -0.12 -1.08 -0.09 0.00 -0.81 0.00 0.00 33.47 31.37 2d45 s TRP 40 CO -0.08 -0.13 1.02 0.45 -0.51 0.00 0.00 176.95 177.70 2d45 s SER 41 N -3.39 6.64 0.03 2.95 0.15 -1.26 -4.87 113.70 113.95 2d45 s SER 41 Ca 0.36 1.91 0.05 0.00 0.70 0.00 0.00 55.95 58.97 2d45 s SER 41 Cb 0.08 -2.57 0.22 0.00 -1.71 0.00 0.00 66.02 62.04 2d45 s SER 41 CO 0.14 -0.57 1.14 -2.65 1.20 0.00 0.00 173.24 172.50 2d45 n PRO 42 N -0.54 0.01 -0.03 5.44 -0.02 -1.26 -0.41 135.00 138.20 2d45 n PRO 42 Ca 0.07 0.47 -0.13 0.00 -2.02 0.00 0.00 63.50 61.89 2d45 n PRO 42 Cb 0.52 -1.54 -0.14 0.00 -0.02 0.00 0.00 33.50 32.31 2d45 n PRO 42 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2d45 n LYS 43 N -1.57 0.68 -0.08 -0.52 4.76 -1.26 -2.93 118.16 117.23 2d45 n LYS 43 Ca 0.01 0.24 -0.10 0.00 -2.87 0.00 0.00 58.31 55.59 2d45 n LYS 43 Cb 0.04 -1.72 0.05 0.00 -1.84 0.00 0.00 35.03 31.56 2d45 n LYS 43 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 2d45 h THR 44 N 0.02 1.28 0.42 -0.18 2.02 -1.09 -2.60 112.91 112.79 2d45 h THR 44 Ca -0.37 -1.48 -0.02 0.00 0.77 0.00 0.00 66.41 65.30 2d45 h THR 44 Cb 2.04 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 69.82 2d45 h THR 44 CO 0.07 0.49 -0.20 0.40 0.37 0.00 0.00 175.52 176.64 2d45 h ILE 45 N 0.66 0.51 -0.98 3.11 2.04 -1.20 -2.66 117.51 118.99 2d45 h ILE 45 Ca 0.07 -0.45 0.28 0.00 1.00 0.00 0.00 64.86 65.75 2d45 h ILE 45 Cb 0.87 0.71 -0.14 0.00 -0.74 0.00 0.00 36.82 37.52 2d45 h ILE 45 CO 0.08 0.07 0.53 0.03 0.00 0.00 0.00 178.15 178.86 2d45 h ARG 46 N -0.86 0.40 -0.83 2.37 3.08 -1.49 0.92 114.38 117.98 2d45 h ARG 46 Ca -0.06 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 2d45 h ARG 46 Cb 0.56 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.48 2d45 h ARG 46 CO 0.10 0.27 0.41 1.15 -1.07 0.00 0.00 179.97 180.82 2d45 h THR 47 N 0.41 1.25 0.00 2.04 2.02 -1.38 0.17 112.91 117.42 2d45 h THR 47 Ca 0.67 -0.69 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 2d45 h THR 47 Cb 1.40 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 2d45 h THR 47 CO -0.56 0.30 -0.10 -0.07 0.37 0.00 0.00 175.52 175.47 2d45 h LEU 48 N 1.18 0.00 0.01 2.58 3.38 0.12 0.39 115.31 122.97 2d45 h LEU 48 Ca 0.29 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 2d45 h LEU 48 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2d45 h LEU 48 CO -0.04 0.10 -0.01 0.40 0.09 0.00 0.00 178.44 178.98 2d45 h ILE 49 N 0.00 0.57 -0.66 1.22 2.04 -0.33 -2.94 117.51 117.40 2d45 h ILE 49 Ca -0.00 -1.40 0.14 0.00 1.00 0.00 0.00 64.86 64.60 2d45 h ILE 49 Cb 0.28 1.06 -0.11 0.00 -0.74 0.00 0.00 36.82 37.32 2d45 h ILE 49 CO 0.01 0.19 0.02 0.74 0.00 0.00 0.00 178.15 179.12 2d45 h THR 50 N -1.00 0.46 -0.48 -0.27 2.02 -0.57 0.56 112.91 113.63 2d45 h THR 50 Ca -0.00 -0.05 0.09 0.00 0.77 0.00 0.00 66.41 67.23 2d45 h THR 50 Cb 0.32 0.31 -0.10 0.00 -1.74 0.00 0.00 68.15 66.95 2d45 h THR 50 CO 0.00 0.02 -0.29 0.03 0.37 0.00 0.00 175.52 175.66 2d45 h ARG 51 N 0.13 -0.18 0.00 6.66 2.47 -1.02 0.76 114.38 123.20 2d45 h ARG 51 Ca 0.35 0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 59.07 2d45 h ARG 51 Cb 0.59 0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.95 2d45 h ARG 51 CO -0.56 -0.12 -0.10 -0.07 0.56 0.00 0.00 179.97 179.69 2d45 h LEU 52 N -0.18 0.00 -0.20 3.04 3.38 -0.72 -0.71 115.31 119.91 2d45 h LEU 52 Ca 0.21 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 2d45 h LEU 52 Cb 0.52 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 2d45 h LEU 52 CO -0.58 0.10 -0.12 0.22 0.09 0.00 0.00 178.44 178.15 2d45 h TYR 53 N 0.00 0.51 -0.22 1.13 3.20 0.55 0.39 116.97 122.53 2d45 h TYR 53 Ca -0.00 -0.13 -0.11 0.00 3.14 0.00 0.00 58.73 61.62 2d45 h TYR 53 Cb 0.48 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.63 2d45 h TYR 53 CO 0.00 0.75 -0.30 0.87 -1.64 0.00 0.00 178.16 177.84 2d45 h LYS 54 N 0.13 0.59 0.00 1.82 1.57 -0.00 -2.08 116.57 118.60 2d45 h LYS 54 Ca 0.04 -0.34 -0.00 0.00 -1.87 0.00 0.00 60.65 58.48 2d45 h LYS 54 Cb 0.62 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.96 2d45 h LYS 54 CO 0.03 0.94 -0.02 0.87 -0.57 0.00 0.00 179.45 180.71 2d45 h LYS 55 N 0.29 0.00 -1.99 3.15 1.57 -1.17 -3.45 116.57 114.97 2d45 h LYS 55 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2d45 h LYS 55 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.18 2d45 h LYS 55 CO 0.07 0.02 0.00 0.41 -0.57 0.00 0.00 179.45 179.38 2d45 n GLY 56 N -1.22 0.68 0.00 3.86 0.00 -0.51 -4.97 105.19 103.02 2d45 n GLY 56 Ca -0.03 -0.39 0.06 0.00 0.00 0.00 0.00 46.02 45.66 2d45 n GLY 56 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2d45 n PHE 57 N -0.99 0.00 -4.24 1.61 3.01 0.01 -4.92 117.46 111.94 2d45 n PHE 57 Ca 0.00 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.30 2d45 n PHE 57 Cb 0.40 -0.23 -0.09 0.00 -0.01 0.00 0.00 39.48 39.55 2d45 n PHE 57 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 2d45 s ILE 58 N -2.69 0.00 0.24 4.37 -4.36 -1.22 0.42 121.20 117.96 2d45 s ILE 58 Ca -0.03 -2.00 -0.03 0.00 -0.26 0.00 0.00 60.65 58.33 2d45 s ILE 58 Cb 0.07 -2.50 -0.03 0.00 1.25 0.00 0.00 42.46 41.26 2d45 s ILE 58 CO 0.46 0.00 0.26 -0.62 0.24 0.00 0.00 174.94 175.28 2d45 s ASP 59 N -3.27 0.29 0.54 4.36 3.68 -0.14 -4.68 116.67 117.45 2d45 s ASP 59 Ca 0.40 -1.32 0.07 0.00 2.13 0.00 0.00 52.55 53.83 2d45 s ASP 59 Cb 0.05 0.47 0.05 0.00 -1.45 0.00 0.00 42.92 42.03 2d45 s ASP 59 CO 0.20 -0.97 0.51 0.00 0.13 0.00 0.00 175.17 175.04 2d45 s ARG 60 N -3.97 2.29 -0.30 4.34 1.70 -1.26 -0.77 118.95 120.98 2d45 s ARG 60 Ca 0.34 -1.88 -0.14 0.00 -0.47 0.00 0.00 55.73 53.59 2d45 s ARG 60 Cb 0.04 -2.27 0.18 0.00 -0.57 0.00 0.00 34.95 32.33 2d45 s ARG 60 CO 0.13 -0.66 1.11 0.21 -1.08 0.00 0.00 175.30 175.01 2d45 s LYS 61 N -4.38 0.12 -1.10 3.89 2.36 -0.10 -4.87 119.74 115.66 2d45 s LYS 61 Ca 0.43 0.16 -0.24 0.00 -2.55 0.00 0.00 55.97 53.77 2d45 s LYS 61 Cb -0.03 0.08 -0.15 0.00 -1.05 0.00 0.00 37.83 36.68 2d45 s LYS 61 CO 0.27 -0.17 1.98 1.17 1.55 0.00 0.00 175.35 180.15 2d45 n LYS 62 N 5.29 1.06 0.29 4.03 3.00 -1.26 -1.13 118.16 129.44 2d45 n LYS 62 Ca 0.00 -2.14 -0.14 0.00 -0.00 0.00 0.00 58.31 56.03 2d45 n LYS 62 Cb 0.56 -3.72 -0.07 0.00 0.00 0.00 0.00 35.03 31.79 2d45 n LYS 62 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 2d45 h ASP 63 N 10.26 -0.65 0.00 3.14 1.82 -1.70 -3.44 116.42 125.85 2d45 h ASP 63 Ca 0.16 -0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.76 2d45 h ASP 63 Cb 0.94 0.17 0.00 0.00 0.68 0.00 0.00 39.33 41.11 2d45 h ASP 63 CO 1.22 -0.29 0.00 -3.20 -1.61 0.00 0.00 179.24 175.36 2d45 n ASN 64 N -5.32 0.00 0.00 2.28 2.85 -1.26 -4.89 115.26 108.92 2d45 n ASN 64 Ca -0.11 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.36 2d45 n ASN 64 Cb 0.34 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.36 2d45 n ASN 64 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 2d45 n LYS 65 N 0.00 0.51 -4.28 1.20 3.00 -1.26 -5.04 118.16 112.29 2d45 n LYS 65 Ca 0.00 -0.61 -0.19 0.00 -0.00 0.00 0.00 58.31 57.51 2d45 n LYS 65 Cb 0.00 -0.62 -0.11 0.00 0.00 0.00 0.00 35.03 34.30 2d45 n LYS 65 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 2d45 s ILE 66 N -0.19 1.54 0.54 3.15 -4.36 -1.26 -5.08 121.20 115.54 2d45 s ILE 66 Ca 0.00 -1.85 -0.20 0.00 -0.26 0.00 0.00 60.65 58.34 2d45 s ILE 66 Cb 0.00 -1.71 -0.06 0.00 1.25 0.00 0.00 42.46 41.95 2d45 s ILE 66 CO 0.00 -0.41 1.14 -0.36 0.24 0.00 0.00 174.94 175.55 2d45 s PHE 67 N -2.24 2.64 -0.08 1.37 0.40 -1.26 -1.93 117.98 116.88 2d45 s PHE 67 Ca 0.13 1.54 -0.00 0.00 -0.60 0.00 0.00 56.93 58.00 2d45 s PHE 67 Cb -0.04 -3.32 0.02 0.00 0.51 0.00 0.00 43.02 40.19 2d45 s PHE 67 CO 0.05 -1.66 -0.04 -0.65 0.70 0.00 0.00 175.22 173.62 2d45 s GLN 68 N -3.26 0.97 0.06 0.44 -1.52 -0.28 -4.34 119.66 111.73 2d45 s GLN 68 Ca 0.73 -0.07 -0.03 0.00 -1.95 0.00 0.00 55.36 54.04 2d45 s GLN 68 Cb -0.25 -1.13 -0.05 0.00 -0.22 0.00 0.00 33.01 31.37 2d45 s GLN 68 CO 0.28 -0.22 0.26 0.71 -0.25 0.00 0.00 175.29 176.07 2d45 s TYR 69 N 1.57 3.52 0.04 0.91 1.51 0.15 -0.92 117.35 124.13 2d45 s TYR 69 Ca -0.00 0.41 -0.00 0.00 -1.01 0.00 0.00 57.07 56.47 2d45 s TYR 69 Cb -0.13 -1.88 -0.03 0.00 -0.11 0.00 0.00 41.96 39.81 2d45 s TYR 69 CO -0.04 0.56 -0.03 1.52 -1.11 0.00 0.00 175.55 176.45 2d45 s TYR 70 N -1.48 0.44 0.95 2.71 1.13 0.05 -1.70 117.35 119.46 2d45 s TYR 70 Ca 0.34 -0.83 -0.12 0.00 -1.41 0.00 0.00 57.07 55.05 2d45 s TYR 70 Cb -0.13 -0.32 0.16 0.00 -1.10 0.00 0.00 41.96 40.58 2d45 s TYR 70 CO 0.23 -0.29 1.09 0.45 -2.51 0.00 0.00 175.55 174.52 2d45 s SER 71 N -2.31 2.91 0.00 -0.18 0.15 -1.26 -0.97 113.70 112.04 2d45 s SER 71 Ca -0.02 1.59 0.00 0.00 0.70 0.00 0.00 55.95 58.21 2d45 s SER 71 Cb 0.00 -2.24 0.00 0.00 -1.71 0.00 0.00 66.02 62.07 2d45 s SER 71 CO -0.06 -3.01 0.00 0.18 1.20 0.00 0.00 173.24 171.55 2d45 n LEU 72 N -4.13 0.82 -4.90 3.45 4.77 0.17 -4.63 117.00 112.54 2d45 n LEU 72 Ca 0.07 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.79 2d45 n LEU 72 Cb 0.55 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.60 2d45 n LEU 72 CO 0.55 0.14 -0.13 0.68 -1.33 0.00 0.00 177.39 177.30 2d45 s VAL 73 N -1.96 5.10 -0.09 4.08 -7.23 -1.23 -5.05 120.40 114.02 2d45 s VAL 73 Ca 0.00 -0.78 -0.30 0.00 -1.81 0.00 0.00 61.98 59.09 2d45 s VAL 73 Cb 0.00 -3.61 -0.03 0.00 0.56 0.00 0.00 36.38 33.30 2d45 s VAL 73 CO 0.00 -0.09 1.29 -0.70 -0.31 0.00 0.00 175.10 175.30 2d45 s GLU 74 N -3.17 4.28 0.00 4.82 -6.30 -1.26 -4.99 118.70 112.08 2d45 s GLU 74 Ca 0.34 1.76 0.00 0.00 -2.50 0.00 0.00 54.97 54.56 2d45 s GLU 74 Cb -0.11 -3.68 0.00 0.00 0.00 0.00 0.00 34.13 30.35 2d45 s GLU 74 CO 0.27 -0.60 0.41 -1.91 0.02 0.00 0.00 175.26 173.45 2d45 n GLU 75 N 5.94 0.00 -0.33 4.30 2.13 -1.26 -1.34 120.64 130.07 2d45 n GLU 75 Ca 0.13 0.32 0.25 0.00 0.66 0.00 0.00 57.16 58.52 2d45 n GLU 75 Cb 0.45 -0.91 0.54 0.00 0.27 0.00 0.00 31.44 31.79 2d45 n GLU 75 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2d45 h SER 76 N 0.00 0.39 -0.90 4.31 4.64 -1.98 0.24 113.55 120.25 2d45 h SER 76 Ca 0.00 0.08 0.06 0.00 -0.47 0.00 0.00 61.79 61.47 2d45 h SER 76 Cb 0.00 0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 62.05 2d45 h SER 76 CO 0.00 0.05 0.59 0.44 -0.87 0.00 0.00 176.83 177.04 2d45 h ASP 77 N 0.33 0.90 0.26 4.97 3.32 -1.84 -1.85 116.42 122.51 2d45 h ASP 77 Ca 0.61 0.01 -0.34 0.00 0.02 0.00 0.00 57.03 57.33 2d45 h ASP 77 Cb 1.67 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 41.03 2d45 h ASP 77 CO -0.28 0.58 -1.75 -0.29 -1.72 0.00 0.00 179.24 175.78 2d45 h ILE 78 N 1.02 0.92 0.07 0.35 2.10 0.70 -3.14 117.51 119.53 2d45 h ILE 78 Ca 0.39 -2.56 -0.00 0.00 1.08 0.00 0.00 64.86 63.77 2d45 h ILE 78 Cb 0.20 2.69 0.00 0.00 -1.09 0.00 0.00 36.82 38.62 2d45 h ILE 78 CO -0.14 0.84 -0.04 0.11 -1.08 0.00 0.00 178.15 177.84 2d45 h LYS 79 N 0.09 -0.10 -0.75 2.19 1.57 -1.02 0.35 116.57 118.89 2d45 h LYS 79 Ca -0.33 0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.60 2d45 h LYS 79 Cb 2.06 0.02 -0.10 0.00 0.08 0.00 0.00 32.23 34.30 2d45 h LYS 79 CO 0.15 0.07 0.29 -0.92 -0.57 0.00 0.00 179.45 178.47 2d45 h TYR 80 N -0.25 0.49 -0.63 -1.35 3.20 -1.49 0.13 116.97 117.08 2d45 h TYR 80 Ca -0.01 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 2d45 h TYR 80 Cb 0.21 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.35 2d45 h TYR 80 CO -0.02 0.05 0.32 -0.22 -1.64 0.00 0.00 178.16 176.65 2d45 h LYS 81 N 0.43 0.88 0.17 1.82 3.64 -1.29 -1.55 116.57 120.66 2d45 h LYS 81 Ca 0.41 -0.10 -0.31 0.00 -1.27 0.00 0.00 60.65 59.38 2d45 h LYS 81 Cb 0.63 -0.17 0.03 0.00 -0.41 0.00 0.00 32.23 32.31 2d45 h LYS 81 CO -0.41 0.66 -1.32 1.15 -2.27 0.00 0.00 179.45 177.26 2d45 h THR 82 N 0.88 1.32 -0.48 1.00 2.02 0.21 -2.95 112.91 114.92 2d45 h THR 82 Ca 0.22 -2.65 -0.01 0.00 0.77 0.00 0.00 66.41 64.74 2d45 h THR 82 Cb 0.06 2.86 -0.02 0.00 -1.74 0.00 0.00 68.15 69.30 2d45 h THR 82 CO -0.03 0.80 0.27 0.28 0.37 0.00 0.00 175.52 177.21 2d45 h SER 83 N 0.19 0.59 -0.63 4.18 0.02 -0.78 0.13 113.55 117.24 2d45 h SER 83 Ca -0.20 -0.08 0.09 0.00 -0.84 0.00 0.00 61.79 60.76 2d45 h SER 83 Cb 2.01 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 64.36 2d45 h SER 83 CO 0.24 0.49 0.42 0.50 -1.14 0.00 0.00 176.83 177.35 2d45 h LYS 84 N 0.63 0.48 -0.11 3.45 1.63 -1.37 -0.57 116.57 120.72 2d45 h LYS 84 Ca 0.17 -0.03 -0.08 0.00 -0.85 0.00 0.00 60.65 59.86 2d45 h LYS 84 Cb 0.03 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.55 2d45 h LYS 84 CO -0.03 0.32 -0.24 -0.97 -3.45 0.00 0.00 179.45 175.08 2d45 h ASN 85 N 0.49 0.40 0.00 4.20 -1.24 -1.03 -3.08 115.58 115.32 2d45 h ASN 85 Ca 0.29 -0.56 0.00 0.00 0.71 0.00 0.00 56.30 56.73 2d45 h ASN 85 Cb 0.48 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 39.41 2d45 h ASN 85 CO -0.09 0.89 0.00 0.33 -1.29 0.00 0.00 177.43 177.27 2d45 n PHE 86 N -4.48 0.00 -0.27 0.67 7.35 0.32 -2.66 117.46 118.39 2d45 n PHE 86 Ca -0.07 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 56.59 2d45 n PHE 86 Cb 0.43 -0.15 0.00 0.00 0.35 0.00 0.00 39.48 40.12 2d45 n PHE 86 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 2d45 n ILE 87 N -1.00 -0.38 -0.34 -2.13 5.41 -0.31 0.24 119.36 120.84 2d45 n ILE 87 Ca 0.00 1.60 0.21 0.00 1.00 0.00 0.00 62.75 65.56 2d45 n ILE 87 Cb 0.00 -2.08 0.45 0.00 -0.71 0.00 0.00 39.64 37.30 2d45 n ILE 87 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 2d45 h ASN 88 N 0.00 0.57 0.60 4.38 4.21 -1.57 0.53 115.58 124.30 2d45 h ASN 88 Ca 0.20 0.13 -0.21 0.00 1.21 0.00 0.00 56.30 57.63 2d45 h ASN 88 Cb 0.37 0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.61 2d45 h ASN 88 CO -0.66 0.05 -0.94 0.07 -1.29 0.00 0.00 177.43 174.66 2d45 h LYS 89 N 0.47 0.21 0.00 0.81 2.10 0.33 -3.42 116.57 117.07 2d45 h LYS 89 Ca 0.65 -0.25 0.00 0.00 -2.00 0.00 0.00 60.65 59.05 2d45 h LYS 89 Cb 1.43 0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.84 2d45 h LYS 89 CO -0.44 1.01 0.00 0.28 -2.00 0.00 0.00 179.45 178.30 2d45 n VAL 90 N -3.62 0.00 -2.37 0.07 0.31 -0.01 -4.91 118.33 107.80 2d45 n VAL 90 Ca -0.04 0.02 -0.43 0.00 -0.01 0.00 0.00 64.34 63.88 2d45 n VAL 90 Cb 0.85 -0.32 -0.02 0.00 -0.91 0.00 0.00 33.84 33.43 2d45 n VAL 90 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2d45 s TYR 91 N -0.04 2.89 0.32 3.52 2.02 -0.11 -4.93 117.35 121.02 2d45 s TYR 91 Ca 0.00 0.98 0.03 0.00 -0.37 0.00 0.00 57.07 57.71 2d45 s TYR 91 Cb 0.00 -3.54 0.53 0.00 -0.40 0.00 0.00 41.96 38.55 2d45 s TYR 91 CO 0.00 -1.88 1.82 0.87 -1.57 0.00 0.00 175.55 174.79 2d45 h LYS 92 N 8.00 0.52 -1.98 -0.62 1.79 -1.86 -3.29 116.57 119.12 2d45 h LYS 92 Ca -0.32 -0.14 -0.57 0.00 -2.18 0.00 0.00 60.65 57.44 2d45 h LYS 92 Cb 1.14 -0.06 -0.20 0.00 -1.58 0.00 0.00 32.23 31.53 2d45 h LYS 92 CO 0.93 0.61 0.57 0.41 -1.08 0.00 0.00 179.45 180.89 2d45 n GLY 93 N -0.71 4.67 6.26 3.86 0.00 -1.26 -5.05 105.19 112.96 2d45 n GLY 93 Ca 0.01 -2.03 0.01 0.00 0.00 0.00 0.00 46.02 44.00 2d45 n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d45 n GLY 94 N 0.48 -0.24 0.29 -0.02 0.00 -1.24 -2.27 105.19 102.19 2d45 n GLY 94 Ca 0.50 -0.24 0.01 0.00 0.00 0.00 0.00 46.02 46.30 2d45 n GLY 94 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2d45 h PHE 95 N -0.04 -0.44 0.00 1.61 3.57 -1.96 -2.93 116.94 116.76 2d45 h PHE 95 Ca 0.00 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2d45 h PHE 95 Cb 0.03 0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 2d45 h PHE 95 CO 0.00 -0.33 -0.01 -0.91 -2.23 0.00 0.00 178.31 174.82 2d45 h ASN 96 N -0.01 -0.04 -0.73 0.41 4.21 -2.01 -1.83 115.58 115.59 2d45 h ASN 96 Ca 0.36 0.00 0.21 0.00 1.21 0.00 0.00 56.30 58.09 2d45 h ASN 96 Cb 0.56 0.01 -0.03 0.00 -1.12 0.00 0.00 38.32 37.74 2d45 h ASN 96 CO -0.79 -0.01 0.98 -0.24 -1.29 0.00 0.00 177.43 176.08 2d45 n SER 97 N -2.51 0.00 -0.06 5.81 2.88 -0.96 0.19 113.62 118.97 2d45 n SER 97 Ca -0.00 0.59 -0.08 0.00 -1.33 0.00 0.00 58.87 58.05 2d45 n SER 97 Cb 0.01 -0.18 -0.07 0.00 -0.75 0.00 0.00 64.21 63.21 2d45 n SER 97 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2d45 h LEU 98 N 0.00 0.00 -0.73 2.46 6.46 -1.34 -3.12 115.31 119.05 2d45 h LEU 98 Ca 0.35 -0.56 0.11 0.00 -0.12 0.00 0.00 57.88 57.66 2d45 h LEU 98 Cb 2.31 0.00 -0.08 0.00 -0.73 0.00 0.00 40.66 42.15 2d45 h LEU 98 CO -0.00 0.80 0.33 0.58 -0.62 0.00 0.00 178.44 179.52 2d45 h VAL 99 N -1.00 0.76 -0.00 1.05 2.07 0.26 1.27 116.25 120.66 2d45 h VAL 99 Ca -0.01 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2d45 h VAL 99 Cb 0.58 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2d45 h VAL 99 CO -0.00 0.10 0.02 0.25 0.02 0.00 0.00 177.57 177.96 2d45 h LEU 100 N 0.53 0.00 0.00 2.57 5.85 -1.10 -0.62 115.31 122.54 2d45 h LEU 100 Ca 0.38 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.10 2d45 h LEU 100 Cb 0.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.51 2d45 h LEU 100 CO -0.33 0.00 -0.65 -3.20 -0.34 0.00 0.00 178.44 173.93 2d45 n ASN 101 N -3.11 0.60 0.11 1.25 2.85 0.43 -2.97 115.26 114.42 2d45 n ASN 101 Ca -0.03 -0.08 -0.24 0.00 -0.11 0.00 0.00 54.58 54.12 2d45 n ASN 101 Cb 0.09 0.31 -0.15 0.00 1.24 0.00 0.00 39.78 41.27 2d45 n ASN 101 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 2d45 h PHE 102 N 0.00 0.85 0.00 1.20 0.05 -0.54 -3.25 116.94 115.26 2d45 h PHE 102 Ca 0.00 -0.62 -0.16 0.00 3.82 0.00 0.00 57.97 61.00 2d45 h PHE 102 Cb 0.65 -0.03 -0.02 0.00 2.00 0.00 0.00 35.95 38.54 2d45 h PHE 102 CO 0.00 1.58 -0.77 0.28 -0.18 0.00 0.00 178.31 179.23 2d45 h VAL 103 N 0.08 1.54 -0.38 -0.55 2.07 -1.66 0.12 116.25 117.47 2d45 h VAL 103 Ca -0.28 -2.64 -0.01 0.00 0.82 0.00 0.00 66.70 64.59 2d45 h VAL 103 Cb 2.10 2.43 -0.02 0.00 -1.52 0.00 0.00 31.29 34.27 2d45 h VAL 103 CO 0.23 0.75 0.18 -0.08 0.02 0.00 0.00 177.57 178.67 2d45 h GLU 104 N 0.00 0.53 -0.78 1.57 4.57 -1.64 0.42 114.58 119.25 2d45 h GLU 104 Ca -0.01 -0.06 -0.43 0.00 -1.18 0.00 0.00 59.36 57.68 2d45 h GLU 104 Cb 1.37 -0.11 -0.25 0.00 -0.16 0.00 0.00 28.75 29.60 2d45 h GLU 104 CO 0.10 0.42 0.38 1.63 -1.18 0.00 0.00 179.01 180.36 2d45 n LYS 105 N -4.41 2.22 -3.16 1.92 4.76 -1.11 -4.95 118.16 113.44 2d45 n LYS 105 Ca 0.02 -3.16 -0.08 0.00 -2.87 0.00 0.00 58.31 52.23 2d45 n LYS 105 Cb 0.12 -2.08 -0.02 0.00 -1.84 0.00 0.00 35.03 31.22 2d45 n LYS 105 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2d45 n GLU 106 N -1.10 -0.95 -0.25 1.97 1.02 0.14 -4.71 120.64 116.75 2d45 n GLU 106 Ca 0.51 -0.09 0.03 0.00 -0.02 0.00 0.00 57.16 57.59 2d45 n GLU 106 Cb 1.32 -0.56 0.13 0.00 -0.02 0.00 0.00 31.44 32.31 2d45 n GLU 106 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2d45 n ASP 107 N -0.26 2.23 -4.16 1.62 4.64 0.38 -4.82 116.55 116.17 2d45 n ASP 107 Ca -0.06 -2.21 -0.31 0.00 -1.38 0.00 0.00 54.79 50.83 2d45 n ASP 107 Cb 0.15 -0.43 -0.17 0.00 -1.04 0.00 0.00 41.12 39.63 2d45 n ASP 107 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 2d45 s LEU 108 N -0.98 1.99 -0.06 -2.67 1.43 -1.26 -5.01 118.68 112.12 2d45 s LEU 108 Ca 0.19 -0.52 -0.08 0.00 -1.03 0.00 0.00 54.13 52.68 2d45 s LEU 108 Cb 0.13 -1.30 -0.05 0.00 0.03 0.00 0.00 46.19 45.00 2d45 s LEU 108 CO 0.08 0.11 0.23 -0.94 0.23 0.00 0.00 176.35 176.06 2d45 s SER 109 N 0.55 6.51 0.54 2.29 1.04 -1.26 -4.91 113.70 118.46 2d45 s SER 109 Ca -0.15 0.59 0.37 0.00 0.48 0.00 0.00 55.95 57.25 2d45 s SER 109 Cb -0.17 -2.11 1.56 0.00 0.10 0.00 0.00 66.02 65.40 2d45 s SER 109 CO 0.05 0.35 1.79 -0.61 0.98 0.00 0.00 173.24 175.79 2d45 h GLN 110 N 4.62 0.01 -0.28 4.02 5.75 -2.00 0.75 115.11 127.98 2d45 h GLN 110 Ca -0.53 -0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 57.87 2d45 h GLN 110 Cb 1.22 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.75 2d45 h GLN 110 CO 0.61 0.01 -0.24 -0.44 -2.65 0.00 0.00 178.83 176.12 2d45 h ASP 111 N 0.01 0.54 0.08 -0.69 3.45 -2.00 -2.57 116.42 115.22 2d45 h ASP 111 Ca 0.59 -0.18 -0.18 0.00 0.43 0.00 0.00 57.03 57.69 2d45 h ASP 111 Cb 2.35 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 40.98 2d45 h ASP 111 CO -0.01 0.77 -0.89 -0.33 -1.57 0.00 0.00 179.24 177.20 2d45 h GLU 112 N 0.47 0.16 -0.64 3.56 5.08 -0.01 -3.30 114.58 119.91 2d45 h GLU 112 Ca 0.07 -0.28 0.19 0.00 -1.00 0.00 0.00 59.36 58.34 2d45 h GLU 112 Cb 0.67 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.00 2d45 h GLU 112 CO 0.05 1.13 0.49 0.82 -1.00 0.00 0.00 179.01 180.50 2d45 h ILE 113 N -0.60 0.60 0.42 3.13 2.04 -0.91 -0.41 117.51 121.79 2d45 h ILE 113 Ca -0.20 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 2d45 h ILE 113 Cb 1.48 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 2d45 h ILE 113 CO 0.03 0.00 -0.20 -0.08 0.00 0.00 0.00 178.15 177.90 2d45 h GLU 114 N 0.00 -0.54 -0.98 2.37 4.57 -1.55 -3.16 114.58 115.29 2d45 h GLU 114 Ca 0.30 0.04 0.25 0.00 -1.18 0.00 0.00 59.36 58.77 2d45 h GLU 114 Cb 1.27 0.12 -0.13 0.00 -0.16 0.00 0.00 28.75 29.86 2d45 h GLU 114 CO -0.00 -0.24 0.55 1.49 -1.18 0.00 0.00 179.01 179.63 2d45 h GLU 115 N -0.84 0.49 -0.28 1.92 4.81 -1.15 -2.12 114.58 117.41 2d45 h GLU 115 Ca -0.06 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.21 2d45 h GLU 115 Cb 0.55 -0.11 -0.07 0.00 0.63 0.00 0.00 28.75 29.75 2d45 h GLU 115 CO 0.09 0.33 -0.20 -0.07 -0.73 0.00 0.00 179.01 178.43 2d45 h LEU 116 N 0.51 -0.65 -0.28 1.64 3.38 -1.48 -0.83 115.31 117.60 2d45 h LEU 116 Ca 0.64 0.13 0.07 0.00 0.09 0.00 0.00 57.88 58.81 2d45 h LEU 116 Cb 1.26 0.33 -0.08 0.00 0.09 0.00 0.00 40.66 42.26 2d45 h LEU 116 CO -0.51 -0.23 -0.30 0.03 0.09 0.00 0.00 178.44 177.52 2d45 h ARG 117 N -0.18 -0.28 -0.05 1.13 3.08 -1.47 1.15 114.38 117.76 2d45 h ARG 117 Ca 0.15 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2d45 h ARG 117 Cb 0.41 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.52 2d45 h ARG 117 CO -0.39 -0.19 0.00 0.09 -1.07 0.00 0.00 179.97 178.41 2d45 n ASN 118 N -5.40 0.05 -0.01 7.04 3.02 -0.63 0.23 115.26 119.54 2d45 n ASN 118 Ca -0.01 -1.00 0.01 0.00 -0.03 0.00 0.00 54.58 53.55 2d45 n ASN 118 Cb 0.32 -0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.42 2d45 n ASN 118 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2d45 n ILE 119 N -0.43 0.14 0.03 2.41 2.08 0.35 -4.38 119.36 119.56 2d45 n ILE 119 Ca 0.00 -0.17 0.04 0.00 0.56 0.00 0.00 62.75 63.18 2d45 n ILE 119 Cb 0.01 -0.11 0.22 0.00 -0.75 0.00 0.00 39.64 39.00 2d45 n ILE 119 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2d45 n LEU 120 N -1.90 3.46 0.00 1.39 4.77 0.16 -5.06 117.00 119.82 2d45 n LEU 120 Ca -0.04 -1.75 0.00 0.00 -0.03 0.00 0.00 56.01 54.19 2d45 n LEU 120 Cb 0.36 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 2d45 n LEU 120 CO 0.12 0.46 0.01 0.59 -1.33 0.00 0.00 177.39 177.24