#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c3y n LEU 14 N 0.00 0.00 -5.01 0.99 4.77 -1.26 -4.37 117.00 112.12 3c3y n LEU 14 Ca 0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 3c3y n LEU 14 Cb 0.00 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.15 3c3y n LEU 14 CO 0.00 0.00 0.38 -0.76 -1.33 0.00 0.00 177.39 175.68 3c3y s LEU 15 N 0.00 3.19 0.48 2.23 1.43 -1.26 -4.99 118.68 119.77 3c3y s LEU 15 Ca 0.00 -0.46 0.17 0.00 -1.03 0.00 0.00 54.13 52.81 3c3y s LEU 15 Cb 0.00 -2.16 1.16 0.00 0.03 0.00 0.00 46.19 45.22 3c3y s LEU 15 CO 0.00 -1.36 2.05 0.06 0.23 0.00 0.00 176.35 177.33 3c3y h GLN 16 N 0.02 0.00 -2.85 1.70 3.07 -2.01 -3.44 115.11 111.59 3c3y h GLN 16 Ca -0.36 0.00 -0.10 0.00 0.09 0.00 0.00 58.65 58.28 3c3y h GLN 16 Cb 1.28 0.00 -0.19 0.00 0.08 0.00 0.00 27.48 28.65 3c3y h GLN 16 CO 0.43 0.12 -0.17 -1.54 0.09 0.00 0.00 178.83 177.76 3c3y s SER 17 N -6.88 -0.28 0.34 0.06 1.04 -1.26 -5.02 113.70 101.70 3c3y s SER 17 Ca -0.04 0.18 0.02 0.00 0.48 0.00 0.00 55.95 56.59 3c3y s SER 17 Cb 0.16 0.36 0.62 0.00 0.10 0.00 0.00 66.02 67.26 3c3y s SER 17 CO 0.67 -0.50 2.00 -0.08 0.98 0.00 0.00 173.24 176.31 3c3y h GLU 18 N 3.60 0.86 -0.72 4.02 4.81 -2.00 -2.44 114.58 122.72 3c3y h GLU 18 Ca -0.29 -0.05 0.09 0.00 -0.13 0.00 0.00 59.36 58.97 3c3y h GLU 18 Cb 1.17 -0.20 -0.07 0.00 0.63 0.00 0.00 28.75 30.29 3c3y h GLU 18 CO 0.40 0.57 0.37 1.49 -0.73 0.00 0.00 179.01 181.11 3c3y h GLU 19 N 0.89 0.61 -0.28 1.92 4.81 -1.99 0.76 114.58 121.30 3c3y h GLU 19 Ca 0.25 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.39 3c3y h GLU 19 Cb -0.08 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 3c3y h GLU 19 CO -0.06 0.41 -0.02 1.25 -0.73 0.00 0.00 179.01 179.86 3c3y h LEU 20 N 0.63 0.51 -0.12 1.64 5.85 -1.85 -1.25 115.31 120.72 3c3y h LEU 20 Ca 0.35 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.76 3c3y h LEU 20 Cb 0.34 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 3c3y h LEU 20 CO -0.25 0.71 -0.01 0.00 -0.34 0.00 0.00 178.44 178.55 3c3y h GLN 22 N 0.03 0.44 -0.10 0.00 1.08 -0.79 -0.77 115.11 115.01 3c3y h GLN 22 Ca 0.05 -0.10 0.01 0.00 -1.45 0.00 0.00 58.65 57.16 3c3y h GLN 22 Cb 0.07 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 3c3y h GLN 22 CO -0.10 0.52 0.04 -0.92 -0.95 0.00 0.00 178.83 177.43 3c3y h TYR 23 N 0.42 0.08 -0.32 2.96 3.20 -0.93 0.14 116.97 122.52 3c3y h TYR 23 Ca 0.09 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 3c3y h TYR 23 Cb 0.38 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 3c3y h TYR 23 CO 0.01 0.05 0.14 0.82 -1.64 0.00 0.00 178.16 177.53 3c3y h ILE 24 N 0.10 1.17 -0.08 1.81 2.04 -0.86 0.04 117.51 121.73 3c3y h ILE 24 Ca 0.04 -0.53 -0.00 0.00 1.00 0.00 0.00 64.86 65.37 3c3y h ILE 24 Cb 0.01 0.93 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 3c3y h ILE 24 CO -0.03 0.19 0.04 -0.07 0.00 0.00 0.00 178.15 178.27 3c3y h LEU 25 N 0.37 0.11 -0.66 1.44 3.38 -0.97 -0.04 115.31 118.93 3c3y h LEU 25 Ca 0.11 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 3c3y h LEU 25 Cb 0.16 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3c3y h LEU 25 CO -0.01 0.20 -0.57 0.03 0.09 0.00 0.00 178.44 178.18 3c3y h ARG 26 N 0.00 0.29 0.10 1.13 3.08 -0.69 0.23 114.38 118.52 3c3y h ARG 26 Ca 0.03 -0.19 -0.18 0.00 0.07 0.00 0.00 59.98 59.71 3c3y h ARG 26 Cb 0.13 0.02 0.02 0.00 0.08 0.00 0.00 29.97 30.22 3c3y h ARG 26 CO -0.00 0.78 -0.76 1.15 -1.07 0.00 0.00 179.97 180.07 3c3y h THR 27 N 0.22 1.48 0.00 2.04 2.02 -0.90 -3.41 112.91 114.36 3c3y h THR 27 Ca -0.00 -2.40 0.00 0.00 0.77 0.00 0.00 66.41 64.78 3c3y h THR 27 Cb 1.07 3.02 0.00 0.00 -1.74 0.00 0.00 68.15 70.50 3c3y h THR 27 CO 0.09 0.69 -0.90 -1.20 0.37 0.00 0.00 175.52 174.56 3c3y n SER 28 N -4.15 4.52 -0.06 4.18 7.64 -0.04 -4.78 113.62 120.93 3c3y n SER 28 Ca -0.13 -0.02 -0.07 0.00 1.01 0.00 0.00 58.87 59.66 3c3y n SER 28 Cb 0.78 0.95 -0.02 0.00 -1.01 0.00 0.00 64.21 64.91 3c3y n SER 28 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3c3y n VAL 29 N -1.40 1.25 -0.33 0.44 0.31 -0.85 -4.56 118.33 113.19 3c3y n VAL 29 Ca 0.00 0.21 0.02 0.00 -0.01 0.00 0.00 64.34 64.57 3c3y n VAL 29 Cb 0.00 -2.13 0.20 0.00 -0.91 0.00 0.00 33.84 30.99 3c3y n VAL 29 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 3c3y h TYR 30 N -0.75 1.14 0.00 3.52 0.99 -0.84 -1.23 116.97 119.80 3c3y h TYR 30 Ca 0.00 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.76 3c3y h TYR 30 Cb 0.75 -0.38 -0.00 0.00 1.00 0.00 0.00 36.73 38.10 3c3y h TYR 30 CO -0.32 0.62 -0.01 -1.35 -0.00 0.00 0.00 178.16 177.10 3c3y h PRO 31 N 1.14 0.00 -0.01 4.88 0.11 -1.79 -2.76 132.00 133.57 3c3y h PRO 31 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 3c3y h PRO 31 Cb 0.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.21 3c3y h PRO 31 CO -0.14 0.01 -0.42 0.54 -0.21 0.00 0.00 178.00 177.79 3c3y n ARG 32 N -3.15 1.73 -2.52 1.05 1.74 -0.62 -4.98 116.66 109.91 3c3y n ARG 32 Ca -0.01 -0.64 -0.41 0.00 -0.77 0.00 0.00 57.85 56.02 3c3y n ARG 32 Cb 0.20 -1.27 -0.04 0.00 -1.02 0.00 0.00 32.46 30.33 3c3y n ARG 32 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3c3y s GLU 33 N -2.02 4.59 0.34 5.56 2.12 -0.56 -4.99 118.70 123.74 3c3y s GLU 33 Ca 0.12 1.71 -0.29 0.00 0.36 0.00 0.00 54.97 56.87 3c3y s GLU 33 Cb 0.13 -3.28 -0.11 0.00 0.26 0.00 0.00 34.13 31.12 3c3y s GLU 33 CO 0.45 0.07 1.55 0.00 -0.54 0.00 0.00 175.26 176.79 3c3y s ALA 34 N -0.18 3.66 0.25 6.30 0.00 -1.26 -4.87 121.76 125.66 3c3y s ALA 34 Ca 0.50 1.59 -0.04 0.00 0.00 0.00 0.00 51.96 54.01 3c3y s ALA 34 Cb -0.29 -3.63 0.49 0.00 0.00 0.00 0.00 23.12 19.69 3c3y s ALA 34 CO 0.35 -1.05 1.67 0.78 0.00 0.00 0.00 175.76 177.51 3c3y h GLY 35 N 3.79 1.04 2.00 0.00 0.00 -1.96 -0.73 103.07 107.20 3c3y h GLY 35 Ca -0.49 -0.01 -0.05 0.00 0.00 0.00 0.00 47.33 46.77 3c3y h GLY 35 CO 0.71 -0.24 -0.25 0.74 0.00 0.00 0.00 176.54 177.50 3c3y h PHE 36 N 0.23 0.00 -0.42 5.60 0.05 -1.95 -1.35 116.94 119.10 3c3y h PHE 36 Ca 0.43 0.00 -0.07 0.00 3.82 0.00 0.00 57.97 62.15 3c3y h PHE 36 Cb 0.77 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.70 3c3y h PHE 36 CO -0.29 0.25 -0.02 -0.07 -0.18 0.00 0.00 178.31 178.00 3c3y h LEU 37 N 0.00 0.75 -0.64 1.54 3.38 -1.51 -1.66 115.31 117.17 3c3y h LEU 37 Ca -0.00 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.67 3c3y h LEU 37 Cb 0.50 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 3c3y h LEU 37 CO 0.03 0.89 0.40 0.11 0.09 0.00 0.00 178.44 179.96 3c3y h LYS 38 N 0.59 0.76 -0.44 1.13 1.57 -0.91 -0.31 116.57 118.95 3c3y h LYS 38 Ca 0.12 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.87 3c3y h LYS 38 Cb 0.52 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 3c3y h LYS 38 CO 0.03 0.50 0.26 0.93 -0.57 0.00 0.00 179.45 180.60 3c3y h GLU 39 N 0.78 0.50 -0.49 3.15 5.08 -1.17 -1.03 114.58 121.41 3c3y h GLU 39 Ca 0.26 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.53 3c3y h GLU 39 Cb 0.01 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 3c3y h GLU 39 CO -0.10 0.33 0.08 1.25 -1.00 0.00 0.00 179.01 179.57 3c3y h LEU 40 N 0.52 0.79 -0.81 1.33 6.46 -0.91 -1.90 115.31 120.80 3c3y h LEU 40 Ca 0.18 -0.26 0.09 0.00 -0.12 0.00 0.00 57.88 57.76 3c3y h LEU 40 Cb 0.02 -0.21 -0.07 0.00 -0.73 0.00 0.00 40.66 39.67 3c3y h LEU 40 CO -0.09 0.85 0.46 -0.09 -0.62 0.00 0.00 178.44 178.96 3c3y h ARG 41 N 0.70 0.77 -0.44 1.25 2.43 -0.72 0.49 114.38 118.86 3c3y h ARG 41 Ca 0.15 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 3c3y h ARG 41 Cb 0.40 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 3c3y h ARG 41 CO 0.01 0.51 -0.02 1.49 -1.51 0.00 0.00 179.97 180.45 3c3y h GLU 42 N 0.80 0.79 -0.83 0.20 4.81 -0.80 -2.80 114.58 116.75 3c3y h GLU 42 Ca 0.38 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 3c3y h GLU 42 Cb 0.32 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 3c3y h GLU 42 CO -0.23 0.86 0.45 0.00 -0.73 0.00 0.00 179.01 179.37 3c3y h ALA 43 N 0.90 1.06 -0.49 2.92 0.00 -0.80 -2.46 119.26 120.38 3c3y h ALA 43 Ca 0.12 -0.12 0.11 0.00 0.00 0.00 0.00 54.91 55.02 3c3y h ALA 43 Cb 0.52 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3c3y h ALA 43 CO 0.03 0.56 0.34 -0.97 0.00 0.00 0.00 179.25 179.21 3c3y h ASN 44 N 1.15 0.17 -0.44 0.00 -0.73 -0.67 -2.51 115.58 112.55 3c3y h ASN 44 Ca 0.29 0.00 0.13 0.00 1.87 0.00 0.00 56.30 58.59 3c3y h ASN 44 Cb 0.03 -0.03 -0.02 0.00 0.27 0.00 0.00 38.32 38.57 3c3y h ASN 44 CO -0.05 0.10 0.41 -0.33 -0.37 0.00 0.00 177.43 177.20 3c3y h GLU 45 N 0.19 0.00 0.00 6.67 5.08 -1.21 -0.91 114.58 124.40 3c3y h GLU 45 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3c3y h GLU 45 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 3c3y h GLU 45 CO -0.04 0.00 -0.14 0.43 -1.00 0.00 0.00 179.01 178.26 3c3y n SER 46 N -3.91 0.81 -4.74 1.42 7.64 -0.94 -4.81 113.62 109.08 3c3y n SER 46 Ca 0.08 0.48 -0.41 0.00 1.01 0.00 0.00 58.87 60.03 3c3y n SER 46 Cb 0.60 -0.59 -0.04 0.00 -1.01 0.00 0.00 64.21 63.17 3c3y n SER 46 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3c3y s HIS 47 N -3.12 3.69 0.54 1.43 5.04 -0.35 -4.93 115.29 117.59 3c3y s HIS 47 Ca 0.10 1.70 0.22 0.00 -1.54 0.00 0.00 55.06 55.54 3c3y s HIS 47 Cb 0.12 -3.20 1.43 0.00 0.04 0.00 0.00 32.58 30.98 3c3y s HIS 47 CO 0.63 -0.31 2.10 -1.00 -2.34 0.00 0.00 174.74 173.82 3c3y h PRO 48 N 4.82 0.00 -0.64 2.88 0.13 -1.87 -1.69 132.00 135.63 3c3y h PRO 48 Ca -0.45 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.36 3c3y h PRO 48 Cb 1.21 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.15 3c3y h PRO 48 CO 0.71 0.00 0.25 -0.25 -0.23 0.00 0.00 178.00 178.48 3c3y n ASP 49 N -4.29 3.17 -0.43 1.44 8.00 -1.26 -4.75 116.55 118.43 3c3y n ASP 49 Ca 0.02 -3.66 0.40 0.00 0.71 0.00 0.00 54.79 52.26 3c3y n ASP 49 Cb 0.29 -0.73 0.77 0.00 -0.02 0.00 0.00 41.12 41.43 3c3y n ASP 49 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3c3y h SER 50 N 1.12 0.02 0.00 -2.24 4.64 -1.51 0.23 113.55 115.80 3c3y h SER 50 Ca 0.40 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 3c3y h SER 50 Cb 2.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.30 3c3y h SER 50 CO 0.71 -0.00 0.03 0.10 -0.87 0.00 0.00 176.83 176.80 3c3y h TYR 51 N 0.01 0.00 0.00 4.77 -0.00 -1.86 -1.87 116.97 118.02 3c3y h TYR 51 Ca 0.68 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.41 3c3y h TYR 51 Cb 2.68 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 39.41 3c3y h TYR 51 CO -0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 178.16 176.83 3c3y n MET 52 N -2.45 0.09 -2.05 0.10 2.81 0.07 -4.84 117.12 110.85 3c3y n MET 52 Ca -0.02 0.13 -0.41 0.00 -1.81 0.00 0.00 57.70 55.59 3c3y n MET 52 Cb 0.07 -1.61 -0.02 0.00 -0.71 0.00 0.00 33.22 30.95 3c3y n MET 52 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3c3y s SER 53 N -3.51 6.69 0.27 7.83 0.15 -0.70 -4.91 113.70 119.51 3c3y s SER 53 Ca 0.11 2.75 -0.30 0.00 0.70 0.00 0.00 55.95 59.21 3c3y s SER 53 Cb 0.15 -2.65 -0.11 0.00 -1.71 0.00 0.00 66.02 61.70 3c3y s SER 53 CO 0.50 -0.61 1.57 -0.89 1.20 0.00 0.00 173.24 175.01 3c3y s THR 54 N -1.03 2.20 0.02 6.45 2.01 -1.26 -4.91 115.64 119.12 3c3y s THR 54 Ca 0.50 0.17 -0.37 0.00 0.31 0.00 0.00 61.69 62.30 3c3y s THR 54 Cb -0.41 -3.11 -0.16 0.00 0.01 0.00 0.00 72.50 68.83 3c3y s THR 54 CO 0.54 0.03 1.49 -0.24 -0.69 0.00 0.00 174.62 175.74 3c3y n SER 55 N 2.42 2.14 0.16 3.53 2.88 -1.26 -4.86 113.62 118.63 3c3y n SER 55 Ca 0.09 1.10 0.09 0.00 -1.33 0.00 0.00 58.87 58.81 3c3y n SER 55 Cb 0.38 -1.23 0.60 0.00 -0.75 0.00 0.00 64.21 63.21 3c3y n SER 55 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3c3y h PRO 56 N 5.57 0.12 -0.07 -1.46 0.11 -1.98 0.39 132.00 134.67 3c3y h PRO 56 Ca -0.47 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 3c3y h PRO 56 Cb 1.31 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 3c3y h PRO 56 CO 0.84 0.08 -0.07 1.25 -0.21 0.00 0.00 178.00 179.89 3c3y h LEU 57 N 0.12 0.18 -0.97 2.35 5.85 -1.98 -0.29 115.31 120.56 3c3y h LEU 57 Ca 0.08 -0.48 0.08 0.00 0.84 0.00 0.00 57.88 58.39 3c3y h LEU 57 Cb 0.15 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.06 3c3y h LEU 57 CO -0.01 0.63 0.62 0.00 -0.34 0.00 0.00 178.44 179.34 3c3y h ALA 58 N 0.56 1.38 -0.86 1.25 0.00 -1.76 -1.65 119.26 118.18 3c3y h ALA 58 Ca 0.01 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.95 3c3y h ALA 58 Cb 0.58 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 3c3y h ALA 58 CO 0.02 0.36 0.55 0.78 0.00 0.00 0.00 179.25 180.95 3c3y h GLY 59 N 1.09 1.26 1.18 0.00 0.00 -0.73 0.44 103.07 106.30 3c3y h GLY 59 Ca 0.44 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 3c3y h GLY 59 CO -0.20 0.33 0.22 -1.61 0.00 0.00 0.00 176.54 175.28 3c3y h GLN 60 N 1.04 1.04 -0.42 4.80 4.15 -0.11 0.36 115.11 125.97 3c3y h GLN 60 Ca 0.35 -0.21 -0.15 0.00 0.77 0.00 0.00 58.65 59.41 3c3y h GLN 60 Cb 0.05 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 3c3y h GLN 60 CO -0.13 0.88 -0.33 1.25 -1.93 0.00 0.00 178.83 178.57 3c3y h LEU 61 N 1.00 1.02 -0.52 -2.39 5.85 -1.00 -2.16 115.31 117.11 3c3y h LEU 61 Ca 0.22 -0.44 0.06 0.00 0.84 0.00 0.00 57.88 58.56 3c3y h LEU 61 Cb 0.27 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 3c3y h LEU 61 CO -0.01 1.25 0.21 0.24 -0.34 0.00 0.00 178.44 179.79 3c3y h MET 62 N 0.80 0.40 -0.50 1.25 2.86 -0.30 -0.45 114.93 118.99 3c3y h MET 62 Ca 0.08 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 3c3y h MET 62 Cb 0.93 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.47 3c3y h MET 62 CO 0.09 0.26 0.28 1.03 1.06 0.00 0.00 176.91 179.63 3c3y h SER 63 N 0.41 0.62 -0.19 1.22 0.87 -0.88 0.04 113.55 115.64 3c3y h SER 63 Ca 0.25 -0.09 0.04 0.00 -1.23 0.00 0.00 61.79 60.75 3c3y h SER 63 Cb 0.24 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.01 3c3y h SER 63 CO -0.23 0.53 -0.03 0.15 -0.53 0.00 0.00 176.83 176.72 3c3y h PHE 64 N 0.67 -0.07 -0.31 2.24 3.57 -0.91 -1.15 116.94 120.97 3c3y h PHE 64 Ca 0.18 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 3c3y h PHE 64 Cb 0.04 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 3c3y h PHE 64 CO -0.02 -0.06 0.03 0.28 -2.23 0.00 0.00 178.31 176.31 3c3y h VAL 65 N 0.02 1.24 -0.37 1.41 2.07 -0.87 -0.85 116.25 118.91 3c3y h VAL 65 Ca 0.09 -0.86 0.06 0.00 0.82 0.00 0.00 66.70 66.81 3c3y h VAL 65 Cb 0.13 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 3c3y h VAL 65 CO -0.18 0.28 0.05 -0.07 0.02 0.00 0.00 177.57 177.67 3c3y h LEU 66 N 0.34 -0.05 -0.75 2.57 3.38 -0.80 -1.85 115.31 118.14 3c3y h LEU 66 Ca 0.09 0.07 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 3c3y h LEU 66 Cb 0.38 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 3c3y h LEU 66 CO 0.01 0.01 -0.10 0.11 0.09 0.00 0.00 178.44 178.55 3c3y h LYS 67 N 0.16 0.84 -0.61 1.13 1.57 -1.12 -2.08 116.57 116.46 3c3y h LYS 67 Ca 0.18 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.68 3c3y h LYS 67 Cb 0.23 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 3c3y h LYS 67 CO -0.26 0.91 0.40 -0.07 -0.57 0.00 0.00 179.45 179.86 3c3y h LEU 68 N 0.76 0.69 -2.27 2.94 3.38 -0.51 -2.64 115.31 117.65 3c3y h LEU 68 Ca 0.13 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3c3y h LEU 68 Cb 0.61 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3c3y h LEU 68 CO 0.04 0.49 0.00 1.33 0.09 0.00 0.00 178.44 180.39 3c3y n VAL 69 N -4.45 0.46 -3.91 1.22 0.24 -0.75 -4.97 118.33 106.17 3c3y n VAL 69 Ca 0.06 -0.73 -0.27 0.00 -2.04 0.00 0.00 64.34 61.36 3c3y n VAL 69 Cb 0.05 1.02 0.01 0.00 -1.47 0.00 0.00 33.84 33.45 3c3y n VAL 69 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3c3y n ASN 70 N 1.36 -2.39 -4.77 -1.34 5.15 -0.92 -4.89 115.26 107.45 3c3y n ASN 70 Ca 0.17 -0.89 -0.41 0.00 -0.60 0.00 0.00 54.58 52.86 3c3y n ASN 70 Cb 0.57 -3.54 -0.00 0.00 -0.53 0.00 0.00 39.78 36.27 3c3y n ASN 70 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3c3y s ALA 71 N -3.58 3.62 0.00 5.20 0.00 -0.83 -4.91 121.76 121.27 3c3y s ALA 71 Ca 0.32 1.58 0.00 0.00 0.00 0.00 0.00 51.96 53.86 3c3y s ALA 71 Cb -0.17 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.33 3c3y s ALA 71 CO 0.86 -1.05 0.00 1.63 0.00 0.00 0.00 175.76 177.20 3c3y n LYS 72 N 0.87 0.00 -3.86 0.00 5.02 -1.26 -4.31 118.16 114.62 3c3y n LYS 72 Ca 0.03 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.96 3c3y n LYS 72 Cb 0.39 -0.79 -0.14 0.00 -0.02 0.00 0.00 35.03 34.47 3c3y n LYS 72 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3c3y s LYS 73 N -1.77 3.18 0.23 1.97 2.20 -1.26 -0.70 119.74 123.58 3c3y s LYS 73 Ca 0.00 -0.77 0.03 0.00 -0.36 0.00 0.00 55.97 54.87 3c3y s LYS 73 Cb 0.00 -3.14 -0.05 0.00 -1.51 0.00 0.00 37.83 33.13 3c3y s LYS 73 CO 0.00 -0.32 0.01 0.95 -0.36 0.00 0.00 175.35 175.63 3c3y s THR 74 N 1.46 0.90 -0.01 3.43 -4.23 -0.29 -0.20 115.64 116.70 3c3y s THR 74 Ca 0.04 -2.02 0.01 0.00 -1.18 0.00 0.00 61.69 58.54 3c3y s THR 74 Cb -0.16 -2.35 0.00 0.00 1.34 0.00 0.00 72.50 71.34 3c3y s THR 74 CO -0.01 -0.30 -0.04 -0.51 -0.54 0.00 0.00 174.62 173.21 3c3y s ILE 75 N -3.51 0.40 -0.08 2.99 2.07 -0.50 -0.59 121.20 121.99 3c3y s ILE 75 Ca 0.29 -0.17 0.03 0.00 -1.41 0.00 0.00 60.65 59.39 3c3y s ILE 75 Cb 0.06 -0.37 0.01 0.00 0.13 0.00 0.00 42.46 42.29 3c3y s ILE 75 CO 0.09 0.13 -0.15 -0.70 -1.91 0.00 0.00 174.94 172.40 3c3y s GLU 76 N 0.17 2.04 -0.34 3.50 2.12 0.63 -0.77 118.70 126.05 3c3y s GLU 76 Ca -0.02 -0.53 -0.01 0.00 0.36 0.00 0.00 54.97 54.77 3c3y s GLU 76 Cb -0.05 -1.64 0.08 0.00 0.26 0.00 0.00 34.13 32.78 3c3y s GLU 76 CO -0.00 0.06 0.07 0.08 -0.54 0.00 0.00 175.26 174.93 3c3y s VAL 77 N 0.60 2.98 0.00 3.70 1.01 0.18 -0.89 120.40 127.98 3c3y s VAL 77 Ca -0.15 -1.74 0.00 0.00 0.00 0.00 0.00 61.98 60.09 3c3y s VAL 77 Cb -0.16 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.33 3c3y s VAL 77 CO 0.05 -0.36 0.00 0.61 0.00 0.00 0.00 175.10 175.39 3c3y n GLY 78 N 4.56 0.37 0.13 4.51 0.00 -0.17 0.03 105.19 114.62 3c3y n GLY 78 Ca -0.07 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 45.07 3c3y n GLY 78 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3c3y n VAL 79 N 0.07 1.21 -0.50 1.61 0.31 -1.26 -4.67 118.33 115.11 3c3y n VAL 79 Ca 0.00 -0.44 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 3c3y n VAL 79 Cb 0.00 -1.32 0.00 0.00 -0.91 0.00 0.00 33.84 31.61 3c3y n VAL 79 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 3c3y n PHE 80 N -3.23 0.00 1.53 3.52 7.35 -1.26 -1.35 117.46 124.02 3c3y n PHE 80 Ca -0.38 0.00 0.13 0.00 -0.76 0.00 0.00 57.45 56.43 3c3y n PHE 80 Cb 0.89 0.01 0.54 0.00 0.35 0.00 0.00 39.48 41.26 3c3y n PHE 80 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 3c3y n THR 81 N 0.00 0.07 0.00 -2.13 -2.24 -1.25 -2.06 114.28 106.67 3c3y n THR 81 Ca 0.00 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3c3y n THR 81 Cb 0.00 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 3c3y n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3c3y n GLY 82 N 1.09 0.89 0.35 3.38 0.00 -0.45 -2.61 105.19 107.84 3c3y n GLY 82 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 3c3y n GLY 82 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3c3y h TYR 83 N 0.00 -0.86 -0.08 1.61 5.03 -1.93 0.58 116.97 121.33 3c3y h TYR 83 Ca 0.00 0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.25 3c3y h TYR 83 Cb 0.00 0.33 -0.01 0.00 1.55 0.00 0.00 36.73 38.60 3c3y h TYR 83 CO 0.00 -0.46 -0.22 0.66 -1.32 0.00 0.00 178.16 176.81 3c3y h SER 84 N -0.69 0.12 -0.14 -2.11 4.64 -1.90 -0.14 113.55 113.32 3c3y h SER 84 Ca -0.03 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.24 3c3y h SER 84 Cb 0.62 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 3c3y h SER 84 CO -0.04 0.35 -0.02 0.25 -0.87 0.00 0.00 176.83 176.51 3c3y h LEU 85 N 0.12 0.26 -0.53 5.97 5.85 -1.77 -0.50 115.31 124.71 3c3y h LEU 85 Ca 0.02 -0.34 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 3c3y h LEU 85 Cb 0.47 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 3c3y h LEU 85 CO 0.03 0.54 0.11 0.25 -0.34 0.00 0.00 178.44 179.04 3c3y h LEU 86 N -0.02 0.82 -0.67 2.25 5.85 -0.64 -0.33 115.31 122.58 3c3y h LEU 86 Ca 0.04 -0.24 0.06 0.00 0.84 0.00 0.00 57.88 58.57 3c3y h LEU 86 Cb 0.42 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 3c3y h LEU 86 CO 0.01 0.86 0.37 0.25 -0.34 0.00 0.00 178.44 179.59 3c3y h LEU 87 N 0.76 0.54 -0.34 2.25 7.12 -0.96 -0.68 115.31 124.00 3c3y h LEU 87 Ca 0.16 0.03 -0.02 0.00 0.13 0.00 0.00 57.88 58.19 3c3y h LEU 87 Cb 0.37 -0.08 -0.02 0.00 -0.53 0.00 0.00 40.66 40.41 3c3y h LEU 87 CO 0.01 0.35 0.14 0.74 -0.13 0.00 0.00 178.44 179.54 3c3y h THR 88 N 0.68 1.18 -0.70 1.05 2.02 -0.75 -2.13 112.91 114.26 3c3y h THR 88 Ca 0.30 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.92 3c3y h THR 88 Cb 0.19 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 3c3y h THR 88 CO -0.18 0.20 0.45 0.00 0.37 0.00 0.00 175.52 176.36 3c3y h ALA 89 N 0.98 1.48 0.00 6.16 0.00 -0.62 -1.07 119.26 126.19 3c3y h ALA 89 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3c3y h ALA 89 Cb 0.18 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3c3y h ALA 89 CO -0.01 0.47 0.00 -0.07 0.00 0.00 0.00 179.25 179.65 3c3y h LEU 90 N 0.95 0.00 0.00 0.00 3.38 -0.87 -3.28 115.31 115.50 3c3y h LEU 90 Ca 0.26 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.93 3c3y h LEU 90 Cb -0.09 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 3c3y h LEU 90 CO -0.05 0.00 -1.73 -1.20 0.09 0.00 0.00 178.44 175.55 3c3y n SER 91 N -2.42 0.90 -4.94 -0.43 7.64 -0.45 -4.95 113.62 108.97 3c3y n SER 91 Ca 0.04 0.40 -0.24 0.00 1.01 0.00 0.00 58.87 60.08 3c3y n SER 91 Cb 0.38 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 3c3y n SER 91 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 3c3y s ILE 92 N -2.59 4.51 1.11 0.44 -4.36 -0.91 -4.64 121.20 114.75 3c3y s ILE 92 Ca -0.05 -0.29 -0.12 0.00 -0.26 0.00 0.00 60.65 59.92 3c3y s ILE 92 Cb 0.08 -3.68 0.25 0.00 1.25 0.00 0.00 42.46 40.36 3c3y s ILE 92 CO 0.82 -0.53 1.05 -2.84 0.24 0.00 0.00 174.94 173.69 3c3y s PRO 93 N -4.56 -0.51 0.47 0.37 0.02 -1.26 -4.81 135.00 124.73 3c3y s PRO 93 Ca 0.46 0.92 0.18 0.00 0.02 0.00 0.00 61.00 62.58 3c3y s PRO 93 Cb -0.10 -1.60 1.17 0.00 0.02 0.00 0.00 34.50 34.00 3c3y s PRO 93 CO 0.39 -3.47 1.99 0.22 -0.33 0.00 0.00 177.00 175.80 3c3y h ASP 94 N -2.45 0.22 -0.44 2.53 1.82 -1.97 0.26 116.42 116.39 3c3y h ASP 94 Ca -0.58 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.07 3c3y h ASP 94 Cb 1.32 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 41.29 3c3y h ASP 94 CO 0.50 0.13 0.00 -0.90 -1.61 0.00 0.00 179.24 177.36 3c3y n ASP 95 N -4.45 2.45 -4.75 2.28 5.75 -1.26 -4.88 116.55 111.69 3c3y n ASP 95 Ca 0.09 -1.98 -0.37 0.00 -0.01 0.00 0.00 54.79 52.52 3c3y n ASP 95 Cb 0.44 -0.29 0.04 0.00 -1.03 0.00 0.00 41.12 40.28 3c3y n ASP 95 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3c3y s GLY 96 N -1.05 2.81 -0.08 6.12 0.00 0.08 -4.97 107.32 110.23 3c3y s GLY 96 Ca 0.31 1.12 -0.00 0.00 0.00 0.00 0.00 44.72 46.15 3c3y s GLY 96 CO 0.22 1.56 -0.04 0.54 0.00 0.00 0.00 173.10 175.37 3c3y s LYS 97 N -3.16 1.00 -0.14 2.90 -0.14 0.12 -4.55 119.74 115.76 3c3y s LYS 97 Ca 0.75 -0.08 -0.01 0.00 -1.36 0.00 0.00 55.97 55.27 3c3y s LYS 97 Cb -0.34 -1.14 -0.02 0.00 -1.68 0.00 0.00 37.83 34.65 3c3y s LYS 97 CO 0.38 -0.21 -0.09 0.42 -0.76 0.00 0.00 175.35 175.08 3c3y s ILE 98 N 1.54 3.39 -0.35 2.17 1.01 0.11 -1.14 121.20 127.94 3c3y s ILE 98 Ca -0.00 -0.54 -0.18 0.00 0.00 0.00 0.00 60.65 59.93 3c3y s ILE 98 Cb -0.13 -2.45 -0.00 0.00 0.01 0.00 0.00 42.46 39.89 3c3y s ILE 98 CO -0.04 0.52 0.48 -0.89 0.00 0.00 0.00 174.94 175.01 3c3y s THR 99 N 0.29 5.05 -0.20 2.92 2.01 0.25 -0.94 115.64 125.02 3c3y s THR 99 Ca -0.07 0.27 0.00 0.00 0.31 0.00 0.00 61.69 62.20 3c3y s THR 99 Cb -0.15 -3.94 0.02 0.00 0.01 0.00 0.00 72.50 68.44 3c3y s THR 99 CO 0.04 -0.20 -0.16 0.00 -0.69 0.00 0.00 174.62 173.62 3c3y s ALA 100 N 2.32 2.44 -0.13 7.40 0.00 -0.23 -0.27 121.76 133.29 3c3y s ALA 100 Ca 0.17 -1.28 0.02 0.00 0.00 0.00 0.00 51.96 50.88 3c3y s ALA 100 Cb -0.16 -1.32 0.00 0.00 0.00 0.00 0.00 23.12 21.64 3c3y s ALA 100 CO 0.13 -0.47 -0.20 0.42 0.00 0.00 0.00 175.76 175.63 3c3y s ILE 101 N 1.30 2.28 -0.13 0.00 1.01 -0.07 -0.18 121.20 125.41 3c3y s ILE 101 Ca 0.04 -0.92 -0.26 0.00 0.00 0.00 0.00 60.65 59.50 3c3y s ILE 101 Cb -0.14 -1.91 0.06 0.00 0.01 0.00 0.00 42.46 40.48 3c3y s ILE 101 CO -0.10 0.54 0.64 -0.62 0.00 0.00 0.00 174.94 175.40 3c3y s ASP 102 N 0.61 -0.64 0.00 3.58 -1.08 -0.85 -1.00 116.67 117.29 3c3y s ASP 102 Ca -0.11 0.93 0.29 0.00 -0.52 0.00 0.00 52.55 53.14 3c3y s ASP 102 Cb -0.16 0.87 1.23 0.00 -1.46 0.00 0.00 42.92 43.40 3c3y s ASP 102 CO 0.03 -0.44 1.86 2.22 0.52 0.00 0.00 175.17 179.36 3c3y n PHE 103 N 1.71 0.00 -3.66 -5.34 1.16 -1.14 -2.22 117.46 107.96 3c3y n PHE 103 Ca -0.17 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.03 3c3y n PHE 103 Cb 0.56 -0.16 -0.09 0.00 -1.61 0.00 0.00 39.48 38.19 3c3y n PHE 103 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 3c3y s ASP 104 N -2.41 5.48 0.35 5.98 -1.08 -1.26 -4.72 116.67 119.01 3c3y s ASP 104 Ca 0.30 -2.54 0.13 0.00 -0.52 0.00 0.00 52.55 49.92 3c3y s ASP 104 Cb 0.20 -1.91 0.66 0.00 -1.46 0.00 0.00 42.92 40.41 3c3y s ASP 104 CO 0.46 -0.47 1.79 -0.09 0.52 0.00 0.00 175.17 177.37 3c3y h ARG 105 N 7.52 0.00 -0.47 4.34 2.43 -1.97 -3.19 114.38 123.04 3c3y h ARG 105 Ca -0.05 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.15 3c3y h ARG 105 Cb 1.00 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.51 3c3y h ARG 105 CO 0.74 0.42 0.26 0.93 -1.51 0.00 0.00 179.97 180.80 3c3y h GLU 106 N 0.00 0.50 -0.51 0.20 4.39 -1.96 -1.39 114.58 115.80 3c3y h GLU 106 Ca -0.00 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.62 3c3y h GLU 106 Cb 0.74 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.26 3c3y h GLU 106 CO 0.05 0.33 0.12 0.00 -1.16 0.00 0.00 179.01 178.35 3c3y h ALA 107 N 1.23 0.68 -0.96 3.43 0.00 -1.82 -2.76 119.26 119.05 3c3y h ALA 107 Ca 0.20 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 55.00 3c3y h ALA 107 Cb 0.07 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.58 3c3y h ALA 107 CO -0.12 0.37 0.60 -0.92 0.00 0.00 0.00 179.25 179.19 3c3y h TYR 108 N 0.71 1.09 0.00 0.00 3.20 -0.91 -1.74 116.97 119.33 3c3y h TYR 108 Ca 0.16 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.06 3c3y h TYR 108 Cb 0.34 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.26 3c3y h TYR 108 CO 0.02 0.47 0.00 0.93 -1.64 0.00 0.00 178.16 177.94 3c3y h GLU 109 N 0.99 0.00 -0.23 1.82 5.08 -0.97 -1.02 114.58 120.25 3c3y h GLU 109 Ca 0.46 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.64 3c3y h GLU 109 Cb 0.39 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 3c3y h GLU 109 CO -0.24 0.00 -0.57 0.82 -1.00 0.00 0.00 179.01 178.02 3c3y h ILE 110 N 0.00 1.30 0.00 3.13 2.04 -1.31 -3.27 117.51 119.40 3c3y h ILE 110 Ca 0.00 -1.79 -0.02 0.00 1.00 0.00 0.00 64.86 64.05 3c3y h ILE 110 Cb 0.20 1.73 -0.00 0.00 -0.74 0.00 0.00 36.82 38.01 3c3y h ILE 110 CO 0.00 0.57 -0.82 1.23 0.00 0.00 0.00 178.15 179.13 3c3y h GLY 111 N 0.85 0.00 0.56 5.37 0.00 -0.98 -3.39 103.07 105.48 3c3y h GLY 111 Ca 0.01 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.45 3c3y h GLY 111 CO 0.12 0.00 0.61 -2.00 0.00 0.00 0.00 176.54 175.26 3c3y h LEU 112 N 0.00 0.84 -1.91 3.11 5.85 -1.29 -0.22 115.31 121.70 3c3y h LEU 112 Ca -0.02 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 3c3y h LEU 112 Cb 1.08 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.97 3c3y h LEU 112 CO 0.01 0.46 -0.07 -0.65 -0.34 0.00 0.00 178.44 177.85 3c3y h PRO 113 N 0.91 0.00 0.12 5.25 0.11 -1.76 -0.12 132.00 136.51 3c3y h PRO 113 Ca 0.46 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 66.29 3c3y h PRO 113 Cb 0.50 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.61 3c3y h PRO 113 CO -0.23 0.07 -1.31 0.74 -0.21 0.00 0.00 178.00 177.07 3c3y h PHE 114 N 0.00 0.47 -0.84 0.65 -1.00 -1.35 -0.52 116.94 114.35 3c3y h PHE 114 Ca -0.00 -0.34 0.04 0.00 2.81 0.00 0.00 57.97 60.48 3c3y h PHE 114 Cb 0.13 -0.02 -0.05 0.00 3.61 0.00 0.00 35.95 39.62 3c3y h PHE 114 CO 0.00 1.30 0.53 0.82 -1.61 0.00 0.00 178.31 179.35 3c3y h ILE 115 N 0.07 1.10 -0.23 -0.55 2.04 -0.87 -1.13 117.51 117.94 3c3y h ILE 115 Ca -0.16 -0.35 -0.09 0.00 1.00 0.00 0.00 64.86 65.26 3c3y h ILE 115 Cb 1.98 -0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 38.05 3c3y h ILE 115 CO 0.19 0.19 -0.19 0.03 0.00 0.00 0.00 178.15 178.36 3c3y h ARG 116 N 1.02 0.53 -0.70 2.37 3.08 -0.95 -2.68 114.38 117.05 3c3y h ARG 116 Ca 0.35 -0.27 0.10 0.00 0.07 0.00 0.00 59.98 60.23 3c3y h ARG 116 Cb 0.06 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 3c3y h ARG 116 CO -0.13 0.85 0.46 0.87 -1.07 0.00 0.00 179.97 180.95 3c3y h LYS 117 N 0.23 0.54 0.00 0.04 1.57 -0.89 -0.78 116.57 117.28 3c3y h LYS 117 Ca 0.04 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3c3y h LYS 117 Cb 0.73 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.92 3c3y h LYS 117 CO 0.05 0.36 0.00 0.00 -0.57 0.00 0.00 179.45 179.29 3c3y n ALA 118 N -2.48 2.23 -2.06 3.86 0.00 -0.45 -4.92 120.51 116.68 3c3y n ALA 118 Ca 0.12 -0.08 -0.07 0.00 0.00 0.00 0.00 53.44 53.41 3c3y n ALA 118 Cb 0.36 -1.44 -0.01 0.00 0.00 0.00 0.00 19.45 18.36 3c3y n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3c3y n GLY 119 N 1.25 0.14 0.10 0.00 0.00 -0.30 -4.95 105.19 101.44 3c3y n GLY 119 Ca 0.06 -0.60 0.01 0.00 0.00 0.00 0.00 46.02 45.49 3c3y n GLY 119 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3c3y n VAL 120 N -3.91 0.71 -0.02 1.61 0.24 -1.05 -4.69 118.33 111.22 3c3y n VAL 120 Ca -0.08 -0.85 0.09 0.00 -2.04 0.00 0.00 64.34 61.45 3c3y n VAL 120 Cb 0.54 0.66 0.49 0.00 -1.47 0.00 0.00 33.84 34.06 3c3y n VAL 120 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3c3y h GLU 121 N 0.34 0.41 0.00 7.34 4.81 -1.90 -1.44 114.58 124.14 3c3y h GLU 121 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3c3y h GLU 121 Cb 0.40 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.69 3c3y h GLU 121 CO 0.00 0.27 0.00 1.12 -0.73 0.00 0.00 179.01 179.67 3c3y h HIS 122 N 0.42 0.00 0.00 0.92 2.07 -1.95 -1.04 115.15 115.58 3c3y h HIS 122 Ca 0.20 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.72 3c3y h HIS 122 Cb 0.26 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.24 3c3y h HIS 122 CO -0.00 0.00 -0.05 1.63 -3.07 0.00 0.00 177.93 176.44 3c3y n LYS 123 N -3.07 0.23 -4.37 5.12 5.02 -0.54 -4.87 118.16 115.68 3c3y n LYS 123 Ca -0.03 0.17 -0.34 0.00 -2.02 0.00 0.00 58.31 56.10 3c3y n LYS 123 Cb 0.10 -1.75 -0.13 0.00 -0.02 0.00 0.00 35.03 33.22 3c3y n LYS 123 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3c3y s ILE 124 N -3.09 3.60 -0.48 -0.18 1.01 -0.39 0.10 121.20 121.76 3c3y s ILE 124 Ca 0.11 -0.45 -0.07 0.00 0.00 0.00 0.00 60.65 60.23 3c3y s ILE 124 Cb 0.13 -2.58 0.12 0.00 0.01 0.00 0.00 42.46 40.15 3c3y s ILE 124 CO 0.60 0.48 0.33 0.21 0.00 0.00 0.00 174.94 176.56 3c3y s ASN 125 N 0.64 5.59 -0.23 3.58 2.47 -0.11 -4.98 114.94 121.90 3c3y s ASN 125 Ca -0.03 -2.03 -0.24 0.00 0.42 0.00 0.00 52.86 50.98 3c3y s ASN 125 Cb -0.15 -1.96 -0.01 0.00 -1.45 0.00 0.00 41.25 37.68 3c3y s ASN 125 CO 0.02 -0.63 0.78 0.12 -3.72 0.00 0.00 177.10 173.68 3c3y s PHE 126 N 1.17 3.33 -0.30 0.43 5.36 -1.26 -1.07 117.98 125.65 3c3y s PHE 126 Ca 0.08 1.09 -0.06 0.00 -0.96 0.00 0.00 56.93 57.08 3c3y s PHE 126 Cb -0.24 -2.99 0.02 0.00 -0.34 0.00 0.00 43.02 39.46 3c3y s PHE 126 CO -0.02 -0.34 0.07 0.42 -1.46 0.00 0.00 175.22 173.89 3c3y s ILE 127 N 2.58 3.79 -0.71 3.12 1.01 0.75 -4.97 121.20 126.77 3c3y s ILE 127 Ca 0.34 -0.83 -0.22 0.00 0.00 0.00 0.00 60.65 59.94 3c3y s ILE 127 Cb -0.16 -3.00 0.08 0.00 0.01 0.00 0.00 42.46 39.40 3c3y s ILE 127 CO 0.09 0.03 0.99 -0.70 0.00 0.00 0.00 174.94 175.34 3c3y s GLU 128 N 1.46 3.21 0.06 2.79 2.12 -1.26 -2.01 118.70 125.07 3c3y s GLU 128 Ca 0.01 -1.06 -0.26 0.00 0.36 0.00 0.00 54.97 54.02 3c3y s GLU 128 Cb -0.18 -4.39 0.08 0.00 0.26 0.00 0.00 34.13 29.91 3c3y s GLU 128 CO 0.02 -1.80 0.70 0.45 -0.54 0.00 0.00 175.26 174.10 3c3y s SER 129 N 3.69 -0.53 0.24 -1.70 0.15 -0.94 -4.93 113.70 109.68 3c3y s SER 129 Ca 0.24 0.16 -0.31 0.00 0.70 0.00 0.00 55.95 56.74 3c3y s SER 129 Cb -0.15 0.52 -0.14 0.00 -1.71 0.00 0.00 66.02 64.54 3c3y s SER 129 CO 0.06 -0.78 1.18 -0.67 1.20 0.00 0.00 173.24 174.23 3c3y n ASP 130 N -0.04 1.78 -0.08 5.45 2.03 -1.26 -2.90 116.55 121.54 3c3y n ASP 130 Ca -0.15 1.16 -0.11 0.00 0.52 0.00 0.00 54.79 56.21 3c3y n ASP 130 Cb 0.62 -1.31 -0.04 0.00 -0.72 0.00 0.00 41.12 39.67 3c3y n ASP 130 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3c3y h ALA 131 N 3.09 0.31 -0.58 -1.67 0.00 -1.94 -2.04 119.26 116.43 3c3y h ALA 131 Ca -0.43 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 3c3y h ALA 131 Cb 1.32 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 3c3y h ALA 131 CO 0.68 -0.03 0.33 1.98 0.00 0.00 0.00 179.25 182.20 3c3y h MET 132 N 0.21 0.80 -0.47 0.00 -1.53 -1.99 -0.87 114.93 111.08 3c3y h MET 132 Ca 0.08 -0.09 0.04 0.00 -3.44 0.00 0.00 59.70 56.29 3c3y h MET 132 Cb 0.28 -0.16 -0.04 0.00 -0.55 0.00 0.00 31.60 31.13 3c3y h MET 132 CO 0.00 0.60 0.23 1.25 0.14 0.00 0.00 176.91 179.13 3c3y h LEU 133 N 0.78 0.33 -0.52 3.39 5.85 -1.92 0.38 115.31 123.61 3c3y h LEU 133 Ca 0.20 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 3c3y h LEU 133 Cb 0.03 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 3c3y h LEU 133 CO -0.03 0.23 0.21 0.00 -0.34 0.00 0.00 178.44 178.51 3c3y h ALA 134 N 1.25 0.68 -0.54 1.25 0.00 -0.97 -0.37 119.26 120.56 3c3y h ALA 134 Ca 0.20 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3c3y h ALA 134 Cb 0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3c3y h ALA 134 CO -0.15 0.29 0.08 -0.07 0.00 0.00 0.00 179.25 179.41 3c3y h LEU 135 N 0.71 0.87 -0.72 0.00 3.38 -0.87 -0.18 115.31 118.50 3c3y h LEU 135 Ca 0.17 -0.26 -0.13 0.00 0.09 0.00 0.00 57.88 57.75 3c3y h LEU 135 Cb 0.20 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 3c3y h LEU 135 CO -0.01 0.91 -0.46 0.44 0.09 0.00 0.00 178.44 179.41 3c3y h ASP 136 N 0.79 0.45 -0.28 -0.43 3.32 -0.72 -1.10 116.42 118.45 3c3y h ASP 136 Ca 0.16 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 3c3y h ASP 136 Cb 0.42 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 3c3y h ASP 136 CO 0.01 0.85 0.07 0.78 -1.72 0.00 0.00 179.24 179.23 3c3y h ASN 137 N 0.34 0.41 -0.67 6.45 2.35 -0.87 -2.69 115.58 120.90 3c3y h ASN 137 Ca 0.02 -0.22 0.11 0.00 -0.55 0.00 0.00 56.30 55.66 3c3y h ASN 137 Cb 0.94 -0.11 -0.08 0.00 0.05 0.00 0.00 38.32 39.13 3c3y h ASN 137 CO 0.08 0.53 0.27 0.25 -1.65 0.00 0.00 177.43 176.91 3c3y h LEU 138 N 0.28 0.28 -0.39 1.61 5.85 -0.78 -2.00 115.31 120.16 3c3y h LEU 138 Ca 0.09 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3c3y h LEU 138 Cb 0.27 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.35 3c3y h LEU 138 CO -0.00 0.15 0.00 0.18 -0.34 0.00 0.00 178.44 178.43 3c3y n LEU 139 N -4.97 0.42 0.23 2.25 4.77 -0.44 -1.63 117.00 117.63 3c3y n LEU 139 Ca 0.11 0.60 0.13 0.00 -0.03 0.00 0.00 56.01 56.81 3c3y n LEU 139 Cb 0.31 -0.53 0.41 0.00 -2.33 0.00 0.00 43.42 41.28 3c3y n LEU 139 CO 0.21 -0.41 0.84 1.56 -1.33 0.00 0.00 177.39 178.27 3c3y h GLN 140 N 0.00 0.00 -6.55 3.23 4.20 -1.03 -3.44 115.11 111.53 3c3y h GLN 140 Ca 0.00 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.15 3c3y h GLN 140 Cb 0.35 0.00 0.05 0.00 0.30 0.00 0.00 27.48 28.19 3c3y h GLN 140 CO 0.00 0.10 0.94 0.41 -0.67 0.00 0.00 178.83 179.61 3c3y n GLY 141 N 0.51 1.37 0.30 3.46 0.00 -0.65 -4.88 105.19 105.31 3c3y n GLY 141 Ca 0.02 0.66 0.19 0.00 0.00 0.00 0.00 46.02 46.89 3c3y n GLY 141 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3c3y h GLN 142 N 6.81 0.00 0.00 1.61 1.08 -1.87 -2.96 115.11 119.78 3c3y h GLN 142 Ca -0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 3c3y h GLN 142 Cb 1.23 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.66 3c3y h GLN 142 CO 0.93 0.00 -0.02 0.39 -0.95 0.00 0.00 178.83 179.17 3c3y n GLU 143 N -3.07 2.02 0.09 1.46 1.02 -1.26 -4.72 120.64 116.18 3c3y n GLU 143 Ca -0.01 -1.83 -0.07 0.00 -0.02 0.00 0.00 57.16 55.23 3c3y n GLU 143 Cb 0.22 -1.14 0.04 0.00 -0.02 0.00 0.00 31.44 30.54 3c3y n GLU 143 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3c3y h SER 144 N 0.00 0.24 -2.87 1.62 4.64 -1.79 -3.42 113.55 111.97 3c3y h SER 144 Ca 0.00 -0.17 -0.52 0.00 -0.47 0.00 0.00 61.79 60.62 3c3y h SER 144 Cb 0.76 -0.07 0.06 0.00 -0.31 0.00 0.00 62.40 62.84 3c3y h SER 144 CO 0.00 0.93 0.94 -1.61 -0.87 0.00 0.00 176.83 176.22 3c3y s GLU 145 N -3.39 4.15 -1.27 4.77 2.02 -1.26 -2.39 118.70 121.34 3c3y s GLU 145 Ca -0.03 2.52 0.00 0.00 0.02 0.00 0.00 54.97 57.48 3c3y s GLU 145 Cb 0.11 -3.09 0.00 0.00 0.10 0.00 0.00 34.13 31.25 3c3y s GLU 145 CO 0.81 -0.67 0.00 0.41 0.02 0.00 0.00 175.26 175.83 3c3y n GLY 146 N 3.48 1.29 0.04 -1.39 0.00 0.20 -4.88 105.19 103.92 3c3y n GLY 146 Ca 0.13 -0.39 0.11 0.00 0.00 0.00 0.00 46.02 45.88 3c3y n GLY 146 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3c3y n SER 147 N -0.13 0.60 -4.87 1.61 3.41 -0.72 -3.91 113.62 109.61 3c3y n SER 147 Ca -0.12 -0.16 -0.37 0.00 -0.26 0.00 0.00 58.87 57.97 3c3y n SER 147 Cb 0.42 0.84 -0.06 0.00 -0.26 0.00 0.00 64.21 65.15 3c3y n SER 147 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3c3y s TYR 148 N -3.23 3.63 0.04 7.33 1.51 -0.26 -4.84 117.35 121.53 3c3y s TYR 148 Ca 0.03 0.68 0.10 0.00 -1.01 0.00 0.00 57.07 56.86 3c3y s TYR 148 Cb 0.14 -2.05 -0.20 0.00 -0.11 0.00 0.00 41.96 39.73 3c3y s TYR 148 CO 0.81 0.69 1.06 -0.44 -1.11 0.00 0.00 175.55 176.56 3c3y h ASP 149 N 4.71 0.00 -3.70 2.29 3.32 -0.91 0.11 116.42 122.24 3c3y h ASP 149 Ca -0.53 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.46 3c3y h ASP 149 Cb 1.22 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.55 3c3y h ASP 149 CO 0.61 0.96 -0.05 0.12 -1.72 0.00 0.00 179.24 179.16 3c3y s PHE 150 N -2.69 -0.72 -0.01 4.55 5.36 -1.20 -2.00 117.98 121.27 3c3y s PHE 150 Ca -0.01 1.65 0.04 0.00 -0.96 0.00 0.00 56.93 57.65 3c3y s PHE 150 Cb 0.09 0.30 -0.01 0.00 -0.34 0.00 0.00 43.02 43.06 3c3y s PHE 150 CO 0.82 -0.35 -0.15 0.20 -1.46 0.00 0.00 175.22 174.28 3c3y s GLY 151 N 0.67 0.71 -0.19 13.12 0.00 0.30 -1.41 107.32 120.53 3c3y s GLY 151 Ca -0.03 -0.62 0.01 0.00 0.00 0.00 0.00 44.72 44.08 3c3y s GLY 151 CO -0.04 -0.51 -0.18 -0.12 0.00 0.00 0.00 173.10 172.24 3c3y s PHE 152 N -0.33 2.77 -0.29 1.90 5.36 0.05 -0.59 117.98 126.84 3c3y s PHE 152 Ca 0.05 -1.69 -0.08 0.00 -0.96 0.00 0.00 56.93 54.26 3c3y s PHE 152 Cb -0.06 -1.88 0.00 0.00 -0.34 0.00 0.00 43.02 40.74 3c3y s PHE 152 CO -0.01 -0.80 0.10 0.08 -1.46 0.00 0.00 175.22 173.13 3c3y s VAL 153 N 1.29 4.15 -0.20 3.12 1.01 0.45 -0.65 120.40 129.57 3c3y s VAL 153 Ca 0.03 -0.58 0.18 0.00 0.00 0.00 0.00 61.98 61.61 3c3y s VAL 153 Cb -0.14 -3.11 0.40 0.00 0.00 0.00 0.00 36.38 33.53 3c3y s VAL 153 CO -0.12 0.10 1.23 -0.67 0.00 0.00 0.00 175.10 175.64 3c3y n ASP 154 N 4.90 0.27 0.00 3.32 2.03 0.10 -2.18 116.55 124.99 3c3y n ASP 154 Ca -0.15 -2.07 0.00 0.00 0.52 0.00 0.00 54.79 53.10 3c3y n ASP 154 Cb 0.49 -0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.87 3c3y n ASP 154 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3c3y n ALA 155 N -0.57 0.00 -2.43 -1.67 0.00 -0.95 -4.48 120.51 110.41 3c3y n ALA 155 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.97 3c3y n ALA 155 Cb 0.88 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.30 3c3y n ALA 155 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 3c3y s ASP 156 N -1.00 6.99 0.30 0.00 -4.77 -1.26 -4.94 116.67 111.98 3c3y s ASP 156 Ca 0.00 1.76 0.00 0.00 -3.30 0.00 0.00 52.55 51.01 3c3y s ASP 156 Cb 0.00 -2.55 0.46 0.00 -1.09 0.00 0.00 42.92 39.74 3c3y s ASP 156 CO 0.00 -0.68 1.84 0.11 0.70 0.00 0.00 175.17 177.14 3c3y h LYS 157 N 7.84 0.74 -0.01 2.11 1.79 -1.97 -1.69 116.57 125.38 3c3y h LYS 157 Ca -0.30 -0.15 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 3c3y h LYS 157 Cb 1.13 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 31.67 3c3y h LYS 157 CO 0.93 0.69 0.05 -1.35 -1.08 0.00 0.00 179.45 178.69 3c3y h PRO 158 N 0.71 0.00 -0.12 3.15 0.11 -1.92 -1.74 132.00 132.19 3c3y h PRO 158 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 3c3y h PRO 158 Cb 0.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.42 3c3y h PRO 158 CO 0.00 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.88 3c3y n ASN 159 N -3.15 2.54 -0.32 -2.05 3.02 -0.64 -4.51 115.26 110.15 3c3y n ASN 159 Ca -0.03 -1.83 0.05 0.00 -0.03 0.00 0.00 54.58 52.74 3c3y n ASN 159 Cb 0.12 -0.07 0.20 0.00 -0.61 0.00 0.00 39.78 39.42 3c3y n ASN 159 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 3c3y h TYR 160 N 3.72 0.96 -0.51 3.10 -1.99 -1.36 0.84 116.97 121.73 3c3y h TYR 160 Ca 0.00 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 3c3y h TYR 160 Cb 0.80 -0.30 -0.02 0.00 2.00 0.00 0.00 36.73 39.21 3c3y h TYR 160 CO 0.07 0.38 0.23 0.82 -0.00 0.00 0.00 178.16 179.66 3c3y h ILE 161 N 0.86 1.20 -0.58 -2.88 2.04 -1.81 -0.20 117.51 116.14 3c3y h ILE 161 Ca 0.44 -0.58 -0.08 0.00 1.00 0.00 0.00 64.86 65.64 3c3y h ILE 161 Cb 0.43 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 3c3y h ILE 161 CO -0.26 0.23 0.03 0.11 0.00 0.00 0.00 178.15 178.25 3c3y h LYS 162 N 0.67 0.99 -0.85 2.37 1.57 -1.65 -2.81 116.57 116.86 3c3y h LYS 162 Ca 0.17 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 3c3y h LYS 162 Cb 0.14 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.30 3c3y h LYS 162 CO -0.02 0.96 0.48 1.88 -0.57 0.00 0.00 179.45 182.18 3c3y h TYR 163 N 0.92 1.15 -0.92 -1.35 0.05 -0.45 -2.60 116.97 113.77 3c3y h TYR 163 Ca 0.17 -0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.99 3c3y h TYR 163 Cb 0.50 -0.37 -0.06 0.00 1.01 0.00 0.00 36.73 37.80 3c3y h TYR 163 CO 0.03 0.79 0.60 1.25 -1.05 0.00 0.00 178.16 179.78 3c3y h HIS 164 N 1.19 1.09 -0.67 4.88 2.76 -0.78 0.13 115.15 123.74 3c3y h HIS 164 Ca 0.30 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.56 3c3y h HIS 164 Cb 0.01 -0.36 -0.06 0.00 1.55 0.00 0.00 27.41 28.55 3c3y h HIS 164 CO 0.01 0.58 0.38 1.49 -1.30 0.00 0.00 177.93 179.09 3c3y h GLU 165 N 1.08 0.67 -0.04 5.26 4.81 -1.35 0.25 114.58 125.26 3c3y h GLU 165 Ca 0.39 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.48 3c3y h GLU 165 Cb 0.14 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 29.38 3c3y h GLU 165 CO -0.14 0.45 -0.35 0.00 -0.73 0.00 0.00 179.01 178.24 3c3y h ARG 166 N 0.70 0.32 -0.23 1.92 -0.00 -1.16 -3.27 114.38 112.65 3c3y h ARG 166 Ca 0.30 -0.28 -0.05 0.00 -0.50 0.00 0.00 59.98 59.45 3c3y h ARG 166 Cb 0.19 0.07 -0.01 0.00 0.00 0.00 0.00 29.97 30.21 3c3y h ARG 166 CO -0.18 0.94 -0.06 -0.07 0.00 0.00 0.00 179.97 180.60 3c3y h LEU 167 N -0.21 0.33 -2.01 3.04 -0.00 -0.58 -1.05 115.31 114.81 3c3y h LEU 167 Ca -0.03 -0.06 -0.01 0.00 -0.00 0.00 0.00 57.88 57.78 3c3y h LEU 167 Cb 1.03 -0.09 -0.00 0.00 -0.00 0.00 0.00 40.66 41.60 3c3y h LEU 167 CO 0.07 0.44 -0.03 0.24 -0.00 0.00 0.00 178.44 179.16 3c3y h MET 168 N 0.34 0.00 0.11 1.13 2.86 -1.00 -0.84 114.93 117.53 3c3y h MET 168 Ca 0.07 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.37 3c3y h MET 168 Cb 0.33 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 3c3y h MET 168 CO 0.01 0.03 -1.84 0.87 1.06 0.00 0.00 176.91 177.05 3c3y h LYS 169 N 0.00 0.23 -0.00 1.72 1.57 -1.28 -3.40 116.57 115.41 3c3y h LYS 169 Ca -0.00 -0.40 -0.23 0.00 -1.87 0.00 0.00 60.65 58.15 3c3y h LYS 169 Cb 0.33 0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.79 3c3y h LYS 169 CO 0.00 1.08 -0.94 -0.07 -0.57 0.00 0.00 179.45 178.95 3c3y h LEU 170 N 0.06 0.55 -9.74 2.94 3.38 -0.98 0.59 115.31 112.11 3c3y h LEU 170 Ca -0.36 -0.44 -0.53 0.00 0.09 0.00 0.00 57.88 56.65 3c3y h LEU 170 Cb 2.04 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 42.59 3c3y h LEU 170 CO 0.11 1.24 0.17 -0.69 0.09 0.00 0.00 178.44 179.35 3c3y s VAL 171 N -3.27 4.40 0.82 1.22 1.01 -0.35 -1.11 120.40 123.12 3c3y s VAL 171 Ca -0.06 1.64 -0.11 0.00 0.00 0.00 0.00 61.98 63.45 3c3y s VAL 171 Cb 0.09 -4.10 0.09 0.00 0.00 0.00 0.00 36.38 32.46 3c3y s VAL 171 CO 0.87 0.49 1.12 -1.59 0.00 0.00 0.00 175.10 175.98 3c3y s LYS 172 N -1.25 1.82 0.23 2.72 -2.85 0.38 -4.33 119.74 116.46 3c3y s LYS 172 Ca 0.36 1.34 -0.32 0.00 -1.00 0.00 0.00 55.97 56.36 3c3y s LYS 172 Cb -0.22 -1.83 -0.12 0.00 -2.06 0.00 0.00 37.83 33.59 3c3y s LYS 172 CO 0.25 -2.00 1.67 0.28 0.10 0.00 0.00 175.35 175.66 3c3y n VAL 173 N -3.70 0.31 -0.22 1.79 0.31 -1.26 -0.29 118.33 115.26 3c3y n VAL 173 Ca 0.10 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 3c3y n VAL 173 Cb 0.52 -1.94 0.00 0.00 -0.91 0.00 0.00 33.84 31.52 3c3y n VAL 173 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3c3y n GLY 174 N 3.39 1.76 3.84 2.92 0.00 0.12 -5.00 105.19 112.22 3c3y n GLY 174 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 3c3y n GLY 174 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3c3y s GLY 175 N -1.91 1.64 -0.04 -0.02 0.00 0.60 -4.69 107.32 102.89 3c3y s GLY 175 Ca 0.00 -0.79 0.07 0.00 0.00 0.00 0.00 44.72 44.00 3c3y s GLY 175 CO 0.00 -0.16 -0.25 -0.42 0.00 0.00 0.00 173.10 172.27 3c3y s ILE 176 N -3.50 2.00 -0.09 0.90 1.09 -0.85 -1.29 121.20 119.46 3c3y s ILE 176 Ca 0.67 -1.06 0.02 0.00 -1.10 0.00 0.00 60.65 59.18 3c3y s ILE 176 Cb -0.10 -1.67 0.01 0.00 -1.06 0.00 0.00 42.46 39.63 3c3y s ILE 176 CO 0.52 0.56 -0.16 -0.69 -0.10 0.00 0.00 174.94 175.07 3c3y s VAL 177 N -0.36 1.53 0.06 2.92 1.01 -0.13 -0.54 120.40 124.89 3c3y s VAL 177 Ca 0.03 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 61.40 3c3y s VAL 177 Cb -0.12 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 3c3y s VAL 177 CO 0.01 0.44 -0.18 0.00 0.00 0.00 0.00 175.10 175.38 3c3y s ALA 178 N 0.74 2.61 -0.09 5.51 0.00 0.24 0.00 121.76 130.77 3c3y s ALA 178 Ca -0.12 -1.23 0.03 0.00 0.00 0.00 0.00 51.96 50.64 3c3y s ALA 178 Cb -0.16 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.25 3c3y s ALA 178 CO 0.02 0.58 -0.18 0.71 0.00 0.00 0.00 175.76 176.89 3c3y s TYR 179 N -0.97 2.07 0.31 0.00 2.02 0.05 -0.41 117.35 120.41 3c3y s TYR 179 Ca 0.15 -0.87 0.02 0.00 -0.37 0.00 0.00 57.07 56.00 3c3y s TYR 179 Cb -0.10 -1.44 -0.03 0.00 -0.40 0.00 0.00 41.96 39.98 3c3y s TYR 179 CO 0.06 -0.40 0.48 0.34 -1.57 0.00 0.00 175.55 174.47 3c3y s ASP 180 N 0.62 6.31 -1.07 2.29 2.15 -0.93 -1.04 116.67 125.00 3c3y s ASP 180 Ca -0.14 0.34 0.00 0.00 0.43 0.00 0.00 52.55 53.18 3c3y s ASP 180 Cb -0.16 -1.98 0.00 0.00 -0.30 0.00 0.00 42.92 40.47 3c3y s ASP 180 CO 0.04 -0.21 0.00 0.59 -0.17 0.00 0.00 175.17 175.42 3c3y n ASN 181 N -1.59 -3.94 0.00 -0.34 4.13 0.72 -4.91 115.26 109.33 3c3y n ASN 181 Ca -0.06 0.04 0.04 0.00 1.68 0.00 0.00 54.58 56.29 3c3y n ASN 181 Cb 0.56 -3.04 0.25 0.00 -1.54 0.00 0.00 39.78 36.01 3c3y n ASN 181 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 3c3y n THR 182 N -3.77 0.00 0.10 3.41 -2.24 -0.71 -1.87 114.28 109.20 3c3y n THR 182 Ca -0.14 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.65 3c3y n THR 182 Cb 0.57 -0.26 0.01 0.00 -2.10 0.00 0.00 70.33 68.56 3c3y n THR 182 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3c3y n LEU 183 N -0.66 1.29 -3.50 3.22 4.77 -0.26 -4.93 117.00 116.94 3c3y n LEU 183 Ca 0.06 -1.08 -0.19 0.00 -0.03 0.00 0.00 56.01 54.77 3c3y n LEU 183 Cb 0.03 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3c3y n LEU 183 CO 0.05 0.30 -0.13 1.87 -1.33 0.00 0.00 177.39 178.15 3c3y n TRP 184 N 0.11 -1.00 -1.06 -1.77 -0.00 -0.78 -0.13 117.44 112.81 3c3y n TRP 184 Ca 0.02 0.30 -0.02 0.00 -0.00 0.00 0.00 57.50 57.80 3c3y n TRP 184 Cb 0.08 -1.55 -0.01 0.00 -0.00 0.00 0.00 31.31 29.84 3c3y n TRP 184 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3c3y n GLY 185 N -1.32 0.44 2.20 5.87 0.00 -1.26 -1.24 105.19 109.87 3c3y n GLY 185 Ca -0.14 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3c3y n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3c3y n GLY 186 N -1.18 1.58 0.24 -0.02 0.00 0.81 -4.12 105.19 102.50 3c3y n GLY 186 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 3c3y n GLY 186 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3c3y h THR 187 N 0.00 0.50 0.00 2.61 1.35 -1.11 -2.48 112.91 113.78 3c3y h THR 187 Ca 0.00 -0.91 -0.00 0.00 -0.55 0.00 0.00 66.41 64.95 3c3y h THR 187 Cb 0.00 1.63 -0.00 0.00 -1.73 0.00 0.00 68.15 68.05 3c3y h THR 187 CO 0.00 0.18 -0.00 -0.37 -0.25 0.00 0.00 175.52 175.07 3c3y h VAL 188 N 0.00 0.11 -0.14 6.82 -1.51 -1.73 -1.41 116.25 118.38 3c3y h VAL 188 Ca -0.00 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 65.45 3c3y h VAL 188 Cb 0.61 1.02 0.00 0.00 -2.13 0.00 0.00 31.29 30.79 3c3y h VAL 188 CO 0.02 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.36 3c3y n ALA 189 N -2.13 2.44 -2.81 5.19 0.00 -0.93 -4.95 120.51 117.31 3c3y n ALA 189 Ca -0.03 -0.77 -0.31 0.00 0.00 0.00 0.00 53.44 52.33 3c3y n ALA 189 Cb 0.08 -0.67 -0.06 0.00 0.00 0.00 0.00 19.45 18.80 3c3y n ALA 189 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3c3y s GLN 190 N -1.48 3.06 0.39 0.00 -0.21 -0.53 -5.08 119.66 115.81 3c3y s GLN 190 Ca 0.26 -0.58 -0.27 0.00 0.02 0.00 0.00 55.36 54.79 3c3y s GLN 190 Cb 0.17 -2.83 -0.09 0.00 1.00 0.00 0.00 33.01 31.25 3c3y s GLN 190 CO 0.25 0.60 1.38 -1.25 -2.12 0.00 0.00 175.29 174.14 3c3y s PRO 191 N -2.25 4.01 0.55 2.91 0.04 -1.26 -4.88 135.00 134.12 3c3y s PRO 191 Ca 0.29 2.34 0.26 0.00 0.04 0.00 0.00 61.00 63.93 3c3y s PRO 191 Cb -0.12 -2.85 1.45 0.00 0.04 0.00 0.00 34.50 33.01 3c3y s PRO 191 CO 0.21 -0.52 1.99 1.49 0.04 0.00 0.00 177.00 180.21 3c3y h GLU 192 N 2.81 0.00 0.00 4.56 4.81 -1.96 -0.34 114.58 124.46 3c3y h GLU 192 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3c3y h GLU 192 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 3c3y h GLU 192 CO 0.63 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 179.57 3c3y h SER 193 N 0.00 0.00 -0.60 1.04 4.64 -2.01 -2.45 113.55 114.16 3c3y h SER 193 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3c3y h SER 193 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3c3y h SER 193 CO -0.00 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.34 3c3y n GLU 194 N -2.77 2.42 -5.07 4.77 1.02 -0.14 -4.93 120.64 115.94 3c3y n GLU 194 Ca 0.00 -2.17 -0.32 0.00 -0.02 0.00 0.00 57.16 54.65 3c3y n GLU 194 Cb 0.23 -1.48 -0.15 0.00 -0.02 0.00 0.00 31.44 30.02 3c3y n GLU 194 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3c3y s VAL 195 N -1.21 2.54 0.45 2.62 1.01 -0.92 -5.01 120.40 119.88 3c3y s VAL 195 Ca 0.40 -0.90 -0.25 0.00 0.00 0.00 0.00 61.98 61.24 3c3y s VAL 195 Cb 0.21 -1.97 -0.09 0.00 0.00 0.00 0.00 36.38 34.54 3c3y s VAL 195 CO 0.27 0.57 1.29 -2.65 0.00 0.00 0.00 175.10 174.59 3c3y n PRO 196 N 2.77 1.90 -0.25 2.72 -0.02 -1.26 -4.91 135.00 135.95 3c3y n PRO 196 Ca -0.17 0.68 0.05 0.00 -2.02 0.00 0.00 63.50 62.04 3c3y n PRO 196 Cb 0.52 -2.44 0.18 0.00 -0.02 0.00 0.00 33.50 31.74 3c3y n PRO 196 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3c3y h ASP 197 N 1.95 0.17 0.56 2.55 5.19 -1.99 -0.49 116.42 124.36 3c3y h ASP 197 Ca -0.49 0.12 0.00 0.00 -0.62 0.00 0.00 57.03 56.05 3c3y h ASP 197 Cb 1.30 0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.94 3c3y h ASP 197 CO 0.59 0.04 0.00 2.22 -3.12 0.00 0.00 179.24 178.97 3c3y n PHE 198 N -5.07 0.71 0.88 4.55 1.16 -1.26 -2.06 117.46 116.38 3c3y n PHE 198 Ca 0.14 0.30 0.11 0.00 -1.87 0.00 0.00 57.45 56.13 3c3y n PHE 198 Cb 0.43 -0.98 0.06 0.00 -1.61 0.00 0.00 39.48 37.39 3c3y n PHE 198 CO 0.00 0.00 0.00 -1.33 -1.87 0.00 0.00 176.76 173.56 3c3y n MET 199 N -2.16 0.08 0.01 3.97 2.81 -0.20 -4.58 117.12 117.04 3c3y n MET 199 Ca 0.02 -0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.84 3c3y n MET 199 Cb 0.18 -1.52 0.13 0.00 -0.71 0.00 0.00 33.22 31.30 3c3y n MET 199 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 3c3y h LYS 200 N 0.00 0.50 -0.02 0.03 1.57 -1.33 -1.58 116.57 115.73 3c3y h LYS 200 Ca 0.00 -0.25 -0.00 0.00 -1.87 0.00 0.00 60.65 58.53 3c3y h LYS 200 Cb 0.56 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 3c3y h LYS 200 CO 0.00 0.82 0.00 1.49 -0.57 0.00 0.00 179.45 181.20 3c3y h GLU 201 N 0.41 0.03 0.00 3.15 4.81 -1.81 -2.41 114.58 118.76 3c3y h GLU 201 Ca 0.03 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.14 3c3y h GLU 201 Cb 0.90 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.26 3c3y h GLU 201 CO 0.08 0.31 -0.55 -0.91 -0.73 0.00 0.00 179.01 177.21 3c3y h ASN 202 N -0.26 0.00 -0.14 1.04 2.35 -1.86 -1.44 115.58 115.27 3c3y h ASN 202 Ca 0.01 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 3c3y h ASN 202 Cb 0.30 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.64 3c3y h ASN 202 CO 0.00 0.55 -0.04 -0.09 -1.65 0.00 0.00 177.43 176.20 3c3y h ARG 203 N 0.00 -0.00 -0.54 0.81 2.43 -1.21 0.10 114.38 115.97 3c3y h ARG 203 Ca -0.01 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 3c3y h ARG 203 Cb 1.11 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 3c3y h ARG 203 CO 0.07 -0.00 -0.01 1.49 -1.51 0.00 0.00 179.97 180.01 3c3y h GLU 204 N -0.01 0.96 -0.87 0.20 4.57 -1.21 -0.73 114.58 117.50 3c3y h GLU 204 Ca 0.07 -0.31 0.00 0.00 -1.18 0.00 0.00 59.36 57.94 3c3y h GLU 204 Cb 0.11 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.57 3c3y h GLU 204 CO -0.15 0.98 0.54 0.00 -1.18 0.00 0.00 179.01 179.20 3c3y h ALA 205 N 0.95 1.10 -0.01 2.92 0.00 -1.06 -0.87 119.26 122.29 3c3y h ALA 205 Ca 0.15 -0.08 -0.22 0.00 0.00 0.00 0.00 54.91 54.75 3c3y h ALA 205 Cb 0.55 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3c3y h ALA 205 CO 0.03 0.54 -0.93 0.28 0.00 0.00 0.00 179.25 179.18 3c3y h VAL 206 N 1.19 1.39 -0.36 0.00 2.07 -0.80 -1.02 116.25 118.71 3c3y h VAL 206 Ca 0.31 -2.41 0.05 0.00 0.82 0.00 0.00 66.70 65.47 3c3y h VAL 206 Cb -0.08 2.38 -0.04 0.00 -1.52 0.00 0.00 31.29 32.03 3c3y h VAL 206 CO -0.06 0.72 0.11 0.40 0.02 0.00 0.00 177.57 178.76 3c3y h ILE 207 N 0.25 0.87 -0.41 4.57 2.04 -0.79 0.80 117.51 124.83 3c3y h ILE 207 Ca -0.08 -0.09 -0.11 0.00 1.00 0.00 0.00 64.86 65.58 3c3y h ILE 207 Cb 1.56 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 3c3y h ILE 207 CO 0.16 0.05 -0.21 -0.33 0.00 0.00 0.00 178.15 177.82 3c3y h GLU 208 N 0.25 0.81 -0.38 2.37 4.39 -1.08 -1.97 114.58 118.97 3c3y h GLU 208 Ca 0.17 -0.32 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 3c3y h GLU 208 Cb 0.16 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 3c3y h GLU 208 CO -0.19 0.94 0.18 1.25 -1.16 0.00 0.00 179.01 180.04 3c3y h LEU 209 N 0.71 0.50 -0.90 1.33 7.12 -0.78 -1.21 115.31 122.08 3c3y h LEU 209 Ca 0.10 -0.13 -0.01 0.00 0.13 0.00 0.00 57.88 57.97 3c3y h LEU 209 Cb 0.72 -0.13 -0.04 0.00 -0.53 0.00 0.00 40.66 40.68 3c3y h LEU 209 CO 0.06 0.49 0.53 0.78 -0.13 0.00 0.00 178.44 180.17 3c3y h ASN 210 N 0.47 1.09 -0.76 1.25 2.35 -0.68 -0.72 115.58 118.58 3c3y h ASN 210 Ca 0.13 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 3c3y h ASN 210 Cb 0.13 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.19 3c3y h ASN 210 CO -0.02 0.84 0.39 0.11 -1.65 0.00 0.00 177.43 177.11 3c3y h LYS 211 N 1.24 1.08 0.07 0.81 1.57 -1.14 -0.83 116.57 119.37 3c3y h LYS 211 Ca 0.32 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3c3y h LYS 211 Cb -0.04 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.07 3c3y h LYS 211 CO -0.06 0.83 -0.03 1.25 -0.57 0.00 0.00 179.45 180.86 3c3y h LEU 212 N 1.07 -0.08 -0.74 2.94 6.46 -0.57 -2.41 115.31 121.97 3c3y h LEU 212 Ca 0.27 -0.21 0.03 0.00 -0.12 0.00 0.00 57.88 57.84 3c3y h LEU 212 Cb 0.08 0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 39.99 3c3y h LEU 212 CO -0.04 0.17 0.47 -0.07 -0.62 0.00 0.00 178.44 178.35 3c3y h LEU 213 N -0.33 0.78 -1.85 2.25 3.38 -1.09 -1.86 115.31 116.59 3c3y h LEU 213 Ca -0.01 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.97 3c3y h LEU 213 Cb 0.29 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3c3y h LEU 213 CO 0.02 0.54 0.14 0.00 0.09 0.00 0.00 178.44 179.22 3c3y h ALA 214 N 1.31 1.94 -0.02 1.53 0.00 -1.04 -2.86 119.26 120.12 3c3y h ALA 214 Ca 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3c3y h ALA 214 Cb -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3c3y h ALA 214 CO -0.10 0.03 -0.28 0.00 0.00 0.00 0.00 179.25 178.90 3c3y n ALA 215 N -2.52 3.10 -2.54 0.00 0.00 -0.92 -4.92 120.51 112.70 3c3y n ALA 215 Ca 0.01 -0.66 -0.43 0.00 0.00 0.00 0.00 53.44 52.36 3c3y n ALA 215 Cb 0.13 -0.79 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 3c3y n ALA 215 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3c3y s ASP 216 N -2.25 6.62 0.21 0.00 -1.08 -0.74 -4.90 116.67 114.52 3c3y s ASP 216 Ca 0.22 0.69 0.21 0.00 -0.52 0.00 0.00 52.55 53.15 3c3y s ASP 216 Cb 0.19 -2.55 0.90 0.00 -1.46 0.00 0.00 42.92 40.00 3c3y s ASP 216 CO 0.45 -1.22 1.63 -0.81 0.52 0.00 0.00 175.17 175.74 3c3y n PRO 217 N 7.71 0.14 0.00 4.34 -0.04 -1.26 -2.78 135.00 143.11 3c3y n PRO 217 Ca 0.13 0.42 0.14 0.00 -0.04 0.00 0.00 63.50 64.16 3c3y n PRO 217 Cb 0.48 -1.80 0.69 0.00 -0.04 0.00 0.00 33.50 32.83 3c3y n PRO 217 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3c3y n ARG 218 N -2.07 0.26 -4.14 0.54 1.74 -1.26 -4.86 116.66 106.87 3c3y n ARG 218 Ca 0.02 0.01 -0.11 0.00 -0.77 0.00 0.00 57.85 57.00 3c3y n ARG 218 Cb 0.18 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.02 3c3y n ARG 218 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 3c3y s ILE 219 N -2.73 0.61 -0.01 0.55 -4.36 -1.12 -0.18 121.20 113.96 3c3y s ILE 219 Ca 0.22 -1.74 0.00 0.00 -0.26 0.00 0.00 60.65 58.88 3c3y s ILE 219 Cb 0.19 -1.43 -0.04 0.00 1.25 0.00 0.00 42.46 42.43 3c3y s ILE 219 CO 0.47 -0.79 0.03 -1.61 0.24 0.00 0.00 174.94 173.28 3c3y s GLU 220 N -3.36 2.90 0.18 0.37 2.02 -0.53 -4.90 118.70 115.38 3c3y s GLU 220 Ca 0.07 -0.55 0.05 0.00 0.02 0.00 0.00 54.97 54.56 3c3y s GLU 220 Cb 0.02 -2.74 -0.05 0.00 0.10 0.00 0.00 34.13 31.46 3c3y s GLU 220 CO -0.04 0.64 -0.08 0.96 0.02 0.00 0.00 175.26 176.76 3c3y s ILE 221 N -1.10 1.24 -0.06 -1.63 -4.36 -1.26 -0.59 121.20 113.44 3c3y s ILE 221 Ca 0.20 -2.08 -0.02 0.00 -0.26 0.00 0.00 60.65 58.48 3c3y s ILE 221 Cb -0.12 -2.03 0.04 0.00 1.25 0.00 0.00 42.46 41.60 3c3y s ILE 221 CO 0.10 -0.60 0.12 0.54 0.24 0.00 0.00 174.94 175.34 3c3y s VAL 222 N -3.29 -0.12 -0.35 8.37 0.11 -0.14 -5.00 120.40 119.99 3c3y s VAL 222 Ca 0.21 0.27 -0.06 0.00 -2.93 0.00 0.00 61.98 59.47 3c3y s VAL 222 Cb 0.03 -0.21 0.05 0.00 -1.53 0.00 0.00 36.38 34.72 3c3y s VAL 222 CO 0.04 0.11 0.12 -2.28 -3.33 0.00 0.00 175.10 169.76 3c3y s HIS 223 N 1.59 3.30 -0.06 1.54 5.04 -1.26 -1.29 115.29 124.15 3c3y s HIS 223 Ca -0.04 -1.60 0.06 0.00 -1.54 0.00 0.00 55.06 51.94 3c3y s HIS 223 Cb -0.12 -2.45 -0.01 0.00 0.04 0.00 0.00 32.58 30.04 3c3y s HIS 223 CO -0.05 -0.78 -0.23 -0.51 -2.34 0.00 0.00 174.74 170.83 3c3y s LEU 224 N 1.36 2.20 -1.50 8.88 1.43 -0.03 -4.98 118.68 126.04 3c3y s LEU 224 Ca -0.01 -0.45 -0.10 0.00 -1.03 0.00 0.00 54.13 52.54 3c3y s LEU 224 Cb -0.20 -1.41 0.01 0.00 0.03 0.00 0.00 46.19 44.61 3c3y s LEU 224 CO 0.01 0.26 2.56 -0.81 0.23 0.00 0.00 176.35 178.61 3c3y n PRO 225 N 2.82 3.63 -4.35 1.29 -0.04 -1.26 -1.22 135.00 135.87 3c3y n PRO 225 Ca -0.17 -2.66 -0.34 0.00 -0.04 0.00 0.00 63.50 60.29 3c3y n PRO 225 Cb 0.52 -2.91 -0.13 0.00 -0.04 0.00 0.00 33.50 30.94 3c3y n PRO 225 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3c3y s LEU 226 N 0.27 3.17 0.00 1.53 1.43 -1.26 -4.83 118.68 118.99 3c3y s LEU 226 Ca 0.58 -0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.50 3c3y s LEU 226 Cb 0.16 -1.77 0.00 0.00 0.03 0.00 0.00 46.19 44.61 3c3y s LEU 226 CO -0.07 0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.26 3c3y n GLY 227 N 3.74 2.46 1.52 -3.19 0.00 -1.26 -1.19 105.19 107.27 3c3y n GLY 227 Ca -0.17 0.13 0.02 0.00 0.00 0.00 0.00 46.02 46.00 3c3y n GLY 227 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3c3y n ASP 228 N 10.42 4.54 0.00 1.61 2.03 -1.26 -4.14 116.55 129.74 3c3y n ASP 228 Ca 0.00 -3.14 0.00 0.00 0.52 0.00 0.00 54.79 52.17 3c3y n ASP 228 Cb 0.00 -0.65 0.00 0.00 -0.72 0.00 0.00 41.12 39.75 3c3y n ASP 228 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3c3y n GLY 229 N -0.18 -0.05 2.84 0.27 0.00 -0.33 -1.10 105.19 106.65 3c3y n GLY 229 Ca 0.30 -1.25 -0.13 0.00 0.00 0.00 0.00 46.02 44.94 3c3y n GLY 229 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3c3y s ILE 230 N -0.40 0.01 -0.16 -0.61 2.07 -0.35 -0.20 121.20 121.55 3c3y s ILE 230 Ca 0.00 0.07 0.00 0.00 -1.41 0.00 0.00 60.65 59.31 3c3y s ILE 230 Cb 0.00 -0.06 0.00 0.00 0.13 0.00 0.00 42.46 42.53 3c3y s ILE 230 CO 0.00 0.04 -0.16 -0.89 -1.91 0.00 0.00 174.94 172.02 3c3y s THR 231 N 0.41 2.51 -0.13 4.00 2.01 -0.21 -0.85 115.64 123.38 3c3y s THR 231 Ca -0.03 -0.81 -0.07 0.00 0.31 0.00 0.00 61.69 61.08 3c3y s THR 231 Cb -0.05 -2.06 -0.04 0.00 0.01 0.00 0.00 72.50 70.36 3c3y s THR 231 CO -0.01 0.52 0.11 -0.36 -0.69 0.00 0.00 174.62 174.19 3c3y s PHE 232 N 0.96 3.49 -0.00 4.92 0.40 -0.41 -0.77 117.98 126.57 3c3y s PHE 232 Ca -0.03 0.42 0.06 0.00 -0.60 0.00 0.00 56.93 56.79 3c3y s PHE 232 Cb -0.15 -1.97 -0.02 0.00 0.51 0.00 0.00 43.02 41.40 3c3y s PHE 232 CO -0.03 0.59 -0.20 0.00 0.70 0.00 0.00 175.22 176.28 3c3y s ARG 234 N -0.59 3.36 -0.06 0.00 3.52 0.24 -0.96 118.95 124.46 3c3y s ARG 234 Ca 0.07 -0.64 -0.30 0.00 -0.13 0.00 0.00 55.73 54.73 3c3y s ARG 234 Cb -0.08 -2.67 -0.03 0.00 -1.56 0.00 0.00 34.95 30.61 3c3y s ARG 234 CO -0.00 0.27 1.14 0.50 -0.81 0.00 0.00 175.30 176.40 3c3y s ARG 235 N 0.22 4.38 -0.08 5.12 3.52 -0.41 -1.45 118.95 130.25 3c3y s ARG 235 Ca -0.07 1.59 -0.02 0.00 -0.13 0.00 0.00 55.73 57.11 3c3y s ARG 235 Cb -0.15 -3.54 -0.26 0.00 -1.56 0.00 0.00 34.95 29.44 3c3y s ARG 235 CO 0.05 -0.39 0.50 -0.07 -0.81 0.00 0.00 175.30 174.58 3c3y h LEU 236 N 8.04 0.32 0.00 -0.88 3.38 -0.91 0.34 115.31 125.59 3c3y h LEU 236 Ca -0.34 -0.67 0.00 0.00 0.09 0.00 0.00 57.88 56.96 3c3y h LEU 236 Cb 1.16 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3c3y h LEU 236 CO 0.87 1.60 0.00 0.00 0.09 0.00 0.00 178.44 180.99