#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u2d s VAL 31 N 0.00 1.63 -0.65 0.44 1.01 -1.26 -4.73 120.40 116.84 1u2d s VAL 31 Ca 0.00 -0.74 -0.27 0.00 0.00 0.00 0.00 61.98 60.97 1u2d s VAL 31 Cb 0.00 -1.45 0.02 0.00 0.00 0.00 0.00 36.38 34.94 1u2d s VAL 31 CO 0.00 0.47 1.42 -0.75 0.00 0.00 0.00 175.10 176.24 1u2d s LYS 32 N 0.73 3.14 0.94 2.72 2.20 -1.26 -5.01 119.74 123.21 1u2d s LYS 32 Ca -0.12 0.16 -0.15 0.00 -0.36 0.00 0.00 55.97 55.51 1u2d s LYS 32 Cb -0.16 -4.19 0.19 0.00 -1.51 0.00 0.00 37.83 32.16 1u2d s LYS 32 CO 0.02 -2.16 1.29 0.00 -0.36 0.00 0.00 175.35 174.15 1u2d s ALA 33 N 6.40 2.36 -0.22 3.13 0.00 -1.26 -1.52 121.76 130.65 1u2d s ALA 33 Ca 0.47 -1.24 -0.34 0.00 0.00 0.00 0.00 51.96 50.85 1u2d s ALA 33 Cb -0.10 -2.72 0.15 0.00 0.00 0.00 0.00 23.12 20.46 1u2d s ALA 33 CO 0.20 -2.35 1.24 0.20 0.00 0.00 0.00 175.76 175.05 1u2d s GLY 34 N -4.87 -0.21 0.60 0.00 0.00 -0.81 -4.63 107.32 97.39 1u2d s GLY 34 Ca 0.73 1.88 0.10 0.00 0.00 0.00 0.00 44.72 47.43 1u2d s GLY 34 CO 0.52 0.68 0.82 -1.14 0.00 0.00 0.00 173.10 173.98 1u2d n SER 35 N 0.08 2.19 -0.07 1.64 3.41 -1.26 -4.14 113.62 115.47 1u2d n SER 35 Ca 0.00 -2.59 -0.10 0.00 -0.26 0.00 0.00 58.87 55.92 1u2d n SER 35 Cb 0.58 -0.43 0.05 0.00 -0.26 0.00 0.00 64.21 64.15 1u2d n SER 35 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u2d h ALA 36 N 0.11 0.73 -0.40 7.33 0.00 -1.92 -2.64 119.26 122.47 1u2d h ALA 36 Ca -0.28 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.11 1u2d h ALA 36 Cb 1.29 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1u2d h ALA 36 CO 0.40 0.66 -0.11 0.93 0.00 0.00 0.00 179.25 181.13 1u2d h GLU 37 N 0.64 0.72 -0.05 0.00 3.07 -1.96 -1.43 114.58 115.57 1u2d h GLU 37 Ca 0.06 -0.23 0.04 0.00 -0.50 0.00 0.00 59.36 58.73 1u2d h GLU 37 Cb 0.91 -0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 28.70 1u2d h GLU 37 CO 0.08 0.81 -0.26 -0.44 -1.40 0.00 0.00 179.01 177.79 1u2d h ASP 38 N 0.65 -0.80 1.17 1.42 5.19 -1.90 -2.73 116.42 119.42 1u2d h ASP 38 Ca 0.11 0.11 -0.02 0.00 -0.62 0.00 0.00 57.03 56.61 1u2d h ASP 38 Cb 0.57 0.33 -0.00 0.00 0.18 0.00 0.00 39.33 40.41 1u2d h ASP 38 CO 0.04 -0.32 -0.11 0.00 -3.12 0.00 0.00 179.24 175.72 1u2d h ALA 39 N 0.48 0.99 -0.23 3.45 0.00 -1.34 -3.11 119.26 119.49 1u2d h ALA 39 Ca 0.08 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1u2d h ALA 39 Cb 0.49 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1u2d h ALA 39 CO -0.27 0.14 0.03 0.00 0.00 0.00 0.00 179.25 179.15 1u2d h ALA 40 N 1.89 0.31 -0.85 0.00 0.00 -0.97 -3.02 119.26 116.62 1u2d h ALA 40 Ca -0.00 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.78 1u2d h ALA 40 Cb 0.73 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 1u2d h ALA 40 CO 0.01 0.00 0.56 0.74 0.00 0.00 0.00 179.25 180.56 1u2d h PHE 41 N 0.19 0.97 -0.17 0.00 0.04 -1.43 -2.49 116.94 114.04 1u2d h PHE 41 Ca 0.07 0.02 -0.15 0.00 2.80 0.00 0.00 57.97 60.72 1u2d h PHE 41 Cb 0.34 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 38.18 1u2d h PHE 41 CO 0.02 0.52 -0.47 0.82 -0.60 0.00 0.00 178.31 178.61 1u2d h ILE 42 N 0.97 1.33 0.00 -0.55 2.04 -1.60 -2.84 117.51 116.86 1u2d h ILE 42 Ca 0.36 -1.72 -0.15 0.00 1.00 0.00 0.00 64.86 64.35 1u2d h ILE 42 Cb 0.18 1.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 1u2d h ILE 42 CO -0.13 0.53 -0.92 0.24 0.00 0.00 0.00 178.15 177.88 1u2d h MET 43 N 0.29 0.00 -0.56 2.37 2.86 -1.49 -3.18 114.93 115.22 1u2d h MET 43 Ca -0.01 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1u2d h MET 43 Cb 1.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.72 1u2d h MET 43 CO 0.10 0.54 0.25 0.87 1.06 0.00 0.00 176.91 179.73 1u2d h LYS 44 N 0.00 0.82 -2.05 1.72 1.79 -1.53 -3.18 116.57 114.14 1u2d h LYS 44 Ca -0.06 -0.13 -0.62 0.00 -2.18 0.00 0.00 60.65 57.65 1u2d h LYS 44 Cb 1.55 -0.14 -0.21 0.00 -1.58 0.00 0.00 32.23 31.85 1u2d h LYS 44 CO 0.07 0.69 0.78 0.09 -1.08 0.00 0.00 179.45 180.00 1u2d n ASN 45 N -4.53 6.97 -3.99 0.86 3.02 -1.07 -4.91 115.26 111.61 1u2d n ASN 45 Ca 0.03 -3.44 -0.16 0.00 -0.03 0.00 0.00 54.58 50.98 1u2d n ASN 45 Cb 0.14 -1.18 -0.14 0.00 -0.61 0.00 0.00 39.78 37.98 1u2d n ASN 45 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1u2d s ALA 46 N -2.59 0.54 0.03 5.41 0.00 -1.20 -4.95 121.76 119.00 1u2d s ALA 46 Ca 0.55 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 52.20 1u2d s ALA 46 Cb 0.38 -0.12 -0.26 0.00 0.00 0.00 0.00 23.12 23.12 1u2d s ALA 46 CO -0.28 0.12 0.94 1.03 0.00 0.00 0.00 175.76 177.57 1u2d h SER 47 N 5.86 0.27 -3.08 0.00 0.87 -1.91 -3.45 113.55 112.11 1u2d h SER 47 Ca -0.29 -0.36 -0.22 0.00 -1.23 0.00 0.00 61.79 59.69 1u2d h SER 47 Cb 1.19 -0.09 -0.32 0.00 -0.44 0.00 0.00 62.40 62.74 1u2d h SER 47 CO 0.49 1.30 -0.53 -0.75 -0.53 0.00 0.00 176.83 176.81 1u2d s LYS 48 N -2.64 0.16 -0.01 2.24 2.20 -1.26 -2.43 119.74 118.00 1u2d s LYS 48 Ca -0.06 0.64 0.04 0.00 -0.36 0.00 0.00 55.97 56.23 1u2d s LYS 48 Cb 0.08 -0.09 -0.03 0.00 -1.51 0.00 0.00 37.83 36.27 1u2d s LYS 48 CO 0.85 -0.24 -0.12 0.08 -0.36 0.00 0.00 175.35 175.56 1u2d s VAL 49 N 1.95 3.25 -0.17 4.02 1.01 0.16 -1.88 120.40 128.73 1u2d s VAL 49 Ca -0.03 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1u2d s VAL 49 Cb -0.11 -2.35 0.04 0.00 0.00 0.00 0.00 36.38 33.95 1u2d s VAL 49 CO -0.08 0.46 -0.09 0.27 0.00 0.00 0.00 175.10 175.66 1u2d s ILE 50 N -0.88 1.39 -0.04 2.22 -4.36 -0.54 -2.78 121.20 116.21 1u2d s ILE 50 Ca 0.14 -0.77 -0.30 0.00 -0.26 0.00 0.00 60.65 59.47 1u2d s ILE 50 Cb -0.11 -1.48 -0.03 0.00 1.25 0.00 0.00 42.46 42.10 1u2d s ILE 50 CO 0.04 0.20 1.10 -0.63 0.24 0.00 0.00 174.94 175.89 1u2d s ILE 51 N 1.52 4.50 -0.55 8.37 1.01 -0.01 -1.68 121.20 134.37 1u2d s ILE 51 Ca 0.01 1.79 -0.00 0.00 0.00 0.00 0.00 60.65 62.45 1u2d s ILE 51 Cb -0.15 -4.15 0.14 0.00 0.01 0.00 0.00 42.46 38.31 1u2d s ILE 51 CO -0.08 0.05 0.33 -0.69 0.00 0.00 0.00 174.94 174.55 1u2d s VAL 52 N 1.72 3.21 0.50 2.92 1.01 0.01 -1.01 120.40 128.75 1u2d s VAL 52 Ca 0.53 -2.93 -0.15 0.00 0.00 0.00 0.00 61.98 59.44 1u2d s VAL 52 Cb -0.23 -3.16 -0.07 0.00 0.00 0.00 0.00 36.38 32.92 1u2d s VAL 52 CO 0.23 -0.81 0.94 -2.16 0.00 0.00 0.00 175.10 173.30 1u2d s PRO 53 N 0.07 3.90 0.00 2.72 0.04 -1.26 -1.28 135.00 139.19 1u2d s PRO 53 Ca 0.16 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.04 1u2d s PRO 53 Cb -0.22 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 32.13 1u2d s PRO 53 CO -0.03 -0.24 0.00 0.41 0.04 0.00 0.00 177.00 177.19 1u2d n GLY 54 N -1.57 4.05 0.32 0.56 0.00 -0.73 -4.77 105.19 103.04 1u2d n GLY 54 Ca 0.06 -1.12 -0.01 0.00 0.00 0.00 0.00 46.02 44.95 1u2d n GLY 54 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1u2d h TYR 55 N 0.08 0.85 -0.29 1.61 3.20 -1.60 -2.32 116.97 118.49 1u2d h TYR 55 Ca 0.00 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.82 1u2d h TYR 55 Cb 0.00 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 37.99 1u2d h TYR 55 CO 0.00 0.62 0.10 0.78 -1.64 0.00 0.00 178.16 178.02 1u2d h GLY 56 N 0.95 0.44 1.46 1.82 0.00 -1.25 -1.47 103.07 105.02 1u2d h GLY 56 Ca 0.21 -0.21 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1u2d h GLY 56 CO -0.03 0.20 -0.17 1.98 0.00 0.00 0.00 176.54 178.51 1u2d h MET 57 N 0.41 0.64 -0.14 4.80 1.85 -1.57 -2.30 114.93 118.61 1u2d h MET 57 Ca 0.10 -0.22 -0.11 0.00 -0.61 0.00 0.00 59.70 58.86 1u2d h MET 57 Cb 0.12 -0.05 0.00 0.00 0.43 0.00 0.00 31.60 32.10 1u2d h MET 57 CO -0.01 0.78 -0.32 0.00 -0.40 0.00 0.00 176.91 176.96 1u2d h ALA 58 N 1.24 0.23 -0.10 0.39 0.00 -1.34 -1.78 119.26 117.90 1u2d h ALA 58 Ca 0.09 -0.42 0.02 0.00 0.00 0.00 0.00 54.91 54.60 1u2d h ALA 58 Cb 0.62 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1u2d h ALA 58 CO 0.04 0.27 -0.05 0.28 0.00 0.00 0.00 179.25 179.80 1u2d h VAL 59 N 0.08 0.85 0.00 0.00 2.07 -1.19 -1.79 116.25 116.27 1u2d h VAL 59 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1u2d h VAL 59 Cb 0.93 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 1u2d h VAL 59 CO 0.07 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.66 1u2d h ALA 60 N 1.06 1.00 -4.86 1.67 0.00 -1.50 -3.47 119.26 113.16 1u2d h ALA 60 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.67 1u2d h ALA 60 Cb 0.12 0.00 0.12 0.00 0.00 0.00 0.00 17.79 18.03 1u2d h ALA 60 CO -0.13 0.00 -0.57 0.94 0.00 0.00 0.00 179.25 179.50 1u2d n GLN 61 N -2.62 -5.87 -1.27 0.00 -0.06 -0.68 -4.59 117.38 102.29 1u2d n GLN 61 Ca 0.02 0.66 -0.25 0.00 -2.00 0.00 0.00 57.00 55.43 1u2d n GLN 61 Cb 0.29 -5.18 0.13 0.00 -4.06 0.00 0.00 30.24 21.42 1u2d n GLN 61 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1u2d n ALA 62 N -4.05 5.65 -0.04 1.69 0.00 -0.73 -4.53 120.51 118.50 1u2d n ALA 62 Ca -0.09 -3.24 -0.11 0.00 0.00 0.00 0.00 53.44 50.00 1u2d n ALA 62 Cb 0.58 -1.37 -0.14 0.00 0.00 0.00 0.00 19.45 18.52 1u2d n ALA 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1u2d n GLN 63 N -1.02 0.66 -0.05 0.00 3.00 -1.26 -1.59 117.38 117.12 1u2d n GLN 63 Ca 0.56 0.22 -0.10 0.00 -0.01 0.00 0.00 57.00 57.66 1u2d n GLN 63 Cb 1.13 -1.71 0.04 0.00 0.00 0.00 0.00 30.24 29.70 1u2d n GLN 63 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1u2d h HIS 64 N 0.01 0.86 -0.08 1.08 3.86 -1.89 -2.23 115.15 116.77 1u2d h HIS 64 Ca -0.37 -0.27 -0.14 0.00 -1.16 0.00 0.00 60.37 58.43 1u2d h HIS 64 Cb 2.07 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 30.35 1u2d h HIS 64 CO 0.01 1.02 -0.56 0.00 0.86 0.00 0.00 177.93 179.26 1u2d h ALA 65 N 0.93 0.91 -0.13 2.45 0.00 -1.87 -2.94 119.26 118.61 1u2d h ALA 65 Ca 0.04 -0.51 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 1u2d h ALA 65 Cb 0.99 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1u2d h ALA 65 CO 0.09 0.70 -0.08 1.25 0.00 0.00 0.00 179.25 181.22 1u2d h LEU 66 N 0.18 0.29 -0.91 0.00 5.85 -1.21 -2.43 115.31 117.07 1u2d h LEU 66 Ca -0.00 -0.43 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1u2d h LEU 66 Cb 1.04 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.99 1u2d h LEU 66 CO 0.09 0.65 0.00 -0.09 -0.34 0.00 0.00 178.44 178.75 1u2d h ARG 67 N -0.08 0.00 0.15 1.25 1.12 -1.47 -0.18 114.38 115.16 1u2d h ARG 67 Ca 0.03 0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 58.89 1u2d h ARG 67 Cb 0.55 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.51 1u2d h ARG 67 CO 0.02 0.00 -0.07 1.49 -3.11 0.00 0.00 179.97 178.30 1u2d h GLU 68 N 0.00 -0.19 -0.64 0.20 4.81 -1.37 -2.43 114.58 114.95 1u2d h GLU 68 Ca 0.00 0.01 0.15 0.00 -0.13 0.00 0.00 59.36 59.39 1u2d h GLU 68 Cb 0.42 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 1u2d h GLU 68 CO 0.00 0.25 0.44 1.98 -0.73 0.00 0.00 179.01 180.95 1u2d h MET 69 N -0.77 0.23 0.57 1.92 4.05 -0.97 -1.92 114.93 118.04 1u2d h MET 69 Ca -0.02 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.36 1u2d h MET 69 Cb 0.53 -0.05 0.01 0.00 -0.80 0.00 0.00 31.60 31.29 1u2d h MET 69 CO 0.03 0.15 -0.28 0.00 0.23 0.00 0.00 176.91 177.05 1u2d h ALA 70 N 1.69 -0.77 -0.36 0.39 0.00 -0.99 -3.09 119.26 116.13 1u2d h ALA 70 Ca 0.31 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1u2d h ALA 70 Cb 0.89 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1u2d h ALA 70 CO -0.06 -0.85 0.00 -0.40 0.00 0.00 0.00 179.25 177.94 1u2d n ASP 71 N -5.36 1.95 0.03 0.00 5.68 -0.92 -1.21 116.55 116.72 1u2d n ASP 71 Ca -0.12 -1.99 -0.15 0.00 -0.50 0.00 0.00 54.79 52.03 1u2d n ASP 71 Cb 0.34 -0.24 -0.14 0.00 -1.14 0.00 0.00 41.12 39.94 1u2d n ASP 71 CO 0.00 0.00 0.00 1.62 -1.33 0.00 0.00 177.20 177.49 1u2d h VAL 72 N 2.14 0.99 -0.29 2.12 3.04 -1.44 -3.16 116.25 119.66 1u2d h VAL 72 Ca 0.00 -2.71 -0.16 0.00 -1.01 0.00 0.00 66.70 62.82 1u2d h VAL 72 Cb 0.49 2.61 -0.00 0.00 -2.01 0.00 0.00 31.29 32.38 1u2d h VAL 72 CO 0.00 0.75 -0.44 -0.07 -1.01 0.00 0.00 177.57 176.80 1u2d h LEU 73 N 0.04 0.88 -0.99 3.16 4.07 -1.32 -3.06 115.31 118.10 1u2d h LEU 73 Ca -0.28 -0.51 -0.10 0.00 0.08 0.00 0.00 57.88 57.07 1u2d h LEU 73 Cb 2.00 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 43.48 1u2d h LEU 73 CO 0.12 1.23 -0.31 0.11 -1.08 0.00 0.00 178.44 178.51 1u2d h LYS 74 N 0.57 0.34 -0.78 1.13 1.57 -1.29 -0.37 116.57 117.74 1u2d h LYS 74 Ca 0.03 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1u2d h LYS 74 Cb 1.04 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.30 1u2d h LYS 74 CO 0.10 0.62 0.37 -0.22 -0.57 0.00 0.00 179.45 179.76 1u2d h LYS 75 N 0.30 1.12 -0.00 3.15 3.64 -1.55 -2.42 116.57 120.81 1u2d h LYS 75 Ca 0.04 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1u2d h LYS 75 Cb 0.70 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1u2d h LYS 75 CO 0.05 0.87 -0.03 -0.85 -2.27 0.00 0.00 179.45 177.23 1u2d n GLU 76 N -4.37 1.04 0.00 1.90 0.28 -1.16 -4.91 120.64 113.42 1u2d n GLU 76 Ca 0.07 -0.28 0.00 0.00 -0.16 0.00 0.00 57.16 56.79 1u2d n GLU 76 Cb 0.14 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.51 1u2d n GLU 76 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1u2d n GLY 77 N 1.13 1.04 3.77 -1.84 0.00 -0.91 -5.09 105.19 103.28 1u2d n GLY 77 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1u2d n GLY 77 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u2d s VAL 78 N -2.00 2.95 -0.27 1.61 1.01 -0.17 -4.94 120.40 118.59 1u2d s VAL 78 Ca 0.00 0.95 -0.29 0.00 0.00 0.00 0.00 61.98 62.64 1u2d s VAL 78 Cb 0.00 -3.60 0.01 0.00 0.00 0.00 0.00 36.38 32.79 1u2d s VAL 78 CO 0.00 0.22 1.09 -1.61 0.00 0.00 0.00 175.10 174.80 1u2d s GLU 79 N -1.65 4.15 -0.05 2.72 2.02 -1.02 -3.99 118.70 120.89 1u2d s GLU 79 Ca 0.48 1.25 0.07 0.00 0.02 0.00 0.00 54.97 56.78 1u2d s GLU 79 Cb -0.37 -3.71 -0.01 0.00 0.10 0.00 0.00 34.13 30.14 1u2d s GLU 79 CO 0.49 -0.78 -0.25 0.08 0.02 0.00 0.00 175.26 174.82 1u2d s VAL 80 N 3.49 2.02 0.14 2.63 1.01 -1.26 -0.66 120.40 127.78 1u2d s VAL 80 Ca 0.46 -1.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.32 1u2d s VAL 80 Cb -0.14 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.52 1u2d s VAL 80 CO 0.12 0.57 0.19 -0.94 0.00 0.00 0.00 175.10 175.03 1u2d s SER 81 N -0.29 0.15 -0.11 3.32 1.04 -1.12 -4.94 113.70 111.76 1u2d s SER 81 Ca 0.00 -0.98 0.01 0.00 0.48 0.00 0.00 55.95 55.46 1u2d s SER 81 Cb -0.13 0.37 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 1u2d s SER 81 CO 0.02 -0.82 -0.14 -0.31 0.98 0.00 0.00 173.24 172.97 1u2d s TYR 82 N -3.99 2.76 -0.36 5.02 1.51 -0.08 -0.83 117.35 121.38 1u2d s TYR 82 Ca 0.19 -0.53 -0.09 0.00 -1.01 0.00 0.00 57.07 55.63 1u2d s TYR 82 Cb 0.05 -1.78 0.04 0.00 -0.11 0.00 0.00 41.96 40.16 1u2d s TYR 82 CO -0.00 -0.11 0.16 0.00 -1.11 0.00 0.00 175.55 174.49 1u2d s ALA 83 N 0.04 3.17 -0.32 3.71 0.00 -0.18 -0.74 121.76 127.44 1u2d s ALA 83 Ca -0.05 -1.77 -0.11 0.00 0.00 0.00 0.00 51.96 50.03 1u2d s ALA 83 Cb -0.15 -2.45 -0.01 0.00 0.00 0.00 0.00 23.12 20.52 1u2d s ALA 83 CO 0.04 -1.39 0.18 0.42 0.00 0.00 0.00 175.76 175.01 1u2d s ILE 84 N 1.47 4.77 0.33 0.00 -1.09 -0.13 -4.26 121.20 122.29 1u2d s ILE 84 Ca 0.00 -0.40 -0.28 0.00 -2.23 0.00 0.00 60.65 57.75 1u2d s ILE 84 Cb -0.20 -3.46 -0.09 0.00 -1.58 0.00 0.00 42.46 37.14 1u2d s ILE 84 CO 0.04 0.02 1.12 -2.28 -1.23 0.00 0.00 174.94 172.62 1u2d s HIS 85 N 1.64 3.38 0.33 3.97 2.46 -1.26 -2.92 115.29 122.89 1u2d s HIS 85 Ca 0.05 1.64 0.13 0.00 0.47 0.00 0.00 55.06 57.35 1u2d s HIS 85 Cb -0.17 -3.30 1.04 0.00 -0.13 0.00 0.00 32.58 30.01 1u2d s HIS 85 CO 0.07 -0.80 1.65 -1.35 -2.47 0.00 0.00 174.74 171.85 1u2d h PRO 86 N 3.30 0.28 -0.48 2.88 0.11 -1.98 -2.53 132.00 133.58 1u2d h PRO 86 Ca -0.48 -0.02 -0.32 0.00 0.11 0.00 0.00 66.00 65.29 1u2d h PRO 86 Cb 1.22 -0.06 -0.22 0.00 0.11 0.00 0.00 31.00 32.04 1u2d h PRO 86 CO 0.65 0.18 -0.39 1.33 -0.21 0.00 0.00 178.00 179.56 1u2d n VAL 87 N -5.10 2.56 -2.33 3.15 0.24 -1.26 -4.64 118.33 110.95 1u2d n VAL 87 Ca 0.30 -3.47 -0.34 0.00 -2.04 0.00 0.00 64.34 58.79 1u2d n VAL 87 Cb 0.95 -0.69 -0.01 0.00 -1.47 0.00 0.00 33.84 32.62 1u2d n VAL 87 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1u2d s ALA 88 N -3.44 2.75 0.00 2.33 0.00 -0.96 -4.80 121.76 117.65 1u2d s ALA 88 Ca 0.47 0.70 0.00 0.00 0.00 0.00 0.00 51.96 53.13 1u2d s ALA 88 Cb 0.41 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 20.22 1u2d s ALA 88 CO -0.00 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.54 1u2d n GLY 89 N -0.11 -0.28 0.46 0.00 0.00 -1.26 -4.32 105.19 99.68 1u2d n GLY 89 Ca 0.10 -1.06 0.06 0.00 0.00 0.00 0.00 46.02 45.13 1u2d n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u2d n ARG 90 N 0.00 0.99 -3.49 1.61 5.12 -1.26 -4.73 116.66 114.89 1u2d n ARG 90 Ca 0.00 -2.44 -0.09 0.00 -1.93 0.00 0.00 57.85 53.39 1u2d n ARG 90 Cb 0.00 -1.18 -0.02 0.00 -1.16 0.00 0.00 32.46 30.10 1u2d n ARG 90 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1u2d s MET 91 N -2.14 0.89 0.11 5.56 0.23 -1.26 -5.06 119.30 117.63 1u2d s MET 91 Ca 0.28 -0.33 -0.31 0.00 -1.03 0.00 0.00 55.69 54.30 1u2d s MET 91 Cb 0.27 0.41 -0.10 0.00 -1.53 0.00 0.00 34.83 33.88 1u2d s MET 91 CO -0.03 -0.39 1.76 -2.14 -2.03 0.00 0.00 175.02 172.20 1u2d s PRO 92 N -3.21 4.16 -0.70 3.16 0.02 -1.26 -2.54 135.00 134.62 1u2d s PRO 92 Ca 0.04 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.57 1u2d s PRO 92 Cb -0.01 -3.56 0.00 0.00 0.02 0.00 0.00 34.50 30.95 1u2d s PRO 92 CO -0.09 -0.80 0.00 0.41 -0.33 0.00 0.00 177.00 176.19 1u2d n GLY 93 N 4.13 0.56 0.08 0.52 0.00 -1.26 -4.95 105.19 104.28 1u2d n GLY 93 Ca 0.17 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.43 1u2d n GLY 93 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1u2d h HIS 94 N 0.00 -0.01 -0.46 1.61 2.76 -1.70 -2.75 115.15 114.60 1u2d h HIS 94 Ca -0.16 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.01 1u2d h HIS 94 Cb 0.76 0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.72 1u2d h HIS 94 CO 0.20 -0.02 0.24 0.52 -1.30 0.00 0.00 177.93 177.57 1u2d h MET 95 N 0.04 0.65 -0.08 5.26 2.86 -1.87 -3.24 114.93 118.55 1u2d h MET 95 Ca 0.06 -0.08 0.03 0.00 -2.06 0.00 0.00 59.70 57.64 1u2d h MET 95 Cb 0.07 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 1u2d h MET 95 CO -0.10 0.53 -0.11 -0.91 1.06 0.00 0.00 176.91 177.38 1u2d h ASN 96 N 0.60 -0.34 -0.44 1.22 4.21 -1.91 -0.95 115.58 117.97 1u2d h ASN 96 Ca 0.16 0.06 -0.04 0.00 1.21 0.00 0.00 56.30 57.69 1u2d h ASN 96 Cb 0.08 0.16 -0.02 0.00 -1.12 0.00 0.00 38.32 37.42 1u2d h ASN 96 CO -0.02 -0.15 0.15 1.62 -1.29 0.00 0.00 177.43 177.74 1u2d h VAL 97 N -0.15 1.20 0.06 2.81 3.04 -1.56 0.16 116.25 121.81 1u2d h VAL 97 Ca 0.07 -0.68 -0.27 0.00 -1.01 0.00 0.00 66.70 64.81 1u2d h VAL 97 Cb 0.25 0.66 0.02 0.00 -2.01 0.00 0.00 31.29 30.20 1u2d h VAL 97 CO -0.17 0.26 -1.11 -0.07 -1.01 0.00 0.00 177.57 175.46 1u2d h LEU 98 N 0.72 0.76 -0.76 3.16 3.38 -1.52 -1.08 115.31 119.97 1u2d h LEU 98 Ca 0.17 -0.66 -0.08 0.00 0.09 0.00 0.00 57.88 57.40 1u2d h LEU 98 Cb 0.21 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1u2d h LEU 98 CO -0.01 1.47 0.10 -0.07 0.09 0.00 0.00 178.44 180.02 1u2d h LEU 99 N 0.28 0.99 -1.21 1.67 3.38 -1.02 -2.45 115.31 116.96 1u2d h LEU 99 Ca -0.14 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 1u2d h LEU 99 Cb 1.77 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 42.23 1u2d h LEU 99 CO 0.21 0.99 0.28 0.00 0.09 0.00 0.00 178.44 180.01 1u2d h ALA 100 N 1.12 1.39 -0.80 1.53 0.00 -0.57 -2.00 119.26 119.92 1u2d h ALA 100 Ca 0.19 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1u2d h ALA 100 Cb 0.43 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1u2d h ALA 100 CO 0.01 0.48 0.34 1.49 0.00 0.00 0.00 179.25 181.58 1u2d h GLU 101 N 0.83 1.19 -0.04 0.00 4.81 -0.96 -2.81 114.58 117.60 1u2d h GLU 101 Ca 0.21 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1u2d h GLU 101 Cb 0.09 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.27 1u2d h GLU 101 CO -0.03 0.95 0.00 0.00 -0.73 0.00 0.00 179.01 179.20 1u2d n ALA 102 N -2.42 2.56 -3.25 2.92 0.00 -0.81 -4.92 120.51 114.59 1u2d n ALA 102 Ca 0.07 -0.17 -0.22 0.00 0.00 0.00 0.00 53.44 53.12 1u2d n ALA 102 Cb 0.17 -1.19 0.05 0.00 0.00 0.00 0.00 19.45 18.49 1u2d n ALA 102 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1u2d n ASN 103 N -0.50 -6.09 -4.69 0.00 3.02 -0.88 -4.92 115.26 101.21 1u2d n ASN 103 Ca 0.11 -0.39 -0.42 0.00 -0.03 0.00 0.00 54.58 53.85 1u2d n ASN 103 Cb 0.10 -4.82 -0.03 0.00 -0.61 0.00 0.00 39.78 34.43 1u2d n ASN 103 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1u2d s VAL 104 N -3.23 4.81 0.50 2.41 -7.23 -0.87 -5.00 120.40 111.78 1u2d s VAL 104 Ca 0.42 2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 62.38 1u2d s VAL 104 Cb -0.19 -4.30 -0.07 0.00 0.56 0.00 0.00 36.38 32.39 1u2d s VAL 104 CO 0.52 0.03 1.13 -2.16 -0.31 0.00 0.00 175.10 174.31 1u2d s PRO 105 N 1.88 3.57 0.43 4.82 0.04 -1.26 -4.65 135.00 139.83 1u2d s PRO 105 Ca 0.48 1.65 0.12 0.00 0.04 0.00 0.00 61.00 63.30 1u2d s PRO 105 Cb -0.18 -2.18 1.01 0.00 0.04 0.00 0.00 34.50 33.18 1u2d s PRO 105 CO 0.19 -0.68 2.01 1.88 0.04 0.00 0.00 177.00 180.44 1u2d h TYR 106 N 1.60 0.42 0.00 0.56 0.05 -1.94 -2.36 116.97 115.29 1u2d h TYR 106 Ca -0.50 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.28 1u2d h TYR 106 Cb 1.25 -0.14 -0.00 0.00 1.01 0.00 0.00 36.73 38.85 1u2d h TYR 106 CO 0.53 0.22 -0.07 0.38 -1.05 0.00 0.00 178.16 178.17 1u2d h ASP 107 N 0.42 0.00 1.23 3.88 3.04 -2.04 -2.01 116.42 120.94 1u2d h ASP 107 Ca 0.23 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.02 1u2d h ASP 107 Cb 0.37 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.66 1u2d h ASP 107 CO -0.06 0.07 -0.43 -0.33 -2.04 0.00 0.00 179.24 176.45 1u2d h GLU 108 N 0.00 0.00 -5.61 4.15 5.08 -1.79 -3.46 114.58 112.96 1u2d h GLU 108 Ca -0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.77 1u2d h GLU 108 Cb 0.19 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.35 1u2d h GLU 108 CO 0.01 0.00 -0.25 0.08 -1.00 0.00 0.00 179.01 177.85 1u2d s VAL 109 N -3.19 5.25 0.01 3.13 1.01 -0.76 -0.91 120.40 124.95 1u2d s VAL 109 Ca 0.06 0.72 0.03 0.00 0.00 0.00 0.00 61.98 62.79 1u2d s VAL 109 Cb 0.11 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 1u2d s VAL 109 CO 0.69 0.37 -0.09 -0.36 0.00 0.00 0.00 175.10 175.71 1u2d s PHE 110 N 0.48 0.79 0.56 5.22 0.08 0.08 -4.94 117.98 120.24 1u2d s PHE 110 Ca 0.20 -0.23 -0.07 0.00 0.12 0.00 0.00 56.93 56.95 1u2d s PHE 110 Cb -0.14 -0.49 -0.02 0.00 -0.57 0.00 0.00 43.02 41.80 1u2d s PHE 110 CO 0.07 -0.01 0.89 -1.83 -0.10 0.00 0.00 175.22 174.23 1u2d s GLU 111 N -0.58 3.32 0.13 0.44 -1.05 -1.26 -0.95 118.70 118.74 1u2d s GLU 111 Ca 0.01 0.27 -0.27 0.00 -0.15 0.00 0.00 54.97 54.82 1u2d s GLU 111 Cb -0.05 -2.26 -0.04 0.00 -0.44 0.00 0.00 34.13 31.34 1u2d s GLU 111 CO 0.00 -0.48 1.60 1.25 0.95 0.00 0.00 175.26 178.58 1u2d h LEU 112 N -0.06 -1.12 -2.18 1.83 6.46 -1.92 -1.90 115.31 116.43 1u2d h LEU 112 Ca -0.46 0.15 -0.01 0.00 -0.12 0.00 0.00 57.88 57.44 1u2d h LEU 112 Cb 1.22 0.46 -0.00 0.00 -0.73 0.00 0.00 40.66 41.61 1u2d h LEU 112 CO 0.62 -0.40 -0.06 -0.33 -0.62 0.00 0.00 178.44 177.65 1u2d h GLU 113 N -0.46 0.00 -0.01 1.25 5.08 -1.94 -2.13 114.58 116.37 1u2d h GLU 113 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1u2d h GLU 113 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1u2d h GLU 113 CO -0.35 0.06 -0.41 -1.91 -1.00 0.00 0.00 179.01 175.40 1u2d n GLU 114 N -3.75 0.93 0.00 2.33 2.13 -0.75 -4.46 120.64 117.06 1u2d n GLU 114 Ca -0.02 -0.68 0.00 0.00 0.66 0.00 0.00 57.16 57.12 1u2d n GLU 114 Cb 0.16 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.39 1u2d n GLU 114 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1u2d n ILE 115 N -0.44 0.00 0.27 6.31 3.06 -0.86 -4.84 119.36 122.86 1u2d n ILE 115 Ca 0.10 -0.29 0.14 0.00 -2.50 0.00 0.00 62.75 60.20 1u2d n ILE 115 Cb 0.40 1.16 0.76 0.00 0.54 0.00 0.00 39.64 42.50 1u2d n ILE 115 CO 0.00 0.00 0.00 0.78 -2.50 0.00 0.00 176.55 174.83 1u2d h ASN 116 N 0.00 0.00 0.88 9.51 2.35 -1.63 -2.37 115.58 124.33 1u2d h ASN 116 Ca 0.00 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.62 1u2d h ASN 116 Cb 0.08 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1u2d h ASN 116 CO 0.00 0.10 -0.63 0.28 -1.65 0.00 0.00 177.43 175.53 1u2d h SER 117 N 0.00 0.00 0.55 5.81 0.02 -1.88 -3.30 113.55 114.76 1u2d h SER 117 Ca -0.00 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1u2d h SER 117 Cb 0.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1u2d h SER 117 CO 0.01 0.63 -0.17 0.28 -1.14 0.00 0.00 176.83 176.45 1u2d h SER 118 N 0.00 0.00 -0.81 3.07 0.02 -1.78 -3.03 113.55 111.03 1u2d h SER 118 Ca -0.01 0.00 0.10 0.00 -0.84 0.00 0.00 61.79 61.05 1u2d h SER 118 Cb 1.24 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.73 1u2d h SER 118 CO 0.08 0.17 0.53 -0.26 -1.14 0.00 0.00 176.83 176.21 1u2d h PHE 119 N 0.00 0.78 -0.48 3.45 -1.00 -1.69 -0.75 116.94 117.24 1u2d h PHE 119 Ca -0.00 0.02 0.08 0.00 2.81 0.00 0.00 57.97 60.88 1u2d h PHE 119 Cb 0.49 -0.25 -0.06 0.00 3.61 0.00 0.00 35.95 39.74 1u2d h PHE 119 CO 0.00 0.35 0.11 1.96 -1.61 0.00 0.00 178.31 179.12 1u2d h GLN 120 N 0.71 0.24 -1.25 1.51 4.20 -1.64 -2.69 115.11 116.19 1u2d h GLN 120 Ca 0.38 -0.01 -0.48 0.00 0.06 0.00 0.00 58.65 58.59 1u2d h GLN 120 Cb 0.49 -0.05 -0.21 0.00 0.30 0.00 0.00 27.48 28.01 1u2d h GLN 120 CO -0.15 0.16 0.62 0.25 -0.67 0.00 0.00 178.83 179.04 1u2d n THR 121 N -5.09 3.13 -3.95 -0.54 -2.24 -0.30 -4.82 114.28 100.47 1u2d n THR 121 Ca 0.05 -2.18 -0.21 0.00 -2.27 0.00 0.00 64.05 59.45 1u2d n THR 121 Cb 0.22 -1.20 -0.17 0.00 -2.10 0.00 0.00 70.33 67.09 1u2d n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1u2d s ALA 122 N -2.73 0.61 0.26 6.98 0.00 -1.03 -4.83 121.76 121.03 1u2d s ALA 122 Ca 0.46 -0.04 0.03 0.00 0.00 0.00 0.00 51.96 52.42 1u2d s ALA 122 Cb 0.37 -0.54 0.34 0.00 0.00 0.00 0.00 23.12 23.28 1u2d s ALA 122 CO 0.00 -0.22 1.64 -0.44 0.00 0.00 0.00 175.76 176.74 1u2d h ASP 123 N 7.69 0.39 -3.55 0.00 5.19 -1.67 -2.35 116.42 122.12 1u2d h ASP 123 Ca -0.31 -0.17 -0.25 0.00 -0.62 0.00 0.00 57.03 55.68 1u2d h ASP 123 Cb 1.14 -0.11 -0.31 0.00 0.18 0.00 0.00 39.33 40.23 1u2d h ASP 123 CO 0.38 0.77 -0.64 0.68 -3.12 0.00 0.00 179.24 177.31 1u2d s VAL 124 N -4.14 -0.04 -0.57 -1.35 -7.23 -1.08 -1.67 120.40 104.31 1u2d s VAL 124 Ca -0.06 0.14 -0.06 0.00 -1.81 0.00 0.00 61.98 60.19 1u2d s VAL 124 Cb 0.13 -0.16 0.15 0.00 0.56 0.00 0.00 36.38 37.05 1u2d s VAL 124 CO 0.79 0.06 0.41 0.00 -0.31 0.00 0.00 175.10 176.06 1u2d s ALA 125 N 0.83 3.52 -0.97 1.32 0.00 -0.94 -1.47 121.76 124.05 1u2d s ALA 125 Ca -0.06 -2.91 -0.24 0.00 0.00 0.00 0.00 51.96 48.75 1u2d s ALA 125 Cb -0.09 -2.79 0.02 0.00 0.00 0.00 0.00 23.12 20.26 1u2d s ALA 125 CO -0.03 -2.01 1.62 0.12 0.00 0.00 0.00 175.76 175.45 1u2d s PHE 126 N 0.64 2.27 -0.77 0.00 5.36 -0.67 -2.39 117.98 122.42 1u2d s PHE 126 Ca 0.12 -0.30 -0.22 0.00 -0.96 0.00 0.00 56.93 55.56 1u2d s PHE 126 Cb -0.21 -4.47 0.08 0.00 -0.34 0.00 0.00 43.02 38.08 1u2d s PHE 126 CO -0.03 -1.88 1.09 0.08 -1.46 0.00 0.00 175.22 173.01 1u2d s VAL 127 N 6.77 4.31 -0.45 3.12 1.01 0.28 -0.81 120.40 134.63 1u2d s VAL 127 Ca 0.54 -0.60 -0.17 0.00 0.00 0.00 0.00 61.98 61.75 1u2d s VAL 127 Cb -0.03 -4.77 0.04 0.00 0.00 0.00 0.00 36.38 31.62 1u2d s VAL 127 CO -0.06 -1.57 0.44 -0.51 0.00 0.00 0.00 175.10 173.40 1u2d s ILE 128 N 4.02 5.12 -1.38 2.22 2.07 -0.40 -1.60 121.20 131.24 1u2d s ILE 128 Ca 0.28 -0.61 0.00 0.00 -1.41 0.00 0.00 60.65 58.91 1u2d s ILE 128 Cb -0.11 -4.09 0.00 0.00 0.13 0.00 0.00 42.46 38.39 1u2d s ILE 128 CO 0.04 -0.51 0.00 0.61 -1.91 0.00 0.00 174.94 173.17 1u2d n GLY 129 N 5.15 0.26 3.25 1.50 0.00 -0.84 -1.78 105.19 112.73 1u2d n GLY 129 Ca -0.09 -0.27 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 1u2d n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u2d s ALA 130 N -2.70 1.97 0.00 4.61 0.00 -1.26 -0.78 121.76 123.59 1u2d s ALA 130 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 50.99 1u2d s ALA 130 Cb 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 23.12 22.55 1u2d s ALA 130 CO 0.00 0.42 0.00 -1.71 0.00 0.00 0.00 175.76 174.47 1u2d n ASN 131 N 2.79 0.00 -0.32 0.00 2.85 -1.26 -4.83 115.26 114.49 1u2d n ASN 131 Ca -0.17 0.00 0.08 0.00 -0.11 0.00 0.00 54.58 54.38 1u2d n ASN 131 Cb 0.52 0.00 0.28 0.00 1.24 0.00 0.00 39.78 41.82 1u2d n ASN 131 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 1u2d h ASP 132 N 0.00 0.84 -0.28 1.20 3.32 -1.96 -1.51 116.42 118.03 1u2d h ASP 132 Ca 0.00 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.16 1u2d h ASP 132 Cb 0.00 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1u2d h ASP 132 CO 0.00 0.47 0.21 0.58 -1.72 0.00 0.00 179.24 178.78 1u2d h VAL 133 N 0.92 0.80 0.00 -1.35 2.07 -1.94 -2.71 116.25 114.04 1u2d h VAL 133 Ca 0.45 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.87 1u2d h VAL 133 Cb 0.46 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1u2d h VAL 133 CO -0.21 0.00 -2.00 0.35 0.02 0.00 0.00 177.57 175.73 1u2d n THR 134 N -4.36 0.46 -1.63 2.57 -2.24 -0.62 -1.95 114.28 106.52 1u2d n THR 134 Ca 0.04 -0.60 -0.54 0.00 -2.27 0.00 0.00 64.05 60.68 1u2d n THR 134 Cb 0.37 -0.18 -0.07 0.00 -2.10 0.00 0.00 70.33 68.35 1u2d n THR 134 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1u2d n ASN 135 N -2.45 2.58 0.00 3.42 2.85 -0.91 -4.73 115.26 116.02 1u2d n ASN 135 Ca -0.11 0.88 0.14 0.00 -0.11 0.00 0.00 54.58 55.38 1u2d n ASN 135 Cb 0.73 -1.22 0.85 0.00 1.24 0.00 0.00 39.78 41.37 1u2d n ASN 135 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1u2d n PRO 136 N 6.45 0.87 0.06 1.20 -0.04 -1.26 -3.42 135.00 138.87 1u2d n PRO 136 Ca 0.30 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.82 1u2d n PRO 136 Cb 0.19 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.46 1u2d n PRO 136 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1u2d n ALA 137 N -1.01 1.31 0.38 0.55 0.00 -1.26 -1.65 120.51 118.82 1u2d n ALA 137 Ca 0.21 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.81 1u2d n ALA 137 Cb 0.10 -1.21 0.46 0.00 0.00 0.00 0.00 19.45 18.81 1u2d n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u2d n ALA 138 N -1.62 1.57 -1.10 0.00 0.00 -1.22 -2.97 120.51 115.18 1u2d n ALA 138 Ca 0.01 0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.53 1u2d n ALA 138 Cb 0.10 -1.34 0.01 0.00 0.00 0.00 0.00 19.45 18.21 1u2d n ALA 138 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1u2d n LYS 139 N -2.10 0.51 -0.98 0.00 2.85 -0.66 -2.28 118.16 115.51 1u2d n LYS 139 Ca 0.02 -0.89 0.02 0.00 -1.05 0.00 0.00 58.31 56.41 1u2d n LYS 139 Cb 0.19 -0.63 0.01 0.00 -0.65 0.00 0.00 35.03 33.95 1u2d n LYS 139 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1u2d n THR 140 N -0.16 0.02 -2.78 0.58 -1.04 -1.09 -4.98 114.28 104.83 1u2d n THR 140 Ca 0.01 -0.51 -0.03 0.00 -2.04 0.00 0.00 64.05 61.48 1u2d n THR 140 Cb 0.52 0.73 0.01 0.00 -1.82 0.00 0.00 70.33 69.78 1u2d n THR 140 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1u2d s ASP 141 N -1.50 -1.10 0.51 8.00 3.68 -1.16 -4.93 116.67 120.17 1u2d s ASP 141 Ca 0.17 -1.22 0.31 0.00 2.13 0.00 0.00 52.55 53.94 1u2d s ASP 141 Cb 0.19 1.44 1.43 0.00 -1.45 0.00 0.00 42.92 44.53 1u2d s ASP 141 CO -0.08 -0.05 1.84 -0.65 0.13 0.00 0.00 175.17 176.36 1u2d h PRO 142 N 4.98 0.08 -0.02 4.34 0.11 -1.94 -1.51 132.00 138.03 1u2d h PRO 142 Ca 0.04 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.97 1u2d h PRO 142 Cb 1.14 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1u2d h PRO 142 CO -0.02 0.05 -0.76 0.66 -0.21 0.00 0.00 178.00 177.72 1u2d h SER 143 N 0.08 0.24 -4.02 -2.05 4.64 -1.95 -3.46 113.55 107.02 1u2d h SER 143 Ca 0.51 -0.17 -0.55 0.00 -0.47 0.00 0.00 61.79 61.11 1u2d h SER 143 Cb 1.86 -0.07 0.13 0.00 -0.31 0.00 0.00 62.40 64.01 1u2d h SER 143 CO -0.06 0.91 0.65 -0.55 -0.87 0.00 0.00 176.83 176.91 1u2d s SER 144 N -6.90 5.53 0.39 4.97 0.15 -0.57 -4.93 113.70 112.34 1u2d s SER 144 Ca -0.03 2.83 0.21 0.00 0.70 0.00 0.00 55.95 59.65 1u2d s SER 144 Cb 0.11 -2.64 0.69 0.00 -1.71 0.00 0.00 66.02 62.47 1u2d s SER 144 CO 0.81 -1.40 1.73 1.55 1.20 0.00 0.00 173.24 177.14 1u2d h PRO 145 N 1.84 0.00 0.00 5.44 0.13 -1.89 -2.98 132.00 134.53 1u2d h PRO 145 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1u2d h PRO 145 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1u2d h PRO 145 CO 0.59 0.32 0.00 1.51 -0.23 0.00 0.00 178.00 180.19 1u2d n ILE 146 N -3.42 0.75 -1.55 -3.56 3.06 -1.26 -4.87 119.36 108.51 1u2d n ILE 146 Ca 0.00 0.11 -0.42 0.00 -2.50 0.00 0.00 62.75 59.94 1u2d n ILE 146 Cb 0.51 -0.98 0.00 0.00 0.54 0.00 0.00 39.64 39.71 1u2d n ILE 146 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1u2d n TYR 147 N -2.09 0.64 0.00 9.51 9.36 -1.13 -3.00 117.16 130.45 1u2d n TYR 147 Ca 0.03 0.62 0.00 0.00 3.32 0.00 0.00 57.90 61.87 1u2d n TYR 147 Cb 0.27 -2.15 0.00 0.00 -0.63 0.00 0.00 39.34 36.83 1u2d n TYR 147 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1u2d n GLY 148 N 1.40 2.79 3.73 2.98 0.00 -0.96 -5.01 105.19 110.11 1u2d n GLY 148 Ca 0.10 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 1u2d n GLY 148 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1u2d s MET 149 N 0.00 4.24 0.19 1.61 -2.45 -1.16 -4.98 119.30 116.75 1u2d s MET 149 Ca 0.00 2.32 -0.30 0.00 -1.25 0.00 0.00 55.69 56.46 1u2d s MET 149 Cb 0.00 -3.15 -0.08 0.00 1.25 0.00 0.00 34.83 32.85 1u2d s MET 149 CO 0.00 -0.54 1.15 -1.25 1.05 0.00 0.00 175.02 175.43 1u2d s PRO 150 N 0.66 4.55 0.39 4.11 0.04 -1.26 -4.84 135.00 138.65 1u2d s PRO 150 Ca 0.66 1.80 0.08 0.00 0.04 0.00 0.00 61.00 63.58 1u2d s PRO 150 Cb -0.43 -3.25 -0.08 0.00 0.04 0.00 0.00 34.50 30.79 1u2d s PRO 150 CO 0.35 0.01 -0.02 0.96 0.04 0.00 0.00 177.00 178.34 1u2d s ILE 151 N -0.25 2.06 -0.17 0.56 -4.36 -1.26 -4.99 121.20 112.79 1u2d s ILE 151 Ca 0.50 -2.06 -0.26 0.00 -0.26 0.00 0.00 60.65 58.57 1u2d s ILE 151 Cb -0.31 -2.90 -0.01 0.00 1.25 0.00 0.00 42.46 40.49 1u2d s ILE 151 CO 0.36 -0.06 0.87 -0.76 0.24 0.00 0.00 174.94 175.60 1u2d s LEU 152 N -3.68 4.18 -1.33 0.37 1.43 -0.82 -4.96 118.68 113.86 1u2d s LEU 152 Ca 0.34 1.23 -0.16 0.00 -1.03 0.00 0.00 54.13 54.52 1u2d s LEU 152 Cb 0.08 -3.30 0.00 0.00 0.03 0.00 0.00 46.19 43.00 1u2d s LEU 152 CO 0.18 -0.43 2.17 0.47 0.23 0.00 0.00 176.35 178.96 1u2d n ASP 153 N 5.31 3.64 0.23 2.29 8.00 -1.26 -4.60 116.55 130.16 1u2d n ASP 153 Ca 0.06 -2.81 0.10 0.00 0.71 0.00 0.00 54.79 52.85 1u2d n ASP 153 Cb 0.48 -1.56 0.51 0.00 -0.02 0.00 0.00 41.12 40.53 1u2d n ASP 153 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1u2d h VAL 154 N 4.12 0.59 0.00 2.53 -1.51 -1.93 -2.88 116.25 117.17 1u2d h VAL 154 Ca 0.54 -1.03 -0.04 0.00 -1.23 0.00 0.00 66.70 64.94 1u2d h VAL 154 Cb 0.65 1.69 -0.01 0.00 -2.13 0.00 0.00 31.29 31.49 1u2d h VAL 154 CO 1.89 0.21 -0.19 1.05 -1.23 0.00 0.00 177.57 179.30 1u2d h GLU 155 N 0.00 0.00 0.00 5.19 4.11 -1.92 -2.70 114.58 119.26 1u2d h GLU 155 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1u2d h GLU 155 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1u2d h GLU 155 CO 0.03 0.19 0.00 1.63 0.07 0.00 0.00 179.01 180.93 1u2d n LYS 156 N -3.88 0.14 -2.76 1.06 5.02 -1.09 -4.73 118.16 111.91 1u2d n LYS 156 Ca -0.02 0.39 -0.31 0.00 -2.02 0.00 0.00 58.31 56.35 1u2d n LYS 156 Cb 0.29 -1.77 -0.04 0.00 -0.02 0.00 0.00 35.03 33.49 1u2d n LYS 156 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1u2d s ALA 157 N -3.24 3.23 0.13 7.82 0.00 -1.02 -3.89 121.76 124.79 1u2d s ALA 157 Ca 0.04 0.01 -0.33 0.00 0.00 0.00 0.00 51.96 51.68 1u2d s ALA 157 Cb 0.09 -2.88 -0.11 0.00 0.00 0.00 0.00 23.12 20.22 1u2d s ALA 157 CO 0.33 -0.01 1.55 0.78 0.00 0.00 0.00 175.76 178.42 1u2d h GLY 158 N 1.38 -1.01 -3.03 0.00 0.00 -1.35 -3.44 103.07 95.62 1u2d h GLY 158 Ca -0.47 0.71 -0.19 0.00 0.00 0.00 0.00 47.33 47.38 1u2d h GLY 158 CO 0.63 -0.13 -0.68 -1.08 0.00 0.00 0.00 176.54 175.29 1u2d s THR 159 N -5.66 0.42 -0.13 4.70 -1.32 -0.67 -4.82 115.64 108.16 1u2d s THR 159 Ca -0.14 -1.89 -0.01 0.00 -1.21 0.00 0.00 61.69 58.44 1u2d s THR 159 Cb 0.08 -1.75 0.03 0.00 -1.51 0.00 0.00 72.50 69.35 1u2d s THR 159 CO 0.61 -0.79 -0.06 -0.69 -2.21 0.00 0.00 174.62 171.48 1u2d s VAL 160 N -3.81 1.00 0.10 5.08 1.01 -0.23 -2.21 120.40 121.35 1u2d s VAL 160 Ca 0.14 -0.36 -0.17 0.00 0.00 0.00 0.00 61.98 61.59 1u2d s VAL 160 Cb 0.07 -1.08 -0.07 0.00 0.00 0.00 0.00 36.38 35.30 1u2d s VAL 160 CO -0.04 0.29 0.55 -0.76 0.00 0.00 0.00 175.10 175.14 1u2d s LEU 161 N 1.71 4.45 -0.37 3.92 2.01 -1.00 -1.05 118.68 128.35 1u2d s LEU 161 Ca 0.04 1.17 0.00 0.00 0.01 0.00 0.00 54.13 55.35 1u2d s LEU 161 Cb -0.13 -3.03 0.13 0.00 0.01 0.00 0.00 46.19 43.17 1u2d s LEU 161 CO -0.08 0.21 0.20 -0.36 1.01 0.00 0.00 176.35 177.33 1u2d s PHE 162 N -1.25 1.18 -0.40 0.29 0.40 -0.61 -0.56 117.98 117.04 1u2d s PHE 162 Ca 0.32 -1.82 -0.23 0.00 -0.60 0.00 0.00 56.93 54.60 1u2d s PHE 162 Cb -0.17 -1.31 0.02 0.00 0.51 0.00 0.00 43.02 42.07 1u2d s PHE 162 CO 0.19 -0.82 0.80 0.42 0.70 0.00 0.00 175.22 176.51 1u2d s ILE 163 N 1.00 4.68 -0.22 0.64 1.01 -0.63 -1.72 121.20 125.96 1u2d s ILE 163 Ca 0.16 0.74 -0.25 0.00 0.00 0.00 0.00 60.65 61.29 1u2d s ILE 163 Cb -0.22 -4.27 0.07 0.00 0.01 0.00 0.00 42.46 38.05 1u2d s ILE 163 CO -0.05 -0.56 0.69 -1.59 0.00 0.00 0.00 174.94 173.42 1u2d s LYS 164 N 3.23 0.86 0.35 2.79 -2.85 -1.13 -1.98 119.74 121.01 1u2d s LYS 164 Ca 0.32 0.82 0.12 0.00 -1.00 0.00 0.00 55.97 56.22 1u2d s LYS 164 Cb -0.12 0.41 0.91 0.00 -2.06 0.00 0.00 37.83 36.97 1u2d s LYS 164 CO 0.20 -0.14 1.79 0.00 0.10 0.00 0.00 175.35 177.30 1u2d h ARG 165 N 4.65 0.57 0.00 1.78 3.08 -1.69 -2.96 114.38 119.80 1u2d h ARG 165 Ca -0.29 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.73 1u2d h ARG 165 Cb 1.16 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.08 1u2d h ARG 165 CO 0.13 0.38 0.00 -1.13 -1.07 0.00 0.00 179.97 178.28 1u2d n SER 166 N -4.68 0.00 -1.46 7.04 3.41 -1.26 -3.75 113.62 112.92 1u2d n SER 166 Ca 0.23 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.94 1u2d n SER 166 Cb 0.68 0.00 0.34 0.00 -0.26 0.00 0.00 64.21 64.97 1u2d n SER 166 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1u2d n MET 167 N 0.00 3.47 -2.03 4.33 2.81 -1.26 -4.99 117.12 119.44 1u2d n MET 167 Ca 0.00 -2.80 -0.36 0.00 -1.81 0.00 0.00 57.70 52.74 1u2d n MET 167 Cb 0.00 -1.79 0.03 0.00 -0.71 0.00 0.00 33.22 30.75 1u2d n MET 167 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1u2d s ALA 168 N -1.67 2.56 0.95 3.04 0.00 -1.26 -5.02 121.76 120.36 1u2d s ALA 168 Ca 0.49 0.97 -0.14 0.00 0.00 0.00 0.00 51.96 53.28 1u2d s ALA 168 Cb 0.30 -3.44 0.16 0.00 0.00 0.00 0.00 23.12 20.15 1u2d s ALA 168 CO 0.25 -1.12 1.16 -1.54 0.00 0.00 0.00 175.76 174.51 1u2d s SER 169 N -1.65 3.15 0.00 0.00 1.04 -1.26 -5.07 113.70 109.91 1u2d s SER 169 Ca 0.77 0.83 0.00 0.00 0.48 0.00 0.00 55.95 58.02 1u2d s SER 169 Cb -0.29 -1.29 0.00 0.00 0.10 0.00 0.00 66.02 64.54 1u2d s SER 169 CO 0.33 -2.76 0.00 0.61 0.98 0.00 0.00 173.24 172.39 1u2d n GLY 170 N -2.27 0.93 0.13 7.32 0.00 -1.26 -4.84 105.19 105.20 1u2d n GLY 170 Ca 0.08 -1.44 -0.12 0.00 0.00 0.00 0.00 46.02 44.55 1u2d n GLY 170 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1u2d h TYR 171 N 0.00 0.39 0.00 1.61 3.20 -1.98 -3.23 116.97 116.96 1u2d h TYR 171 Ca 0.00 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.80 1u2d h TYR 171 Cb 0.00 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.17 1u2d h TYR 171 CO 0.00 0.56 0.00 0.00 -1.64 0.00 0.00 178.16 177.08 1u2d n ALA 172 N -2.33 1.94 -2.94 1.82 0.00 -1.26 -4.92 120.51 112.82 1u2d n ALA 172 Ca -0.04 -0.07 -0.11 0.00 0.00 0.00 0.00 53.44 53.21 1u2d n ALA 172 Cb 0.24 -1.33 0.06 0.00 0.00 0.00 0.00 19.45 18.42 1u2d n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u2d n GLY 173 N 0.56 -0.05 3.07 0.00 0.00 -1.22 -4.99 105.19 102.55 1u2d n GLY 173 Ca 0.05 -0.11 -0.17 0.00 0.00 0.00 0.00 46.02 45.80 1u2d n GLY 173 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1u2d s VAL 174 N -3.22 0.76 0.40 1.61 -7.23 -1.26 -5.00 120.40 106.46 1u2d s VAL 174 Ca 0.05 -0.83 -0.26 0.00 -1.81 0.00 0.00 61.98 59.13 1u2d s VAL 174 Cb -0.02 -0.72 -0.09 0.00 0.56 0.00 0.00 36.38 36.11 1u2d s VAL 174 CO 0.46 -0.09 1.28 -1.61 -0.31 0.00 0.00 175.10 174.83 1u2d s GLU 175 N -1.03 3.98 -0.14 4.82 0.41 -1.26 -4.47 118.70 121.01 1u2d s GLU 175 Ca -0.02 2.10 -0.16 0.00 -0.41 0.00 0.00 54.97 56.48 1u2d s GLU 175 Cb -0.07 -2.74 -0.04 0.00 -1.78 0.00 0.00 34.13 29.49 1u2d s GLU 175 CO 0.01 -0.46 0.39 1.21 -0.49 0.00 0.00 175.26 175.91 1u2d s ASN 176 N -0.81 6.56 0.21 -0.19 3.84 -1.26 -4.96 114.94 118.33 1u2d s ASN 176 Ca 0.57 0.66 -0.07 0.00 0.21 0.00 0.00 52.86 54.23 1u2d s ASN 176 Cb -0.37 -2.23 0.17 0.00 -0.55 0.00 0.00 41.25 38.27 1u2d s ASN 176 CO 0.47 0.05 1.73 -0.33 -2.79 0.00 0.00 177.10 176.22 1u2d h GLU 177 N 6.72 1.08 -0.51 0.43 5.08 -1.95 -2.89 114.58 122.53 1u2d h GLU 177 Ca -0.41 -0.26 0.04 0.00 -1.00 0.00 0.00 59.36 57.72 1u2d h GLU 177 Cb 1.17 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 1u2d h GLU 177 CO 0.76 0.96 0.34 -0.07 -1.00 0.00 0.00 179.01 180.00 1u2d h LEU 178 N 1.02 0.49 -0.90 1.33 3.38 -1.95 -3.16 115.31 115.52 1u2d h LEU 178 Ca 0.21 -0.01 0.25 0.00 0.09 0.00 0.00 57.88 58.43 1u2d h LEU 178 Cb 0.39 -0.11 -0.15 0.00 0.09 0.00 0.00 40.66 40.87 1u2d h LEU 178 CO 0.01 0.33 0.23 -0.26 0.09 0.00 0.00 178.44 178.84 1u2d h PHE 179 N 0.56 0.33 -3.65 1.13 0.04 -1.93 -3.26 116.94 110.17 1u2d h PHE 179 Ca 0.21 0.05 -0.66 0.00 2.80 0.00 0.00 57.97 60.37 1u2d h PHE 179 Cb 0.13 0.00 -0.40 0.00 2.20 0.00 0.00 35.95 37.88 1u2d h PHE 179 CO -0.00 -0.26 -0.70 -0.59 -0.60 0.00 0.00 178.31 176.16 1u2d s PHE 180 N -5.92 3.70 -0.23 -0.55 -0.71 -1.19 -4.67 117.98 108.41 1u2d s PHE 180 Ca -0.12 -3.00 -0.29 0.00 -1.04 0.00 0.00 56.93 52.48 1u2d s PHE 180 Cb 0.27 -2.93 0.16 0.00 -1.21 0.00 0.00 43.02 39.30 1u2d s PHE 180 CO 0.77 -0.93 1.18 -0.98 -1.34 0.00 0.00 175.22 173.92 1u2d s ARG 181 N 0.79 0.33 0.56 1.99 1.70 -1.23 -5.02 118.95 118.08 1u2d s ARG 181 Ca 0.12 0.15 0.40 0.00 -0.47 0.00 0.00 55.73 55.92 1u2d s ARG 181 Cb -0.20 0.16 1.53 0.00 -0.57 0.00 0.00 34.95 35.87 1u2d s ARG 181 CO -0.07 -0.09 1.65 -0.91 -1.08 0.00 0.00 175.30 174.80 1u2d h ASN 182 N 2.65 0.00 -0.17 -2.89 -0.26 -1.97 -0.43 115.58 112.51 1u2d h ASN 182 Ca -0.17 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.57 1u2d h ASN 182 Cb 1.18 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.44 1u2d h ASN 182 CO 0.24 0.00 0.00 -0.46 -1.06 0.00 0.00 177.43 176.15 1u2d n ASN 183 N -3.91 2.11 -4.10 5.81 6.94 -1.26 -4.89 115.26 115.96 1u2d n ASN 183 Ca 0.31 -2.21 -0.15 0.00 -0.02 0.00 0.00 54.58 52.50 1u2d n ASN 183 Cb 1.53 -0.47 -0.12 0.00 -2.36 0.00 0.00 39.78 38.35 1u2d n ASN 183 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1u2d s THR 184 N -1.54 0.77 -0.07 5.53 2.01 -0.17 -1.07 115.64 121.09 1u2d s THR 184 Ca 0.15 -1.14 -0.03 0.00 0.31 0.00 0.00 61.69 60.98 1u2d s THR 184 Cb 0.11 -0.78 0.04 0.00 0.01 0.00 0.00 72.50 71.88 1u2d s THR 184 CO 0.05 -0.30 0.16 -0.32 -0.69 0.00 0.00 174.62 173.53 1u2d s MET 185 N -1.59 0.09 -0.46 4.92 1.75 -0.21 -4.69 119.30 119.11 1u2d s MET 185 Ca -0.06 0.43 -0.17 0.00 -1.25 0.00 0.00 55.69 54.63 1u2d s MET 185 Cb -0.10 -0.19 0.05 0.00 2.84 0.00 0.00 34.83 37.43 1u2d s MET 185 CO 0.01 -0.19 0.47 -1.64 -0.65 0.00 0.00 175.02 173.02 1u2d s MET 186 N 1.40 3.06 -0.76 4.11 -1.94 -0.58 -1.57 119.30 123.03 1u2d s MET 186 Ca -0.07 -0.98 -0.22 0.00 -1.71 0.00 0.00 55.69 52.71 1u2d s MET 186 Cb -0.12 -4.05 0.08 0.00 2.01 0.00 0.00 34.83 32.75 1u2d s MET 186 CO -0.06 -1.01 1.06 -0.51 -0.01 0.00 0.00 175.02 174.49 1u2d s LEU 187 N 2.11 4.42 -0.27 -0.03 1.02 -0.70 -1.93 118.68 123.30 1u2d s LEU 187 Ca 0.10 -1.26 -0.29 0.00 0.02 0.00 0.00 54.13 52.70 1u2d s LEU 187 Cb -0.20 -2.43 0.00 0.00 0.02 0.00 0.00 46.19 43.58 1u2d s LEU 187 CO 0.11 -1.37 1.20 -0.36 0.02 0.00 0.00 176.35 175.94 1u2d s PHE 188 N 3.88 2.93 -5.00 0.29 0.08 -1.26 -2.86 117.98 116.04 1u2d s PHE 188 Ca 0.27 1.06 0.00 0.00 0.12 0.00 0.00 56.93 58.38 1u2d s PHE 188 Cb -0.12 -3.68 0.00 0.00 -0.57 0.00 0.00 43.02 38.65 1u2d s PHE 188 CO 0.04 -1.31 0.00 0.41 -0.10 0.00 0.00 175.22 174.26 1u2d n GLY 189 N 3.92 -0.65 3.77 4.36 0.00 -1.12 -4.92 105.19 110.55 1u2d n GLY 189 Ca 0.13 -1.39 -0.38 0.00 0.00 0.00 0.00 46.02 44.39 1u2d n GLY 189 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1u2d s ASP 190 N -4.00 6.32 0.30 1.61 -1.08 -1.26 -2.02 116.67 116.54 1u2d s ASP 190 Ca 0.00 2.34 0.15 0.00 -0.52 0.00 0.00 52.55 54.52 1u2d s ASP 190 Cb 0.00 -2.61 0.34 0.00 -1.46 0.00 0.00 42.92 39.19 1u2d s ASP 190 CO 0.00 -0.82 1.57 0.00 0.52 0.00 0.00 175.17 176.44 1u2d h ALA 191 N 2.31 0.81 0.15 3.66 0.00 -1.92 -1.46 119.26 122.81 1u2d h ALA 191 Ca -0.49 -0.48 -0.22 0.00 0.00 0.00 0.00 54.91 53.71 1u2d h ALA 191 Cb 1.24 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.97 1u2d h ALA 191 CO 0.61 0.66 -1.02 -0.22 0.00 0.00 0.00 179.25 179.28 1u2d h LYS 192 N 0.00 0.32 -0.31 0.00 3.64 -1.89 -2.95 116.57 115.37 1u2d h LYS 192 Ca -0.01 -0.54 -0.17 0.00 -1.27 0.00 0.00 60.65 58.67 1u2d h LYS 192 Cb 1.19 0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 33.20 1u2d h LYS 192 CO 0.07 1.26 -0.47 -0.22 -2.27 0.00 0.00 179.45 177.82 1u2d h LYS 193 N -0.30 0.87 -0.61 1.90 1.63 -1.93 -1.10 116.57 117.03 1u2d h LYS 193 Ca -0.19 -0.52 -0.05 0.00 -0.85 0.00 0.00 60.65 59.04 1u2d h LYS 193 Cb 1.73 0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 33.38 1u2d h LYS 193 CO 0.15 1.16 0.19 0.52 -3.45 0.00 0.00 179.45 178.01 1u2d h MET 194 N 0.66 0.95 -0.02 1.90 2.86 -1.41 -0.78 114.93 119.08 1u2d h MET 194 Ca 0.03 -0.20 -0.19 0.00 -2.06 0.00 0.00 59.70 57.28 1u2d h MET 194 Cb 1.07 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 1u2d h MET 194 CO 0.11 0.84 -0.82 1.15 1.06 0.00 0.00 176.91 179.25 1u2d h THR 195 N 0.87 1.46 -0.37 2.22 2.02 -1.50 -1.58 112.91 116.03 1u2d h THR 195 Ca 0.20 -2.46 -0.10 0.00 0.77 0.00 0.00 66.41 64.82 1u2d h THR 195 Cb 0.29 2.35 -0.02 0.00 -1.74 0.00 0.00 68.15 69.03 1u2d h THR 195 CO -0.01 0.72 -0.18 -0.33 0.37 0.00 0.00 175.52 176.10 1u2d h GLU 196 N 0.13 0.69 0.00 6.66 5.08 -1.13 -2.42 114.58 123.60 1u2d h GLU 196 Ca -0.04 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.01 1u2d h GLU 196 Cb 1.42 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 1u2d h GLU 196 CO 0.13 0.83 -0.30 1.96 -1.00 0.00 0.00 179.01 180.62 1u2d h GLN 197 N 0.62 0.00 0.05 2.33 4.20 -0.93 -2.74 115.11 118.65 1u2d h GLN 197 Ca 0.10 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.57 1u2d h GLN 197 Cb 0.65 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.42 1u2d h GLN 197 CO 0.05 0.30 -1.05 0.82 -0.67 0.00 0.00 178.83 178.28 1u2d h ILE 198 N 0.00 1.49 -0.49 2.54 2.04 -1.09 -2.80 117.51 119.20 1u2d h ILE 198 Ca -0.00 -2.82 -0.11 0.00 1.00 0.00 0.00 64.86 62.92 1u2d h ILE 198 Cb 0.78 2.68 -0.02 0.00 -0.74 0.00 0.00 36.82 39.52 1u2d h ILE 198 CO 0.04 0.83 -0.15 0.58 0.00 0.00 0.00 178.15 179.45 1u2d h VAL 199 N 0.11 1.27 -0.76 1.67 2.07 -1.34 -2.66 116.25 116.61 1u2d h VAL 199 Ca -0.08 -1.29 -0.06 0.00 0.82 0.00 0.00 66.70 66.09 1u2d h VAL 199 Cb 1.73 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 32.51 1u2d h VAL 199 CO 0.17 0.45 0.24 1.56 0.02 0.00 0.00 177.57 180.01 1u2d h GLN 200 N 0.83 1.17 0.00 1.57 1.08 -1.52 -2.60 115.11 115.64 1u2d h GLN 200 Ca 0.13 -0.25 -0.05 0.00 -1.45 0.00 0.00 58.65 57.03 1u2d h GLN 200 Cb 0.70 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.95 1u2d h GLN 200 CO 0.05 0.99 -0.22 0.00 -0.95 0.00 0.00 178.83 178.70 1u2d h ALA 201 N 1.13 1.45 -1.68 3.87 0.00 -1.39 -3.43 119.26 119.22 1u2d h ALA 201 Ca 0.24 -0.20 -0.46 0.00 0.00 0.00 0.00 54.91 54.50 1u2d h ALA 201 Cb 0.30 -0.04 0.09 0.00 0.00 0.00 0.00 17.79 18.15 1u2d h ALA 201 CO -0.01 0.27 0.16 -1.64 0.00 0.00 0.00 179.25 178.04 1u2d s MET 202 N -4.33 1.70 0.00 0.00 -1.94 -0.98 -4.99 119.30 108.77 1u2d s MET 202 Ca -0.03 -0.81 0.00 0.00 -1.71 0.00 0.00 55.69 53.14 1u2d s MET 202 Cb 0.14 -2.24 0.00 0.00 2.01 0.00 0.00 34.83 34.74 1u2d s MET 202 CO 0.67 -1.48 0.27 0.09 -0.01 0.00 0.00 175.02 174.55