#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m9y s GLN 13 N 0.00 1.81 0.08 1.57 -0.21 -1.26 -5.11 119.66 116.55 1m9y s GLN 13 Ca 0.00 -0.89 -0.31 0.00 0.02 0.00 0.00 55.36 54.18 1m9y s GLN 13 Cb 0.00 -2.46 -0.08 0.00 1.00 0.00 0.00 33.01 31.47 1m9y s GLN 13 CO 0.00 -0.50 1.55 0.00 -2.12 0.00 0.00 175.29 174.22 1m9y s ALA 14 N 1.41 3.67 0.29 6.09 0.00 -1.26 -4.84 121.76 127.12 1m9y s ALA 14 Ca -0.03 1.17 -0.10 0.00 0.00 0.00 0.00 51.96 53.00 1m9y s ALA 14 Cb -0.17 -3.64 -0.09 0.00 0.00 0.00 0.00 23.12 19.22 1m9y s ALA 14 CO -0.07 -0.94 -0.07 0.44 0.00 0.00 0.00 175.76 175.12 1m9y n ILE 15 N 4.45 0.00 -3.47 0.00 -6.64 -1.26 -4.92 119.36 107.52 1m9y n ILE 15 Ca 0.14 -0.29 -0.38 0.00 -1.77 0.00 0.00 62.75 60.46 1m9y n ILE 15 Cb 0.41 0.00 -0.06 0.00 -1.44 0.00 0.00 39.64 38.55 1m9y n ILE 15 CO 0.00 0.00 0.00 -0.94 -1.77 0.00 0.00 176.55 173.84 1m9y s SER 16 N -0.58 6.76 0.63 7.28 1.04 -1.26 -4.98 113.70 122.60 1m9y s SER 16 Ca 0.33 0.91 0.23 0.00 0.48 0.00 0.00 55.95 57.90 1m9y s SER 16 Cb -0.29 -2.25 1.09 0.00 0.10 0.00 0.00 66.02 64.67 1m9y s SER 16 CO 0.38 0.25 1.58 -0.65 0.98 0.00 0.00 173.24 175.78 1m9y h PRO 17 N 5.20 0.00 0.00 4.02 0.11 -1.98 -1.96 132.00 137.39 1m9y h PRO 17 Ca -0.49 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 1m9y h PRO 17 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1m9y h PRO 17 CO 0.65 0.00 -0.45 0.00 -0.21 0.00 0.00 178.00 177.99 1m9y h ARG 18 N 0.00 0.00 -0.97 1.05 2.47 -1.98 0.20 114.38 115.15 1m9y h ARG 18 Ca 0.19 0.00 0.15 0.00 -1.26 0.00 0.00 59.98 59.07 1m9y h ARG 18 Cb 1.66 0.00 -0.09 0.00 -1.65 0.00 0.00 29.97 29.89 1m9y h ARG 18 CO -0.00 0.71 0.61 1.15 0.56 0.00 0.00 179.97 183.00 1m9y h THR 19 N -1.00 0.81 -0.21 2.04 2.02 -1.86 -0.64 112.91 114.07 1m9y h THR 19 Ca -0.11 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 66.75 1m9y h THR 19 Cb 0.86 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1m9y h THR 19 CO -0.07 0.15 -0.06 -0.07 0.37 0.00 0.00 175.52 175.84 1m9y h LEU 20 N 0.80 0.42 -1.95 2.58 3.38 -1.44 -1.71 115.31 117.39 1m9y h LEU 20 Ca 0.51 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1m9y h LEU 20 Cb 0.73 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 1m9y h LEU 20 CO -0.28 0.70 -0.11 0.78 0.09 0.00 0.00 178.44 179.62 1m9y h ASN 21 N 0.14 0.00 0.20 -0.43 -0.26 -0.22 -1.21 115.58 113.80 1m9y h ASN 21 Ca 0.05 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.78 1m9y h ASN 21 Cb 0.52 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.79 1m9y h ASN 21 CO 0.02 0.11 -0.10 0.00 -1.06 0.00 0.00 177.43 176.41 1m9y h ALA 22 N 1.89 -0.27 -0.27 -0.83 0.00 -0.86 -1.25 119.26 117.66 1m9y h ALA 22 Ca -0.00 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.80 1m9y h ALA 22 Cb 0.25 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1m9y h ALA 22 CO 0.01 -0.53 0.01 2.35 0.00 0.00 0.00 179.25 181.09 1m9y h TRP 23 N -0.52 0.00 -0.77 0.00 2.91 -1.22 0.38 115.95 116.73 1m9y h TRP 23 Ca -0.03 0.02 0.16 0.00 1.13 0.00 0.00 58.89 60.17 1m9y h TRP 23 Cb 0.39 0.04 -0.10 0.00 -0.51 0.00 0.00 29.16 28.98 1m9y h TRP 23 CO 0.01 -0.03 0.29 0.28 -1.03 0.00 0.00 178.44 177.95 1m9y h VAL 24 N 0.09 0.61 -0.01 2.65 2.07 -1.00 -1.13 116.25 119.53 1m9y h VAL 24 Ca 0.13 -0.14 -0.17 0.00 0.82 0.00 0.00 66.70 67.34 1m9y h VAL 24 Cb 0.17 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1m9y h VAL 24 CO -0.21 0.07 -0.76 0.11 0.02 0.00 0.00 177.57 176.80 1m9y h LYS 25 N 0.41 0.09 0.24 1.57 1.57 -0.78 -1.88 116.57 117.79 1m9y h LYS 25 Ca 0.44 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 59.12 1m9y h LYS 25 Cb 0.70 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1m9y h LYS 25 CO -0.44 0.81 -0.12 0.28 -0.57 0.00 0.00 179.45 179.41 1m9y h VAL 26 N 0.05 0.78 -0.59 0.50 2.07 0.65 -2.87 116.25 116.85 1m9y h VAL 26 Ca -0.02 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1m9y h VAL 26 Cb 1.34 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1m9y h VAL 26 CO 0.11 0.03 0.29 0.58 0.02 0.00 0.00 177.57 178.60 1m9y h VAL 27 N -0.38 1.19 0.00 2.57 2.07 -1.19 -2.46 116.25 118.05 1m9y h VAL 27 Ca -0.03 -0.52 -0.08 0.00 0.82 0.00 0.00 66.70 66.89 1m9y h VAL 27 Cb 0.29 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1m9y h VAL 27 CO 0.05 0.22 -0.37 -0.08 0.02 0.00 0.00 177.57 177.41 1m9y h GLU 28 N 0.83 0.00 0.00 1.57 4.81 -1.36 -2.77 114.58 117.67 1m9y h GLU 28 Ca 0.21 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1m9y h GLU 28 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1m9y h GLU 28 CO -0.03 0.37 0.00 -1.91 -0.73 0.00 0.00 179.01 176.71 1m9y n GLU 29 N -3.75 0.00 0.00 1.92 4.07 -1.08 -4.52 120.64 117.28 1m9y n GLU 29 Ca -0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.09 1m9y n GLU 29 Cb 0.46 -0.20 0.00 0.00 -0.06 0.00 0.00 31.44 31.64 1m9y n GLU 29 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1m9y n LYS 30 N -1.91 0.00 0.00 5.31 4.76 -0.95 -4.87 118.16 120.51 1m9y n LYS 30 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1m9y n LYS 30 Cb 0.00 -1.37 0.00 0.00 -1.84 0.00 0.00 35.03 31.82 1m9y n LYS 30 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1m9y n ALA 31 N -0.79 0.00 -2.83 7.82 0.00 -1.04 -1.53 120.51 122.13 1m9y n ALA 31 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1m9y n ALA 31 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 1m9y n ALA 31 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1m9y n PHE 32 N 5.30 1.02 -2.32 0.00 3.72 -1.26 -4.63 117.46 119.29 1m9y n PHE 32 Ca 0.00 -3.17 -0.29 0.00 -0.05 0.00 0.00 57.45 53.94 1m9y n PHE 32 Cb 0.00 -0.38 0.01 0.00 -0.94 0.00 0.00 39.48 38.17 1m9y n PHE 32 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1m9y s SER 33 N -2.93 6.16 0.66 4.37 1.04 -0.58 -4.44 113.70 117.98 1m9y s SER 33 Ca 0.33 1.09 0.32 0.00 0.48 0.00 0.00 55.95 58.16 1m9y s SER 33 Cb 0.42 -2.27 1.74 0.00 0.10 0.00 0.00 66.02 66.02 1m9y s SER 33 CO -0.01 -0.75 1.99 -0.65 0.98 0.00 0.00 173.24 174.80 1m9y h PRO 34 N -0.03 0.00 0.00 4.02 0.11 -1.91 -2.57 132.00 131.62 1m9y h PRO 34 Ca -0.46 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 1m9y h PRO 34 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1m9y h PRO 34 CO 0.62 0.00 -0.17 0.93 -0.21 0.00 0.00 178.00 179.17 1m9y h GLU 35 N 0.00 0.00 -0.67 1.05 5.08 -1.91 -2.52 114.58 115.61 1m9y h GLU 35 Ca 0.02 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.52 1m9y h GLU 35 Cb 0.59 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 1m9y h GLU 35 CO -0.00 0.17 0.46 -0.24 -1.00 0.00 0.00 179.01 178.39 1m9y h VAL 36 N 0.00 0.79 0.10 3.13 3.04 -1.80 -2.83 116.25 118.69 1m9y h VAL 36 Ca -0.00 -0.10 -0.00 0.00 -1.01 0.00 0.00 66.70 65.58 1m9y h VAL 36 Cb 0.36 0.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.11 1m9y h VAL 36 CO 0.02 0.05 -0.05 0.40 -1.01 0.00 0.00 177.57 176.99 1m9y h ILE 37 N 0.30 1.10 -0.98 3.17 2.04 -1.68 0.10 117.51 121.56 1m9y h ILE 37 Ca 0.32 -1.26 0.11 0.00 1.00 0.00 0.00 64.86 65.03 1m9y h ILE 37 Cb 0.85 1.84 -0.08 0.00 -0.74 0.00 0.00 36.82 38.68 1m9y h ILE 37 CO -0.08 0.28 0.61 -0.65 0.00 0.00 0.00 178.15 178.31 1m9y h PRO 38 N -0.77 0.97 -0.61 2.37 0.11 -1.73 -1.22 132.00 131.12 1m9y h PRO 38 Ca -0.01 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.98 1m9y h PRO 38 Cb 0.57 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 31.43 1m9y h PRO 38 CO 0.02 0.64 0.17 0.52 -0.21 0.00 0.00 178.00 179.15 1m9y h MET 39 N 1.00 0.95 -0.36 1.05 2.86 -1.39 -1.49 114.93 117.54 1m9y h MET 39 Ca 0.47 -0.20 -0.11 0.00 -2.06 0.00 0.00 59.70 57.81 1m9y h MET 39 Cb 0.41 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 1m9y h MET 39 CO -0.25 0.83 -0.23 0.35 1.06 0.00 0.00 176.91 178.68 1m9y h PHE 40 N 0.91 0.79 -0.47 -0.22 3.57 0.35 -2.25 116.94 119.63 1m9y h PHE 40 Ca 0.20 -0.18 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 1m9y h PHE 40 Cb 0.30 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 1m9y h PHE 40 CO 0.02 0.87 0.28 0.77 -2.23 0.00 0.00 178.31 178.02 1m9y h SER 41 N 0.62 0.56 0.06 0.41 0.02 -0.40 -2.15 113.55 112.66 1m9y h SER 41 Ca 0.09 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1m9y h SER 41 Cb 0.71 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.11 1m9y h SER 41 CO 0.05 0.45 -0.03 0.00 -1.14 0.00 0.00 176.83 176.17 1m9y h ALA 42 N 1.13 -0.08 0.00 3.77 0.00 -1.22 -3.04 119.26 119.82 1m9y h ALA 42 Ca 0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1m9y h ALA 42 Cb -0.00 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1m9y h ALA 42 CO -0.03 -0.48 -0.02 -0.07 0.00 0.00 0.00 179.25 178.65 1m9y h LEU 43 N -0.22 0.00 -3.30 0.00 3.38 -1.36 -2.60 115.31 111.21 1m9y h LEU 43 Ca -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1m9y h LEU 43 Cb 0.19 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1m9y h LEU 43 CO 0.01 0.02 0.00 -1.54 0.09 0.00 0.00 178.44 177.03 1m9y n SER 44 N -3.31 3.55 -4.71 -0.43 3.41 -0.82 -4.96 113.62 106.36 1m9y n SER 44 Ca -0.02 -3.20 -0.42 0.00 -0.26 0.00 0.00 58.87 54.96 1m9y n SER 44 Cb 0.14 -0.57 -0.03 0.00 -0.26 0.00 0.00 64.21 63.49 1m9y n SER 44 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1m9y s GLU 45 N -2.94 4.20 -0.15 4.33 2.02 -0.98 -2.13 118.70 123.04 1m9y s GLU 45 Ca 0.43 2.39 0.00 0.00 0.02 0.00 0.00 54.97 57.81 1m9y s GLU 45 Cb 0.36 -3.28 0.00 0.00 0.10 0.00 0.00 34.13 31.31 1m9y s GLU 45 CO 0.07 -0.67 0.00 0.41 0.02 0.00 0.00 175.26 175.09 1m9y n GLY 46 N 3.86 0.32 3.78 -1.39 0.00 -1.26 -4.96 105.19 105.55 1m9y n GLY 46 Ca 0.15 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 1m9y n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m9y s ALA 47 N -1.51 2.64 0.39 4.61 0.00 -0.91 -5.02 121.76 121.97 1m9y s ALA 47 Ca 0.00 0.66 -0.02 0.00 0.00 0.00 0.00 51.96 52.60 1m9y s ALA 47 Cb 0.00 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 1m9y s ALA 47 CO 0.00 -0.90 0.63 0.95 0.00 0.00 0.00 175.76 176.44 1m9y s THR 48 N -2.07 5.03 0.28 0.00 -4.23 -1.26 -4.34 115.64 109.05 1m9y s THR 48 Ca 0.69 -0.19 0.01 0.00 -1.18 0.00 0.00 61.69 61.02 1m9y s THR 48 Cb -0.21 -3.85 0.28 0.00 1.34 0.00 0.00 72.50 70.05 1m9y s THR 48 CO 0.32 -0.64 1.69 -0.65 -0.54 0.00 0.00 174.62 174.80 1m9y h PRO 49 N 0.65 0.34 -0.84 3.99 0.11 -1.87 -0.84 132.00 133.54 1m9y h PRO 49 Ca -0.49 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 1m9y h PRO 49 Cb 1.21 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 1m9y h PRO 49 CO 0.62 0.22 0.52 0.37 -0.21 0.00 0.00 178.00 179.52 1m9y h GLN 50 N 0.35 1.13 -0.29 1.05 4.15 -1.91 0.36 115.11 119.96 1m9y h GLN 50 Ca 0.52 -0.09 -0.01 0.00 0.77 0.00 0.00 58.65 59.84 1m9y h GLN 50 Cb 0.96 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 28.39 1m9y h GLN 50 CO -0.53 0.78 0.15 -0.44 -1.93 0.00 0.00 178.83 176.85 1m9y h ASP 51 N 1.15 0.37 -0.57 -0.69 3.32 -1.59 -1.17 116.42 117.24 1m9y h ASP 51 Ca 0.30 -0.10 0.10 0.00 0.02 0.00 0.00 57.03 57.35 1m9y h ASP 51 Cb -0.07 -0.09 -0.08 0.00 0.22 0.00 0.00 39.33 39.30 1m9y h ASP 51 CO -0.06 0.37 0.15 -0.07 -1.72 0.00 0.00 179.24 177.90 1m9y h LEU 52 N 0.34 0.06 -1.47 1.55 3.38 -1.01 -1.20 115.31 116.96 1m9y h LEU 52 Ca 0.10 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 1m9y h LEU 52 Cb 0.09 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1m9y h LEU 52 CO -0.01 0.05 -0.27 0.78 0.09 0.00 0.00 178.44 179.07 1m9y h ASN 53 N 0.29 0.00 0.63 -0.43 2.35 -0.51 -0.63 115.58 117.28 1m9y h ASN 53 Ca 0.29 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.84 1m9y h ASN 53 Cb 0.41 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1m9y h ASN 53 CO -0.36 0.27 -0.90 0.71 -1.65 0.00 0.00 177.43 175.50 1m9y h THR 54 N 0.00 1.51 -0.36 2.81 1.35 -0.58 -0.46 112.91 117.19 1m9y h THR 54 Ca -0.00 -2.71 -0.06 0.00 -0.55 0.00 0.00 66.41 63.09 1m9y h THR 54 Cb 0.50 2.52 -0.01 0.00 -1.73 0.00 0.00 68.15 69.43 1m9y h THR 54 CO 0.03 0.79 -0.01 0.24 -0.25 0.00 0.00 175.52 176.32 1m9y h MET 55 N 0.09 0.64 -0.19 4.72 2.86 -0.91 -2.55 114.93 119.59 1m9y h MET 55 Ca -0.04 -0.21 -0.09 0.00 -2.06 0.00 0.00 59.70 57.30 1m9y h MET 55 Cb 1.54 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 33.14 1m9y h MET 55 CO 0.14 0.76 -0.27 -0.07 1.06 0.00 0.00 176.91 178.53 1m9y h LEU 56 N 0.45 0.37 -0.54 1.22 3.38 -0.86 -3.21 115.31 116.12 1m9y h LEU 56 Ca 0.10 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1m9y h LEU 56 Cb 0.48 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1m9y h LEU 56 CO 0.02 0.64 0.00 0.78 0.09 0.00 0.00 178.44 179.97 1m9y h ASN 57 N 0.33 0.00 1.74 -0.43 2.35 -0.94 -1.84 115.58 116.80 1m9y h ASN 57 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1m9y h ASN 57 Cb 0.65 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.02 1m9y h ASN 57 CO 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.83 1m9y h THR 58 N 0.00 0.00 -3.19 2.81 1.03 -1.46 -3.43 112.91 108.68 1m9y h THR 58 Ca 0.00 -0.75 -0.56 0.00 -0.01 0.00 0.00 66.41 65.09 1m9y h THR 58 Cb 0.60 1.75 -0.05 0.00 -1.07 0.00 0.00 68.15 69.38 1m9y h THR 58 CO 0.00 0.00 1.08 -0.69 -0.01 0.00 0.00 175.52 175.90 1m9y s VAL 59 N -3.17 3.88 0.11 0.00 1.01 -0.69 -4.96 120.40 116.58 1m9y s VAL 59 Ca 0.09 0.87 -0.17 0.00 0.00 0.00 0.00 61.98 62.76 1m9y s VAL 59 Cb 0.08 -4.28 -0.07 0.00 0.00 0.00 0.00 36.38 32.12 1m9y s VAL 59 CO 0.63 -0.87 0.56 -0.83 0.00 0.00 0.00 175.10 174.59 1m9y s GLY 60 N 4.04 2.56 0.00 4.51 0.00 -1.26 -4.86 107.32 112.31 1m9y s GLY 60 Ca 0.59 -0.05 0.00 0.00 0.00 0.00 0.00 44.72 45.26 1m9y s GLY 60 CO 0.31 0.30 0.00 0.61 0.00 0.00 0.00 173.10 174.32 1m9y n GLY 61 N 1.25 0.26 4.49 0.20 0.00 -1.26 -4.88 105.19 105.25 1m9y n GLY 61 Ca -0.08 -0.91 -0.40 0.00 0.00 0.00 0.00 46.02 44.63 1m9y n GLY 61 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1m9y n HIS 62 N 1.63 -1.20 -0.24 1.61 -0.00 -1.26 -4.84 115.22 110.92 1m9y n HIS 62 Ca 0.00 0.68 0.03 0.00 -0.00 0.00 0.00 57.72 58.43 1m9y n HIS 62 Cb 0.00 -2.08 0.13 0.00 -0.00 0.00 0.00 29.99 28.04 1m9y n HIS 62 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.34 176.71 1m9y h GLN 63 N -1.07 0.09 -0.34 -0.41 5.75 -1.94 -1.94 115.11 115.25 1m9y h GLN 63 Ca -0.61 -0.01 -0.11 0.00 -0.15 0.00 0.00 58.65 57.77 1m9y h GLN 63 Cb 1.39 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.91 1m9y h GLN 63 CO 0.86 0.06 -0.25 0.00 -2.65 0.00 0.00 178.83 176.85 1m9y h ALA 64 N 1.66 0.94 -0.36 3.38 0.00 -2.00 -2.11 119.26 120.77 1m9y h ALA 64 Ca 0.38 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1m9y h ALA 64 Cb 0.64 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1m9y h ALA 64 CO -0.63 0.61 -0.14 0.00 0.00 0.00 0.00 179.25 179.09 1m9y h ALA 65 N 1.15 0.50 -0.26 0.00 0.00 -1.89 -1.72 119.26 117.03 1m9y h ALA 65 Ca 0.08 -0.33 0.06 0.00 0.00 0.00 0.00 54.91 54.71 1m9y h ALA 65 Cb 0.73 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1m9y h ALA 65 CO 0.06 0.40 0.18 0.52 0.00 0.00 0.00 179.25 180.41 1m9y h MET 66 N 0.52 0.09 -0.04 0.00 2.07 -1.14 0.08 114.93 116.50 1m9y h MET 66 Ca 0.08 -0.01 -0.23 0.00 -2.07 0.00 0.00 59.70 57.47 1m9y h MET 66 Cb 0.67 -0.02 0.01 0.00 -1.87 0.00 0.00 31.60 30.39 1m9y h MET 66 CO 0.05 0.06 -0.92 0.37 1.07 0.00 0.00 176.91 177.54 1m9y h GLN 67 N 0.09 0.59 -0.68 1.72 5.75 -0.88 -0.92 115.11 120.77 1m9y h GLN 67 Ca 0.12 -0.58 0.04 0.00 -0.15 0.00 0.00 58.65 58.08 1m9y h GLN 67 Cb 0.36 0.15 -0.05 0.00 1.07 0.00 0.00 27.48 29.02 1m9y h GLN 67 CO -0.01 1.19 0.41 0.52 -2.65 0.00 0.00 178.83 178.30 1m9y h MET 68 N 0.36 0.77 -0.15 1.69 2.86 -0.38 0.19 114.93 120.26 1m9y h MET 68 Ca -0.08 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.52 1m9y h MET 68 Cb 1.55 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 33.02 1m9y h MET 68 CO 0.17 0.51 0.04 1.25 1.06 0.00 0.00 176.91 179.94 1m9y h LEU 69 N 0.79 0.03 -0.46 1.22 5.85 -0.81 -2.08 115.31 119.86 1m9y h LEU 69 Ca 0.28 0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.08 1m9y h LEU 69 Cb 0.07 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.07 1m9y h LEU 69 CO -0.13 0.04 0.18 0.11 -0.34 0.00 0.00 178.44 178.30 1m9y h LYS 70 N 0.11 0.35 -0.93 1.25 1.57 -0.83 0.17 116.57 118.25 1m9y h LYS 70 Ca 0.06 -0.02 0.15 0.00 -1.87 0.00 0.00 60.65 58.97 1m9y h LYS 70 Cb 0.05 -0.08 -0.09 0.00 0.08 0.00 0.00 32.23 32.18 1m9y h LYS 70 CO -0.08 0.23 0.54 0.93 -0.57 0.00 0.00 179.45 180.50 1m9y h GLU 71 N 0.36 0.74 -0.20 3.15 5.08 -0.68 0.10 114.58 123.13 1m9y h GLU 71 Ca 0.21 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.47 1m9y h GLU 71 Cb 0.19 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1m9y h GLU 71 CO -0.20 0.49 -0.09 1.15 -1.00 0.00 0.00 179.01 179.36 1m9y h THR 72 N 0.76 1.30 -0.57 1.13 2.02 -0.59 -1.84 112.91 115.13 1m9y h THR 72 Ca 0.50 -1.13 0.08 0.00 0.77 0.00 0.00 66.41 66.63 1m9y h THR 72 Cb 0.67 1.62 -0.06 0.00 -1.74 0.00 0.00 68.15 68.64 1m9y h THR 72 CO -0.34 0.34 0.22 0.40 0.37 0.00 0.00 175.52 176.52 1m9y h ILE 73 N 0.11 0.81 -0.49 3.11 2.04 -0.34 0.11 117.51 122.86 1m9y h ILE 73 Ca 0.05 -0.14 -0.04 0.00 1.00 0.00 0.00 64.86 65.72 1m9y h ILE 73 Cb 0.56 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 1m9y h ILE 73 CO 0.03 0.08 0.14 0.78 0.00 0.00 0.00 178.15 179.17 1m9y h ASN 74 N 0.42 0.68 -0.05 1.72 -0.26 -0.71 0.01 115.58 117.38 1m9y h ASN 74 Ca 0.28 -0.11 -0.07 0.00 -0.56 0.00 0.00 56.30 55.85 1m9y h ASN 74 Cb 0.31 -0.18 0.00 0.00 -1.06 0.00 0.00 38.32 37.40 1m9y h ASN 74 CO -0.27 0.66 -0.23 -0.33 -1.06 0.00 0.00 177.43 176.21 1m9y h GLU 75 N 0.72 0.24 -0.27 0.81 5.08 -0.92 -1.60 114.58 118.63 1m9y h GLU 75 Ca 0.16 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1m9y h GLU 75 Cb 0.24 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1m9y h GLU 75 CO -0.01 0.84 0.08 0.93 -1.00 0.00 0.00 179.01 179.85 1m9y h GLU 76 N -0.29 0.39 -0.34 2.33 4.39 -0.50 -2.33 114.58 118.22 1m9y h GLU 76 Ca -0.01 -0.05 -0.14 0.00 0.34 0.00 0.00 59.36 59.49 1m9y h GLU 76 Cb 0.87 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.45 1m9y h GLU 76 CO 0.05 0.35 -0.36 0.00 -1.16 0.00 0.00 179.01 177.89 1m9y h ALA 77 N 1.70 0.49 -0.45 3.43 0.00 -0.84 -1.17 119.26 122.43 1m9y h ALA 77 Ca 0.09 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1m9y h ALA 77 Cb 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1m9y h ALA 77 CO -0.01 0.57 0.14 0.00 0.00 0.00 0.00 179.25 179.95 1m9y h ALA 78 N 0.73 1.40 -0.32 0.00 0.00 -1.13 -1.66 119.26 118.29 1m9y h ALA 78 Ca 0.05 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1m9y h ALA 78 Cb 0.94 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1m9y h ALA 78 CO 0.09 0.44 -0.31 1.49 0.00 0.00 0.00 179.25 180.96 1m9y h GLU 79 N 0.65 0.68 -0.22 0.00 4.57 -1.24 -0.79 114.58 118.23 1m9y h GLU 79 Ca 0.15 -0.31 -0.06 0.00 -1.18 0.00 0.00 59.36 57.97 1m9y h GLU 79 Cb 0.20 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1m9y h GLU 79 CO -0.01 0.90 -0.08 2.35 -1.18 0.00 0.00 179.01 180.99 1m9y h TRP 80 N 0.58 0.51 -0.56 0.92 2.91 -0.84 -0.99 115.95 118.47 1m9y h TRP 80 Ca 0.07 -0.12 0.07 0.00 1.13 0.00 0.00 58.89 60.04 1m9y h TRP 80 Cb 0.82 -0.12 -0.06 0.00 -0.51 0.00 0.00 29.16 29.29 1m9y h TRP 80 CO 0.04 0.71 0.24 -0.44 -1.03 0.00 0.00 178.44 177.95 1m9y h ASP 81 N 0.16 0.28 -0.91 2.65 3.32 -1.05 -1.23 116.42 119.65 1m9y h ASP 81 Ca 0.05 0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.20 1m9y h ASP 81 Cb 0.56 0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.07 1m9y h ASP 81 CO 0.03 0.19 0.58 -0.09 -1.72 0.00 0.00 179.24 178.23 1m9y h ARG 82 N 0.44 1.08 -0.23 3.56 2.43 -0.70 -1.37 114.38 119.59 1m9y h ARG 82 Ca 0.27 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 1m9y h ARG 82 Cb 0.27 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1m9y h ARG 82 CO -0.24 0.71 0.00 1.28 -1.51 0.00 0.00 179.97 180.21 1m9y n LEU 83 N -4.53 2.15 -3.45 3.80 4.77 -0.42 -4.54 117.00 114.78 1m9y n LEU 83 Ca 0.12 -0.91 -0.27 0.00 -0.03 0.00 0.00 56.01 54.93 1m9y n LEU 83 Cb 0.12 -0.14 -0.10 0.00 -2.33 0.00 0.00 43.42 40.97 1m9y n LEU 83 CO 0.33 0.45 -0.23 1.41 -1.33 0.00 0.00 177.39 178.02 1m9y n HIS 84 N 0.64 0.27 -1.51 -1.77 8.25 -0.52 -5.06 115.22 115.52 1m9y n HIS 84 Ca 0.17 -3.60 -0.43 0.00 -0.26 0.00 0.00 57.72 53.60 1m9y n HIS 84 Cb 0.40 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.44 1m9y n HIS 84 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1m9y n PRO 85 N 2.25 0.85 -2.18 -0.41 -0.02 -1.25 -4.82 135.00 129.42 1m9y n PRO 85 Ca 0.26 0.31 -0.43 0.00 -2.02 0.00 0.00 63.50 61.62 1m9y n PRO 85 Cb 0.46 -1.65 -0.02 0.00 -0.02 0.00 0.00 33.50 32.27 1m9y n PRO 85 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1m9y s VAL 86 N -1.30 3.83 0.57 -1.45 1.01 -1.26 -5.00 120.40 116.81 1m9y s VAL 86 Ca 0.62 0.97 -0.20 0.00 0.00 0.00 0.00 61.98 63.37 1m9y s VAL 86 Cb -0.64 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 1m9y s VAL 86 CO 0.58 -0.22 1.27 0.00 0.00 0.00 0.00 175.10 176.72 1m9y s ALA 87 N 4.50 2.64 0.37 5.51 0.00 -1.26 -4.94 121.76 128.57 1m9y s ALA 87 Ca 0.67 1.14 -0.28 0.00 0.00 0.00 0.00 51.96 53.49 1m9y s ALA 87 Cb -0.25 -3.50 -0.11 0.00 0.00 0.00 0.00 23.12 19.25 1m9y s ALA 87 CO 0.26 -1.26 1.45 0.00 0.00 0.00 0.00 175.76 176.21 1m9y n ALA 88 N -1.35 2.18 -2.89 0.00 0.00 -1.26 -5.01 120.51 112.17 1m9y n ALA 88 Ca 0.12 0.35 -0.23 0.00 0.00 0.00 0.00 53.44 53.68 1m9y n ALA 88 Cb 0.48 -2.39 -0.02 0.00 0.00 0.00 0.00 19.45 17.52 1m9y n ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m9y s ALA 89 N -1.10 3.88 0.21 0.00 0.00 -1.26 -4.63 121.76 118.87 1m9y s ALA 89 Ca 0.54 -1.10 -0.23 0.00 0.00 0.00 0.00 51.96 51.17 1m9y s ALA 89 Cb -0.49 -1.83 -0.08 0.00 0.00 0.00 0.00 23.12 20.71 1m9y s ALA 89 CO 0.63 0.26 0.77 -1.25 0.00 0.00 0.00 175.76 176.17 1m9y s PRO 90 N -3.87 4.41 0.34 0.00 0.04 -1.26 -5.15 135.00 129.52 1m9y s PRO 90 Ca 0.36 1.04 -0.27 0.00 0.04 0.00 0.00 61.00 62.16 1m9y s PRO 90 Cb -0.10 -3.02 -0.09 0.00 0.04 0.00 0.00 34.50 31.33 1m9y s PRO 90 CO 0.30 0.45 1.12 -1.50 0.04 0.00 0.00 177.00 177.41 1m9y s ILE 91 N -1.39 3.41 0.33 0.56 1.10 -1.26 -4.98 121.20 118.97 1m9y s ILE 91 Ca 0.41 1.27 -0.28 0.00 -0.51 0.00 0.00 60.65 61.55 1m9y s ILE 91 Cb -0.19 -3.76 -0.09 0.00 0.15 0.00 0.00 42.46 38.57 1m9y s ILE 91 CO 0.23 0.20 1.15 0.00 -2.11 0.00 0.00 174.94 174.41 1m9y s ALA 92 N -1.34 3.32 0.62 1.50 0.00 -1.26 -4.92 121.76 119.68 1m9y s ALA 92 Ca 0.51 0.96 -0.18 0.00 0.00 0.00 0.00 51.96 53.25 1m9y s ALA 92 Cb -0.30 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 1m9y s ALA 92 CO 0.38 -0.35 1.02 -2.30 0.00 0.00 0.00 175.76 174.51 1m9y n PRO 93 N 0.68 0.89 -1.62 0.00 -0.02 -1.26 -1.08 135.00 132.59 1m9y n PRO 93 Ca 0.01 0.35 -0.18 0.00 -2.02 0.00 0.00 63.50 61.66 1m9y n PRO 93 Cb 0.45 -2.24 -0.07 0.00 -0.02 0.00 0.00 33.50 31.62 1m9y n PRO 93 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1m9y n GLY 94 N 1.22 1.49 3.38 -1.23 0.00 -1.26 -4.99 105.19 103.81 1m9y n GLY 94 Ca 0.14 -0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 1m9y n GLY 94 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1m9y s GLN 95 N -3.68 1.41 -0.14 1.61 -1.52 -0.24 -5.13 119.66 111.96 1m9y s GLN 95 Ca 0.00 -1.46 -0.07 0.00 -1.95 0.00 0.00 55.36 51.87 1m9y s GLN 95 Cb 0.00 -1.63 -0.04 0.00 -0.22 0.00 0.00 33.01 31.12 1m9y s GLN 95 CO 0.00 0.35 0.11 1.41 -0.25 0.00 0.00 175.29 176.91 1m9y s MET 96 N -2.68 3.64 0.83 2.91 -2.45 -1.26 -4.86 119.30 115.43 1m9y s MET 96 Ca 0.18 -0.21 -0.12 0.00 -1.25 0.00 0.00 55.69 54.29 1m9y s MET 96 Cb -0.07 -3.21 0.10 0.00 1.25 0.00 0.00 34.83 32.90 1m9y s MET 96 CO 0.08 0.60 1.18 -0.98 1.05 0.00 0.00 175.02 176.95 1m9y s ARG 97 N -0.51 1.54 0.48 4.11 1.70 -1.26 -4.97 118.95 120.03 1m9y s ARG 97 Ca 0.12 1.66 -0.21 0.00 -0.47 0.00 0.00 55.73 56.83 1m9y s ARG 97 Cb -0.12 -1.78 -0.08 0.00 -0.57 0.00 0.00 34.95 32.40 1m9y s ARG 97 CO 0.02 -2.26 1.05 -1.21 -1.08 0.00 0.00 175.30 171.81 1m9y s GLU 98 N -4.31 3.83 0.17 3.89 0.41 -1.26 -4.99 118.70 116.44 1m9y s GLU 98 Ca 0.71 1.40 -0.30 0.00 -0.41 0.00 0.00 54.97 56.37 1m9y s GLU 98 Cb -0.26 -2.16 -0.08 0.00 -1.78 0.00 0.00 34.13 29.86 1m9y s GLU 98 CO 0.52 -0.42 1.14 -1.25 -0.49 0.00 0.00 175.26 174.77 1m9y s PRO 99 N -3.12 4.54 0.85 0.39 0.04 -1.26 -5.05 135.00 131.39 1m9y s PRO 99 Ca 0.66 1.78 -0.12 0.00 0.04 0.00 0.00 61.00 63.37 1m9y s PRO 99 Cb -0.18 -3.27 0.13 0.00 0.04 0.00 0.00 34.50 31.22 1m9y s PRO 99 CO 0.22 -0.01 1.20 1.03 0.04 0.00 0.00 177.00 179.47 1m9y s ARG 100 N -0.25 1.47 0.13 4.56 1.81 -1.26 -4.93 118.95 120.48 1m9y s ARG 100 Ca 0.51 -0.23 -0.17 0.00 -1.72 0.00 0.00 55.73 54.11 1m9y s ARG 100 Cb -0.31 -1.97 -0.02 0.00 -0.45 0.00 0.00 34.95 32.20 1m9y s ARG 100 CO 0.35 -1.85 1.76 0.78 -0.68 0.00 0.00 175.30 175.66 1m9y h GLY 101 N -1.18 0.48 1.92 -3.53 0.00 -1.93 0.02 103.07 98.85 1m9y h GLY 101 Ca -0.44 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 46.66 1m9y h GLY 101 CO 0.52 0.20 -0.02 1.76 0.00 0.00 0.00 176.54 179.00 1m9y h SER 102 N 0.42 0.10 -0.28 0.19 0.02 -1.95 0.48 113.55 112.52 1m9y h SER 102 Ca 0.12 -0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 60.91 1m9y h SER 102 Cb 0.02 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1m9y h SER 102 CO -0.02 0.14 -0.42 0.44 -1.14 0.00 0.00 176.83 175.83 1m9y h ASP 103 N 0.11 0.86 0.10 3.07 3.32 -1.38 -1.72 116.42 120.77 1m9y h ASP 103 Ca 0.03 -0.51 -0.12 0.00 0.02 0.00 0.00 57.03 56.45 1m9y h ASP 103 Cb 0.12 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1m9y h ASP 103 CO 0.00 1.20 -0.40 0.40 -1.72 0.00 0.00 179.24 178.73 1m9y h ILE 104 N 0.54 1.30 -0.01 0.35 2.04 0.34 -1.89 117.51 120.18 1m9y h ILE 104 Ca 0.03 -1.52 0.00 0.00 1.00 0.00 0.00 64.86 64.36 1m9y h ILE 104 Cb 1.01 1.61 0.00 0.00 -0.74 0.00 0.00 36.82 38.70 1m9y h ILE 104 CO 0.10 0.47 0.00 0.00 0.00 0.00 0.00 178.15 178.71 1m9y n ALA 105 N -2.49 2.64 -1.06 1.87 0.00 0.02 -4.65 120.51 116.85 1m9y n ALA 105 Ca -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 53.44 53.17 1m9y n ALA 105 Cb 0.49 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.54 1m9y n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m9y n GLY 106 N 0.98 0.55 0.05 0.00 0.00 -0.71 -4.91 105.19 101.15 1m9y n GLY 106 Ca 0.20 -0.71 0.11 0.00 0.00 0.00 0.00 46.02 45.63 1m9y n GLY 106 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1m9y n THR 107 N -2.91 0.23 -2.31 2.61 -2.24 -0.67 -4.40 114.28 104.60 1m9y n THR 107 Ca -0.02 -0.39 0.04 0.00 -2.27 0.00 0.00 64.05 61.41 1m9y n THR 107 Cb 0.09 0.04 0.03 0.00 -2.10 0.00 0.00 70.33 68.39 1m9y n THR 107 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1m9y n THR 108 N -2.22 0.21 -4.29 4.28 -2.24 -1.12 -5.02 114.28 103.89 1m9y n THR 108 Ca -0.00 -1.02 -0.16 0.00 -2.27 0.00 0.00 64.05 60.60 1m9y n THR 108 Cb 0.50 0.79 -0.10 0.00 -2.10 0.00 0.00 70.33 69.42 1m9y n THR 108 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1m9y s SER 109 N -1.93 1.78 0.35 3.42 1.04 -1.26 -4.72 113.70 112.38 1m9y s SER 109 Ca 0.28 -1.13 0.07 0.00 0.48 0.00 0.00 55.95 55.66 1m9y s SER 109 Cb 0.32 0.01 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 1m9y s SER 109 CO -0.13 -0.43 0.41 0.42 0.98 0.00 0.00 173.24 174.48 1m9y s THR 110 N -3.39 3.63 0.08 2.02 -4.23 -1.26 -4.94 115.64 107.55 1m9y s THR 110 Ca 0.23 -1.17 -0.18 0.00 -1.18 0.00 0.00 61.69 59.40 1m9y s THR 110 Cb 0.04 -3.24 -0.09 0.00 1.34 0.00 0.00 72.50 70.55 1m9y s THR 110 CO 0.05 -0.13 1.45 0.25 -0.54 0.00 0.00 174.62 175.69 1m9y h LEU 111 N 1.01 0.53 -0.73 4.79 5.85 -1.98 0.52 115.31 125.30 1m9y h LEU 111 Ca -0.44 -0.40 -0.04 0.00 0.84 0.00 0.00 57.88 57.84 1m9y h LEU 111 Cb 1.26 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 1m9y h LEU 111 CO 0.54 0.81 0.31 1.56 -0.34 0.00 0.00 178.44 181.33 1m9y h GLN 112 N 0.24 1.08 -0.21 1.25 7.50 -1.97 0.51 115.11 123.50 1m9y h GLN 112 Ca 0.06 -0.18 0.05 0.00 0.50 0.00 0.00 58.65 59.07 1m9y h GLN 112 Cb 0.61 -0.18 -0.05 0.00 0.05 0.00 0.00 27.48 27.91 1m9y h GLN 112 CO 0.03 0.87 -0.12 0.93 -1.50 0.00 0.00 178.83 179.05 1m9y h GLU 113 N 1.04 -0.10 -0.40 1.46 5.08 -1.95 1.28 114.58 120.99 1m9y h GLU 113 Ca 0.25 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.68 1m9y h GLU 113 Cb 0.18 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.39 1m9y h GLU 113 CO -0.02 -0.07 0.02 1.96 -1.00 0.00 0.00 179.01 179.89 1m9y h GLN 114 N -0.11 0.12 -0.73 2.33 4.20 0.49 -1.43 115.11 119.99 1m9y h GLN 114 Ca 0.12 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.83 1m9y h GLN 114 Cb 0.29 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.00 1m9y h GLN 114 CO -0.28 0.08 0.48 0.82 -0.67 0.00 0.00 178.83 179.26 1m9y h ILE 115 N 0.13 1.19 -0.71 2.54 2.04 0.94 -1.68 117.51 121.96 1m9y h ILE 115 Ca 0.20 -0.35 0.03 0.00 1.00 0.00 0.00 64.86 65.73 1m9y h ILE 115 Cb 0.27 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.43 1m9y h ILE 115 CO -0.32 0.18 0.45 1.23 0.00 0.00 0.00 178.15 179.70 1m9y h GLY 116 N 0.99 1.02 1.11 5.37 0.00 0.21 0.54 103.07 112.30 1m9y h GLY 116 Ca 0.27 -0.34 -0.09 0.00 0.00 0.00 0.00 47.33 47.17 1m9y h GLY 116 CO -0.06 0.30 0.06 1.49 0.00 0.00 0.00 176.54 178.34 1m9y h TRP 117 N 0.89 1.15 0.00 5.60 6.55 -0.88 1.04 115.95 130.30 1m9y h TRP 117 Ca 0.28 -0.17 -0.05 0.00 0.95 0.00 0.00 58.89 59.89 1m9y h TRP 117 Cb -0.01 -0.31 -0.01 0.00 -0.86 0.00 0.00 29.16 27.97 1m9y h TRP 117 CO -0.04 0.98 -0.26 0.52 -1.05 0.00 0.00 178.44 178.60 1m9y h MET 118 N 0.99 0.00 -0.00 0.49 2.86 -0.62 0.75 114.93 119.40 1m9y h MET 118 Ca 0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1m9y h MET 118 Cb 0.48 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1m9y h MET 118 CO 0.02 0.26 -0.56 0.25 1.06 0.00 0.00 176.91 177.95 1m9y n THR 119 N -3.37 0.00 -0.55 2.22 -2.24 0.12 -4.73 114.28 105.72 1m9y n THR 119 Ca 0.00 -0.22 -0.29 0.00 -2.27 0.00 0.00 64.05 61.27 1m9y n THR 119 Cb 0.47 1.07 0.23 0.00 -2.10 0.00 0.00 70.33 70.00 1m9y n THR 119 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1m9y n HIS 120 N -0.89 -0.59 -3.72 4.78 -0.00 0.35 -4.86 115.22 110.28 1m9y n HIS 120 Ca 0.04 0.04 -0.30 0.00 -0.00 0.00 0.00 57.72 57.50 1m9y n HIS 120 Cb 0.27 -1.79 -0.14 0.00 -0.00 0.00 0.00 29.99 28.32 1m9y n HIS 120 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1m9y s ASN 121 N -2.45 3.89 0.90 0.26 3.04 -1.26 -1.82 114.94 117.49 1m9y s ASN 121 Ca 0.67 -2.01 -0.12 0.00 0.04 0.00 0.00 52.86 51.44 1m9y s ASN 121 Cb -0.24 -0.93 0.13 0.00 -1.54 0.00 0.00 41.25 38.67 1m9y s ASN 121 CO 0.63 -0.36 1.14 -2.84 -3.04 0.00 0.00 177.10 172.63 1m9y s PRO 122 N 1.15 1.27 0.25 0.43 0.02 -1.26 -5.17 135.00 131.69 1m9y s PRO 122 Ca 0.13 0.30 0.00 0.00 0.02 0.00 0.00 61.00 61.45 1m9y s PRO 122 Cb -0.20 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 1m9y s PRO 122 CO -0.15 -2.11 0.44 -1.25 -0.33 0.00 0.00 177.00 173.60 1m9y s PRO 123 N -5.30 3.51 -0.34 5.54 0.04 -0.76 -4.97 135.00 132.72 1m9y s PRO 123 Ca 0.63 -0.38 -0.07 0.00 0.04 0.00 0.00 61.00 61.23 1m9y s PRO 123 Cb -0.14 -2.79 0.04 0.00 0.04 0.00 0.00 34.50 31.65 1m9y s PRO 123 CO 0.53 0.32 0.11 0.42 0.04 0.00 0.00 177.00 178.43 1m9y s ILE 124 N -2.02 3.83 -1.34 0.56 -1.09 0.26 -5.01 121.20 116.39 1m9y s ILE 124 Ca 0.39 -1.12 -0.15 0.00 -2.23 0.00 0.00 60.65 57.53 1m9y s ILE 124 Cb -0.10 -3.17 0.08 0.00 -1.58 0.00 0.00 42.46 37.69 1m9y s ILE 124 CO 0.31 -0.19 1.89 -0.81 -1.23 0.00 0.00 174.94 174.91 1m9y n PRO 125 N 4.82 3.15 -0.33 2.79 -0.04 -1.26 -3.41 135.00 140.71 1m9y n PRO 125 Ca -0.12 -3.15 -0.00 0.00 -0.04 0.00 0.00 63.50 60.19 1m9y n PRO 125 Cb 0.45 -3.30 0.16 0.00 -0.04 0.00 0.00 33.50 30.76 1m9y n PRO 125 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 1m9y h VAL 126 N 4.70 1.21 -0.24 0.52 -1.51 -1.87 0.20 116.25 119.26 1m9y h VAL 126 Ca 0.47 -0.43 0.05 0.00 -1.23 0.00 0.00 66.70 65.56 1m9y h VAL 126 Cb 0.76 -0.14 -0.05 0.00 -2.13 0.00 0.00 31.29 29.74 1m9y h VAL 126 CO 1.60 0.23 -0.08 1.23 -1.23 0.00 0.00 177.57 179.32 1m9y h GLY 127 N 1.24 0.15 1.31 5.19 0.00 -1.87 -1.04 103.07 108.04 1m9y h GLY 127 Ca 0.35 0.10 -0.07 0.00 0.00 0.00 0.00 47.33 47.71 1m9y h GLY 127 CO -0.09 -0.10 0.05 0.83 0.00 0.00 0.00 176.54 177.22 1m9y h GLU 128 N -0.03 0.85 0.24 4.80 4.39 -1.28 -0.77 114.58 122.78 1m9y h GLU 128 Ca 0.12 -0.21 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 1m9y h GLU 128 Cb 0.20 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1m9y h GLU 128 CO -0.26 0.82 -0.11 0.82 -1.16 0.00 0.00 179.01 179.12 1m9y h ILE 129 N 0.80 0.83 -0.89 3.13 2.04 -1.02 -2.01 117.51 120.39 1m9y h ILE 129 Ca 0.16 -0.50 0.03 0.00 1.00 0.00 0.00 64.86 65.54 1m9y h ILE 129 Cb 0.41 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 37.56 1m9y h ILE 129 CO 0.01 0.11 0.59 0.22 0.00 0.00 0.00 178.15 179.08 1m9y h TYR 130 N -0.58 1.09 -0.44 1.37 3.20 -1.17 -0.25 116.97 120.18 1m9y h TYR 130 Ca -0.03 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.87 1m9y h TYR 130 Cb 0.42 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 1m9y h TYR 130 CO 0.01 0.65 0.29 -0.22 -1.64 0.00 0.00 178.16 177.26 1m9y h LYS 131 N 1.15 0.56 -0.39 1.82 3.64 -0.96 -0.10 116.57 122.29 1m9y h LYS 131 Ca 0.34 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.58 1m9y h LYS 131 Cb -0.04 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.65 1m9y h LYS 131 CO -0.09 0.37 -0.19 0.00 -2.27 0.00 0.00 179.45 177.26 1m9y h ARG 132 N 0.57 0.81 -0.83 1.90 3.08 -0.30 -0.83 114.38 118.79 1m9y h ARG 132 Ca 0.17 -0.36 -0.04 0.00 0.07 0.00 0.00 59.98 59.82 1m9y h ARG 132 Cb -0.03 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 29.96 1m9y h ARG 132 CO -0.04 0.99 0.37 -1.49 -1.07 0.00 0.00 179.97 178.73 1m9y h TRP 133 N 0.62 1.22 -0.33 3.04 6.55 -0.64 -2.00 115.95 124.41 1m9y h TRP 133 Ca 0.09 -0.07 0.01 0.00 0.95 0.00 0.00 58.89 59.86 1m9y h TRP 133 Cb 0.75 -0.37 -0.02 0.00 -0.86 0.00 0.00 29.16 28.66 1m9y h TRP 133 CO 0.06 0.90 0.21 0.82 -1.05 0.00 0.00 178.44 179.38 1m9y h ILE 134 N 1.19 1.07 -0.28 1.49 2.04 -0.81 -1.38 117.51 120.83 1m9y h ILE 134 Ca 0.28 -0.15 -0.09 0.00 1.00 0.00 0.00 64.86 65.90 1m9y h ILE 134 Cb 0.16 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1m9y h ILE 134 CO -0.03 0.08 -0.21 0.40 0.00 0.00 0.00 178.15 178.39 1m9y h ILE 135 N 0.43 1.26 -0.53 -0.67 2.04 -0.96 0.30 117.51 119.38 1m9y h ILE 135 Ca 0.13 -1.19 -0.00 0.00 1.00 0.00 0.00 64.86 64.79 1m9y h ILE 135 Cb -0.03 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1m9y h ILE 135 CO -0.04 0.38 0.32 -0.07 0.00 0.00 0.00 178.15 178.74 1m9y h LEU 136 N 0.46 0.63 -0.65 1.44 3.38 -0.99 -0.88 115.31 118.70 1m9y h LEU 136 Ca 0.07 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1m9y h LEU 136 Cb 0.62 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1m9y h LEU 136 CO 0.04 0.50 -0.05 1.23 0.09 0.00 0.00 178.44 180.26 1m9y h GLY 137 N 0.71 1.08 0.78 0.83 0.00 -0.22 -1.56 103.07 104.70 1m9y h GLY 137 Ca 0.19 -0.82 0.05 0.00 0.00 0.00 0.00 47.33 46.76 1m9y h GLY 137 CO -0.04 0.75 0.63 1.41 0.00 0.00 0.00 176.54 179.30 1m9y h LEU 138 N 0.91 1.02 -1.08 3.11 3.38 -0.27 -1.99 115.31 120.39 1m9y h LEU 138 Ca 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1m9y h LEU 138 Cb 0.59 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 1m9y h LEU 138 CO 0.04 0.67 0.48 0.78 0.09 0.00 0.00 178.44 180.49 1m9y h ASN 139 N 1.17 0.99 -0.67 -0.43 2.35 -0.78 -1.07 115.58 117.13 1m9y h ASN 139 Ca 0.41 -0.06 0.04 0.00 -0.55 0.00 0.00 56.30 56.14 1m9y h ASN 139 Cb 0.11 -0.25 -0.05 0.00 0.05 0.00 0.00 38.32 38.18 1m9y h ASN 139 CO -0.16 0.77 0.40 0.50 -1.65 0.00 0.00 177.43 177.29 1m9y h LYS 140 N 1.13 0.75 -0.27 0.81 3.64 -0.74 -1.46 116.57 120.41 1m9y h LYS 140 Ca 0.29 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.60 1m9y h LYS 140 Cb -0.03 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 1m9y h LYS 140 CO -0.05 0.49 0.07 0.82 -2.27 0.00 0.00 179.45 178.51 1m9y h ILE 141 N 0.77 1.21 -0.63 2.00 2.04 -1.12 -2.14 117.51 119.64 1m9y h ILE 141 Ca 0.28 -0.69 -0.03 0.00 1.00 0.00 0.00 64.86 65.42 1m9y h ILE 141 Cb 0.08 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 1m9y h ILE 141 CO -0.13 0.23 0.28 0.58 0.00 0.00 0.00 178.15 179.11 1m9y h VAL 142 N 0.27 1.23 0.00 1.67 2.07 -1.07 0.21 116.25 120.63 1m9y h VAL 142 Ca 0.09 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 1m9y h VAL 142 Cb 0.28 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1m9y h VAL 142 CO 0.00 0.27 -0.08 0.08 0.02 0.00 0.00 177.57 177.86 1m9y h ARG 143 N 0.88 0.00 0.02 1.57 0.11 -1.19 0.15 114.38 115.91 1m9y h ARG 143 Ca 0.22 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.26 1m9y h ARG 143 Cb 0.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.24 1m9y h ARG 143 CO -0.02 0.08 -0.14 1.98 0.10 0.00 0.00 179.97 181.96 1m9y h MET 144 N 0.00 0.07 -0.00 0.08 4.05 -0.05 -3.33 114.93 115.75 1m9y h MET 144 Ca -0.00 -0.10 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 1m9y h MET 144 Cb 0.63 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.46 1m9y h MET 144 CO 0.01 0.97 -0.44 0.66 0.23 0.00 0.00 176.91 178.34 1m9y n TYR 145 N -4.55 0.00 -1.31 1.39 4.01 0.43 -5.11 117.16 112.02 1m9y n TYR 145 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1m9y n TYR 145 Cb 0.51 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 1m9y n TYR 145 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27