#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rep s PRO 16 N 0.00 1.49 -0.35 1.43 0.04 -1.26 -4.58 135.00 131.78 1rep s PRO 16 Ca 0.00 1.72 -0.11 0.00 0.04 0.00 0.00 61.00 62.65 1rep s PRO 16 Cb 0.00 -1.76 0.01 0.00 0.04 0.00 0.00 34.50 32.79 1rep s PRO 16 CO 0.00 -2.32 0.19 0.50 0.04 0.00 0.00 177.00 175.42 1rep s ARG 17 N -4.25 3.09 0.33 4.56 3.00 -1.26 -2.21 118.95 122.21 1rep s ARG 17 Ca 0.72 -0.90 -0.26 0.00 -1.00 0.00 0.00 55.73 54.29 1rep s ARG 17 Cb -0.27 -3.68 -0.10 0.00 0.00 0.00 0.00 34.95 30.89 1rep s ARG 17 CO 0.52 -0.57 0.97 0.42 0.00 0.00 0.00 175.30 176.64 1rep s ILE 18 N 1.60 4.10 -0.35 4.11 -1.09 0.20 -4.88 121.20 124.89 1rep s ILE 18 Ca 0.04 1.76 0.00 0.00 -2.23 0.00 0.00 60.65 60.22 1rep s ILE 18 Cb -0.18 -3.98 0.14 0.00 -1.58 0.00 0.00 42.46 36.86 1rep s ILE 18 CO 0.07 0.15 0.25 -0.69 -1.23 0.00 0.00 174.94 173.49 1rep s VAL 19 N -1.58 -0.04 0.20 2.92 1.01 -1.26 -1.40 120.40 120.25 1rep s VAL 19 Ca 0.50 -1.34 0.07 0.00 0.00 0.00 0.00 61.98 61.21 1rep s VAL 19 Cb -0.20 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 1rep s VAL 19 CO 0.25 -0.83 0.11 0.00 0.00 0.00 0.00 175.10 174.64 1rep s GLN 20 N 1.35 2.74 0.58 2.72 -2.07 0.20 -4.70 119.66 120.49 1rep s GLN 20 Ca 0.16 -1.03 -0.17 0.00 -1.82 0.00 0.00 55.36 52.50 1rep s GLN 20 Cb -0.20 -2.51 -0.04 0.00 -1.09 0.00 0.00 33.01 29.17 1rep s GLN 20 CO -0.06 0.44 1.08 0.45 -1.32 0.00 0.00 175.29 175.88 1rep s SER 21 N -3.34 5.72 0.47 12.60 0.15 -1.24 0.05 113.70 128.11 1rep s SER 21 Ca 0.31 1.95 0.17 0.00 0.70 0.00 0.00 55.95 59.08 1rep s SER 21 Cb -0.09 -2.55 1.14 0.00 -1.71 0.00 0.00 66.02 62.81 1rep s SER 21 CO 0.22 -1.21 2.04 0.78 1.20 0.00 0.00 173.24 176.27 1rep h ASN 22 N 0.69 0.00 -0.32 5.45 2.35 -1.86 -1.76 115.58 120.13 1rep h ASN 22 Ca -0.48 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 55.34 1rep h ASN 22 Cb 1.23 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.53 1rep h ASN 22 CO 0.57 0.14 -0.18 0.44 -1.65 0.00 0.00 177.43 176.74 1rep h ASP 23 N 0.00 -0.61 0.08 5.81 3.45 -1.91 1.17 116.42 124.41 1rep h ASP 23 Ca -0.00 0.13 -0.00 0.00 0.43 0.00 0.00 57.03 57.59 1rep h ASP 23 Cb 0.26 0.32 0.00 0.00 -0.56 0.00 0.00 39.33 39.35 1rep h ASP 23 CO 0.02 -0.22 -0.04 0.25 -1.57 0.00 0.00 179.24 177.68 1rep h LEU 24 N -0.14 -0.09 -1.98 1.55 6.46 -1.70 0.33 115.31 119.73 1rep h LEU 24 Ca 0.17 -0.29 0.37 0.00 -0.12 0.00 0.00 57.88 58.01 1rep h LEU 24 Cb 0.40 0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.30 1rep h LEU 24 CO -0.41 0.24 0.93 0.74 -0.62 0.00 0.00 178.44 179.32 1rep h THR 25 N -0.43 0.35 -0.01 1.05 2.02 -0.32 0.95 112.91 116.51 1rep h THR 25 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1rep h THR 25 Cb 0.37 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 1rep h THR 25 CO 0.02 0.00 -0.22 -0.62 0.37 0.00 0.00 175.52 175.07 1rep n GLU 26 N -4.12 1.58 -1.74 6.66 1.02 0.39 -4.80 120.64 119.63 1rep n GLU 26 Ca 0.27 -0.99 -0.38 0.00 -0.02 0.00 0.00 57.16 56.04 1rep n GLU 26 Cb 1.34 -1.27 0.05 0.00 -0.02 0.00 0.00 31.44 31.54 1rep n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1rep n ALA 27 N 0.19 1.56 -2.61 0.62 0.00 0.33 -4.86 120.51 115.73 1rep n ALA 27 Ca 0.07 0.12 -0.40 0.00 0.00 0.00 0.00 53.44 53.23 1rep n ALA 27 Cb 0.35 -2.35 -0.08 0.00 0.00 0.00 0.00 19.45 17.37 1rep n ALA 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rep s ALA 28 N -1.29 3.58 0.19 0.00 0.00 -0.58 -4.77 121.76 118.88 1rep s ALA 28 Ca 0.72 -0.63 -0.24 0.00 0.00 0.00 0.00 51.96 51.81 1rep s ALA 28 Cb -0.41 -2.91 0.05 0.00 0.00 0.00 0.00 23.12 19.85 1rep s ALA 28 CO 0.48 -0.79 0.88 1.52 0.00 0.00 0.00 175.76 177.86 1rep s TYR 29 N 2.33 -0.16 -0.30 0.00 -0.85 -1.11 -2.11 117.35 115.15 1rep s TYR 29 Ca 0.21 -0.19 -0.01 0.00 -0.52 0.00 0.00 57.07 56.56 1rep s TYR 29 Cb -0.16 0.66 0.10 0.00 0.38 0.00 0.00 41.96 42.94 1rep s TYR 29 CO 0.10 -0.94 0.10 0.45 -1.52 0.00 0.00 175.55 173.73 1rep s SER 30 N -2.92 3.87 0.36 -0.18 0.15 -1.26 -4.41 113.70 109.30 1rep s SER 30 Ca 0.12 -1.52 0.06 0.00 0.70 0.00 0.00 55.95 55.30 1rep s SER 30 Cb -0.03 -0.76 -0.07 0.00 -1.71 0.00 0.00 66.02 63.46 1rep s SER 30 CO 0.03 -0.41 0.02 -0.76 1.20 0.00 0.00 173.24 173.32 1rep s LEU 31 N 1.72 2.55 0.00 3.45 1.43 -1.26 -5.03 118.68 121.54 1rep s LEU 31 Ca 0.09 -1.35 0.06 0.00 -1.03 0.00 0.00 54.13 51.90 1rep s LEU 31 Cb -0.17 -0.67 0.11 0.00 0.03 0.00 0.00 46.19 45.50 1rep s LEU 31 CO -0.26 -0.50 0.87 -1.54 0.23 0.00 0.00 176.35 175.15 1rep n SER 32 N -0.82 1.87 0.23 2.29 3.41 -1.26 -4.87 113.62 114.47 1rep n SER 32 Ca -0.04 -2.41 -0.09 0.00 -0.26 0.00 0.00 58.87 56.07 1rep n SER 32 Cb 0.66 -0.50 -0.04 0.00 -0.26 0.00 0.00 64.21 64.07 1rep n SER 32 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1rep h ARG 33 N 0.00 -0.57 -1.01 4.33 2.43 -1.96 0.13 114.38 117.74 1rep h ARG 33 Ca -0.29 0.04 0.27 0.00 -0.81 0.00 0.00 59.98 59.19 1rep h ARG 33 Cb 1.25 0.13 -0.06 0.00 -0.42 0.00 0.00 29.97 30.86 1rep h ARG 33 CO 0.38 -0.38 0.69 -0.44 -1.51 0.00 0.00 179.97 178.71 1rep h ASP 34 N -0.64 0.21 0.42 -3.80 3.32 -1.94 0.70 116.42 114.68 1rep h ASP 34 Ca -0.06 0.03 -0.18 0.00 0.02 0.00 0.00 57.03 56.84 1rep h ASP 34 Cb 0.45 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1rep h ASP 34 CO 0.10 0.05 -0.76 1.56 -1.72 0.00 0.00 179.24 178.47 1rep h GLN 35 N 0.19 0.27 0.04 3.56 4.20 -1.84 -2.18 115.11 119.35 1rep h GLN 35 Ca 0.52 -0.24 -0.28 0.00 0.06 0.00 0.00 58.65 58.71 1rep h GLN 35 Cb 1.69 0.06 0.02 0.00 0.30 0.00 0.00 27.48 29.55 1rep h GLN 35 CO -0.13 0.91 -1.11 0.87 -0.67 0.00 0.00 178.83 178.70 1rep h LYS 36 N 0.18 0.66 -0.82 1.46 1.57 0.30 -2.09 116.57 117.84 1rep h LYS 36 Ca -0.03 -0.77 0.02 0.00 -1.87 0.00 0.00 60.65 58.00 1rep h LYS 36 Cb 1.34 0.23 -0.04 0.00 0.08 0.00 0.00 32.23 33.84 1rep h LYS 36 CO 0.12 1.34 0.54 0.00 -0.57 0.00 0.00 179.45 180.88 1rep h ARG 37 N 0.35 1.03 -0.59 3.15 3.08 -0.38 -1.00 114.38 120.01 1rep h ARG 37 Ca -0.15 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 59.75 1rep h ARG 37 Cb 1.77 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 31.57 1rep h ARG 37 CO 0.22 0.68 0.02 1.98 -1.07 0.00 0.00 179.97 181.80 1rep h MET 38 N 1.06 1.02 -0.32 0.04 4.05 -1.29 -2.96 114.93 116.53 1rep h MET 38 Ca 0.31 -0.31 -0.11 0.00 -0.28 0.00 0.00 59.70 59.31 1rep h MET 38 Cb -0.04 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.65 1rep h MET 38 CO -0.08 1.00 -0.26 1.25 0.23 0.00 0.00 176.91 179.05 1rep h LEU 39 N 0.92 0.65 0.20 3.39 5.85 -0.60 -1.92 115.31 123.79 1rep h LEU 39 Ca 0.17 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.66 1rep h LEU 39 Cb 0.52 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1rep h LEU 39 CO 0.03 0.89 -0.46 1.88 -0.34 0.00 0.00 178.44 180.43 1rep h TYR 40 N 0.55 -1.30 -0.58 1.25 0.05 -1.06 0.48 116.97 116.36 1rep h TYR 40 Ca 0.07 0.03 0.10 0.00 0.05 0.00 0.00 58.73 58.99 1rep h TYR 40 Cb 0.74 0.54 -0.03 0.00 1.01 0.00 0.00 36.73 38.98 1rep h TYR 40 CO 0.03 -0.57 0.39 -0.07 -1.05 0.00 0.00 178.16 176.90 1rep h LEU 41 N -0.75 0.32 -0.32 3.88 4.07 -1.43 -0.23 115.31 120.85 1rep h LEU 41 Ca -0.00 0.01 -0.06 0.00 0.08 0.00 0.00 57.88 57.91 1rep h LEU 41 Cb 0.74 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.41 1rep h LEU 41 CO -0.21 0.19 -0.03 -0.26 -1.08 0.00 0.00 178.44 177.04 1rep h PHE 42 N 0.36 0.65 0.41 1.13 0.05 -0.36 -1.40 116.94 117.78 1rep h PHE 42 Ca 0.27 -0.12 -0.02 0.00 3.82 0.00 0.00 57.97 61.92 1rep h PHE 42 Cb 0.60 -0.16 0.00 0.00 2.00 0.00 0.00 35.95 38.39 1rep h PHE 42 CO -0.00 0.73 -0.20 0.28 -0.18 0.00 0.00 178.31 178.95 1rep h VAL 43 N 0.37 0.54 0.00 -0.55 2.07 0.09 -1.57 116.25 117.20 1rep h VAL 43 Ca 0.09 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1rep h VAL 43 Cb 0.50 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1rep h VAL 43 CO 0.02 0.08 0.00 -0.67 0.02 0.00 0.00 177.57 177.02 1rep n ASP 44 N -5.22 0.00 -0.30 0.57 2.03 -0.20 -0.41 116.55 113.02 1rep n ASP 44 Ca -0.10 0.83 0.31 0.00 0.52 0.00 0.00 54.79 56.35 1rep n ASP 44 Cb 0.29 -0.33 0.69 0.00 -0.72 0.00 0.00 41.12 41.04 1rep n ASP 44 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 1rep h GLN 45 N 0.00 0.09 0.06 -0.67 4.15 -1.34 -0.40 115.11 117.00 1rep h GLN 45 Ca 0.00 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.41 1rep h GLN 45 Cb 0.00 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.67 1rep h GLN 45 CO 0.00 0.06 -0.03 0.82 -1.93 0.00 0.00 178.83 177.75 1rep h ILE 46 N 0.09 1.23 0.10 2.39 2.04 0.31 -3.24 117.51 120.44 1rep h ILE 46 Ca 0.55 -1.01 0.01 0.00 1.00 0.00 0.00 64.86 65.41 1rep h ILE 46 Cb 2.00 1.89 -0.05 0.00 -0.74 0.00 0.00 36.82 39.92 1rep h ILE 46 CO -0.08 0.25 -0.52 0.03 0.00 0.00 0.00 178.15 177.84 1rep h ARG 47 N -0.53 -0.70 -3.02 2.37 3.08 0.97 -1.32 114.38 115.23 1rep h ARG 47 Ca -0.01 0.05 -0.62 0.00 0.07 0.00 0.00 59.98 59.47 1rep h ARG 47 Cb 0.47 0.16 0.02 0.00 0.08 0.00 0.00 29.97 30.70 1rep h ARG 47 CO 0.01 -0.46 3.56 1.63 -1.07 0.00 0.00 179.97 183.64 1rep n LYS 48 N -5.38 3.44 0.00 0.04 5.02 -0.88 -5.12 118.16 115.29 1rep n LYS 48 Ca -0.08 -2.06 0.00 0.00 -2.02 0.00 0.00 58.31 54.15 1rep n LYS 48 Cb 0.40 -2.73 0.00 0.00 -0.02 0.00 0.00 35.03 32.68 1rep n LYS 48 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1rep n SER 49 N 3.61 0.00 -3.63 4.39 2.88 -0.50 -4.86 113.62 115.51 1rep n SER 49 Ca 0.73 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 58.24 1rep n SER 49 Cb 0.24 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.68 1rep n SER 49 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 1rep s HIS 56 N 2.21 -0.07 -0.10 0.66 5.04 -1.26 -5.04 115.29 116.72 1rep s HIS 56 Ca 0.00 0.07 0.21 0.00 -1.54 0.00 0.00 55.06 53.80 1rep s HIS 56 Cb 0.00 0.50 -0.25 0.00 0.04 0.00 0.00 32.58 32.87 1rep s HIS 56 CO 0.00 -0.09 0.53 -0.40 -2.34 0.00 0.00 174.74 172.43 1rep n ASP 57 N 0.14 0.23 0.00 9.88 5.75 -1.26 -4.98 116.55 126.31 1rep n ASP 57 Ca 0.02 0.10 0.00 0.00 -0.01 0.00 0.00 54.79 54.89 1rep n ASP 57 Cb 0.58 1.35 0.00 0.00 -1.03 0.00 0.00 41.12 42.02 1rep n ASP 57 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1rep n GLY 58 N 1.36 2.42 3.56 6.12 0.00 -1.26 -4.18 105.19 113.20 1rep n GLY 58 Ca -0.10 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 1rep n GLY 58 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1rep n ILE 59 N -2.00 0.83 -2.13 -0.61 5.41 -1.25 -1.82 119.36 117.78 1rep n ILE 59 Ca 0.00 -0.86 -0.28 0.00 1.00 0.00 0.00 62.75 62.61 1rep n ILE 59 Cb 0.00 -2.08 0.18 0.00 -0.71 0.00 0.00 39.64 37.03 1rep n ILE 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1rep s GLU 61 N -5.72 0.70 0.02 0.00 2.02 -1.26 0.08 118.70 114.55 1rep s GLU 61 Ca 0.73 -0.13 0.03 0.00 0.02 0.00 0.00 54.97 55.63 1rep s GLU 61 Cb -0.03 0.31 -0.02 0.00 0.10 0.00 0.00 34.13 34.50 1rep s GLU 61 CO 0.51 -0.19 -0.10 0.42 0.02 0.00 0.00 175.26 175.92 1rep s ILE 62 N -1.26 0.76 -0.02 -1.63 -1.09 0.22 -4.97 121.20 113.20 1rep s ILE 62 Ca -0.13 -0.75 0.05 0.00 -2.23 0.00 0.00 60.65 57.59 1rep s ILE 62 Cb -0.05 -0.71 -0.03 0.00 -1.58 0.00 0.00 42.46 40.10 1rep s ILE 62 CO 0.05 -0.03 -0.16 -1.00 -1.23 0.00 0.00 174.94 172.57 1rep s HIS 63 N -0.71 2.64 0.18 3.97 3.76 -1.26 -0.18 115.29 123.68 1rep s HIS 63 Ca -0.01 -0.20 -0.01 0.00 -0.15 0.00 0.00 55.06 54.68 1rep s HIS 63 Cb -0.06 -1.58 0.07 0.00 1.11 0.00 0.00 32.58 32.12 1rep s HIS 63 CO 0.00 0.18 1.45 0.28 -0.85 0.00 0.00 174.74 175.81 1rep h VAL 64 N 4.24 1.37 -0.29 -0.90 2.07 -0.31 -2.07 116.25 120.36 1rep h VAL 64 Ca -0.46 -2.08 -0.10 0.00 0.82 0.00 0.00 66.70 64.88 1rep h VAL 64 Cb 1.15 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.97 1rep h VAL 64 CO 0.49 0.63 -0.20 0.00 0.02 0.00 0.00 177.57 178.51 1rep h ALA 65 N 0.95 0.41 0.62 1.67 0.00 -1.92 0.27 119.26 121.26 1rep h ALA 65 Ca -0.02 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 1rep h ALA 65 Cb 1.27 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.97 1rep h ALA 65 CO 0.12 0.35 -0.30 -0.22 0.00 0.00 0.00 179.25 179.21 1rep h LYS 66 N 0.38 -0.80 -0.50 0.00 3.11 -1.95 0.13 116.57 116.94 1rep h LYS 66 Ca 0.06 0.05 0.10 0.00 -2.81 0.00 0.00 60.65 58.05 1rep h LYS 66 Cb 0.75 0.18 -0.10 0.00 -1.00 0.00 0.00 32.23 32.06 1rep h LYS 66 CO 0.05 -0.49 -0.17 -0.92 -2.81 0.00 0.00 179.45 175.11 1rep h TYR 67 N -0.99 -0.41 -0.32 1.91 3.20 -1.39 0.64 116.97 119.61 1rep h TYR 67 Ca -0.09 0.05 0.06 0.00 3.14 0.00 0.00 58.73 61.90 1rep h TYR 67 Cb 0.68 0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.19 1rep h TYR 67 CO -0.01 -0.26 0.22 0.00 -1.64 0.00 0.00 178.16 176.47 1rep h ALA 68 N 1.36 2.10 0.10 1.82 0.00 -0.25 -2.41 119.26 121.98 1rep h ALA 68 Ca 0.24 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1rep h ALA 68 Cb 0.42 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1rep h ALA 68 CO -0.54 -0.17 -0.05 1.05 0.00 0.00 0.00 179.25 179.54 1rep h GLU 69 N 0.16 -0.13 -0.69 0.00 4.11 0.29 0.31 114.58 118.64 1rep h GLU 69 Ca 0.15 0.01 0.12 0.00 0.07 0.00 0.00 59.36 59.70 1rep h GLU 69 Cb 0.38 0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.53 1rep h GLU 69 CO -0.02 -0.09 -0.34 0.82 0.07 0.00 0.00 179.01 179.45 1rep h ILE 70 N -0.85 0.13 -0.34 -1.06 2.04 -0.41 -0.55 117.51 116.47 1rep h ILE 70 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1rep h ILE 70 Cb 0.10 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.32 1rep h ILE 70 CO 0.02 0.00 0.00 0.49 0.00 0.00 0.00 178.15 178.66 1rep n PHE 71 N -5.44 0.46 -3.11 1.37 3.01 -0.91 -4.95 117.46 107.88 1rep n PHE 71 Ca 0.06 -0.23 -0.20 0.00 1.01 0.00 0.00 57.45 58.09 1rep n PHE 71 Cb 0.37 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.88 1rep n PHE 71 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1rep n GLY 72 N 1.05 -0.36 3.80 1.37 0.00 -0.21 -5.03 105.19 105.80 1rep n GLY 72 Ca 0.11 0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1rep n GLY 72 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rep s LEU 73 N -6.11 3.50 0.58 0.99 1.43 0.11 -5.01 118.68 114.17 1rep s LEU 73 Ca 0.35 -0.55 -0.17 0.00 -1.03 0.00 0.00 54.13 52.73 1rep s LEU 73 Cb -0.16 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 1rep s LEU 73 CO 0.44 -0.27 1.08 0.42 0.23 0.00 0.00 176.35 178.25 1rep s THR 74 N -2.32 3.52 0.34 5.49 -4.23 -1.26 -4.52 115.64 112.66 1rep s THR 74 Ca 0.38 0.80 0.10 0.00 -1.18 0.00 0.00 61.69 61.79 1rep s THR 74 Cb -0.05 -3.30 0.33 0.00 1.34 0.00 0.00 72.50 70.82 1rep s THR 74 CO 0.25 -0.35 1.78 -1.28 -0.54 0.00 0.00 174.62 174.48 1rep h SER 75 N 0.68 0.67 0.78 3.99 0.87 -1.90 -0.98 113.55 117.66 1rep h SER 75 Ca -0.48 0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.13 1rep h SER 75 Cb 1.24 -0.03 0.01 0.00 -0.44 0.00 0.00 62.40 63.18 1rep h SER 75 CO 0.57 0.22 -0.38 0.00 -0.53 0.00 0.00 176.83 176.71 1rep h ALA 76 N 1.64 -1.05 -0.14 6.23 0.00 -1.95 -2.62 119.26 121.37 1rep h ALA 76 Ca 0.57 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 1rep h ALA 76 Cb 1.06 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1rep h ALA 76 CO -0.34 -0.99 0.08 1.49 0.00 0.00 0.00 179.25 179.49 1rep h GLU 77 N -1.25 0.19 0.00 0.00 4.57 -1.85 -0.08 114.58 116.17 1rep h GLU 77 Ca -0.11 -0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 57.99 1rep h GLU 77 Cb 0.81 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.35 1rep h GLU 77 CO 0.18 0.15 -0.35 0.00 -1.18 0.00 0.00 179.01 177.80 1rep h ALA 78 N 1.89 1.34 -0.37 2.92 0.00 -1.15 -2.42 119.26 121.46 1rep h ALA 78 Ca 0.05 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 1rep h ALA 78 Cb 0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1rep h ALA 78 CO -0.01 0.43 -0.27 1.03 0.00 0.00 0.00 179.25 180.43 1rep h SER 79 N 0.00 0.88 0.30 0.00 0.87 -0.63 -2.03 113.55 112.94 1rep h SER 79 Ca -0.00 -0.44 -0.01 0.00 -1.23 0.00 0.00 61.79 60.11 1rep h SER 79 Cb 0.65 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.36 1rep h SER 79 CO 0.05 1.13 -0.18 0.50 -0.53 0.00 0.00 176.83 177.80 1rep h LYS 80 N 0.64 -0.44 0.12 2.24 3.64 -1.09 -0.53 116.57 121.15 1rep h LYS 80 Ca 0.07 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1rep h LYS 80 Cb 0.85 0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.73 1rep h LYS 80 CO 0.07 -0.29 -0.26 -0.44 -2.27 0.00 0.00 179.45 176.26 1rep h ASP 81 N -0.45 -0.73 -0.46 4.20 3.32 -1.43 -0.26 116.42 120.61 1rep h ASP 81 Ca -0.03 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1rep h ASP 81 Cb 0.37 0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 1rep h ASP 81 CO 0.04 -0.35 0.27 0.40 -1.72 0.00 0.00 179.24 177.88 1rep h ILE 82 N -0.46 1.15 -0.15 0.35 2.04 -1.34 -0.03 117.51 119.07 1rep h ILE 82 Ca 0.03 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1rep h ILE 82 Cb 0.49 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1rep h ILE 82 CO -0.15 0.15 0.04 0.03 0.00 0.00 0.00 178.15 178.22 1rep h ARG 83 N 0.61 0.23 -0.29 2.37 3.08 -0.91 -1.19 114.38 118.29 1rep h ARG 83 Ca 0.17 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 60.02 1rep h ARG 83 Cb 0.01 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1rep h ARG 83 CO -0.03 0.38 -0.37 1.96 -1.07 0.00 0.00 179.97 180.84 1rep h GLN 84 N 0.04 0.76 0.00 0.04 4.20 -1.04 -3.00 115.11 116.12 1rep h GLN 84 Ca 0.05 -0.43 -0.02 0.00 0.06 0.00 0.00 58.65 58.30 1rep h GLN 84 Cb 0.25 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.06 1rep h GLN 84 CO 0.00 1.06 -0.10 0.00 -0.67 0.00 0.00 178.83 179.11 1rep h ALA 85 N 0.69 1.43 0.00 3.87 0.00 -0.98 -2.08 119.26 122.20 1rep h ALA 85 Ca 0.04 -0.09 -0.19 0.00 0.00 0.00 0.00 54.91 54.66 1rep h ALA 85 Cb 0.95 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1rep h ALA 85 CO 0.09 0.13 -0.85 -0.07 0.00 0.00 0.00 179.25 178.54 1rep h LEU 86 N 0.00 0.16 0.00 0.00 3.38 -1.07 -3.25 115.31 114.52 1rep h LEU 86 Ca -0.00 -0.13 -0.22 0.00 0.09 0.00 0.00 57.88 57.62 1rep h LEU 86 Cb 0.25 -0.05 0.02 0.00 0.09 0.00 0.00 40.66 40.97 1rep h LEU 86 CO 0.01 0.94 -0.87 0.11 0.09 0.00 0.00 178.44 178.72 1rep h LYS 87 N 0.07 0.58 0.00 1.13 1.57 -1.38 -3.17 116.57 115.37 1rep h LYS 87 Ca -0.03 -0.63 0.00 0.00 -1.87 0.00 0.00 60.65 58.12 1rep h LYS 87 Cb 1.48 0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.97 1rep h LYS 87 CO 0.12 1.24 0.00 0.43 -0.57 0.00 0.00 179.45 180.67 1rep n SER 88 N -4.00 0.00 0.00 0.86 7.64 -0.83 -1.16 113.62 116.13 1rep n SER 88 Ca -0.11 -0.53 0.10 0.00 1.01 0.00 0.00 58.87 59.35 1rep n SER 88 Cb 0.80 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.91 1rep n SER 88 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1rep n PHE 89 N -0.59 0.00 -2.27 1.43 3.01 -1.20 -4.79 117.46 113.06 1rep n PHE 89 Ca 0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.05 1rep n PHE 89 Cb 0.01 -0.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.40 1rep n PHE 89 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1rep s ALA 90 N -3.02 3.53 0.00 4.37 0.00 -0.31 -2.93 121.76 123.41 1rep s ALA 90 Ca 0.08 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.96 1rep s ALA 90 Cb 0.16 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1rep s ALA 90 CO 0.86 -0.70 0.00 0.41 0.00 0.00 0.00 175.76 176.33 1rep n GLY 91 N 3.48 1.66 3.79 0.00 0.00 -1.26 -5.02 105.19 107.84 1rep n GLY 91 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1rep n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rep s LYS 92 N -0.18 4.42 0.35 1.61 1.02 -1.15 -5.05 119.74 120.76 1rep s LYS 92 Ca 0.00 0.99 0.07 0.00 0.02 0.00 0.00 55.97 57.06 1rep s LYS 92 Cb 0.00 -3.20 -0.07 0.00 -0.52 0.00 0.00 37.83 34.04 1rep s LYS 92 CO 0.00 0.57 -0.03 -1.21 -0.92 0.00 0.00 175.35 173.76 1rep s GLU 93 N -1.25 1.80 -0.10 1.68 2.02 -1.26 -2.64 118.70 118.96 1rep s GLU 93 Ca 0.35 -1.97 0.03 0.00 0.02 0.00 0.00 54.97 53.39 1rep s GLU 93 Cb -0.21 -1.48 0.01 0.00 0.10 0.00 0.00 34.13 32.55 1rep s GLU 93 CO 0.23 0.01 -0.17 0.08 0.02 0.00 0.00 175.26 175.43 1rep s VAL 94 N -2.80 1.57 -0.35 2.63 1.01 0.19 -4.68 120.40 117.98 1rep s VAL 94 Ca 0.33 -0.71 -0.05 0.00 0.00 0.00 0.00 61.98 61.55 1rep s VAL 94 Cb 0.06 -1.41 0.05 0.00 0.00 0.00 0.00 36.38 35.09 1rep s VAL 94 CO 0.16 0.45 0.11 -0.69 0.00 0.00 0.00 175.10 175.13 1rep s VAL 95 N 0.71 3.56 -0.47 2.92 1.01 -0.90 0.86 120.40 128.10 1rep s VAL 95 Ca -0.12 -1.34 -0.18 0.00 0.00 0.00 0.00 61.98 60.34 1rep s VAL 95 Cb -0.16 -3.09 0.05 0.00 0.00 0.00 0.00 36.38 33.17 1rep s VAL 95 CO 0.03 -0.26 0.55 -0.36 0.00 0.00 0.00 175.10 175.06 1rep s PHE 96 N 1.33 3.11 -1.05 5.22 0.40 -1.26 -1.53 117.98 124.20 1rep s PHE 96 Ca -0.01 -0.48 -0.23 0.00 -0.60 0.00 0.00 56.93 55.61 1rep s PHE 96 Cb -0.20 -3.29 -0.01 0.00 0.51 0.00 0.00 43.02 40.03 1rep s PHE 96 CO 0.01 -0.89 1.78 0.71 0.70 0.00 0.00 175.22 177.53 1rep s TYR 97 N 2.39 2.17 0.00 0.36 1.51 -1.26 -4.86 117.35 117.66 1rep s TYR 97 Ca 0.14 -0.12 0.00 0.00 -1.01 0.00 0.00 57.07 56.08 1rep s TYR 97 Cb -0.19 -4.31 0.00 0.00 -0.11 0.00 0.00 41.96 37.35 1rep s TYR 97 CO 0.13 -1.69 0.00 0.39 -1.11 0.00 0.00 175.55 173.26 1rep n GLU 110 N 8.68 0.00 -3.93 -0.62 -0.58 -1.26 -5.08 120.64 117.85 1rep n GLU 110 Ca 0.40 0.47 -0.33 0.00 -0.42 0.00 0.00 57.16 57.29 1rep n GLU 110 Cb 0.48 -0.94 -0.05 0.00 -0.57 0.00 0.00 31.44 30.36 1rep n GLU 110 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1rep s SER 111 N 0.00 6.28 0.01 1.62 0.15 -1.26 -4.38 113.70 116.12 1rep s SER 111 Ca 0.00 0.30 0.01 0.00 0.70 0.00 0.00 55.95 56.95 1rep s SER 111 Cb 0.00 -1.94 -0.01 0.00 -1.71 0.00 0.00 66.02 62.36 1rep s SER 111 CO 0.00 0.23 -0.02 -0.36 1.20 0.00 0.00 173.24 174.29 1rep s PHE 112 N -1.37 0.22 0.15 3.44 0.08 0.25 -4.89 117.98 115.85 1rep s PHE 112 Ca 0.29 -0.18 -0.30 0.00 0.12 0.00 0.00 56.93 56.86 1rep s PHE 112 Cb -0.13 -0.14 -0.07 0.00 -0.57 0.00 0.00 43.02 42.11 1rep s PHE 112 CO 0.21 -0.05 0.99 -1.25 -0.10 0.00 0.00 175.22 175.02 1rep s PRO 113 N -0.49 4.70 0.09 0.24 0.04 -1.26 0.54 135.00 138.86 1rep s PRO 113 Ca -0.04 1.52 -0.31 0.00 0.04 0.00 0.00 61.00 62.22 1rep s PRO 113 Cb -0.04 -3.34 -0.14 0.00 0.04 0.00 0.00 34.50 31.02 1rep s PRO 113 CO -0.00 0.23 1.63 -1.49 0.04 0.00 0.00 177.00 177.40 1rep h TRP 114 N 5.25 -0.82 -2.90 0.56 4.06 -1.81 -3.40 115.95 116.89 1rep h TRP 114 Ca -0.44 -0.00 -0.60 0.00 2.06 0.00 0.00 58.89 59.91 1rep h TRP 114 Cb 1.21 0.31 -0.10 0.00 -1.00 0.00 0.00 29.16 29.58 1rep h TRP 114 CO 0.64 -0.46 -0.63 -0.06 -3.56 0.00 0.00 178.44 174.37 1rep s PHE 115 N -6.04 2.96 -0.38 0.49 0.08 -1.26 -1.21 117.98 112.63 1rep s PHE 115 Ca -0.17 -0.08 0.06 0.00 0.12 0.00 0.00 56.93 56.86 1rep s PHE 115 Cb 0.05 -1.45 -0.05 0.00 -0.57 0.00 0.00 43.02 41.01 1rep s PHE 115 CO 0.63 0.51 0.33 0.44 -0.10 0.00 0.00 175.22 177.03 1rep n ILE 116 N -0.08 0.00 -3.77 0.64 -5.35 -1.13 -4.78 119.36 104.88 1rep n ILE 116 Ca -0.09 -0.38 -0.13 0.00 -0.27 0.00 0.00 62.75 61.88 1rep n ILE 116 Cb 0.54 1.02 -0.10 0.00 -1.74 0.00 0.00 39.64 39.37 1rep n ILE 116 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1rep s LYS 117 N -1.42 0.47 0.33 6.28 1.02 -1.26 -5.11 119.74 120.06 1rep s LYS 117 Ca 0.03 0.17 -0.28 0.00 0.02 0.00 0.00 55.97 55.91 1rep s LYS 117 Cb 0.05 0.22 -0.12 0.00 -0.52 0.00 0.00 37.83 37.45 1rep s LYS 117 CO 0.22 -0.09 1.29 -2.30 -0.92 0.00 0.00 175.35 173.55 1rep n PRO 118 N 2.28 2.11 -0.96 -1.68 -0.02 -1.26 -4.51 135.00 130.96 1rep n PRO 118 Ca -0.16 0.74 -0.31 0.00 -2.02 0.00 0.00 63.50 61.74 1rep n PRO 118 Cb 0.57 -2.32 0.13 0.00 -0.02 0.00 0.00 33.50 31.86 1rep n PRO 118 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rep s ALA 119 N -1.01 1.80 -0.12 3.55 0.00 -1.26 -4.86 121.76 119.85 1rep s ALA 119 Ca 0.56 0.51 -0.26 0.00 0.00 0.00 0.00 51.96 52.77 1rep s ALA 119 Cb -0.58 -3.39 0.06 0.00 0.00 0.00 0.00 23.12 19.21 1rep s ALA 119 CO 0.61 -2.34 0.63 -3.38 0.00 0.00 0.00 175.76 171.28 1rep s HIS 120 N -2.68 -0.63 -0.43 0.00 -3.43 -0.97 -5.01 115.29 102.15 1rep s HIS 120 Ca 0.65 1.28 -0.15 0.00 -0.80 0.00 0.00 55.06 56.04 1rep s HIS 120 Cb -0.21 0.31 0.03 0.00 -1.43 0.00 0.00 32.58 31.28 1rep s HIS 120 CO 0.56 -0.48 0.34 0.45 -2.00 0.00 0.00 174.74 173.61 1rep s SER 121 N -0.61 6.13 0.11 7.38 0.15 -1.26 -0.43 113.70 125.16 1rep s SER 121 Ca -0.07 -0.96 0.02 0.00 0.70 0.00 0.00 55.95 55.65 1rep s SER 121 Cb -0.02 -2.18 -0.22 0.00 -1.71 0.00 0.00 66.02 61.89 1rep s SER 121 CO 0.06 -0.51 1.24 1.55 1.20 0.00 0.00 173.24 176.77 1rep h PRO 122 N 8.67 0.11 -4.86 5.44 0.14 -1.93 -3.46 132.00 136.12 1rep h PRO 122 Ca -0.27 -0.19 -0.34 0.00 0.14 0.00 0.00 66.00 65.34 1rep h PRO 122 Cb 1.12 0.07 -0.23 0.00 0.14 0.00 0.00 31.00 32.10 1rep h PRO 122 CO 0.77 1.08 -0.76 0.45 0.14 0.00 0.00 178.00 179.68 1rep s SER 123 N -6.89 1.17 -0.26 1.44 0.15 -1.24 -5.06 113.70 103.00 1rep s SER 123 Ca -0.01 -0.50 -0.30 0.00 0.70 0.00 0.00 55.95 55.84 1rep s SER 123 Cb 0.09 -0.02 -0.07 0.00 -1.71 0.00 0.00 66.02 64.31 1rep s SER 123 CO 0.84 -0.10 2.21 -1.14 1.20 0.00 0.00 173.24 176.26 1rep n ARG 124 N 1.66 1.70 0.00 5.44 0.63 -1.26 -0.21 116.66 124.63 1rep n ARG 124 Ca -0.20 0.46 0.00 0.00 -0.92 0.00 0.00 57.85 57.19 1rep n ARG 124 Cb 0.55 -3.01 0.00 0.00 0.45 0.00 0.00 32.46 30.45 1rep n ARG 124 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1rep n GLY 125 N 5.99 0.47 3.09 5.14 0.00 -1.26 -5.02 105.19 113.60 1rep n GLY 125 Ca 0.33 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.08 1rep n GLY 125 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rep s LEU 126 N 0.00 1.79 -0.05 0.99 2.96 0.70 0.53 118.68 125.61 1rep s LEU 126 Ca 0.00 -0.38 0.05 0.00 -0.22 0.00 0.00 54.13 53.59 1rep s LEU 126 Cb 0.00 -1.01 -0.02 0.00 0.50 0.00 0.00 46.19 45.67 1rep s LEU 126 CO 0.00 0.08 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.59 1rep s TYR 127 N 0.52 2.51 -0.13 5.38 1.51 0.74 -3.16 117.35 124.73 1rep s TYR 127 Ca -0.15 -0.48 -0.02 0.00 -1.01 0.00 0.00 57.07 55.41 1rep s TYR 127 Cb -0.16 -1.60 -0.03 0.00 -0.11 0.00 0.00 41.96 40.06 1rep s TYR 127 CO 0.05 -0.06 -0.05 0.45 -1.11 0.00 0.00 175.55 174.84 1rep s SER 128 N -0.40 4.74 -0.00 2.29 0.15 0.42 0.70 113.70 121.59 1rep s SER 128 Ca 0.04 -0.10 0.04 0.00 0.70 0.00 0.00 55.95 56.62 1rep s SER 128 Cb -0.12 -1.60 -0.01 0.00 -1.71 0.00 0.00 66.02 62.58 1rep s SER 128 CO 0.02 0.23 -0.11 0.68 1.20 0.00 0.00 173.24 175.25 1rep s VAL 129 N -0.01 0.90 -1.04 4.45 -7.23 0.11 -2.30 120.40 115.28 1rep s VAL 129 Ca 0.00 -0.54 -0.06 0.00 -1.81 0.00 0.00 61.98 59.58 1rep s VAL 129 Cb -0.13 -0.76 0.26 0.00 0.56 0.00 0.00 36.38 36.31 1rep s VAL 129 CO 0.03 0.22 1.02 1.57 -0.31 0.00 0.00 175.10 177.62 1rep n HIS 130 N 2.70 4.81 -1.68 2.82 -0.00 -1.26 0.11 115.22 122.71 1rep n HIS 130 Ca -0.14 -3.95 -0.45 0.00 0.46 0.00 0.00 57.72 53.64 1rep n HIS 130 Cb 0.56 -1.49 -0.04 0.00 -0.12 0.00 0.00 29.99 28.90 1rep n HIS 130 CO 0.00 0.00 0.00 -0.89 0.46 0.00 0.00 176.34 175.91 1rep n ILE 131 N 2.47 0.06 -1.41 3.57 2.08 -0.76 -2.85 119.36 122.53 1rep n ILE 131 Ca 0.23 -0.01 -0.61 0.00 0.56 0.00 0.00 62.75 62.92 1rep n ILE 131 Cb 0.38 -1.72 -0.11 0.00 -0.75 0.00 0.00 39.64 37.44 1rep n ILE 131 CO 0.00 0.00 0.00 -3.20 0.56 0.00 0.00 176.55 173.91 1rep n ASN 132 N 3.92 1.05 -0.33 4.38 2.85 -0.35 -4.42 115.26 122.37 1rep n ASN 132 Ca 0.17 0.80 0.21 0.00 -0.11 0.00 0.00 54.58 55.64 1rep n ASN 132 Cb 0.31 -0.94 0.42 0.00 1.24 0.00 0.00 39.78 40.81 1rep n ASN 132 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1rep h PRO 133 N 8.27 0.31 0.00 1.20 0.13 -1.86 0.18 132.00 140.22 1rep h PRO 133 Ca -0.21 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1rep h PRO 133 Cb 1.40 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1rep h PRO 133 CO 1.05 0.20 0.00 0.66 -0.23 0.00 0.00 178.00 179.68 1rep n TYR 134 N -5.09 0.00 0.90 1.56 4.01 -1.26 -2.45 117.16 114.83 1rep n TYR 134 Ca 0.29 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 58.13 1rep n TYR 134 Cb 0.89 -0.40 -0.04 0.00 -0.31 0.00 0.00 39.34 39.49 1rep n TYR 134 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1rep n LEU 135 N -1.40 0.80 0.11 7.72 4.32 0.63 -4.51 117.00 124.67 1rep n LEU 135 Ca 0.00 -0.32 -0.12 0.00 -0.02 0.00 0.00 56.01 55.55 1rep n LEU 135 Cb 0.01 -0.06 -0.06 0.00 -1.62 0.00 0.00 43.42 41.70 1rep n LEU 135 CO 0.01 0.19 0.71 0.40 -1.22 0.00 0.00 177.39 177.48 1rep h ILE 136 N 0.00 0.50 -1.00 -0.08 1.08 -1.63 -2.42 117.51 113.96 1rep h ILE 136 Ca 0.00 0.00 0.18 0.00 -0.39 0.00 0.00 64.86 64.65 1rep h ILE 136 Cb 0.55 0.50 -0.18 0.00 -3.07 0.00 0.00 36.82 34.62 1rep h ILE 136 CO 0.00 0.00 -0.31 -0.65 -0.69 0.00 0.00 178.15 176.50 1rep h PRO 137 N -0.41 -0.00 -0.52 2.37 0.11 -1.82 0.15 132.00 131.87 1rep h PRO 137 Ca 0.03 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.09 1rep h PRO 137 Cb 0.44 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.53 1rep h PRO 137 CO -0.13 -0.00 0.14 0.74 -0.21 0.00 0.00 178.00 178.53 1rep h PHE 138 N -0.00 0.87 0.00 0.65 -1.00 -1.81 -1.77 116.94 113.88 1rep h PHE 138 Ca 0.43 -0.10 0.00 0.00 2.81 0.00 0.00 57.97 61.10 1rep h PHE 138 Cb 0.67 -0.25 0.00 0.00 3.61 0.00 0.00 35.95 39.99 1rep h PHE 138 CO -0.81 0.76 0.00 1.19 -1.61 0.00 0.00 178.31 177.84 1rep n PHE 139 N -4.44 0.00 -3.99 -0.55 0.99 0.40 -3.73 117.46 106.13 1rep n PHE 139 Ca 0.02 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.18 1rep n PHE 139 Cb 0.22 -0.18 -0.17 0.00 -1.00 0.00 0.00 39.48 38.35 1rep n PHE 139 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 1rep s ILE 140 N -2.37 1.34 0.00 4.37 -1.09 -0.54 -4.31 121.20 118.60 1rep s ILE 140 Ca 0.13 -0.49 0.00 0.00 -2.23 0.00 0.00 60.65 58.06 1rep s ILE 140 Cb 0.08 -1.29 0.00 0.00 -1.58 0.00 0.00 42.46 39.67 1rep s ILE 140 CO 0.16 0.42 0.00 0.61 -1.23 0.00 0.00 174.94 174.90 1rep n GLY 141 N 4.82 0.00 4.26 6.18 0.00 -1.26 -4.63 105.19 114.55 1rep n GLY 141 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1rep n GLY 141 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rep n LEU 142 N -2.32 0.00 -3.86 0.99 4.32 -1.26 -4.80 117.00 110.07 1rep n LEU 142 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 56.01 55.89 1rep n LEU 142 Cb 0.00 -0.21 0.02 0.00 -1.62 0.00 0.00 43.42 41.61 1rep n LEU 142 CO 0.00 0.00 0.46 -1.58 -1.22 0.00 0.00 177.39 175.05 1rep s GLN 143 N 0.00 2.24 0.35 3.23 2.00 -1.26 -5.05 119.66 121.17 1rep s GLN 143 Ca 0.00 -1.56 0.06 0.00 -2.00 0.00 0.00 55.36 51.85 1rep s GLN 143 Cb 0.00 0.59 0.64 0.00 0.80 0.00 0.00 33.01 35.05 1rep s GLN 143 CO 0.00 -1.03 1.88 -2.95 -0.50 0.00 0.00 175.29 172.69 1rep h ASN 144 N 2.01 0.41 -3.02 6.67 7.08 -2.02 -3.43 115.58 123.29 1rep h ASN 144 Ca -0.33 -0.08 -0.54 0.00 -3.08 0.00 0.00 56.30 52.27 1rep h ASN 144 Cb 1.25 -0.11 0.00 0.00 -2.08 0.00 0.00 38.32 37.38 1rep h ASN 144 CO 0.42 0.52 0.72 0.00 -2.08 0.00 0.00 177.43 177.01 1rep s ARG 145 N -4.87 4.34 -0.07 4.14 1.04 -1.26 -4.98 118.95 117.29 1rep s ARG 145 Ca -0.07 1.92 -0.32 0.00 -1.04 0.00 0.00 55.73 56.22 1rep s ARG 145 Cb 0.15 -3.43 0.13 0.00 -2.04 0.00 0.00 34.95 29.77 1rep s ARG 145 CO 0.76 -0.44 1.29 -0.59 -0.04 0.00 0.00 175.30 176.27 1rep s PHE 146 N 1.69 -0.06 0.01 5.89 -0.12 -1.26 -4.32 117.98 119.80 1rep s PHE 146 Ca 0.62 -0.02 0.07 0.00 -0.05 0.00 0.00 56.93 57.55 1rep s PHE 146 Cb -0.32 0.53 -0.02 0.00 -0.63 0.00 0.00 43.02 42.59 1rep s PHE 146 CO 0.28 -0.23 -0.22 0.99 -0.05 0.00 0.00 175.22 175.99 1rep s THR 147 N -2.38 1.77 0.03 -4.49 2.01 0.11 -4.77 115.64 107.92 1rep s THR 147 Ca 0.13 -1.06 -0.03 0.00 0.31 0.00 0.00 61.69 61.05 1rep s THR 147 Cb 0.04 -1.49 -0.02 0.00 0.01 0.00 0.00 72.50 71.04 1rep s THR 147 CO -0.04 0.41 0.04 0.00 -0.69 0.00 0.00 174.62 174.33 1rep s GLN 148 N -0.76 0.50 0.04 4.92 -2.07 -1.26 -0.62 119.66 120.41 1rep s GLN 148 Ca 0.09 -0.78 -0.28 0.00 -1.82 0.00 0.00 55.36 52.56 1rep s GLN 148 Cb -0.09 0.19 0.10 0.00 -1.09 0.00 0.00 33.01 32.12 1rep s GLN 148 CO 0.00 -0.11 1.20 -0.59 -1.32 0.00 0.00 175.29 174.47 1rep s PHE 149 N -2.45 -0.05 0.07 9.60 -0.12 -0.50 -4.91 117.98 119.62 1rep s PHE 149 Ca -0.06 -0.13 0.03 0.00 -0.05 0.00 0.00 56.93 56.72 1rep s PHE 149 Cb -0.02 0.58 -0.04 0.00 -0.63 0.00 0.00 43.02 42.91 1rep s PHE 149 CO -0.04 -0.45 0.05 1.03 -0.05 0.00 0.00 175.22 175.76 1rep s ARG 150 N -2.56 2.79 0.63 1.99 0.52 -1.26 0.59 118.95 121.64 1rep s ARG 150 Ca 0.16 -0.72 0.34 0.00 -0.52 0.00 0.00 55.73 54.99 1rep s ARG 150 Cb 0.02 -2.68 1.92 0.00 0.52 0.00 0.00 34.95 34.74 1rep s ARG 150 CO -0.02 0.57 2.16 -0.07 0.02 0.00 0.00 175.30 177.97 1rep h LEU 151 N 3.46 0.00 -0.85 2.53 3.38 -1.69 -0.07 115.31 122.06 1rep h LEU 151 Ca -0.47 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.42 1rep h LEU 151 Cb 1.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1rep h LEU 151 CO 0.63 0.00 -0.39 0.28 0.09 0.00 0.00 178.44 179.06 1rep h SER 152 N 0.00 0.00 0.06 -0.43 0.02 -1.89 0.90 113.55 112.21 1rep h SER 152 Ca 0.03 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.83 1rep h SER 152 Cb 0.33 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1rep h SER 152 CO -0.00 0.39 -0.55 -0.33 -1.14 0.00 0.00 176.83 175.20 1rep h GLU 153 N 0.00 0.52 -0.19 3.45 5.08 -1.34 -3.33 114.58 118.77 1rep h GLU 153 Ca -0.00 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1rep h GLU 153 Cb 0.94 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1rep h GLU 153 CO 0.05 0.93 0.00 0.25 -1.00 0.00 0.00 179.01 179.24 1rep n THR 154 N -3.95 0.59 0.51 1.13 -2.24 -1.16 -4.43 114.28 104.72 1rep n THR 154 Ca -0.03 -0.79 0.13 0.00 -2.27 0.00 0.00 64.05 61.08 1rep n THR 154 Cb 0.60 0.79 0.30 0.00 -2.10 0.00 0.00 70.33 69.92 1rep n THR 154 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1rep h LYS 155 N 1.87 0.00 -0.01 -0.78 2.10 -0.93 -3.26 116.57 115.57 1rep h LYS 155 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1rep h LYS 155 Cb 0.59 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.92 1rep h LYS 155 CO 0.00 0.00 -0.53 -1.91 -2.00 0.00 0.00 179.45 175.01 1rep n GLU 156 N -2.43 0.72 -2.65 0.07 2.13 -1.26 -4.94 120.64 112.28 1rep n GLU 156 Ca 0.05 -0.54 -0.39 0.00 0.66 0.00 0.00 57.16 56.94 1rep n GLU 156 Cb 0.46 -1.49 -0.05 0.00 0.27 0.00 0.00 31.44 30.63 1rep n GLU 156 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1rep s ILE 157 N -2.66 3.88 -0.16 6.31 1.01 -1.23 -4.91 121.20 123.45 1rep s ILE 157 Ca 0.17 1.74 -0.03 0.00 0.00 0.00 0.00 60.65 62.53 1rep s ILE 157 Cb 0.18 -4.05 -0.08 0.00 0.01 0.00 0.00 42.46 38.51 1rep s ILE 157 CO 0.64 0.31 -0.17 0.41 0.00 0.00 0.00 174.94 176.12 1rep n THR 158 N 0.96 0.88 -2.37 2.92 -1.04 -1.26 -4.96 114.28 109.41 1rep n THR 158 Ca 0.00 -0.28 -0.43 0.00 -2.04 0.00 0.00 64.05 61.30 1rep n THR 158 Cb 0.47 -1.38 -0.02 0.00 -1.82 0.00 0.00 70.33 67.58 1rep n THR 158 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1rep s ASN 159 N -5.96 6.88 0.64 8.00 3.84 -1.26 -4.63 114.94 122.44 1rep s ASN 159 Ca -0.22 1.70 0.41 0.00 0.21 0.00 0.00 52.86 54.97 1rep s ASN 159 Cb 0.07 -2.54 2.24 0.00 -0.55 0.00 0.00 41.25 40.47 1rep s ASN 159 CO 0.32 -0.82 2.26 1.55 -2.79 0.00 0.00 177.10 177.62 1rep h PRO 160 N 8.51 0.00 0.09 0.43 0.13 -1.91 -0.53 132.00 138.71 1rep h PRO 160 Ca -0.28 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.60 1rep h PRO 160 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 1rep h PRO 160 CO 0.98 0.00 -1.14 1.88 -0.23 0.00 0.00 178.00 179.49 1rep h TYR 161 N 0.00 0.44 -0.19 1.56 0.99 -1.92 -2.68 116.97 115.16 1rep h TYR 161 Ca 0.00 -0.30 -0.09 0.00 2.00 0.00 0.00 58.73 60.34 1rep h TYR 161 Cb 0.08 -0.03 -0.01 0.00 1.00 0.00 0.00 36.73 37.77 1rep h TYR 161 CO 0.00 1.20 -0.28 0.00 -0.00 0.00 0.00 178.16 179.08 1rep h ALA 162 N 0.69 1.16 -0.01 3.88 0.00 -1.47 0.63 119.26 124.14 1rep h ALA 162 Ca -0.10 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.38 1rep h ALA 162 Cb 1.85 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.52 1rep h ALA 162 CO 0.18 0.54 -0.40 0.52 0.00 0.00 0.00 179.25 180.09 1rep h MET 163 N 0.33 0.02 -0.03 0.00 2.86 -1.40 -2.06 114.93 114.64 1rep h MET 163 Ca 0.05 -0.01 -0.10 0.00 -2.06 0.00 0.00 59.70 57.58 1rep h MET 163 Cb 0.67 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.33 1rep h MET 163 CO 0.05 0.41 -0.39 0.00 1.06 0.00 0.00 176.91 178.04 1rep h ARG 164 N 0.01 0.31 0.59 1.72 2.47 -0.86 -2.86 114.38 115.78 1rep h ARG 164 Ca -0.00 -0.30 -0.02 0.00 -1.26 0.00 0.00 59.98 58.40 1rep h ARG 164 Cb 0.71 0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 29.09 1rep h ARG 164 CO 0.05 0.98 -0.49 1.25 0.56 0.00 0.00 179.97 182.32 1rep h LEU 165 N -0.24 -1.30 -0.77 3.04 6.46 -0.77 -2.04 115.31 119.69 1rep h LEU 165 Ca -0.04 0.09 0.16 0.00 -0.12 0.00 0.00 57.88 57.97 1rep h LEU 165 Cb 1.09 0.41 -0.14 0.00 -0.73 0.00 0.00 40.66 41.29 1rep h LEU 165 CO 0.08 -0.69 -0.13 0.22 -0.62 0.00 0.00 178.44 177.30 1rep h TYR 166 N -1.06 -0.30 -0.84 1.25 3.20 -1.48 0.29 116.97 118.03 1rep h TYR 166 Ca -0.07 0.07 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 1rep h TYR 166 Cb 0.89 0.25 -0.04 0.00 1.54 0.00 0.00 36.73 39.38 1rep h TYR 166 CO -0.20 -0.31 0.49 0.93 -1.64 0.00 0.00 178.16 177.43 1rep h GLU 167 N 0.02 1.15 -0.26 1.82 5.08 -1.32 0.66 114.58 121.72 1rep h GLU 167 Ca 0.38 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.60 1rep h GLU 167 Cb 0.62 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1rep h GLU 167 CO -0.76 0.82 0.04 0.77 -1.00 0.00 0.00 179.01 178.88 1rep h SER 168 N 1.15 0.41 -1.00 1.42 0.02 0.12 -2.38 113.55 113.30 1rep h SER 168 Ca 0.30 -0.26 0.06 0.00 -0.84 0.00 0.00 61.79 61.05 1rep h SER 168 Cb -0.02 -0.11 -0.07 0.00 0.14 0.00 0.00 62.40 62.35 1rep h SER 168 CO -0.05 0.56 0.65 -0.07 -1.14 0.00 0.00 176.83 176.78 1rep h LEU 169 N 0.24 1.04 -1.63 5.07 3.38 -0.20 0.38 115.31 123.59 1rep h LEU 169 Ca 0.08 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1rep h LEU 169 Cb 0.33 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1rep h LEU 169 CO 0.00 0.68 0.00 0.00 0.09 0.00 0.00 178.44 179.21 1rep n GLN 171 N -2.65 0.20 -0.04 0.00 7.27 0.12 -2.95 117.38 119.33 1rep n GLN 171 Ca -0.00 0.26 0.01 0.00 0.07 0.00 0.00 57.00 57.34 1rep n GLN 171 Cb 0.16 -1.78 0.03 0.00 2.41 0.00 0.00 30.24 31.06 1rep n GLN 171 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1rep n TYR 172 N -2.13 0.09 -2.35 3.69 4.02 -0.08 -4.98 117.16 115.41 1rep n TYR 172 Ca 0.04 -0.49 -0.40 0.00 -0.01 0.00 0.00 57.90 57.04 1rep n TYR 172 Cb 0.34 -0.04 -0.03 0.00 -0.02 0.00 0.00 39.34 39.59 1rep n TYR 172 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1rep s ARG 173 N -0.99 4.44 0.28 -0.72 0.52 -1.06 -4.55 118.95 116.87 1rep s ARG 173 Ca 0.05 1.91 0.06 0.00 -0.52 0.00 0.00 55.73 57.23 1rep s ARG 173 Cb 0.02 -3.04 -0.03 0.00 0.52 0.00 0.00 34.95 32.43 1rep s ARG 173 CO 0.03 -0.00 0.30 -1.59 0.02 0.00 0.00 175.30 174.06 1rep s LYS 174 N -1.73 3.06 0.46 3.54 -2.85 -0.26 -4.93 119.74 117.03 1rep s LYS 174 Ca 0.48 -1.01 0.31 0.00 -1.00 0.00 0.00 55.97 54.76 1rep s LYS 174 Cb -0.33 -2.68 1.42 0.00 -2.06 0.00 0.00 37.83 34.18 1rep s LYS 174 CO 0.43 0.30 1.68 -1.35 0.10 0.00 0.00 175.35 176.51 1rep h PRO 175 N 1.26 0.12 -0.44 1.78 0.11 -1.96 0.83 132.00 133.70 1rep h PRO 175 Ca -0.48 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.71 1rep h PRO 175 Cb 1.24 -0.03 -0.09 0.00 0.11 0.00 0.00 31.00 32.24 1rep h PRO 175 CO 0.59 0.08 -0.15 -0.44 -0.21 0.00 0.00 178.00 177.87 1rep h ASP 176 N 0.13 -0.53 0.00 -2.05 3.45 -2.02 -3.45 116.42 111.95 1rep h ASP 176 Ca 0.74 0.15 0.00 0.00 0.43 0.00 0.00 57.03 58.35 1rep h ASP 176 Cb 2.45 0.32 0.00 0.00 -0.56 0.00 0.00 39.33 41.54 1rep h ASP 176 CO -0.27 -0.19 0.00 0.61 -1.57 0.00 0.00 179.24 177.83 1rep n GLY 177 N -1.36 1.95 3.38 2.75 0.00 0.29 -4.90 105.19 107.29 1rep n GLY 177 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.89 1rep n GLY 177 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rep s SER 178 N -2.00 1.06 0.00 1.61 1.04 -1.25 -1.44 113.70 112.72 1rep s SER 178 Ca 0.00 -1.55 0.00 0.00 0.48 0.00 0.00 55.95 54.88 1rep s SER 178 Cb 0.00 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.70 1rep s SER 178 CO 0.00 -1.14 0.00 0.61 0.98 0.00 0.00 173.24 173.69 1rep n GLY 179 N -0.54 -0.47 3.10 7.32 0.00 -0.03 -1.10 105.19 113.47 1rep n GLY 179 Ca 0.04 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.85 1rep n GLY 179 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1rep s ILE 180 N -2.00 -0.02 -0.08 -0.61 2.07 -1.26 -0.71 121.20 118.59 1rep s ILE 180 Ca 0.00 0.08 -0.14 0.00 -1.41 0.00 0.00 60.65 59.19 1rep s ILE 180 Cb 0.00 -0.38 0.03 0.00 0.13 0.00 0.00 42.46 42.24 1rep s ILE 180 CO 0.00 0.03 0.34 0.54 -1.91 0.00 0.00 174.94 173.94 1rep s VAL 181 N 0.80 0.03 -0.13 4.00 0.11 0.71 -5.00 120.40 120.92 1rep s VAL 181 Ca -0.05 -0.22 -0.03 0.00 -2.93 0.00 0.00 61.98 58.75 1rep s VAL 181 Cb -0.07 -0.56 -0.03 0.00 -1.53 0.00 0.00 36.38 34.20 1rep s VAL 181 CO -0.05 -0.12 -0.04 -0.55 -3.33 0.00 0.00 175.10 171.01 1rep s SER 182 N -0.53 4.80 -0.02 3.54 0.15 -1.26 0.43 113.70 120.81 1rep s SER 182 Ca -0.06 -0.08 0.07 0.00 0.70 0.00 0.00 55.95 56.58 1rep s SER 182 Cb -0.04 -1.63 -0.02 0.00 -1.71 0.00 0.00 66.02 62.63 1rep s SER 182 CO 0.02 0.23 -0.25 -0.76 1.20 0.00 0.00 173.24 173.69 1rep s LEU 183 N 0.00 2.05 0.17 3.45 1.43 0.45 -4.91 118.68 121.32 1rep s LEU 183 Ca 0.01 -0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 52.36 1rep s LEU 183 Cb -0.13 -1.27 -0.07 0.00 0.03 0.00 0.00 46.19 44.74 1rep s LEU 183 CO 0.03 0.30 1.08 -0.75 0.23 0.00 0.00 176.35 177.23 1rep s LYS 184 N -0.54 4.61 0.29 1.70 2.36 -1.26 0.28 119.74 127.19 1rep s LYS 184 Ca 0.08 1.68 -0.02 0.00 -2.55 0.00 0.00 55.97 55.16 1rep s LYS 184 Cb -0.10 -3.29 0.42 0.00 -1.05 0.00 0.00 37.83 33.81 1rep s LYS 184 CO -0.01 0.11 1.95 0.82 1.55 0.00 0.00 175.35 179.77 1rep h ILE 185 N 3.74 1.20 0.32 5.43 2.04 -0.99 -2.12 117.51 127.13 1rep h ILE 185 Ca -0.44 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.02 1rep h ILE 185 Cb 1.21 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1rep h ILE 185 CO 0.72 0.21 -0.52 0.44 0.00 0.00 0.00 178.15 179.00 1rep h ASP 186 N 1.16 -1.51 -0.71 1.72 5.19 -1.92 -1.16 116.42 119.20 1rep h ASP 186 Ca 0.34 0.14 0.14 0.00 -0.62 0.00 0.00 57.03 57.02 1rep h ASP 186 Cb -0.07 0.53 -0.10 0.00 0.18 0.00 0.00 39.33 39.87 1rep h ASP 186 CO -0.08 -0.62 0.24 -0.25 -3.12 0.00 0.00 179.24 175.40 1rep h TRP 187 N -0.90 0.40 -0.29 4.55 7.01 -1.88 -0.36 115.95 124.49 1rep h TRP 187 Ca -0.04 0.04 -0.00 0.00 2.11 0.00 0.00 58.89 61.00 1rep h TRP 187 Cb 0.83 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.81 1rep h TRP 187 CO -0.36 0.01 0.17 0.82 -2.79 0.00 0.00 178.44 176.30 1rep h ILE 188 N 0.37 1.11 -0.78 2.65 2.04 -1.05 0.15 117.51 122.00 1rep h ILE 188 Ca 0.39 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 1rep h ILE 188 Cb 0.60 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.42 1rep h ILE 188 CO -0.42 0.11 0.40 0.40 0.00 0.00 0.00 178.15 178.64 1rep h ILE 189 N 0.36 1.24 -0.04 -0.67 2.04 -0.33 -1.52 117.51 118.59 1rep h ILE 189 Ca 0.10 -0.64 -0.15 0.00 1.00 0.00 0.00 64.86 65.16 1rep h ILE 189 Cb 0.03 0.23 0.01 0.00 -0.74 0.00 0.00 36.82 36.35 1rep h ILE 189 CO -0.02 0.28 -0.58 -0.08 0.00 0.00 0.00 178.15 177.75 1rep h GLU 190 N 1.09 0.46 0.04 2.37 4.81 -0.79 -2.60 114.58 119.97 1rep h GLU 190 Ca 0.27 -0.44 -0.15 0.00 -0.13 0.00 0.00 59.36 58.91 1rep h GLU 190 Cb 0.08 0.11 0.01 0.00 0.63 0.00 0.00 28.75 29.59 1rep h GLU 190 CO -0.04 1.09 -0.62 0.00 -0.73 0.00 0.00 179.01 178.71 1rep h ARG 191 N -0.00 0.34 -0.00 1.92 2.47 -0.73 -3.21 114.38 115.17 1rep h ARG 191 Ca -0.06 -0.43 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 1rep h ARG 191 Cb 1.26 0.13 0.00 0.00 -1.65 0.00 0.00 29.97 29.72 1rep h ARG 191 CO 0.12 1.13 -0.00 0.66 0.56 0.00 0.00 179.97 182.43 1rep n TYR 192 N -4.23 0.00 -3.86 3.04 4.02 -0.57 -2.75 117.16 112.81 1rep n TYR 192 Ca -0.11 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.45 1rep n TYR 192 Cb 0.70 -0.11 0.01 0.00 -0.02 0.00 0.00 39.34 39.92 1rep n TYR 192 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1rep n GLN 193 N -1.10 -1.03 -2.49 -0.72 6.02 -1.01 -4.87 117.38 112.18 1rep n GLN 193 Ca 0.20 0.52 -0.33 0.00 -0.01 0.00 0.00 57.00 57.38 1rep n GLN 193 Cb 0.16 -2.64 -0.04 0.00 1.02 0.00 0.00 30.24 28.75 1rep n GLN 193 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1rep s LEU 194 N -5.95 3.76 0.58 1.08 1.02 -1.02 -4.97 118.68 113.18 1rep s LEU 194 Ca 0.21 1.76 -0.18 0.00 0.02 0.00 0.00 54.13 55.95 1rep s LEU 194 Cb -0.11 -4.54 -0.07 0.00 0.02 0.00 0.00 46.19 41.49 1rep s LEU 194 CO 0.92 -0.70 0.70 -2.65 0.02 0.00 0.00 176.35 174.64 1rep n PRO 195 N -1.22 0.66 -0.25 1.29 -0.02 -1.26 -4.87 135.00 129.33 1rep n PRO 195 Ca 0.08 0.26 0.02 0.00 -2.02 0.00 0.00 63.50 61.83 1rep n PRO 195 Cb 0.53 -1.89 0.14 0.00 -0.02 0.00 0.00 33.50 32.27 1rep n PRO 195 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1rep h GLN 196 N 0.33 0.59 0.00 -0.52 -0.00 -2.00 -1.60 115.11 111.91 1rep h GLN 196 Ca -0.47 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.15 1rep h GLN 196 Cb 1.39 -0.13 0.00 0.00 0.00 0.00 0.00 27.48 28.73 1rep h GLN 196 CO 0.48 0.39 0.00 -1.13 0.00 0.00 0.00 178.83 178.57 1rep n SER 197 N -4.86 0.00 -0.93 -0.69 3.41 -1.26 -1.38 113.62 107.91 1rep n SER 197 Ca 0.11 0.34 0.07 0.00 -0.26 0.00 0.00 58.87 59.13 1rep n SER 197 Cb 0.28 -0.36 0.21 0.00 -0.26 0.00 0.00 64.21 64.07 1rep n SER 197 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1rep n TYR 198 N -1.36 0.73 0.65 7.33 0.53 -0.60 -3.11 117.16 121.33 1rep n TYR 198 Ca 0.01 -0.33 0.13 0.00 -1.02 0.00 0.00 57.90 56.69 1rep n TYR 198 Cb 0.02 -0.07 0.35 0.00 -1.03 0.00 0.00 39.34 38.60 1rep n TYR 198 CO 0.00 0.00 0.00 1.04 -1.02 0.00 0.00 176.86 176.88 1rep n GLN 199 N 0.71 0.24 -3.18 -0.72 1.13 -0.48 -4.41 117.38 110.68 1rep n GLN 199 Ca 0.15 0.16 -0.45 0.00 -1.94 0.00 0.00 57.00 54.92 1rep n GLN 199 Cb 0.47 -1.74 -0.04 0.00 0.11 0.00 0.00 30.24 29.03 1rep n GLN 199 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1rep s ARG 200 N -3.11 3.10 0.25 -1.09 3.52 -1.18 -4.97 118.95 115.47 1rep s ARG 200 Ca 0.10 -1.55 0.03 0.00 -0.13 0.00 0.00 55.73 54.17 1rep s ARG 200 Cb 0.13 -4.32 0.65 0.00 -1.56 0.00 0.00 34.95 29.86 1rep s ARG 200 CO 0.63 -1.47 1.26 -0.12 -0.81 0.00 0.00 175.30 174.79 1rep n MET 201 N 5.82 -0.06 0.26 5.12 0.00 -1.26 0.42 117.12 127.41 1rep n MET 201 Ca -0.08 1.20 0.17 0.00 -0.00 0.00 0.00 57.70 58.99 1rep n MET 201 Cb 0.42 -1.92 0.90 0.00 0.00 0.00 0.00 33.22 32.63 1rep n MET 201 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 175.97 174.62 1rep h PRO 202 N 0.00 0.00 0.00 2.12 0.11 -1.94 -0.84 132.00 131.45 1rep h PRO 202 Ca 0.50 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 66.41 1rep h PRO 202 Cb 1.07 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.15 1rep h PRO 202 CO -0.74 0.00 -1.45 -0.44 -0.21 0.00 0.00 178.00 175.15 1rep h ASP 203 N 0.00 0.00 0.04 -2.05 3.32 -0.32 -3.26 116.42 114.15 1rep h ASP 203 Ca 0.04 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.97 1rep h ASP 203 Cb 0.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1rep h ASP 203 CO -0.00 0.73 -0.40 0.15 -1.72 0.00 0.00 179.24 178.00 1rep h PHE 204 N 0.00 0.54 0.19 4.55 3.57 -0.93 -1.54 116.94 123.33 1rep h PHE 204 Ca -0.19 -0.15 -0.01 0.00 3.53 0.00 0.00 57.97 61.15 1rep h PHE 204 Cb 1.73 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 40.35 1rep h PHE 204 CO 0.00 0.79 -0.09 0.00 -2.23 0.00 0.00 178.31 176.78 1rep h ARG 205 N 0.38 -0.25 0.31 1.11 3.08 -1.38 0.91 114.38 118.54 1rep h ARG 205 Ca 0.03 0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 1rep h ARG 205 Cb 0.87 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.98 1rep h ARG 205 CO 0.07 0.08 -0.15 0.00 -1.07 0.00 0.00 179.97 178.91 1rep h ARG 206 N -0.61 -0.40 0.00 0.04 3.08 -1.59 0.13 114.38 115.02 1rep h ARG 206 Ca -0.03 0.03 -0.20 0.00 0.07 0.00 0.00 59.98 59.85 1rep h ARG 206 Cb 0.45 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.56 1rep h ARG 206 CO 0.04 -0.10 -1.20 0.00 -1.07 0.00 0.00 179.97 177.65 1rep h ARG 207 N -0.72 0.00 0.00 0.04 2.47 -1.44 -3.35 114.38 111.37 1rep h ARG 207 Ca -0.04 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1rep h ARG 207 Cb 0.49 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.81 1rep h ARG 207 CO 0.07 0.58 -0.30 0.34 0.56 0.00 0.00 179.97 181.22 1rep n PHE 208 N -3.12 0.00 0.08 3.04 -0.00 -0.98 -4.52 117.46 111.95 1rep n PHE 208 Ca -0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 57.45 57.34 1rep n PHE 208 Cb 0.90 -0.15 -0.02 0.00 -0.00 0.00 0.00 39.48 40.21 1rep n PHE 208 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 1rep h LEU 209 N -0.30 -0.28 -0.60 -2.13 3.38 -0.77 -1.13 115.31 113.48 1rep h LEU 209 Ca 0.00 0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.11 1rep h LEU 209 Cb 0.30 0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.04 1rep h LEU 209 CO 0.00 -0.15 0.02 1.56 0.09 0.00 0.00 178.44 179.96 1rep h GLN 210 N -0.24 0.14 -0.01 1.13 7.50 -0.96 -0.73 115.11 121.94 1rep h GLN 210 Ca -0.02 -0.01 0.02 0.00 0.50 0.00 0.00 58.65 59.15 1rep h GLN 210 Cb 0.20 -0.03 -0.03 0.00 0.05 0.00 0.00 27.48 27.67 1rep h GLN 210 CO 0.00 0.09 -0.14 0.28 -1.50 0.00 0.00 178.83 177.57 1rep h VAL 211 N 0.14 0.65 -0.28 -0.54 2.07 -1.68 -1.83 116.25 114.78 1rep h VAL 211 Ca 0.32 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.71 1rep h VAL 211 Cb 0.50 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1rep h VAL 211 CO -0.50 0.00 -0.33 0.00 0.02 0.00 0.00 177.57 176.76 1rep h VAL 213 N 0.52 1.10 0.35 0.00 2.07 -0.97 -1.98 116.25 117.34 1rep h VAL 213 Ca 0.06 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1rep h VAL 213 Cb 0.83 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1rep h VAL 213 CO 0.07 0.08 -0.17 0.78 0.02 0.00 0.00 177.57 178.35 1rep h ASN 214 N -0.03 -0.40 -0.93 0.57 4.21 -1.30 -1.28 115.58 116.42 1rep h ASN 214 Ca 0.02 0.01 0.25 0.00 1.21 0.00 0.00 56.30 57.79 1rep h ASN 214 Cb 0.11 0.10 -0.13 0.00 -1.12 0.00 0.00 38.32 37.28 1rep h ASN 214 CO -0.00 -0.28 0.43 -0.08 -1.29 0.00 0.00 177.43 176.21 1rep h GLU 215 N -0.48 0.36 -0.09 0.81 4.81 -1.27 -0.61 114.58 118.11 1rep h GLU 215 Ca -0.05 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 1rep h GLU 215 Cb 0.36 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.66 1rep h GLU 215 CO 0.08 0.24 -0.14 0.82 -0.73 0.00 0.00 179.01 179.28 1rep h ILE 216 N 0.37 1.38 0.00 2.32 2.04 -1.04 -0.95 117.51 121.62 1rep h ILE 216 Ca 0.61 -1.37 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1rep h ILE 216 Cb 1.24 2.07 0.00 0.00 -0.74 0.00 0.00 36.82 39.38 1rep h ILE 216 CO -0.57 0.39 0.00 0.59 0.00 0.00 0.00 178.15 178.56 1rep n ASN 217 N -4.61 0.55 0.00 1.72 3.02 -0.27 -2.19 115.26 113.49 1rep n ASN 217 Ca -0.07 -1.10 0.00 0.00 -0.03 0.00 0.00 54.58 53.38 1rep n ASN 217 Cb 0.36 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 1rep n ASN 217 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1rep n SER 218 N 0.23 0.00 -0.20 6.41 7.64 -0.98 -4.91 113.62 121.82 1rep n SER 218 Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.90 1rep n SER 218 Cb 0.14 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.37 1rep n SER 218 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1rep n ARG 219 N -0.27 1.39 -4.19 1.43 3.00 -0.37 -5.04 116.66 112.61 1rep n ARG 219 Ca 0.00 -1.26 -0.11 0.00 -0.01 0.00 0.00 57.85 56.47 1rep n ARG 219 Cb 0.00 -1.09 -0.10 0.00 0.00 0.00 0.00 32.46 31.27 1rep n ARG 219 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1rep s THR 220 N -0.69 0.22 -1.75 0.55 -4.23 -0.93 -4.46 115.64 104.35 1rep s THR 220 Ca 0.07 -1.95 0.21 0.00 -1.18 0.00 0.00 61.69 58.84 1rep s THR 220 Cb 0.04 -2.19 0.49 0.00 1.34 0.00 0.00 72.50 72.18 1rep s THR 220 CO 0.05 -0.35 1.63 -0.81 -0.54 0.00 0.00 174.62 174.61 1rep n PRO 221 N -0.18 0.50 -3.28 3.99 -0.04 -1.26 -4.80 135.00 129.93 1rep n PRO 221 Ca -0.04 0.04 -0.34 0.00 -0.04 0.00 0.00 63.50 63.12 1rep n PRO 221 Cb 0.64 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.54 1rep n PRO 221 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1rep s MET 222 N -2.25 4.00 -0.19 0.54 1.75 -1.26 0.46 119.30 122.35 1rep s MET 222 Ca 0.26 0.55 -0.01 0.00 -1.25 0.00 0.00 55.69 55.24 1rep s MET 222 Cb 0.14 -2.75 0.05 0.00 2.84 0.00 0.00 34.83 35.11 1rep s MET 222 CO 0.27 0.36 -0.01 1.03 -0.65 0.00 0.00 175.02 176.02 1rep s ARG 223 N -2.37 1.08 0.13 4.11 1.81 -0.88 -4.16 118.95 118.67 1rep s ARG 223 Ca 0.44 -0.53 0.04 0.00 -1.72 0.00 0.00 55.73 53.96 1rep s ARG 223 Cb -0.13 -2.10 -0.04 0.00 -0.45 0.00 0.00 34.95 32.22 1rep s ARG 223 CO 0.20 -0.55 -0.09 -0.48 -0.68 0.00 0.00 175.30 173.70 1rep s LEU 224 N 1.70 2.52 0.25 2.53 2.34 -1.26 -1.55 118.68 125.22 1rep s LEU 224 Ca -0.01 -1.01 0.02 0.00 0.06 0.00 0.00 54.13 53.19 1rep s LEU 224 Cb -0.17 -0.26 -0.04 0.00 -0.56 0.00 0.00 46.19 45.17 1rep s LEU 224 CO -0.07 -0.37 0.19 -0.94 -1.06 0.00 0.00 176.35 174.09 1rep s SER 225 N -3.13 0.74 0.08 1.48 1.04 -0.72 -4.97 113.70 108.23 1rep s SER 225 Ca 0.15 -1.53 -0.16 0.00 0.48 0.00 0.00 55.95 54.89 1rep s SER 225 Cb 0.03 0.45 0.03 0.00 0.10 0.00 0.00 66.02 66.63 1rep s SER 225 CO -0.01 -0.93 0.37 -0.72 0.98 0.00 0.00 173.24 172.93 1rep s TYR 226 N -3.88 -0.18 -0.02 5.02 -0.85 -1.26 -1.97 117.35 114.21 1rep s TYR 226 Ca 0.40 -0.02 0.04 0.00 -0.52 0.00 0.00 57.07 56.96 1rep s TYR 226 Cb 0.05 0.19 -0.01 0.00 0.38 0.00 0.00 41.96 42.58 1rep s TYR 226 CO 0.18 -0.61 -0.12 0.42 -1.52 0.00 0.00 175.55 173.90 1rep s ILE 227 N -3.14 0.98 -0.17 -3.49 1.01 -0.17 -4.96 121.20 111.26 1rep s ILE 227 Ca -0.01 -0.51 -0.20 0.00 0.00 0.00 0.00 60.65 59.93 1rep s ILE 227 Cb 0.01 -0.83 -0.03 0.00 0.01 0.00 0.00 42.46 41.62 1rep s ILE 227 CO -0.07 0.28 0.60 -1.61 0.00 0.00 0.00 174.94 174.14 1rep s GLU 228 N -0.13 4.25 0.10 2.79 2.02 -1.26 0.17 118.70 126.64 1rep s GLU 228 Ca 0.02 0.59 -0.19 0.00 0.02 0.00 0.00 54.97 55.41 1rep s GLU 228 Cb -0.06 -3.54 -0.07 0.00 0.10 0.00 0.00 34.13 30.55 1rep s GLU 228 CO 0.00 -0.14 0.59 0.21 0.02 0.00 0.00 175.26 175.94 1rep s LYS 229 N 1.58 4.22 0.40 1.61 2.20 -0.71 -4.97 119.74 124.07 1rep s LYS 229 Ca 0.29 0.76 0.08 0.00 -0.36 0.00 0.00 55.97 56.73 1rep s LYS 229 Cb -0.16 -3.20 -0.08 0.00 -1.51 0.00 0.00 37.83 32.89 1rep s LYS 229 CO 0.11 0.61 -0.01 0.21 -0.36 0.00 0.00 175.35 175.91 1rep s LYS 230 N -1.23 1.93 -0.39 4.03 2.20 -1.26 -0.28 119.74 124.74 1rep s LYS 230 Ca 0.31 -2.07 0.12 0.00 -0.36 0.00 0.00 55.97 53.97 1rep s LYS 230 Cb -0.19 -1.65 0.38 0.00 -1.51 0.00 0.00 37.83 34.86 1rep s LYS 230 CO 0.20 -0.01 0.84 1.17 -0.36 0.00 0.00 175.35 177.19 1rep n LYS 231 N -0.93 1.45 0.00 4.03 0.00 0.13 -4.77 118.16 118.07 1rep n LYS 231 Ca -0.05 -3.60 0.00 0.00 0.00 0.00 0.00 58.31 54.66 1rep n LYS 231 Cb 0.66 -1.68 0.00 0.00 0.00 0.00 0.00 35.03 34.01 1rep n LYS 231 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1rep n GLY 232 N 0.07 1.19 0.71 3.14 0.00 -1.26 -3.91 105.19 105.13 1rep n GLY 232 Ca 0.22 -0.44 0.08 0.00 0.00 0.00 0.00 46.02 45.88 1rep n GLY 232 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rep n ARG 233 N 0.00 1.64 -4.09 1.61 1.74 -1.26 -4.99 116.66 111.31 1rep n ARG 233 Ca 0.00 -1.67 -0.15 0.00 -0.77 0.00 0.00 57.85 55.26 1rep n ARG 233 Cb 0.00 -1.33 -0.14 0.00 -1.02 0.00 0.00 32.46 29.97 1rep n ARG 233 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1rep s GLN 234 N -1.23 0.33 0.06 5.56 -0.21 -1.25 -5.12 119.66 117.79 1rep s GLN 234 Ca 0.22 -0.15 -0.30 0.00 0.02 0.00 0.00 55.36 55.15 1rep s GLN 234 Cb 0.14 -0.31 -0.05 0.00 1.00 0.00 0.00 33.01 33.79 1rep s GLN 234 CO 0.21 0.08 1.11 0.99 -2.12 0.00 0.00 175.29 175.56 1rep s THR 235 N -0.12 4.27 -0.15 -0.19 2.01 -1.26 0.17 115.64 120.36 1rep s THR 235 Ca 0.01 1.68 -0.09 0.00 0.31 0.00 0.00 61.69 63.60 1rep s THR 235 Cb -0.02 -4.07 -0.07 0.00 0.01 0.00 0.00 72.50 68.35 1rep s THR 235 CO -0.00 0.16 -0.22 0.35 -0.69 0.00 0.00 174.62 174.22 1rep n THR 236 N 3.65 1.02 -4.68 -0.82 -2.24 0.62 -4.91 114.28 106.92 1rep n THR 236 Ca 0.07 -0.15 -0.30 0.00 -2.27 0.00 0.00 64.05 61.40 1rep n THR 236 Cb 0.48 -1.79 -0.09 0.00 -2.10 0.00 0.00 70.33 66.82 1rep n THR 236 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1rep s HIS 237 N -2.36 2.22 -0.09 4.78 3.76 -1.22 -0.31 115.29 122.07 1rep s HIS 237 Ca -0.23 -0.81 0.00 0.00 -0.15 0.00 0.00 55.06 53.88 1rep s HIS 237 Cb 0.08 -1.69 0.02 0.00 1.11 0.00 0.00 32.58 32.10 1rep s HIS 237 CO 0.29 0.34 -0.08 0.42 -0.85 0.00 0.00 174.74 174.86 1rep s ILE 238 N -2.80 0.95 -0.41 0.60 -1.09 0.14 -1.74 121.20 116.86 1rep s ILE 238 Ca 0.22 -0.30 -0.17 0.00 -2.23 0.00 0.00 60.65 58.17 1rep s ILE 238 Cb 0.06 -0.95 0.02 0.00 -1.58 0.00 0.00 42.46 40.01 1rep s ILE 238 CO 0.11 0.34 0.44 -0.69 -1.23 0.00 0.00 174.94 173.92 1rep s VAL 239 N 1.31 5.08 -0.18 2.92 1.01 0.13 -0.41 120.40 130.26 1rep s VAL 239 Ca -0.03 -0.26 -0.10 0.00 0.00 0.00 0.00 61.98 61.59 1rep s VAL 239 Cb -0.14 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 1rep s VAL 239 CO -0.03 -0.39 0.15 -0.36 0.00 0.00 0.00 175.10 174.47 1rep s PHE 240 N 2.17 3.46 -0.09 5.22 0.40 0.17 -1.00 117.98 128.32 1rep s PHE 240 Ca 0.13 0.41 0.00 0.00 -0.60 0.00 0.00 56.93 56.87 1rep s PHE 240 Cb -0.17 -2.13 0.02 0.00 0.51 0.00 0.00 43.02 41.25 1rep s PHE 240 CO 0.14 0.38 -0.08 -1.12 0.70 0.00 0.00 175.22 175.24 1rep s SER 241 N 0.06 1.89 0.05 1.36 0.01 -0.83 -0.21 113.70 116.03 1rep s SER 241 Ca 0.11 -0.27 0.02 0.00 1.31 0.00 0.00 55.95 57.12 1rep s SER 241 Cb -0.11 -0.77 -0.03 0.00 0.21 0.00 0.00 66.02 65.32 1rep s SER 241 CO 0.00 -0.07 -0.08 0.72 0.41 0.00 0.00 173.24 174.22 1rep s PHE 242 N 1.35 0.70 -0.00 2.43 -0.12 0.12 -1.75 117.98 120.71 1rep s PHE 242 Ca -0.02 -0.53 0.00 0.00 -0.05 0.00 0.00 56.93 56.33 1rep s PHE 242 Cb -0.14 -0.42 -0.00 0.00 -0.63 0.00 0.00 43.02 41.83 1rep s PHE 242 CO -0.04 -0.08 -0.02 1.03 -0.05 0.00 0.00 175.22 176.06 1rep s ARG 243 N -1.76 0.13 0.27 1.99 1.81 -0.59 -0.85 118.95 119.96 1rep s ARG 243 Ca -0.08 -0.07 -0.30 0.00 -1.72 0.00 0.00 55.73 53.57 1rep s ARG 243 Cb -0.09 -0.12 -0.10 0.00 -0.45 0.00 0.00 34.95 34.19 1rep s ARG 243 CO 0.00 0.03 1.37 0.34 -0.68 0.00 0.00 175.30 176.37 1rep s ASP 244 N -0.06 6.73 0.46 0.23 -1.08 -0.52 -2.07 116.67 120.34 1rep s ASP 244 Ca 0.00 2.64 0.14 0.00 -0.52 0.00 0.00 52.55 54.82 1rep s ASP 244 Cb -0.01 -2.63 1.04 0.00 -1.46 0.00 0.00 42.92 39.86 1rep s ASP 244 CO -0.00 -0.62 2.02 -0.29 0.52 0.00 0.00 175.17 176.80 1rep h ILE 245 N 3.38 1.11 -0.02 4.11 6.09 -0.32 -3.47 117.51 128.39 1rep h ILE 245 Ca -0.47 -0.52 0.00 0.00 -1.37 0.00 0.00 64.86 62.50 1rep h ILE 245 Cb 1.22 1.27 0.00 0.00 0.47 0.00 0.00 36.82 39.78 1rep h ILE 245 CO 0.73 0.15 0.00 1.07 -3.07 0.00 0.00 178.15 177.03