#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dxm n ALA 3 N 0.00 0.15 -1.92 1.79 0.00 -1.26 -0.70 120.51 118.58 3dxm n ALA 3 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3dxm n ALA 3 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.32 3dxm n ALA 3 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 3dxm n THR 4 N 0.01 0.00 -0.07 0.00 5.66 -1.26 -4.90 114.28 113.73 3dxm n THR 4 Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 3dxm n THR 4 Cb 0.00 0.15 -0.06 0.00 -1.55 0.00 0.00 70.33 68.87 3dxm n THR 4 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 3dxm h LEU 5 N 0.00 0.00 -0.63 1.09 5.85 -1.35 -3.25 115.31 117.01 3dxm h LEU 5 Ca 0.00 -0.37 0.04 0.00 0.84 0.00 0.00 57.88 58.39 3dxm h LEU 5 Cb 1.05 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 3dxm h LEU 5 CO 0.00 0.81 0.38 -0.09 -0.34 0.00 0.00 178.44 179.20 3dxm h ARG 6 N -1.00 0.71 -0.27 1.25 1.12 -1.92 -1.49 114.38 112.77 3dxm h ARG 6 Ca -0.04 -0.04 -0.03 0.00 -1.11 0.00 0.00 59.98 58.76 3dxm h ARG 6 Cb 0.54 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 30.33 3dxm h ARG 6 CO -0.02 0.47 0.05 -1.35 -3.11 0.00 0.00 179.97 176.00 3dxm h PRO 7 N 0.73 0.39 0.49 0.20 0.11 -1.91 -0.71 132.00 131.30 3dxm h PRO 7 Ca 0.26 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.29 3dxm h PRO 7 Cb 0.07 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.12 3dxm h PRO 7 CO -0.13 0.38 -0.23 -0.92 -0.21 0.00 0.00 178.00 176.89 3dxm h TYR 8 N 0.39 -0.61 -0.31 0.65 3.20 -1.44 -2.73 116.97 116.11 3dxm h TYR 8 Ca 0.09 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.97 3dxm h TYR 8 Cb 0.18 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 3dxm h TYR 8 CO 0.00 -0.30 0.21 -0.07 -1.64 0.00 0.00 178.16 176.37 3dxm h LEU 9 N -1.06 0.30 -0.59 2.82 3.38 -1.19 -1.35 115.31 117.62 3dxm h LEU 9 Ca -0.07 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 3dxm h LEU 9 Cb 0.58 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3dxm h LEU 9 CO 0.11 0.21 0.06 0.28 0.09 0.00 0.00 178.44 179.19 3dxm h SER 10 N 0.35 0.97 -0.38 -0.43 0.02 -1.15 0.19 113.55 113.11 3dxm h SER 10 Ca 0.12 -0.28 -0.13 0.00 -0.84 0.00 0.00 61.79 60.67 3dxm h SER 10 Cb 0.07 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 3dxm h SER 10 CO -0.03 1.00 -0.25 0.00 -1.14 0.00 0.00 176.83 176.41 3dxm h ALA 11 N 1.00 0.55 -0.51 3.77 0.00 -1.02 -2.40 119.26 120.64 3dxm h ALA 11 Ca 0.18 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 3dxm h ALA 11 Cb 0.47 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3dxm h ALA 11 CO 0.02 0.55 0.12 0.28 0.00 0.00 0.00 179.25 180.22 3dxm h VAL 12 N 0.65 1.24 -0.45 0.00 2.07 -1.13 -2.40 116.25 116.22 3dxm h VAL 12 Ca 0.08 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.75 3dxm h VAL 12 Cb 0.82 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3dxm h VAL 12 CO 0.07 0.31 0.30 -0.09 0.02 0.00 0.00 177.57 178.18 3dxm h ARG 13 N 0.70 0.60 -0.72 1.57 2.43 -0.90 -1.21 114.38 116.86 3dxm h ARG 13 Ca 0.16 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 3dxm h ARG 13 Cb 0.33 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 3dxm h ARG 13 CO 0.00 0.40 0.38 0.00 -1.51 0.00 0.00 179.97 179.24 3dxm h ALA 14 N 1.16 0.92 -0.41 2.80 0.00 -1.33 -1.78 119.26 120.62 3dxm h ALA 14 Ca 0.17 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3dxm h ALA 14 Cb -0.07 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3dxm h ALA 14 CO -0.04 0.46 -0.11 1.15 0.00 0.00 0.00 179.25 180.71 3dxm h THR 15 N 0.99 1.25 -0.15 0.00 2.02 -1.15 -2.35 112.91 113.53 3dxm h THR 15 Ca 0.25 -1.15 -0.09 0.00 0.77 0.00 0.00 66.41 66.20 3dxm h THR 15 Cb 0.07 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 3dxm h THR 15 CO -0.04 0.39 -0.30 -0.07 0.37 0.00 0.00 175.52 175.88 3dxm h LEU 16 N 0.66 0.28 -0.69 2.58 3.38 -0.85 -0.37 115.31 120.30 3dxm h LEU 16 Ca 0.11 -0.09 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 3dxm h LEU 16 Cb 0.57 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3dxm h LEU 16 CO 0.04 0.57 -0.39 -0.61 0.09 0.00 0.00 178.44 178.14 3dxm h GLN 17 N 0.25 0.56 -0.03 1.13 4.15 -0.92 -0.40 115.11 119.85 3dxm h GLN 17 Ca 0.03 -0.28 -0.21 0.00 0.77 0.00 0.00 58.65 58.96 3dxm h GLN 17 Cb 0.65 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.35 3dxm h GLN 17 CO 0.05 0.86 -0.87 0.00 -1.93 0.00 0.00 178.83 176.94 3dxm h ALA 18 N 1.11 0.43 0.01 3.38 0.00 -1.06 -3.31 119.26 119.83 3dxm h ALA 18 Ca 0.04 -0.68 -0.22 0.00 0.00 0.00 0.00 54.91 54.06 3dxm h ALA 18 Cb 0.89 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 3dxm h ALA 18 CO 0.08 0.80 -0.94 0.00 0.00 0.00 0.00 179.25 179.18 3dxm h ALA 19 N 0.80 0.40 -0.17 0.00 0.00 -0.95 -3.37 119.26 115.97 3dxm h ALA 19 Ca -0.06 -0.73 -0.60 0.00 0.00 0.00 0.00 54.91 53.52 3dxm h ALA 19 Cb 1.49 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 3dxm h ALA 19 CO 0.15 0.88 2.63 1.28 0.00 0.00 0.00 179.25 184.19 3dxm n LEU 20 N -3.68 7.90 -3.62 0.00 4.77 -0.17 -4.60 117.00 117.59 3dxm n LEU 20 Ca -0.05 -4.27 -0.27 0.00 -0.03 0.00 0.00 56.01 51.38 3dxm n LEU 20 Cb 0.84 -1.47 -0.10 0.00 -2.33 0.00 0.00 43.42 40.36 3dxm n LEU 20 CO 0.50 1.99 -0.11 0.00 -1.33 0.00 0.00 177.39 178.44 3dxm s LEU 22 N -1.25 3.60 0.07 0.00 1.43 -1.26 -4.95 118.68 116.33 3dxm s LEU 22 Ca 0.31 -0.40 -0.08 0.00 -1.03 0.00 0.00 54.13 52.93 3dxm s LEU 22 Cb 0.03 -2.14 -0.00 0.00 0.03 0.00 0.00 46.19 44.11 3dxm s LEU 22 CO -0.14 -0.06 0.16 -1.83 0.23 0.00 0.00 176.35 174.71 3dxm s GLU 23 N -3.81 0.77 0.13 1.70 -1.05 -0.95 -4.95 118.70 110.55 3dxm s GLU 23 Ca 0.33 -0.90 -0.31 0.00 -0.15 0.00 0.00 54.97 53.94 3dxm s GLU 23 Cb -0.07 0.31 -0.10 0.00 -0.44 0.00 0.00 34.13 33.83 3dxm s GLU 23 CO 0.24 -0.23 1.67 1.21 0.95 0.00 0.00 175.26 179.10 3dxm s ASN 24 N -2.66 6.52 -0.14 0.83 3.84 -1.26 -4.20 114.94 117.88 3dxm s ASN 24 Ca 0.02 2.65 -0.02 0.00 0.21 0.00 0.00 52.86 55.72 3dxm s ASN 24 Cb 0.04 -2.58 0.05 0.00 -0.55 0.00 0.00 41.25 38.20 3dxm s ASN 24 CO -0.09 -0.91 0.02 0.12 -2.79 0.00 0.00 177.10 173.45 3dxm s PHE 25 N 1.96 0.88 0.35 0.43 5.36 -1.26 -5.05 117.98 120.65 3dxm s PHE 25 Ca 0.74 -0.55 -0.26 0.00 -0.96 0.00 0.00 56.93 55.90 3dxm s PHE 25 Cb -0.44 -0.94 -0.09 0.00 -0.34 0.00 0.00 43.02 41.21 3dxm s PHE 25 CO 0.33 -0.49 1.05 -1.12 -1.46 0.00 0.00 175.22 173.53 3dxm s SER 26 N 1.91 6.98 0.23 6.13 0.01 -1.26 -4.54 113.70 123.16 3dxm s SER 26 Ca 0.02 2.09 -0.32 0.00 1.31 0.00 0.00 55.95 59.05 3dxm s SER 26 Cb -0.15 -2.60 -0.13 0.00 0.21 0.00 0.00 66.02 63.35 3dxm s SER 26 CO -0.07 -0.33 1.47 -0.24 0.41 0.00 0.00 173.24 174.48 3dxm n SER 27 N 0.40 2.98 0.06 2.44 2.88 0.75 -4.89 113.62 118.25 3dxm n SER 27 Ca 0.03 1.13 0.10 0.00 -1.33 0.00 0.00 58.87 58.79 3dxm n SER 27 Cb 0.48 -1.45 -0.06 0.00 -0.75 0.00 0.00 64.21 62.43 3dxm n SER 27 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 3dxm n GLN 28 N 2.34 0.62 -0.11 -1.46 7.27 -1.26 -4.37 117.38 120.41 3dxm n GLN 28 Ca 0.12 0.04 -0.14 0.00 0.07 0.00 0.00 57.00 57.09 3dxm n GLN 28 Cb 0.32 -1.73 -0.14 0.00 2.41 0.00 0.00 30.24 31.09 3dxm n GLN 28 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 3dxm n VAL 29 N -2.58 1.45 -4.71 1.69 0.31 -1.26 -4.95 118.33 108.28 3dxm n VAL 29 Ca -0.03 -0.72 -0.31 0.00 -0.01 0.00 0.00 64.34 63.27 3dxm n VAL 29 Cb 0.60 -0.95 -0.17 0.00 -0.91 0.00 0.00 33.84 32.41 3dxm n VAL 29 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3dxm s VAL 30 N -2.51 1.86 0.03 2.52 1.01 -1.26 -5.09 120.40 116.96 3dxm s VAL 30 Ca -0.22 -0.87 -0.34 0.00 0.00 0.00 0.00 61.98 60.55 3dxm s VAL 30 Cb 0.07 -1.65 -0.12 0.00 0.00 0.00 0.00 36.38 34.68 3dxm s VAL 30 CO 0.72 0.51 1.77 1.21 0.00 0.00 0.00 175.10 179.31 3dxm n GLU 31 N 3.99 2.24 -2.42 2.72 2.13 -1.26 -2.14 120.64 125.89 3dxm n GLU 31 Ca -0.20 0.82 -0.21 0.00 0.66 0.00 0.00 57.16 58.23 3dxm n GLU 31 Cb 0.52 -2.64 -0.01 0.00 0.27 0.00 0.00 31.44 29.58 3dxm n GLU 31 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3dxm n ARG 32 N 5.37 -1.81 -4.26 5.31 1.74 -1.26 -5.00 116.66 116.74 3dxm n ARG 32 Ca 0.20 1.00 -0.27 0.00 -0.77 0.00 0.00 57.85 58.02 3dxm n ARG 32 Cb 0.30 -5.67 -0.09 0.00 -1.02 0.00 0.00 32.46 25.98 3dxm n ARG 32 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3dxm s HIS 33 N -3.05 2.72 -0.14 -1.55 3.76 -0.91 -5.02 115.29 111.09 3dxm s HIS 33 Ca 0.01 -0.19 -0.04 0.00 -0.15 0.00 0.00 55.06 54.70 3dxm s HIS 33 Cb -0.01 -1.33 0.05 0.00 1.11 0.00 0.00 32.58 32.41 3dxm s HIS 33 CO 0.02 0.51 0.07 1.21 -0.85 0.00 0.00 174.74 175.70 3dxm s ASN 34 N -2.85 2.15 0.06 1.40 3.84 -1.26 -0.18 114.94 118.10 3dxm s ASN 34 Ca 0.26 -0.48 0.04 0.00 0.21 0.00 0.00 52.86 52.89 3dxm s ASN 34 Cb -0.09 -0.27 -0.03 0.00 -0.55 0.00 0.00 41.25 40.31 3dxm s ASN 34 CO 0.16 -0.32 -0.13 -0.54 -2.79 0.00 0.00 177.10 173.49 3dxm s LYS 35 N 2.11 0.75 -0.29 0.43 1.02 -1.26 -4.97 119.74 117.53 3dxm s LYS 35 Ca 0.02 -0.89 -0.29 0.00 0.02 0.00 0.00 55.97 54.84 3dxm s LYS 35 Cb -0.15 -0.71 -0.02 0.00 -0.52 0.00 0.00 37.83 36.43 3dxm s LYS 35 CO -0.08 0.16 1.72 -1.25 -0.92 0.00 0.00 175.35 174.98 3dxm s PRO 36 N -1.64 3.53 0.44 -1.68 0.04 -1.26 -4.86 135.00 129.56 3dxm s PRO 36 Ca -0.04 1.52 0.14 0.00 0.04 0.00 0.00 61.00 62.66 3dxm s PRO 36 Cb -0.10 -4.13 1.04 0.00 0.04 0.00 0.00 34.50 31.35 3dxm s PRO 36 CO 0.02 -1.62 1.99 0.93 0.04 0.00 0.00 177.00 178.35 3dxm h GLU 37 N 11.97 0.38 0.00 4.56 4.39 -1.93 -1.16 114.58 132.79 3dxm h GLU 37 Ca -0.34 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.34 3dxm h GLU 37 Cb 1.16 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 3dxm h GLU 37 CO 1.02 0.25 0.00 -0.24 -1.16 0.00 0.00 179.01 178.88 3dxm h VAL 38 N 0.39 0.00 0.00 3.13 3.04 -1.89 0.06 116.25 120.98 3dxm h VAL 38 Ca 0.26 -0.42 -0.17 0.00 -1.01 0.00 0.00 66.70 65.36 3dxm h VAL 38 Cb 0.53 1.37 -0.03 0.00 -2.01 0.00 0.00 31.29 31.15 3dxm h VAL 38 CO -0.07 0.00 -1.03 -0.33 -1.01 0.00 0.00 177.57 175.13 3dxm h GLU 39 N 0.00 0.00 0.01 4.17 4.39 -1.61 -3.40 114.58 118.14 3dxm h GLU 39 Ca 0.00 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.47 3dxm h GLU 39 Cb 0.44 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 3dxm h GLU 39 CO 0.00 0.76 -0.96 -0.39 -1.16 0.00 0.00 179.01 177.26 3dxm h VAL 40 N -1.00 1.41 -5.78 3.13 -1.51 -1.51 -3.48 116.25 107.51 3dxm h VAL 40 Ca -0.25 -2.50 -0.43 0.00 -1.23 0.00 0.00 66.70 62.29 3dxm h VAL 40 Cb 1.10 2.46 -0.07 0.00 -2.13 0.00 0.00 31.29 32.64 3dxm h VAL 40 CO -0.15 0.74 -0.65 0.54 -1.23 0.00 0.00 177.57 176.82 3dxm n ARG 41 N -3.73 -4.08 0.00 5.19 1.74 0.01 -4.86 116.66 110.93 3dxm n ARG 41 Ca -0.07 0.53 0.14 0.00 -0.77 0.00 0.00 57.85 57.69 3dxm n ARG 41 Cb 0.85 -5.31 0.60 0.00 -1.02 0.00 0.00 32.46 27.57 3dxm n ARG 41 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3dxm n SER 42 N -2.51 0.88 -3.53 0.55 3.41 -1.26 -4.54 113.62 106.62 3dxm n SER 42 Ca 0.01 -1.05 -0.29 0.00 -0.26 0.00 0.00 58.87 57.27 3dxm n SER 42 Cb 0.54 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.36 3dxm n SER 42 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3dxm s SER 43 N -2.22 3.25 0.48 4.04 0.01 -1.26 -5.02 113.70 112.98 3dxm s SER 43 Ca 0.35 -2.03 0.27 0.00 1.31 0.00 0.00 55.95 55.85 3dxm s SER 43 Cb 0.21 -0.51 1.33 0.00 0.21 0.00 0.00 66.02 67.26 3dxm s SER 43 CO 0.41 -0.34 1.81 0.11 0.41 0.00 0.00 173.24 175.65 3dxm h LYS 44 N 7.33 0.18 0.00 12.44 1.79 -1.97 -0.96 116.57 135.37 3dxm h LYS 44 Ca -0.02 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 3dxm h LYS 44 Cb 0.97 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 3dxm h LYS 44 CO 0.34 0.12 0.00 1.05 -1.08 0.00 0.00 179.45 179.88 3dxm h GLU 45 N 0.19 0.00 -0.01 3.15 9.09 -1.98 -2.68 114.58 122.34 3dxm h GLU 45 Ca 0.54 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.95 3dxm h GLU 45 Cb 1.76 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.86 3dxm h GLU 45 CO -0.13 0.00 -0.21 1.28 0.05 0.00 0.00 179.01 179.99 3dxm n LEU 46 N -2.61 1.06 -4.87 3.06 4.77 -0.37 -4.88 117.00 113.17 3dxm n LEU 46 Ca 0.02 -0.28 -0.36 0.00 -0.03 0.00 0.00 56.01 55.35 3dxm n LEU 46 Cb 0.28 -0.11 -0.06 0.00 -2.33 0.00 0.00 43.42 41.20 3dxm n LEU 46 CO 0.24 0.19 -0.04 -0.76 -1.33 0.00 0.00 177.39 175.69 3dxm s LEU 47 N -2.43 4.41 0.42 2.23 1.43 -1.01 -1.79 118.68 121.93 3dxm s LEU 47 Ca 0.26 0.67 0.07 0.00 -1.03 0.00 0.00 54.13 54.10 3dxm s LEU 47 Cb 0.19 -2.47 0.01 0.00 0.03 0.00 0.00 46.19 43.96 3dxm s LEU 47 CO 0.49 0.32 0.57 -0.76 0.23 0.00 0.00 176.35 177.21 3dxm s LEU 48 N -1.33 3.68 -0.00 1.79 1.43 -0.42 -4.95 118.68 118.87 3dxm s LEU 48 Ca 0.23 -0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 52.68 3dxm s LEU 48 Cb -0.14 -2.70 -0.06 0.00 0.03 0.00 0.00 46.19 43.33 3dxm s LEU 48 CO 0.11 -0.74 1.45 -1.58 0.23 0.00 0.00 176.35 175.82 3dxm s GLN 49 N -4.36 4.26 0.41 1.70 2.00 -1.26 -4.57 119.66 117.83 3dxm s GLN 49 Ca 0.54 2.02 -0.25 0.00 -2.00 0.00 0.00 55.36 55.66 3dxm s GLN 49 Cb -0.10 -3.62 -0.08 0.00 0.80 0.00 0.00 33.01 30.01 3dxm s GLN 49 CO 0.33 -0.63 1.19 -2.14 -0.50 0.00 0.00 175.29 173.54 3dxm s PRO 50 N 2.63 4.01 0.04 1.67 0.02 -1.26 -4.68 135.00 137.42 3dxm s PRO 50 Ca 0.66 1.88 0.02 0.00 0.02 0.00 0.00 61.00 63.58 3dxm s PRO 50 Cb -0.32 -2.66 -0.02 0.00 0.02 0.00 0.00 34.50 31.51 3dxm s PRO 50 CO 0.27 -0.37 -0.08 0.14 -0.33 0.00 0.00 177.00 176.63 3dxm s VAL 51 N -1.40 0.59 0.02 3.83 -7.23 -0.89 -5.01 120.40 110.31 3dxm s VAL 51 Ca 0.58 -0.96 0.08 0.00 -1.81 0.00 0.00 61.98 59.87 3dxm s VAL 51 Cb -0.32 -0.62 -0.02 0.00 0.56 0.00 0.00 36.38 35.98 3dxm s VAL 51 CO 0.40 -0.27 -0.24 -0.89 -0.31 0.00 0.00 175.10 173.79 3dxm s THR 52 N -1.14 1.91 -0.14 5.32 2.01 -1.26 -1.13 115.64 121.20 3dxm s THR 52 Ca -0.07 -1.19 0.01 0.00 0.31 0.00 0.00 61.69 60.75 3dxm s THR 52 Cb -0.09 -1.62 0.02 0.00 0.01 0.00 0.00 72.50 70.82 3dxm s THR 52 CO 0.00 0.39 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.55 3dxm s ILE 53 N -0.70 1.62 0.05 1.82 1.09 -0.71 -4.98 121.20 119.38 3dxm s ILE 53 Ca 0.10 -0.67 0.09 0.00 -1.10 0.00 0.00 60.65 59.07 3dxm s ILE 53 Cb -0.09 -1.50 -0.03 0.00 -1.06 0.00 0.00 42.46 39.78 3dxm s ILE 53 CO 0.01 0.47 -0.26 -0.94 -0.10 0.00 0.00 174.94 174.12 3dxm s SER 54 N 1.35 3.08 -0.16 3.58 1.04 -1.26 -0.44 113.70 120.88 3dxm s SER 54 Ca 0.02 -0.59 0.07 0.00 0.48 0.00 0.00 55.95 55.93 3dxm s SER 54 Cb -0.13 -0.27 -0.23 0.00 0.10 0.00 0.00 66.02 65.49 3dxm s SER 54 CO -0.09 0.24 0.20 -1.14 0.98 0.00 0.00 173.24 173.44 3dxm n ARG 55 N 1.75 0.68 -0.52 4.02 0.63 -0.13 -4.98 116.66 118.10 3dxm n ARG 55 Ca -0.17 0.17 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3dxm n ARG 55 Cb 0.52 -1.63 0.00 0.00 0.45 0.00 0.00 32.46 31.80 3dxm n ARG 55 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 3dxm n ASN 56 N -3.12 0.00 0.25 6.15 0.23 -1.19 -5.00 115.26 112.59 3dxm n ASN 56 Ca -0.32 -0.50 0.12 0.00 -0.53 0.00 0.00 54.58 53.35 3dxm n ASN 56 Cb 1.06 0.00 0.67 0.00 -2.08 0.00 0.00 39.78 39.44 3dxm n ASN 56 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3dxm h GLU 57 N 0.00 0.00 0.00 -3.83 4.11 -2.04 -3.33 114.58 109.49 3dxm h GLU 57 Ca 0.00 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 59.10 3dxm h GLU 57 Cb 0.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 3dxm h GLU 57 CO 0.00 0.14 -2.22 1.63 0.07 0.00 0.00 179.01 178.63 3dxm n LYS 58 N -3.63 0.52 -3.11 1.06 4.76 -1.26 -4.98 118.16 111.51 3dxm n LYS 58 Ca -0.02 0.15 -0.39 0.00 -2.87 0.00 0.00 58.31 55.17 3dxm n LYS 58 Cb 0.27 -1.39 -0.05 0.00 -1.84 0.00 0.00 35.03 32.01 3dxm n LYS 58 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3dxm s GLU 59 N -2.42 4.35 0.13 1.97 2.02 -1.25 -4.76 118.70 118.73 3dxm s GLU 59 Ca -0.29 0.72 -0.25 0.00 0.02 0.00 0.00 54.97 55.17 3dxm s GLU 59 Cb 0.09 -3.49 0.07 0.00 0.10 0.00 0.00 34.13 30.90 3dxm s GLU 59 CO 0.47 -0.02 0.86 -1.59 0.02 0.00 0.00 175.26 175.00 3dxm s LYS 60 N 1.14 1.19 -0.06 1.61 -2.85 -1.22 -0.95 119.74 118.59 3dxm s LYS 60 Ca 0.33 -0.59 -0.01 0.00 -1.00 0.00 0.00 55.97 54.71 3dxm s LYS 60 Cb -0.17 0.45 0.03 0.00 -2.06 0.00 0.00 37.83 36.08 3dxm s LYS 60 CO 0.14 -0.54 -0.01 0.08 0.10 0.00 0.00 175.35 175.12 3dxm s VAL 61 N -3.39 0.41 -0.21 1.79 1.01 0.41 -1.03 120.40 119.39 3dxm s VAL 61 Ca 0.09 0.05 -0.12 0.00 0.00 0.00 0.00 61.98 62.00 3dxm s VAL 61 Cb -0.02 -0.53 -0.05 0.00 0.00 0.00 0.00 36.38 35.79 3dxm s VAL 61 CO -0.02 0.24 0.20 -0.22 0.00 0.00 0.00 175.10 175.31 3dxm s LEU 62 N 1.61 4.17 -0.20 3.92 2.96 0.61 -1.74 118.68 130.01 3dxm s LEU 62 Ca -0.00 0.27 0.01 0.00 -0.22 0.00 0.00 54.13 54.19 3dxm s LEU 62 Cb -0.13 -2.20 0.04 0.00 0.50 0.00 0.00 46.19 44.40 3dxm s LEU 62 CO -0.04 0.09 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.33 3dxm s ILE 63 N 0.76 1.83 -0.27 6.68 1.01 -0.29 -0.75 121.20 130.17 3dxm s ILE 63 Ca 0.11 -1.10 -0.01 0.00 0.00 0.00 0.00 60.65 59.64 3dxm s ILE 63 Cb -0.13 -1.85 0.04 0.00 0.01 0.00 0.00 42.46 40.54 3dxm s ILE 63 CO 0.03 0.22 -0.04 -1.61 0.00 0.00 0.00 174.94 173.54 3dxm s GLU 64 N 1.32 2.61 0.38 2.79 2.02 -0.21 -2.09 118.70 125.51 3dxm s GLU 64 Ca -0.01 -1.14 0.07 0.00 0.02 0.00 0.00 54.97 53.92 3dxm s GLU 64 Cb -0.16 -3.07 -0.00 0.00 0.10 0.00 0.00 34.13 30.99 3dxm s GLU 64 CO -0.09 -0.51 0.49 0.20 0.02 0.00 0.00 175.26 175.36 3dxm s GLY 65 N 1.28 1.81 0.35 -1.39 0.00 -1.26 -0.41 107.32 107.68 3dxm s GLY 65 Ca -0.03 -1.60 -0.14 0.00 0.00 0.00 0.00 44.72 42.94 3dxm s GLY 65 CO -0.03 -1.47 0.70 -1.35 0.00 0.00 0.00 173.10 170.95 3dxm s SER 66 N -4.22 0.09 0.44 1.64 1.04 -0.15 -1.30 113.70 111.23 3dxm s SER 66 Ca 0.49 -1.08 0.11 0.00 0.48 0.00 0.00 55.95 55.96 3dxm s SER 66 Cb -0.09 0.78 0.96 0.00 0.10 0.00 0.00 66.02 67.77 3dxm s SER 66 CO 0.31 -1.52 2.02 -0.29 0.98 0.00 0.00 173.24 174.75 3dxm h ILE 67 N 2.04 1.11 0.00 -1.02 2.10 -1.73 -3.27 117.51 116.74 3dxm h ILE 67 Ca -0.28 -0.42 0.00 0.00 1.08 0.00 0.00 64.86 65.23 3dxm h ILE 67 Cb 1.25 1.02 0.00 0.00 -1.09 0.00 0.00 36.82 38.00 3dxm h ILE 67 CO 0.36 0.14 -0.08 -0.46 -1.08 0.00 0.00 178.15 177.04 3dxm n ASN 68 N -4.40 1.39 -3.51 2.19 6.94 -1.26 -2.24 115.26 114.37 3dxm n ASN 68 Ca -0.01 -2.10 -0.08 0.00 -0.02 0.00 0.00 54.58 52.36 3dxm n ASN 68 Cb 0.17 -0.15 -0.02 0.00 -2.36 0.00 0.00 39.78 37.42 3dxm n ASN 68 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3dxm s SER 69 N -1.32 -0.35 -0.01 0.53 1.04 -1.23 -1.66 113.70 110.68 3dxm s SER 69 Ca 0.09 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.56 3dxm s SER 69 Cb 0.08 0.36 0.01 0.00 0.10 0.00 0.00 66.02 66.57 3dxm s SER 69 CO 0.01 -0.57 -0.01 -0.69 0.98 0.00 0.00 173.24 172.95 3dxm s VAL 70 N -2.90 0.14 -0.21 5.02 1.01 0.51 -0.97 120.40 122.99 3dxm s VAL 70 Ca 0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 3dxm s VAL 70 Cb -0.01 -0.16 -0.00 0.00 0.00 0.00 0.00 36.38 36.21 3dxm s VAL 70 CO -0.08 0.07 -0.07 -0.60 0.00 0.00 0.00 175.10 174.42 3dxm s ARG 71 N 0.32 3.31 -0.23 2.72 3.52 0.45 -0.88 118.95 128.16 3dxm s ARG 71 Ca -0.03 -0.66 -0.02 0.00 -0.13 0.00 0.00 55.73 54.89 3dxm s ARG 71 Cb -0.05 -2.91 0.02 0.00 -1.56 0.00 0.00 34.95 30.44 3dxm s ARG 71 CO -0.01 -0.18 -0.08 0.08 -0.81 0.00 0.00 175.30 174.30 3dxm s VAL 72 N 1.39 2.85 -0.08 7.11 1.01 0.18 -1.04 120.40 131.82 3dxm s VAL 72 Ca 0.05 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.19 3dxm s VAL 72 Cb -0.14 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 3dxm s VAL 72 CO -0.05 0.33 -0.13 -0.44 0.00 0.00 0.00 175.10 174.81 3dxm s SER 73 N 1.36 4.05 -0.03 3.32 0.01 0.07 0.11 113.70 122.59 3dxm s SER 73 Ca 0.03 -0.23 0.07 0.00 1.31 0.00 0.00 55.95 57.12 3dxm s SER 73 Cb -0.15 -1.14 -0.01 0.00 0.21 0.00 0.00 66.02 64.93 3dxm s SER 73 CO -0.06 0.28 -0.24 -0.63 0.41 0.00 0.00 173.24 173.00 3dxm s ILE 74 N -0.35 1.93 -0.40 1.44 1.01 0.20 -0.28 121.20 124.75 3dxm s ILE 74 Ca 0.03 -1.02 -0.11 0.00 0.00 0.00 0.00 60.65 59.55 3dxm s ILE 74 Cb -0.13 -1.61 0.05 0.00 0.01 0.00 0.00 42.46 40.78 3dxm s ILE 74 CO 0.02 0.54 0.25 0.00 0.00 0.00 0.00 174.94 175.75 3dxm s ALA 75 N -0.39 3.32 0.43 9.38 0.00 -0.20 -1.38 121.76 132.93 3dxm s ALA 75 Ca 0.04 -1.88 -0.20 0.00 0.00 0.00 0.00 51.96 49.93 3dxm s ALA 75 Cb -0.11 -2.68 -0.10 0.00 0.00 0.00 0.00 23.12 20.23 3dxm s ALA 75 CO 0.01 -1.50 0.93 0.08 0.00 0.00 0.00 175.76 175.28 3dxm s VAL 76 N 1.54 4.44 0.10 0.00 1.01 -1.26 -3.46 120.40 122.77 3dxm s VAL 76 Ca 0.02 1.39 -0.31 0.00 0.00 0.00 0.00 61.98 63.08 3dxm s VAL 76 Cb -0.21 -3.62 -0.08 0.00 0.00 0.00 0.00 36.38 32.47 3dxm s VAL 76 CO 0.06 -0.36 1.46 -0.75 0.00 0.00 0.00 175.10 175.50 3dxm s LYS 77 N -3.30 4.28 -0.36 2.72 2.20 -1.26 -4.86 119.74 119.16 3dxm s LYS 77 Ca 0.61 2.14 0.01 0.00 -0.36 0.00 0.00 55.97 58.37 3dxm s LYS 77 Cb -0.09 -3.32 0.15 0.00 -1.51 0.00 0.00 37.83 33.05 3dxm s LYS 77 CO 0.16 -0.53 0.27 -0.65 -0.36 0.00 0.00 175.35 174.25 3dxm s GLN 78 N 1.50 0.59 0.19 4.03 -0.21 -1.26 -4.95 119.66 119.55 3dxm s GLN 78 Ca 0.67 -1.20 -0.09 0.00 0.02 0.00 0.00 55.36 54.75 3dxm s GLN 78 Cb -0.38 -1.10 0.10 0.00 1.00 0.00 0.00 33.01 32.64 3dxm s GLN 78 CO 0.30 -1.21 1.72 0.00 -2.12 0.00 0.00 175.29 173.97 3dxm h ALA 79 N 6.96 0.90 -3.69 6.09 0.00 -1.93 -3.45 119.26 124.13 3dxm h ALA 79 Ca 0.07 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.58 3dxm h ALA 79 Cb 1.00 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 3dxm h ALA 79 CO 0.24 0.59 -0.16 -0.40 0.00 0.00 0.00 179.25 179.52 3dxm n ASP 80 N -4.30 -0.11 -0.04 0.00 5.68 -1.26 -5.05 116.55 111.48 3dxm n ASP 80 Ca 0.05 -1.76 -0.09 0.00 -0.50 0.00 0.00 54.79 52.49 3dxm n ASP 80 Cb 0.24 0.56 -0.03 0.00 -1.14 0.00 0.00 41.12 40.75 3dxm n ASP 80 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3dxm h GLU 81 N 0.00 0.19 -0.31 0.11 5.08 -1.99 -0.68 114.58 116.98 3dxm h GLU 81 Ca -0.08 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 3dxm h GLU 81 Cb 0.42 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 3dxm h GLU 81 CO 0.12 0.13 0.02 0.97 -1.00 0.00 0.00 179.01 179.25 3dxm h ILE 82 N 0.19 1.17 -0.06 3.13 6.09 -1.99 -1.20 117.51 124.85 3dxm h ILE 82 Ca 0.09 -0.67 -0.17 0.00 -1.37 0.00 0.00 64.86 62.74 3dxm h ILE 82 Cb 0.04 0.92 -0.01 0.00 0.47 0.00 0.00 36.82 38.24 3dxm h ILE 82 CO -0.07 0.23 -0.70 -0.33 -3.07 0.00 0.00 178.15 174.21 3dxm h GLU 83 N 0.45 0.28 -0.29 2.19 5.08 -1.88 -1.66 114.58 118.75 3dxm h GLU 83 Ca 0.10 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 3dxm h GLU 83 Cb 0.27 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3dxm h GLU 83 CO 0.01 0.87 0.08 -0.22 -1.00 0.00 0.00 179.01 178.74 3dxm h LYS 84 N 0.19 0.46 -0.08 2.33 3.64 -0.29 -0.76 116.57 122.07 3dxm h LYS 84 Ca -0.02 -0.11 -0.19 0.00 -1.27 0.00 0.00 60.65 59.06 3dxm h LYS 84 Cb 1.25 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 33.00 3dxm h LYS 84 CO 0.11 0.53 -0.75 -0.84 -2.27 0.00 0.00 179.45 176.24 3dxm h ILE 85 N 0.31 1.37 -0.50 2.00 -0.00 -1.25 -1.86 117.51 117.57 3dxm h ILE 85 Ca 0.09 -2.15 -0.07 0.00 -0.00 0.00 0.00 64.86 62.73 3dxm h ILE 85 Cb 0.27 2.12 -0.02 0.00 -0.00 0.00 0.00 36.82 39.20 3dxm h ILE 85 CO -0.00 0.65 0.03 -0.07 -0.00 0.00 0.00 178.15 178.76 3dxm h LEU 86 N 0.29 0.84 -0.41 0.16 3.38 -1.24 -0.80 115.31 117.53 3dxm h LEU 86 Ca -0.04 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 3dxm h LEU 86 Cb 1.33 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 3dxm h LEU 86 CO 0.13 0.93 0.07 0.00 0.09 0.00 0.00 178.44 179.66 3dxm h HIS 88 N 0.53 0.68 -0.59 0.00 -0.00 -1.16 -0.70 115.15 113.92 3dxm h HIS 88 Ca 0.13 -0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.38 3dxm h HIS 88 Cb 0.37 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 27.54 3dxm h HIS 88 CO 0.03 0.52 0.01 0.87 -0.00 0.00 0.00 177.93 179.36 3dxm h LYS 89 N 0.64 1.04 -0.26 5.26 1.57 -1.06 -1.87 116.57 121.90 3dxm h LYS 89 Ca 0.17 -0.33 -0.04 0.00 -1.87 0.00 0.00 60.65 58.58 3dxm h LYS 89 Cb 0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 3dxm h LYS 89 CO -0.02 1.02 0.01 0.35 -0.57 0.00 0.00 179.45 180.23 3dxm h PHE 90 N 0.93 0.49 -0.62 -1.35 3.57 -0.90 0.19 116.94 119.25 3dxm h PHE 90 Ca 0.17 -0.08 -0.06 0.00 3.53 0.00 0.00 57.97 61.53 3dxm h PHE 90 Cb 0.54 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 3dxm h PHE 90 CO 0.04 0.60 0.16 0.52 -2.23 0.00 0.00 178.31 177.40 3dxm h MET 91 N 0.24 0.99 -0.54 1.11 2.86 -1.13 -1.85 114.93 116.61 3dxm h MET 91 Ca 0.07 -0.23 -0.03 0.00 -2.06 0.00 0.00 59.70 57.45 3dxm h MET 91 Cb 0.40 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 3dxm h MET 91 CO 0.01 0.90 0.24 -0.09 1.06 0.00 0.00 176.91 179.03 3dxm h ARG 92 N 0.91 0.79 -0.50 1.72 2.43 -1.23 -0.79 114.38 117.72 3dxm h ARG 92 Ca 0.20 -0.13 0.07 0.00 -0.81 0.00 0.00 59.98 59.31 3dxm h ARG 92 Cb 0.34 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 29.70 3dxm h ARG 92 CO 0.00 0.68 0.16 0.35 -1.51 0.00 0.00 179.97 179.64 3dxm h PHE 93 N 0.73 0.27 -0.21 2.20 3.57 -0.60 -0.99 116.94 121.91 3dxm h PHE 93 Ca 0.18 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.52 3dxm h PHE 93 Cb 0.16 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 38.85 3dxm h PHE 93 CO 0.00 0.07 -0.61 0.52 -2.23 0.00 0.00 178.31 176.06 3dxm h MET 94 N 0.32 0.72 -0.08 1.11 2.86 -1.07 -3.15 114.93 115.63 3dxm h MET 94 Ca 0.24 -0.49 -0.06 0.00 -2.06 0.00 0.00 59.70 57.33 3dxm h MET 94 Cb 0.28 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 3dxm h MET 94 CO -0.26 1.11 -0.25 0.52 1.06 0.00 0.00 176.91 179.09 3dxm h MET 95 N 0.53 0.13 0.00 1.72 2.86 -0.76 -1.16 114.93 118.26 3dxm h MET 95 Ca -0.01 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 3dxm h MET 95 Cb 1.20 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.85 3dxm h MET 95 CO 0.12 0.38 -0.04 1.98 1.06 0.00 0.00 176.91 180.42 3dxm h MET 96 N 0.12 0.00 -0.40 1.72 -1.53 -1.15 -1.88 114.93 111.81 3dxm h MET 96 Ca 0.02 0.00 -0.10 0.00 -3.44 0.00 0.00 59.70 56.18 3dxm h MET 96 Cb 0.51 0.00 -0.06 0.00 -0.55 0.00 0.00 31.60 31.50 3dxm h MET 96 CO 0.04 0.04 0.05 0.54 0.14 0.00 0.00 176.91 177.71 3dxm n ARG 97 N -3.21 2.81 -0.29 0.39 1.74 -0.46 -4.74 116.66 112.90 3dxm n ARG 97 Ca -0.01 -2.99 0.25 0.00 -0.77 0.00 0.00 57.85 54.33 3dxm n ARG 97 Cb 0.23 -1.93 0.58 0.00 -1.02 0.00 0.00 32.46 30.32 3dxm n ARG 97 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dxm h ALA 98 N 1.78 2.45 -0.36 7.54 0.00 -1.04 -1.35 119.26 128.28 3dxm h ALA 98 Ca 0.13 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3dxm h ALA 98 Cb 1.72 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.53 3dxm h ALA 98 CO 0.39 -0.81 0.00 0.93 0.00 0.00 0.00 179.25 179.77 3dxm h GLU 99 N 0.28 0.57 0.10 0.00 5.08 -1.85 -2.37 114.58 116.39 3dxm h GLU 99 Ca 0.54 -0.12 -0.28 0.00 -1.00 0.00 0.00 59.36 58.50 3dxm h GLU 99 Cb 1.59 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.76 3dxm h GLU 99 CO -0.19 0.59 -1.32 -0.91 -1.00 0.00 0.00 179.01 176.18 3dxm h ASN 100 N 0.54 0.34 -1.93 1.42 2.35 -1.67 -3.31 115.58 113.33 3dxm h ASN 100 Ca 0.12 -0.40 -0.78 0.00 -0.55 0.00 0.00 56.30 54.68 3dxm h ASN 100 Cb 0.34 -0.11 -0.23 0.00 0.05 0.00 0.00 38.32 38.37 3dxm h ASN 100 CO 0.01 1.33 1.32 0.33 -1.65 0.00 0.00 177.43 178.77 3dxm n PHE 101 N -3.46 2.71 0.00 1.19 -0.00 -0.83 -4.90 117.46 112.16 3dxm n PHE 101 Ca -0.10 -2.57 0.00 0.00 -0.00 0.00 0.00 57.45 54.78 3dxm n PHE 101 Cb 1.02 -1.35 0.00 0.00 -0.00 0.00 0.00 39.48 39.15 3dxm n PHE 101 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.76 178.73 3dxm n PHE 102 N 0.32 0.00 0.28 -5.13 1.16 -0.92 -1.17 117.46 112.00 3dxm n PHE 102 Ca 0.51 0.00 0.07 0.00 -1.87 0.00 0.00 57.45 56.17 3dxm n PHE 102 Cb 0.27 -0.07 0.11 0.00 -1.61 0.00 0.00 39.48 38.19 3dxm n PHE 102 CO 0.00 0.00 0.00 0.44 -1.87 0.00 0.00 176.76 175.33 3dxm n ILE 103 N -0.93 0.39 -3.40 1.97 -5.35 -1.26 -4.96 119.36 105.82 3dxm n ILE 103 Ca 0.00 -0.69 -0.36 0.00 -0.27 0.00 0.00 62.75 61.43 3dxm n ILE 103 Cb 0.26 0.99 -0.06 0.00 -1.74 0.00 0.00 39.64 39.10 3dxm n ILE 103 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 3dxm s LEU 104 N -1.13 4.39 0.33 7.28 1.43 -0.31 -0.14 118.68 130.52 3dxm s LEU 104 Ca 0.22 1.04 -0.13 0.00 -1.03 0.00 0.00 54.13 54.23 3dxm s LEU 104 Cb 0.14 -3.07 -0.08 0.00 0.03 0.00 0.00 46.19 43.20 3dxm s LEU 104 CO 0.19 0.17 0.72 -0.13 0.23 0.00 0.00 176.35 177.53 3dxm s ARG 105 N -1.71 3.93 0.46 1.70 0.52 -0.08 -4.72 118.95 119.05 3dxm s ARG 105 Ca 0.34 0.57 0.26 0.00 -0.52 0.00 0.00 55.73 56.38 3dxm s ARG 105 Cb -0.16 -2.45 0.88 0.00 0.52 0.00 0.00 34.95 33.75 3dxm s ARG 105 CO 0.18 0.13 1.80 0.00 0.02 0.00 0.00 175.30 177.44 3dxm h ARG 106 N 2.05 0.00 -4.12 3.54 3.08 -1.88 -3.44 114.38 113.61 3dxm h ARG 106 Ca -0.48 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.32 3dxm h ARG 106 Cb 1.18 0.00 -0.25 0.00 0.08 0.00 0.00 29.97 30.98 3dxm h ARG 106 CO 0.65 0.13 -0.73 0.15 -1.07 0.00 0.00 179.97 179.11 3dxm s LYS 107 N -3.51 0.30 0.60 0.04 1.02 -1.26 -4.83 119.74 112.10 3dxm s LYS 107 Ca 0.02 -0.36 -0.13 0.00 0.02 0.00 0.00 55.97 55.51 3dxm s LYS 107 Cb 0.09 -0.14 -0.04 0.00 -0.52 0.00 0.00 37.83 37.22 3dxm s LYS 107 CO 0.62 0.03 1.03 -2.14 -0.92 0.00 0.00 175.35 173.97 3dxm s PRO 108 N -0.73 3.46 0.36 -1.68 0.02 -1.26 -4.69 135.00 130.47 3dxm s PRO 108 Ca -0.06 0.96 -0.28 0.00 0.02 0.00 0.00 61.00 61.65 3dxm s PRO 108 Cb -0.05 -2.06 -0.10 0.00 0.02 0.00 0.00 34.50 32.31 3dxm s PRO 108 CO -0.00 -0.68 1.27 0.08 -0.33 0.00 0.00 177.00 177.34 3dxm s VAL 109 N -2.84 2.80 0.10 3.83 1.01 -1.26 -4.87 120.40 119.18 3dxm s VAL 109 Ca 0.59 0.76 -0.34 0.00 0.00 0.00 0.00 61.98 62.99 3dxm s VAL 109 Cb -0.13 -3.47 -0.14 0.00 0.00 0.00 0.00 36.38 32.65 3dxm s VAL 109 CO 0.44 0.15 1.61 1.21 0.00 0.00 0.00 175.10 178.51 3dxm n GLU 110 N 0.54 2.04 0.00 2.72 2.13 -1.26 -1.58 120.64 125.22 3dxm n GLU 110 Ca 0.02 0.74 0.00 0.00 0.66 0.00 0.00 57.16 58.57 3dxm n GLU 110 Cb 0.43 -2.50 0.00 0.00 0.27 0.00 0.00 31.44 29.64 3dxm n GLU 110 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3dxm n GLY 111 N 3.50 0.47 3.35 8.31 0.00 -1.26 -5.08 105.19 114.48 3dxm n GLY 111 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 3dxm n GLY 111 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dxm s TYR 112 N -2.00 1.67 0.00 1.61 1.51 -0.61 -4.88 117.35 114.65 3dxm s TYR 112 Ca 0.00 -0.74 0.08 0.00 -1.01 0.00 0.00 57.07 55.40 3dxm s TYR 112 Cb 0.00 -0.90 -0.23 0.00 -0.11 0.00 0.00 41.96 40.72 3dxm s TYR 112 CO 0.00 0.18 0.83 -0.44 -1.11 0.00 0.00 175.55 175.02 3dxm h ASP 113 N 2.48 0.07 -4.54 2.29 3.32 -1.51 -3.42 116.42 115.11 3dxm h ASP 113 Ca -0.38 -0.12 -0.10 0.00 0.02 0.00 0.00 57.03 56.45 3dxm h ASP 113 Cb 1.22 -0.02 -0.21 0.00 0.22 0.00 0.00 39.33 40.54 3dxm h ASP 113 CO 0.65 1.10 -0.10 -0.51 -1.72 0.00 0.00 179.24 178.65 3dxm s ILE 114 N -2.63 0.02 0.02 0.35 1.10 -1.14 -4.77 121.20 114.14 3dxm s ILE 114 Ca -0.05 -0.16 0.02 0.00 -0.51 0.00 0.00 60.65 59.95 3dxm s ILE 114 Cb 0.08 -0.74 -0.01 0.00 0.15 0.00 0.00 42.46 41.94 3dxm s ILE 114 CO 0.82 -0.09 -0.07 -0.44 -2.11 0.00 0.00 174.94 173.06 3dxm s SER 115 N -0.62 0.78 0.11 4.50 0.01 -1.26 -0.63 113.70 116.59 3dxm s SER 115 Ca -0.07 -0.30 0.07 0.00 1.31 0.00 0.00 55.95 56.96 3dxm s SER 115 Cb -0.03 -0.03 -0.04 0.00 0.21 0.00 0.00 66.02 66.13 3dxm s SER 115 CO 0.04 -0.05 -0.08 -0.36 0.41 0.00 0.00 173.24 173.20 3dxm s PHE 116 N -0.68 2.76 -0.29 2.43 0.40 0.29 -0.90 117.98 121.99 3dxm s PHE 116 Ca -0.03 -0.15 -0.01 0.00 -0.60 0.00 0.00 56.93 56.14 3dxm s PHE 116 Cb -0.06 -1.43 0.09 0.00 0.51 0.00 0.00 43.02 42.14 3dxm s PHE 116 CO 0.00 0.44 0.09 -1.17 0.70 0.00 0.00 175.22 175.29 3dxm s LEU 117 N -2.31 1.94 -0.21 -0.37 2.96 0.80 -0.64 118.68 120.85 3dxm s LEU 117 Ca 0.22 -1.49 -0.07 0.00 -0.22 0.00 0.00 54.13 52.57 3dxm s LEU 117 Cb -0.11 -0.79 -0.04 0.00 0.50 0.00 0.00 46.19 45.76 3dxm s LEU 117 CO 0.15 -0.40 0.07 -0.63 -1.32 0.00 0.00 176.35 174.21 3dxm s ILE 118 N 1.69 4.55 0.42 6.68 1.01 -0.06 -4.62 121.20 130.88 3dxm s ILE 118 Ca 0.08 -0.10 0.07 0.00 0.00 0.00 0.00 60.65 60.70 3dxm s ILE 118 Cb -0.17 -3.09 -0.04 0.00 0.01 0.00 0.00 42.46 39.18 3dxm s ILE 118 CO -0.24 0.40 0.28 0.42 0.00 0.00 0.00 174.94 175.80 3dxm s THR 119 N 0.96 2.46 0.58 2.92 -4.23 -1.26 -0.37 115.64 116.71 3dxm s THR 119 Ca 0.04 -1.52 0.28 0.00 -1.18 0.00 0.00 61.69 59.30 3dxm s THR 119 Cb -0.14 -2.99 0.35 0.00 1.34 0.00 0.00 72.50 71.06 3dxm s THR 119 CO 0.03 0.00 2.19 -0.55 -0.54 0.00 0.00 174.62 175.74 3dxm h ASN 120 N 1.23 0.00 0.50 3.99 -1.07 -1.63 0.59 115.58 119.19 3dxm h ASN 120 Ca -0.42 0.00 -0.09 0.00 0.07 0.00 0.00 56.30 55.86 3dxm h ASN 120 Cb 1.26 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.50 3dxm h ASN 120 CO 0.64 0.00 -0.42 -0.26 0.07 0.00 0.00 177.43 177.45 3dxm h PHE 121 N 0.00 0.00 0.01 4.14 -1.00 -1.95 -1.26 116.94 116.88 3dxm h PHE 121 Ca 0.04 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.68 3dxm h PHE 121 Cb 0.20 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.77 3dxm h PHE 121 CO 0.00 0.42 -0.53 0.45 -1.61 0.00 0.00 178.31 177.04 3dxm h HIS 122 N 0.00 0.53 0.00 -0.55 3.86 -1.28 -2.88 115.15 114.82 3dxm h HIS 122 Ca -0.00 -0.29 0.00 0.00 -1.16 0.00 0.00 60.37 58.92 3dxm h HIS 122 Cb 0.79 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.20 3dxm h HIS 122 CO 0.00 1.11 0.00 0.25 0.86 0.00 0.00 177.93 180.15 3dxm n THR 123 N -4.28 1.00 0.03 2.45 -2.24 -0.97 -0.88 114.28 109.38 3dxm n THR 123 Ca -0.10 0.27 -0.21 0.00 -2.27 0.00 0.00 64.05 61.74 3dxm n THR 123 Cb 0.64 -1.10 -0.14 0.00 -2.10 0.00 0.00 70.33 67.63 3dxm n THR 123 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3dxm h GLU 124 N 0.00 0.29 -0.03 -0.78 5.08 -1.18 -3.38 114.58 114.59 3dxm h GLU 124 Ca 0.00 -0.50 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 3dxm h GLU 124 Cb 0.27 0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3dxm h GLU 124 CO 0.00 1.21 -0.05 0.00 -1.00 0.00 0.00 179.01 179.17 3dxm n GLN 125 N -3.49 2.08 -3.91 2.33 10.64 -1.06 -4.92 117.38 119.05 3dxm n GLN 125 Ca -0.28 -1.64 -0.11 0.00 -1.83 0.00 0.00 57.00 53.14 3dxm n GLN 125 Cb 1.06 -1.47 -0.13 0.00 -0.86 0.00 0.00 30.24 28.84 3dxm n GLN 125 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 3dxm s MET 126 N -2.05 0.11 -0.09 2.61 -1.94 -0.06 -5.08 119.30 112.79 3dxm s MET 126 Ca 0.29 -0.21 -0.29 0.00 -1.71 0.00 0.00 55.69 53.77 3dxm s MET 126 Cb 0.20 0.04 -0.06 0.00 2.01 0.00 0.00 34.83 37.01 3dxm s MET 126 CO 0.33 -0.02 1.94 0.71 -0.01 0.00 0.00 175.02 177.97 3dxm s TYR 127 N -0.50 1.48 0.55 -0.03 1.51 -1.26 -4.41 117.35 114.69 3dxm s TYR 127 Ca -0.05 0.08 0.24 0.00 -1.01 0.00 0.00 57.07 56.33 3dxm s TYR 127 Cb -0.03 -4.07 1.49 0.00 -0.11 0.00 0.00 41.96 39.23 3dxm s TYR 127 CO -0.00 -4.47 2.09 1.57 -1.11 0.00 0.00 175.55 173.62 3dxm h LYS 128 N 11.77 0.00 0.00 -0.62 2.10 -1.90 0.14 116.57 128.06 3dxm h LYS 128 Ca -0.43 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.17 3dxm h LYS 128 Cb 1.22 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.54 3dxm h LYS 128 CO 0.96 0.00 -0.26 1.12 -2.00 0.00 0.00 179.45 179.27 3dxm h HIS 129 N 0.00 0.00 0.00 0.07 2.07 -1.96 -2.19 115.15 113.14 3dxm h HIS 129 Ca 0.11 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.54 3dxm h HIS 129 Cb 0.49 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.45 3dxm h HIS 129 CO 0.00 0.26 -0.66 0.87 -3.07 0.00 0.00 177.93 175.32 3dxm h LYS 130 N 0.00 0.00 -0.12 5.12 1.79 -1.12 -2.12 116.57 120.13 3dxm h LYS 130 Ca -0.00 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.25 3dxm h LYS 130 Cb 0.95 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.61 3dxm h LYS 130 CO 0.03 0.30 -0.80 -0.07 -1.08 0.00 0.00 179.45 177.83 3dxm h LEU 131 N 0.00 0.85 -0.56 2.94 3.38 -1.12 -0.15 115.31 120.65 3dxm h LEU 131 Ca -0.04 -0.57 -0.06 0.00 0.09 0.00 0.00 57.88 57.31 3dxm h LEU 131 Cb 1.31 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 3dxm h LEU 131 CO 0.04 1.36 0.13 0.58 0.09 0.00 0.00 178.44 180.64 3dxm h VAL 132 N 0.47 1.25 -0.78 1.22 2.07 -1.39 -1.74 116.25 117.35 3dxm h VAL 132 Ca -0.06 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.57 3dxm h VAL 132 Cb 1.42 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 3dxm h VAL 132 CO 0.16 0.33 0.49 0.44 0.02 0.00 0.00 177.57 179.01 3dxm h ASP 133 N 0.80 0.92 -0.48 0.57 3.32 -1.23 -2.79 116.42 117.52 3dxm h ASP 133 Ca 0.17 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 3dxm h ASP 133 Cb 0.36 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 3dxm h ASP 133 CO 0.00 0.69 0.29 0.15 -1.72 0.00 0.00 179.24 178.65 3dxm h PHE 134 N 1.06 0.63 -0.65 4.55 3.57 -0.45 0.27 116.94 125.92 3dxm h PHE 134 Ca 0.28 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.76 3dxm h PHE 134 Cb -0.08 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.42 3dxm h PHE 134 CO -0.01 0.44 0.33 0.28 -2.23 0.00 0.00 178.31 177.12 3dxm h VAL 135 N 0.64 1.21 -0.32 1.41 2.07 -1.15 0.32 116.25 120.43 3dxm h VAL 135 Ca 0.17 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 3dxm h VAL 135 Cb -0.01 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 3dxm h VAL 135 CO -0.03 0.24 0.04 0.40 0.02 0.00 0.00 177.57 178.24 3dxm h ILE 136 N 0.90 1.24 -0.85 4.57 1.08 -1.32 -1.45 117.51 121.68 3dxm h ILE 136 Ca 0.23 -0.84 0.05 0.00 -0.39 0.00 0.00 64.86 63.91 3dxm h ILE 136 Cb 0.08 1.17 -0.06 0.00 -3.07 0.00 0.00 36.82 34.95 3dxm h ILE 136 CO -0.03 0.28 0.53 -0.74 -0.69 0.00 0.00 178.15 177.50 3dxm h HIS 137 N 0.35 0.99 -0.24 1.37 -0.00 -0.56 -1.87 115.15 115.20 3dxm h HIS 137 Ca 0.10 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.49 3dxm h HIS 137 Cb 0.36 -0.32 -0.01 0.00 -0.00 0.00 0.00 27.41 27.44 3dxm h HIS 137 CO 0.03 0.53 0.12 0.35 -0.00 0.00 0.00 177.93 178.96 3dxm h PHE 138 N 1.00 0.34 -0.86 5.26 3.57 -0.05 -0.10 116.94 126.09 3dxm h PHE 138 Ca 0.36 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.85 3dxm h PHE 138 Cb 0.12 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.71 3dxm h PHE 138 CO -0.03 0.31 0.54 0.52 -2.23 0.00 0.00 178.31 177.42 3dxm h MET 139 N 0.27 1.14 -0.22 1.11 2.86 -0.86 -0.91 114.93 118.32 3dxm h MET 139 Ca 0.08 -0.08 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 3dxm h MET 139 Cb 0.09 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 3dxm h MET 139 CO -0.01 0.78 -0.09 0.93 1.06 0.00 0.00 176.91 179.58 3dxm h GLU 140 N 1.17 0.45 -0.03 1.72 5.08 -1.16 -3.27 114.58 118.53 3dxm h GLU 140 Ca 0.31 -0.19 -0.15 0.00 -1.00 0.00 0.00 59.36 58.33 3dxm h GLU 140 Cb -0.09 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 3dxm h GLU 140 CO -0.06 0.71 -0.66 0.93 -1.00 0.00 0.00 179.01 178.93 3dxm h GLU 141 N 0.16 0.15 -0.10 2.33 4.39 -0.79 -3.00 114.58 117.71 3dxm h GLU 141 Ca 0.05 -0.11 -0.09 0.00 0.34 0.00 0.00 59.36 59.54 3dxm h GLU 141 Cb 0.57 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.23 3dxm h GLU 141 CO 0.03 0.76 -0.36 -0.84 -1.16 0.00 0.00 179.01 177.43 3dxm h ILE 142 N 0.10 1.28 -0.21 3.13 3.07 -1.27 -0.83 117.51 122.80 3dxm h ILE 142 Ca -0.01 -1.38 -0.04 0.00 1.55 0.00 0.00 64.86 64.99 3dxm h ILE 142 Cb 1.18 1.61 -0.01 0.00 -0.27 0.00 0.00 36.82 39.33 3dxm h ILE 142 CO 0.10 0.41 -0.01 0.44 -1.05 0.00 0.00 178.15 178.04 3dxm h ASP 143 N 0.18 0.37 -0.52 2.16 3.32 -1.60 -1.33 116.42 119.00 3dxm h ASP 143 Ca 0.02 -0.32 -0.06 0.00 0.02 0.00 0.00 57.03 56.69 3dxm h ASP 143 Cb 0.73 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 3dxm h ASP 143 CO 0.05 0.60 0.10 0.11 -1.72 0.00 0.00 179.24 178.38 3dxm h LYS 144 N 0.13 0.91 -0.38 3.56 1.57 -1.36 -1.97 116.57 119.04 3dxm h LYS 144 Ca 0.06 -0.22 -0.14 0.00 -1.87 0.00 0.00 60.65 58.48 3dxm h LYS 144 Cb 0.42 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3dxm h LYS 144 CO 0.01 0.84 -0.33 1.49 -0.57 0.00 0.00 179.45 180.90 3dxm h GLU 145 N 0.86 0.85 -0.44 3.15 4.57 -1.07 -1.02 114.58 121.48 3dxm h GLU 145 Ca 0.18 -0.41 -0.07 0.00 -1.18 0.00 0.00 59.36 57.88 3dxm h GLU 145 Cb 0.37 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 3dxm h GLU 145 CO 0.01 1.05 -0.01 0.82 -1.18 0.00 0.00 179.01 179.70 3dxm h ILE 146 N 0.71 1.23 -0.28 2.32 2.04 -1.03 0.10 117.51 122.61 3dxm h ILE 146 Ca 0.07 -0.97 -0.08 0.00 1.00 0.00 0.00 64.86 64.88 3dxm h ILE 146 Cb 0.89 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 3dxm h ILE 146 CO 0.08 0.34 -0.14 0.28 0.00 0.00 0.00 178.15 178.71 3dxm h SER 147 N 0.68 0.61 -0.67 1.72 0.02 -1.14 -1.67 113.55 113.10 3dxm h SER 147 Ca 0.13 -0.41 -0.05 0.00 -0.84 0.00 0.00 61.79 60.62 3dxm h SER 147 Cb 0.43 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.78 3dxm h SER 147 CO 0.02 0.89 0.22 -0.33 -1.14 0.00 0.00 176.83 176.48 3dxm h GLU 148 N 0.33 1.05 -0.62 3.45 4.39 -0.82 -1.51 114.58 120.85 3dxm h GLU 148 Ca 0.06 -0.21 -0.04 0.00 0.34 0.00 0.00 59.36 59.51 3dxm h GLU 148 Cb 0.66 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 3dxm h GLU 148 CO 0.04 0.90 0.23 0.52 -1.16 0.00 0.00 179.01 179.54 3dxm h MET 149 N 1.02 0.94 -0.32 2.33 2.86 -0.70 -0.60 114.93 120.46 3dxm h MET 149 Ca 0.22 -0.18 0.02 0.00 -2.06 0.00 0.00 59.70 57.70 3dxm h MET 149 Cb 0.28 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 3dxm h MET 149 CO -0.01 0.81 0.18 -0.22 1.06 0.00 0.00 176.91 178.72 3dxm h LYS 150 N 0.88 0.35 -0.75 1.72 3.64 -0.82 -1.16 116.57 120.43 3dxm h LYS 150 Ca 0.21 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 3dxm h LYS 150 Cb 0.23 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 3dxm h LYS 150 CO -0.01 0.23 0.39 -0.07 -2.27 0.00 0.00 179.45 177.72 3dxm h LEU 151 N 0.36 0.95 0.28 5.20 3.38 -1.02 -2.48 115.31 121.99 3dxm h LEU 151 Ca 0.13 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 3dxm h LEU 151 Cb 0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3dxm h LEU 151 CO -0.08 0.80 -0.22 0.28 0.09 0.00 0.00 178.44 179.31 3dxm h SER 152 N 1.04 -0.57 -0.30 -0.43 0.02 -0.50 0.17 113.55 112.98 3dxm h SER 152 Ca 0.26 0.05 0.05 0.00 -0.84 0.00 0.00 61.79 61.31 3dxm h SER 152 Cb 0.07 0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.75 3dxm h SER 152 CO -0.04 -0.34 0.01 0.58 -1.14 0.00 0.00 176.83 175.91 3dxm h VAL 153 N -0.51 0.79 -0.82 2.27 2.07 -1.15 -0.18 116.25 118.73 3dxm h VAL 153 Ca -0.02 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 3dxm h VAL 153 Cb 0.45 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 3dxm h VAL 153 CO -0.01 0.02 0.50 0.78 0.02 0.00 0.00 177.57 178.88 3dxm h ASN 154 N 0.10 0.97 -0.24 0.57 4.21 -1.26 -0.31 115.58 119.63 3dxm h ASN 154 Ca 0.14 -0.06 -0.01 0.00 1.21 0.00 0.00 56.30 57.59 3dxm h ASN 154 Cb 0.19 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 37.13 3dxm h ASN 154 CO -0.23 0.74 0.12 0.00 -1.29 0.00 0.00 177.43 176.77 3dxm h ALA 155 N 1.27 0.30 0.00 -0.83 0.00 0.04 -2.29 119.26 117.77 3dxm h ALA 155 Ca 0.29 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 3dxm h ALA 155 Cb -0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3dxm h ALA 155 CO -0.06 -0.15 -0.49 0.07 0.00 0.00 0.00 179.25 178.63 3dxm h ARG 156 N 0.26 0.00 -0.51 0.00 0.11 -0.87 -3.06 114.38 110.31 3dxm h ARG 156 Ca 0.08 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.13 3dxm h ARG 156 Cb 0.10 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.16 3dxm h ARG 156 CO -0.01 0.49 0.18 0.00 0.10 0.00 0.00 179.97 180.72 3dxm h ALA 157 N 1.51 0.67 -0.69 0.08 0.00 -0.74 -1.06 119.26 119.03 3dxm h ALA 157 Ca -0.00 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 3dxm h ALA 157 Cb 0.86 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 3dxm h ALA 157 CO 0.06 0.31 0.16 -0.09 0.00 0.00 0.00 179.25 179.69 3dxm h ARG 158 N 0.70 1.10 -0.18 0.00 2.43 -1.33 -0.54 114.38 116.56 3dxm h ARG 158 Ca 0.17 -0.27 -0.11 0.00 -0.81 0.00 0.00 59.98 58.96 3dxm h ARG 158 Cb 0.25 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 3dxm h ARG 158 CO -0.01 0.98 -0.36 0.82 -1.51 0.00 0.00 179.97 179.89 3dxm h ILE 159 N 1.04 1.29 -0.26 1.20 2.04 -1.43 -0.93 117.51 120.46 3dxm h ILE 159 Ca 0.21 -1.45 -0.18 0.00 1.00 0.00 0.00 64.86 64.44 3dxm h ILE 159 Cb 0.38 1.55 -0.00 0.00 -0.74 0.00 0.00 36.82 38.01 3dxm h ILE 159 CO 0.00 0.45 -0.55 0.58 0.00 0.00 0.00 178.15 178.63 3dxm h VAL 160 N 0.33 1.29 -0.28 1.67 2.07 -0.86 -0.59 116.25 119.88 3dxm h VAL 160 Ca 0.04 -1.75 -0.19 0.00 0.82 0.00 0.00 66.70 65.62 3dxm h VAL 160 Cb 0.79 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 3dxm h VAL 160 CO 0.06 0.57 -0.55 0.00 0.02 0.00 0.00 177.57 177.67 3dxm h ALA 161 N 0.76 0.48 -0.47 1.67 0.00 -0.97 -3.04 119.26 117.69 3dxm h ALA 161 Ca 0.01 -0.52 -0.13 0.00 0.00 0.00 0.00 54.91 54.27 3dxm h ALA 161 Cb 1.15 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 3dxm h ALA 161 CO 0.12 0.68 -0.23 0.93 0.00 0.00 0.00 179.25 180.75 3dxm h GLU 162 N 0.66 0.98 -0.75 0.00 5.08 -1.14 -1.87 114.58 117.54 3dxm h GLU 162 Ca 0.01 -0.43 -0.02 0.00 -1.00 0.00 0.00 59.36 57.92 3dxm h GLU 162 Cb 1.16 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 3dxm h GLU 162 CO 0.12 1.10 0.37 1.49 -1.00 0.00 0.00 179.01 181.10 3dxm h GLU 163 N 0.84 1.06 0.24 2.33 4.57 -1.12 -0.18 114.58 122.32 3dxm h GLU 163 Ca 0.11 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 3dxm h GLU 163 Cb 0.81 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 3dxm h GLU 163 CO 0.07 0.82 -0.12 0.35 -1.18 0.00 0.00 179.01 178.95 3dxm h PHE 164 N 1.04 -0.30 -0.84 0.92 3.57 -1.51 -3.28 116.94 116.54 3dxm h PHE 164 Ca 0.26 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.79 3dxm h PHE 164 Cb 0.10 0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.89 3dxm h PHE 164 CO 0.01 0.07 0.55 -0.07 -2.23 0.00 0.00 178.31 176.64 3dxm h LEU 165 N -0.87 0.89 -1.13 0.59 4.07 -1.33 -2.54 115.31 114.99 3dxm h LEU 165 Ca -0.03 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.92 3dxm h LEU 165 Cb 0.51 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.05 3dxm h LEU 165 CO 0.05 0.61 0.00 0.07 -1.08 0.00 0.00 178.44 178.09 3dxm h LYS 166 N 1.03 0.00 -0.00 1.13 2.10 -1.13 -3.06 116.57 116.64 3dxm h LYS 166 Ca 0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.99 3dxm h LYS 166 Cb 0.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.39 3dxm h LYS 166 CO -0.10 0.00 -0.26 0.09 -2.00 0.00 0.00 179.45 177.18 3dxm n ASN 167 N -2.63 0.44 0.00 7.07 3.02 -0.96 -5.09 115.26 117.11 3dxm n ASN 167 Ca 0.01 -0.24 0.10 0.00 -0.03 0.00 0.00 54.58 54.42 3dxm n ASN 167 Cb 0.25 -0.02 0.60 0.00 -0.61 0.00 0.00 39.78 40.00 3dxm n ASN 167 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13