#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1by1 n LYS 2 N 0.00 1.68 0.00 0.03 5.02 -1.26 -2.68 118.16 120.95 1by1 n LYS 2 Ca 0.00 -2.25 0.00 0.00 -2.02 0.00 0.00 58.31 54.04 1by1 n LYS 2 Cb 0.00 -3.35 0.00 0.00 -0.02 0.00 0.00 35.03 31.66 1by1 n LYS 2 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1by1 n GLY 3 N 5.18 2.25 2.74 0.72 0.00 -1.26 -5.08 105.19 109.74 1by1 n GLY 3 Ca 0.47 -0.21 -0.04 0.00 0.00 0.00 0.00 46.02 46.25 1by1 n GLY 3 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1by1 n PHE 4 N 0.00 -2.98 -2.90 1.61 7.35 -1.09 -4.94 117.46 114.51 1by1 n PHE 4 Ca 0.00 1.74 -0.01 0.00 -0.76 0.00 0.00 57.45 58.41 1by1 n PHE 4 Cb 0.00 -2.92 0.01 0.00 0.35 0.00 0.00 39.48 36.92 1by1 n PHE 4 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1by1 s ASP 5 N -0.43 -1.16 -0.18 -2.13 -1.08 -1.26 -5.01 116.67 105.42 1by1 s ASP 5 Ca -0.18 -1.00 0.15 0.00 -0.52 0.00 0.00 52.55 50.99 1by1 s ASP 5 Cb 0.01 1.50 0.35 0.00 -1.46 0.00 0.00 42.92 43.33 1by1 s ASP 5 CO 0.50 -0.08 1.24 0.41 0.52 0.00 0.00 175.17 177.76 1by1 n THR 6 N 3.49 0.34 -0.04 1.71 -1.04 -1.26 -4.89 114.28 112.59 1by1 n THR 6 Ca 0.13 -1.28 0.04 0.00 -2.04 0.00 0.00 64.05 60.89 1by1 n THR 6 Cb 0.59 0.97 -0.16 0.00 -1.82 0.00 0.00 70.33 69.91 1by1 n THR 6 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1by1 n THR 7 N -0.59 0.46 -1.33 12.58 -2.24 -1.26 -4.98 114.28 116.91 1by1 n THR 7 Ca -0.09 -0.60 -0.11 0.00 -2.27 0.00 0.00 64.05 60.98 1by1 n THR 7 Cb 0.87 -0.15 -0.05 0.00 -2.10 0.00 0.00 70.33 68.89 1by1 n THR 7 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1by1 n ALA 8 N -2.39 -0.17 -0.29 6.98 0.00 -1.26 -4.71 120.51 118.66 1by1 n ALA 8 Ca -0.13 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1by1 n ALA 8 Cb 0.75 -1.44 -0.00 0.00 0.00 0.00 0.00 19.45 18.76 1by1 n ALA 8 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1by1 n ILE 9 N -2.55 0.00 0.00 0.00 -5.35 -1.26 -4.64 119.36 105.55 1by1 n ILE 9 Ca -0.11 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.37 1by1 n ILE 9 Cb 0.43 -0.01 0.00 0.00 -1.74 0.00 0.00 39.64 38.32 1by1 n ILE 9 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1by1 n ASN 10 N -3.76 0.00 -2.91 7.28 2.85 -1.26 -4.37 115.26 113.09 1by1 n ASN 10 Ca 0.00 0.00 -0.36 0.00 -0.11 0.00 0.00 54.58 54.11 1by1 n ASN 10 Cb 0.01 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.03 1by1 n ASN 10 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 1by1 n LYS 11 N 0.00 3.13 -2.78 1.20 2.85 -1.26 -4.64 118.16 116.65 1by1 n LYS 11 Ca 0.00 -3.26 -0.00 0.00 -1.05 0.00 0.00 58.31 54.00 1by1 n LYS 11 Cb 0.00 -2.28 0.01 0.00 -0.65 0.00 0.00 35.03 32.11 1by1 n LYS 11 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1by1 s SER 12 N -0.50 -0.50 0.54 -5.58 1.04 -1.26 -5.01 113.70 102.43 1by1 s SER 12 Ca 0.53 -0.39 0.23 0.00 0.48 0.00 0.00 55.95 56.80 1by1 s SER 12 Cb 0.37 0.65 1.44 0.00 0.10 0.00 0.00 66.02 68.57 1by1 s SER 12 CO -0.29 -0.04 2.10 0.22 0.98 0.00 0.00 173.24 176.21 1by1 h TYR 13 N 5.14 0.00 0.62 5.02 3.20 -1.98 -2.37 116.97 126.61 1by1 h TYR 13 Ca -0.01 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 1by1 h TYR 13 Cb 1.20 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.46 1by1 h TYR 13 CO -0.06 0.00 -0.39 -0.92 -1.64 0.00 0.00 178.16 175.15 1by1 h TYR 14 N 0.00 -1.03 0.00 -3.82 3.20 -1.99 -2.10 116.97 111.23 1by1 h TYR 14 Ca 0.10 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 1by1 h TYR 14 Cb 0.41 0.37 -0.00 0.00 1.54 0.00 0.00 36.73 39.05 1by1 h TYR 14 CO 0.00 -0.59 -0.07 -0.91 -1.64 0.00 0.00 178.16 174.95 1by1 h ASN 15 N -0.95 0.00 0.22 -2.11 2.35 -1.88 -2.28 115.58 110.93 1by1 h ASN 15 Ca -0.08 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.55 1by1 h ASN 15 Cb 0.78 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.14 1by1 h ASN 15 CO 0.07 0.07 -0.47 0.58 -1.65 0.00 0.00 177.43 176.03 1by1 h VAL 16 N 0.00 1.33 0.37 2.81 2.07 -0.94 -0.86 116.25 121.03 1by1 h VAL 16 Ca -0.00 -1.67 -0.02 0.00 0.82 0.00 0.00 66.70 65.84 1by1 h VAL 16 Cb 0.34 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1by1 h VAL 16 CO 0.01 0.50 -0.18 0.58 0.02 0.00 0.00 177.57 178.50 1by1 h VAL 17 N 0.24 0.53 0.00 2.57 2.07 -0.78 -1.01 116.25 119.87 1by1 h VAL 17 Ca 0.01 -0.60 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 1by1 h VAL 17 Cb 0.92 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1by1 h VAL 17 CO 0.08 0.10 -0.18 -0.07 0.02 0.00 0.00 177.57 177.51 1by1 h LEU 18 N -0.88 0.00 0.06 2.57 -0.00 -1.60 -1.98 115.31 113.48 1by1 h LEU 18 Ca -0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.83 1by1 h LEU 18 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.20 1by1 h LEU 18 CO 0.08 0.18 -0.03 1.56 -0.00 0.00 0.00 178.44 180.23 1by1 h GLN 19 N 0.00 -0.08 -0.01 1.13 1.08 -1.04 0.70 115.11 116.89 1by1 h GLN 19 Ca -0.00 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1by1 h GLN 19 Cb 0.39 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.84 1by1 h GLN 19 CO 0.02 0.19 0.00 -0.97 -0.95 0.00 0.00 178.83 177.12 1by1 h ASN 20 N -0.35 0.01 -1.00 1.46 -0.73 -0.97 -2.73 115.58 111.27 1by1 h ASN 20 Ca -0.01 -0.13 0.09 0.00 1.87 0.00 0.00 56.30 58.12 1by1 h ASN 20 Cb 0.31 -0.00 -0.07 0.00 0.27 0.00 0.00 38.32 38.82 1by1 h ASN 20 CO 0.01 0.14 0.64 0.40 -0.37 0.00 0.00 177.43 178.26 1by1 h ILE 21 N -0.12 1.02 -0.76 2.57 1.08 -1.36 -0.07 117.51 119.86 1by1 h ILE 21 Ca 0.00 -0.38 0.13 0.00 -0.39 0.00 0.00 64.86 64.23 1by1 h ILE 21 Cb 0.13 -0.18 -0.05 0.00 -3.07 0.00 0.00 36.82 33.65 1by1 h ILE 21 CO -0.00 0.20 0.50 -0.07 -0.69 0.00 0.00 178.15 178.09 1by1 h LEU 22 N 1.10 0.47 -0.05 1.44 4.07 -0.55 0.57 115.31 122.36 1by1 h LEU 22 Ca 0.46 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 58.44 1by1 h LEU 22 Cb 0.30 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 41.96 1by1 h LEU 22 CO -0.21 0.25 0.03 -0.33 -1.08 0.00 0.00 178.44 177.10 1by1 h GLU 23 N 0.51 0.08 0.21 1.13 4.39 -0.82 -0.39 114.58 119.68 1by1 h GLU 23 Ca 0.37 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 60.05 1by1 h GLU 23 Cb 0.73 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 1by1 h GLU 23 CO -0.13 0.12 -0.10 1.15 -1.16 0.00 0.00 179.01 178.89 1by1 h THR 24 N 0.01 0.84 -0.93 1.13 2.02 -1.09 -2.83 112.91 112.07 1by1 h THR 24 Ca 0.02 -0.29 0.14 0.00 0.77 0.00 0.00 66.41 67.05 1by1 h THR 24 Cb 0.07 1.01 -0.08 0.00 -1.74 0.00 0.00 68.15 67.42 1by1 h THR 24 CO -0.00 0.07 0.59 -0.33 0.37 0.00 0.00 175.52 176.22 1by1 h GLU 25 N -0.43 0.75 -1.00 6.66 4.39 -0.90 0.57 114.58 124.61 1by1 h GLU 25 Ca -0.03 -0.05 0.15 0.00 0.34 0.00 0.00 59.36 59.77 1by1 h GLU 25 Cb 0.33 -0.17 -0.09 0.00 -0.10 0.00 0.00 28.75 28.72 1by1 h GLU 25 CO 0.05 0.50 0.62 -0.97 -1.16 0.00 0.00 179.01 178.04 1by1 h ASN 26 N 0.77 0.87 0.31 1.42 -1.24 -0.81 1.39 115.58 118.30 1by1 h ASN 26 Ca 0.47 0.07 -0.05 0.00 0.71 0.00 0.00 56.30 57.50 1by1 h ASN 26 Cb 0.68 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 39.63 1by1 h ASN 26 CO -0.23 0.41 -0.22 -0.33 -1.29 0.00 0.00 177.43 175.77 1by1 h GLU 27 N 0.91 0.00 0.20 6.67 4.39 -0.83 1.33 114.58 127.26 1by1 h GLU 27 Ca 0.53 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.88 1by1 h GLU 27 Cb 0.64 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.30 1by1 h GLU 27 CO -0.31 0.22 -1.65 -0.92 -1.16 0.00 0.00 179.01 175.19 1by1 h TYR 28 N 0.00 0.77 0.16 4.33 3.20 0.59 -2.89 116.97 123.14 1by1 h TYR 28 Ca -0.00 -0.57 -0.26 0.00 3.14 0.00 0.00 58.73 61.04 1by1 h TYR 28 Cb 0.43 -0.03 0.03 0.00 1.54 0.00 0.00 36.73 38.70 1by1 h TYR 28 CO 0.00 1.61 -1.12 0.77 -1.64 0.00 0.00 178.16 177.78 1by1 h SER 29 N 0.12 0.71 1.01 -2.11 0.02 0.18 -3.15 113.55 110.32 1by1 h SER 29 Ca -0.31 -0.89 -0.02 0.00 -0.84 0.00 0.00 61.79 59.73 1by1 h SER 29 Cb 2.11 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 64.42 1by1 h SER 29 CO 0.21 1.54 -0.12 0.07 -1.14 0.00 0.00 176.83 177.39 1by1 h LYS 30 N -0.01 0.00 0.25 3.45 5.09 0.16 -2.59 116.57 122.92 1by1 h LYS 30 Ca -0.19 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.54 1by1 h LYS 30 Cb 1.86 0.00 0.00 0.00 0.10 0.00 0.00 32.23 34.19 1by1 h LYS 30 CO 0.21 0.12 -0.12 1.49 -2.09 0.00 0.00 179.45 179.06 1by1 h GLU 31 N 0.00 -0.32 -0.71 0.07 4.81 -1.56 -2.80 114.58 114.07 1by1 h GLU 31 Ca -0.00 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1by1 h GLU 31 Cb 0.65 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.06 1by1 h GLU 31 CO 0.02 -0.05 0.45 -0.07 -0.73 0.00 0.00 179.01 178.63 1by1 h LEU 32 N -1.01 0.76 -1.17 1.64 3.38 -1.58 -2.02 115.31 115.31 1by1 h LEU 32 Ca -0.03 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 57.99 1by1 h LEU 32 Cb 0.42 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 1by1 h LEU 32 CO 0.06 0.53 0.57 -0.61 0.09 0.00 0.00 178.44 179.08 1by1 h GLN 33 N 0.90 0.98 0.00 1.13 4.15 -1.57 -0.53 115.11 120.16 1by1 h GLN 33 Ca 0.28 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.64 1by1 h GLN 33 Cb -0.03 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 27.44 1by1 h GLN 33 CO -0.09 0.65 0.00 2.41 -1.93 0.00 0.00 178.83 179.87 1by1 n THR 34 N -4.48 0.00 -0.33 2.39 -1.04 -0.76 -1.51 114.28 108.54 1by1 n THR 34 Ca 0.13 1.24 0.10 0.00 -2.04 0.00 0.00 64.05 63.48 1by1 n THR 34 Cb 0.19 -2.17 0.31 0.00 -1.82 0.00 0.00 70.33 66.84 1by1 n THR 34 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1by1 h VAL 35 N 0.00 0.83 0.09 12.58 2.07 -1.57 0.91 116.25 131.16 1by1 h VAL 35 Ca 0.00 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.24 1by1 h VAL 35 Cb 0.00 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.66 1by1 h VAL 35 CO 0.00 0.15 -0.35 -0.07 0.02 0.00 0.00 177.57 177.32 1by1 h LEU 36 N 0.84 -1.06 -0.01 2.57 3.38 -1.05 0.56 115.31 120.54 1by1 h LEU 36 Ca 0.51 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.59 1by1 h LEU 36 Cb 0.68 0.39 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1by1 h LEU 36 CO -0.28 -0.38 0.00 0.28 0.09 0.00 0.00 178.44 178.15 1by1 h SER 37 N -0.51 0.00 0.38 -0.43 0.02 -0.85 0.28 113.55 112.44 1by1 h SER 37 Ca -0.01 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1by1 h SER 37 Cb 0.51 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 1by1 h SER 37 CO -0.18 0.00 -0.18 0.74 -1.14 0.00 0.00 176.83 176.06 1by1 h THR 38 N 0.00 0.00 0.00 -2.27 2.02 0.12 -3.42 112.91 109.35 1by1 h THR 38 Ca 0.00 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.62 1by1 h THR 38 Cb 0.90 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 1by1 h THR 38 CO 0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89 1by1 n TYR 39 N -4.92 0.00 0.07 3.16 0.18 -0.48 -4.77 117.16 110.40 1by1 n TYR 39 Ca -0.06 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.62 1by1 n TYR 39 Cb 0.20 0.00 -0.13 0.00 -0.38 0.00 0.00 39.34 39.04 1by1 n TYR 39 CO 0.00 0.00 0.00 1.25 -2.08 0.00 0.00 176.86 176.03 1by1 h LEU 40 N 0.00 0.12 -0.85 -3.48 5.85 -0.31 -3.35 115.31 113.28 1by1 h LEU 40 Ca 0.00 -0.13 0.13 0.00 0.84 0.00 0.00 57.88 58.72 1by1 h LEU 40 Cb 0.08 -0.04 -0.14 0.00 0.37 0.00 0.00 40.66 40.94 1by1 h LEU 40 CO 0.00 1.10 -0.41 0.03 -0.34 0.00 0.00 178.44 178.82 1by1 h ARG 41 N 0.02 -0.07 -0.71 1.25 2.47 -0.69 0.48 114.38 117.14 1by1 h ARG 41 Ca -0.04 0.00 0.21 0.00 -1.26 0.00 0.00 59.98 58.89 1by1 h ARG 41 Cb 1.83 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 30.13 1by1 h ARG 41 CO 0.15 -0.04 0.84 -1.35 0.56 0.00 0.00 179.97 180.13 1by1 h PRO 42 N -0.07 0.00 -0.10 0.04 0.11 -1.88 0.70 132.00 130.80 1by1 h PRO 42 Ca 0.28 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.42 1by1 h PRO 42 Cb 0.56 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.67 1by1 h PRO 42 CO -0.88 0.00 0.37 1.25 -0.21 0.00 0.00 178.00 178.53 1by1 h LEU 43 N 0.00 0.00 -1.73 2.35 5.85 -0.26 -1.94 115.31 119.58 1by1 h LEU 43 Ca 0.34 0.00 0.08 0.00 0.84 0.00 0.00 57.88 59.14 1by1 h LEU 43 Cb 2.02 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 43.04 1by1 h LEU 43 CO -0.00 0.00 0.53 1.56 -0.34 0.00 0.00 178.44 180.19 1by1 h GLN 44 N 0.00 0.00 0.00 1.25 4.20 -1.03 0.51 115.11 120.04 1by1 h GLN 44 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1by1 h GLN 44 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1by1 h GLN 44 CO -0.00 0.00 -1.07 2.41 -0.67 0.00 0.00 178.83 179.50 1by1 n THR 45 N -3.27 0.33 0.50 -0.54 -1.04 -0.73 -3.89 114.28 105.65 1by1 n THR 45 Ca 0.05 -0.38 0.12 0.00 -2.04 0.00 0.00 64.05 61.80 1by1 n THR 45 Cb 0.66 -0.05 0.18 0.00 -1.82 0.00 0.00 70.33 69.29 1by1 n THR 45 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1by1 h SER 46 N 0.00 0.00 -3.78 8.00 0.02 -0.17 -3.49 113.55 114.13 1by1 h SER 46 Ca 0.00 -0.15 -0.13 0.00 -0.84 0.00 0.00 61.79 60.67 1by1 h SER 46 Cb 0.86 0.00 0.08 0.00 0.14 0.00 0.00 62.40 63.48 1by1 h SER 46 CO 0.00 0.07 -0.35 -0.62 -1.14 0.00 0.00 176.83 174.79 1by1 n GLU 47 N -2.25 -2.19 -1.95 3.45 -0.58 -0.92 -3.02 120.64 113.18 1by1 n GLU 47 Ca 0.03 0.38 -0.15 0.00 -0.42 0.00 0.00 57.16 57.00 1by1 n GLU 47 Cb 0.46 -3.76 -0.04 0.00 -0.57 0.00 0.00 31.44 27.53 1by1 n GLU 47 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1by1 n LYS 48 N -2.33 -1.70 -2.74 3.49 4.76 -1.25 -2.45 118.16 115.93 1by1 n LYS 48 Ca -0.09 0.81 -0.01 0.00 -2.87 0.00 0.00 58.31 56.15 1by1 n LYS 48 Cb 0.57 -5.26 0.00 0.00 -1.84 0.00 0.00 35.03 28.50 1by1 n LYS 48 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1by1 n LEU 49 N -2.45 -6.07 0.00 -0.35 4.77 -1.17 -4.57 117.00 107.16 1by1 n LEU 49 Ca -0.17 0.02 -0.05 0.00 -0.03 0.00 0.00 56.01 55.79 1by1 n LEU 49 Cb 0.57 -2.90 0.05 0.00 -2.33 0.00 0.00 43.42 38.80 1by1 n LEU 49 CO 0.22 -1.08 0.05 -1.20 -1.33 0.00 0.00 177.39 174.05 1by1 n SER 50 N -1.42 -1.79 -0.06 -1.43 7.64 -1.03 -3.22 113.62 112.31 1by1 n SER 50 Ca 0.02 -0.14 -0.01 0.00 1.01 0.00 0.00 58.87 59.76 1by1 n SER 50 Cb 0.48 -0.20 -0.00 0.00 -1.01 0.00 0.00 64.21 63.48 1by1 n SER 50 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1by1 n SER 51 N -2.11 -1.23 -1.23 6.43 7.64 -1.26 -3.47 113.62 118.38 1by1 n SER 51 Ca 0.02 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.76 1by1 n SER 51 Cb 0.09 -0.61 -0.05 0.00 -1.01 0.00 0.00 64.21 62.63 1by1 n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1by1 n ALA 52 N -0.91 -0.27 0.28 -0.43 0.00 -1.26 -4.87 120.51 113.05 1by1 n ALA 52 Ca -0.01 0.20 0.16 0.00 0.00 0.00 0.00 53.44 53.80 1by1 n ALA 52 Cb 0.48 -1.59 0.79 0.00 0.00 0.00 0.00 19.45 19.12 1by1 n ALA 52 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1by1 h ASN 53 N 0.00 0.00 -0.51 0.00 -0.73 -1.58 -2.96 115.58 109.80 1by1 h ASN 53 Ca -0.31 0.00 0.10 0.00 1.87 0.00 0.00 56.30 57.96 1by1 h ASN 53 Cb 1.01 0.00 -0.08 0.00 0.27 0.00 0.00 38.32 39.52 1by1 h ASN 53 CO 0.42 0.06 0.00 0.40 -0.37 0.00 0.00 177.43 177.95 1by1 h ILE 54 N 0.00 0.60 -0.15 2.57 1.08 -1.81 0.29 117.51 120.09 1by1 h ILE 54 Ca -0.00 -0.04 0.04 0.00 -0.39 0.00 0.00 64.86 64.47 1by1 h ILE 54 Cb 0.37 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 34.59 1by1 h ILE 54 CO 0.01 0.02 0.33 0.28 -0.69 0.00 0.00 178.15 178.10 1by1 h SER 55 N 0.12 0.00 0.00 1.72 0.02 -1.92 0.75 113.55 114.24 1by1 h SER 55 Ca 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1by1 h SER 55 Cb 0.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.93 1by1 h SER 55 CO -0.42 0.00 0.00 -1.22 -1.14 0.00 0.00 176.83 174.05 1by1 n TYR 56 N -3.26 0.00 -0.02 3.45 4.01 0.98 -4.87 117.16 117.45 1by1 n TYR 56 Ca 0.01 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.74 1by1 n TYR 56 Cb 0.43 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.46 1by1 n TYR 56 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1by1 n LEU 57 N 0.00 0.37 -0.35 7.72 0.00 -1.08 -4.59 117.00 119.08 1by1 n LEU 57 Ca 0.00 0.28 0.08 0.00 0.00 0.00 0.00 56.01 56.36 1by1 n LEU 57 Cb 0.00 -0.57 0.17 0.00 0.00 0.00 0.00 43.42 43.02 1by1 n LEU 57 CO 0.00 -0.49 0.70 0.24 0.00 0.00 0.00 177.39 177.84 1by1 h MET 58 N -0.20 0.00 -1.70 1.96 2.86 -1.71 0.34 114.93 116.47 1by1 h MET 58 Ca 0.00 -0.00 0.49 0.00 -2.06 0.00 0.00 59.70 58.13 1by1 h MET 58 Cb 0.12 -0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.71 1by1 h MET 58 CO 0.00 0.00 1.32 0.78 1.06 0.00 0.00 176.91 180.07 1by1 h GLY 59 N 0.00 0.00 0.00 8.32 0.00 0.33 1.31 103.07 113.04 1by1 h GLY 59 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.83 1by1 h GLY 59 CO -0.98 0.00 0.00 0.70 0.00 0.00 0.00 176.54 176.26 1by1 n ASN 60 N -3.82 0.00 -0.28 0.19 3.02 0.12 -3.77 115.26 110.71 1by1 n ASN 60 Ca 0.38 0.11 -0.03 0.00 -0.03 0.00 0.00 54.58 55.01 1by1 n ASN 60 Cb 1.84 -0.22 0.08 0.00 -0.61 0.00 0.00 39.78 40.86 1by1 n ASN 60 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1by1 h LEU 61 N 0.00 0.87 -1.03 3.41 5.85 -1.42 0.83 115.31 123.82 1by1 h LEU 61 Ca 0.00 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 1by1 h LEU 61 Cb 0.00 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 1by1 h LEU 61 CO 0.00 0.62 0.14 1.05 -0.34 0.00 0.00 178.44 179.90 1by1 h GLU 62 N 1.02 0.84 0.21 1.25 -0.00 0.15 -2.76 114.58 115.29 1by1 h GLU 62 Ca 0.30 -0.17 -0.34 0.00 -0.00 0.00 0.00 59.36 59.14 1by1 h GLU 62 Cb -0.07 -0.13 0.02 0.00 -0.00 0.00 0.00 28.75 28.57 1by1 h GLU 62 CO -0.08 0.75 -1.64 0.93 -0.00 0.00 0.00 179.01 178.96 1by1 h GLU 63 N 0.81 0.44 -0.20 1.06 5.08 -1.21 -3.29 114.58 117.27 1by1 h GLU 63 Ca 0.18 -0.75 0.06 0.00 -1.00 0.00 0.00 59.36 57.84 1by1 h GLU 63 Cb 0.29 0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 1by1 h GLU 63 CO -0.00 1.36 0.30 0.82 -1.00 0.00 0.00 179.01 180.48 1by1 h ILE 64 N 0.12 0.30 -0.40 3.13 2.04 0.76 -1.11 117.51 122.35 1by1 h ILE 64 Ca -0.31 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.63 1by1 h ILE 64 Cb 2.12 0.75 -0.08 0.00 -0.74 0.00 0.00 36.82 38.87 1by1 h ILE 64 CO 0.21 0.00 -0.11 0.00 0.00 0.00 0.00 178.15 178.25 1by1 h SER 66 N -0.02 0.81 0.72 0.00 0.02 -1.43 -3.04 113.55 110.61 1by1 h SER 66 Ca 0.19 -0.28 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1by1 h SER 66 Cb 0.31 -0.22 0.01 0.00 0.14 0.00 0.00 62.40 62.64 1by1 h SER 66 CO -0.42 0.99 -0.34 0.15 -1.14 0.00 0.00 176.83 176.06 1by1 h PHE 67 N 0.70 -0.89 -1.29 3.45 3.04 -0.98 -2.69 116.94 118.28 1by1 h PHE 67 Ca 0.10 -0.02 0.41 0.00 3.98 0.00 0.00 57.97 62.44 1by1 h PHE 67 Cb 0.70 0.29 -0.12 0.00 2.56 0.00 0.00 35.95 39.39 1by1 h PHE 67 CO 0.04 -0.53 0.84 0.37 -2.02 0.00 0.00 178.31 177.01 1by1 h GLN 68 N -1.16 0.13 -0.08 1.11 -0.00 0.15 1.56 115.11 116.82 1by1 h GLN 68 Ca -0.10 -0.01 -0.06 0.00 -0.00 0.00 0.00 58.65 58.49 1by1 h GLN 68 Cb 0.76 -0.03 0.00 0.00 0.00 0.00 0.00 27.48 28.21 1by1 h GLN 68 CO 0.16 0.09 -0.17 1.96 0.00 0.00 0.00 178.83 180.87 1by1 h GLN 69 N 0.13 0.26 0.01 1.69 1.08 -1.40 -3.29 115.11 113.59 1by1 h GLN 69 Ca 0.77 -0.17 -0.22 0.00 -1.45 0.00 0.00 58.65 57.58 1by1 h GLN 69 Cb 2.42 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 29.84 1by1 h GLN 69 CO -0.36 0.77 -1.09 0.52 -0.95 0.00 0.00 178.83 177.72 1by1 h MET 70 N -0.21 0.02 -0.79 1.46 0.00 -0.35 -3.13 114.93 111.93 1by1 h MET 70 Ca 0.00 -0.04 0.07 0.00 0.00 0.00 0.00 59.70 59.74 1by1 h MET 70 Cb 0.76 0.01 -0.09 0.00 0.00 0.00 0.00 31.60 32.28 1by1 h MET 70 CO 0.04 0.97 -0.47 -0.11 0.00 0.00 0.00 176.91 177.34 1by1 n LEU 71 N -3.33 -0.84 0.01 1.22 -0.00 0.50 0.15 117.00 114.72 1by1 n LEU 71 Ca -0.02 1.49 -0.21 0.00 -0.00 0.00 0.00 56.01 57.27 1by1 n LEU 71 Cb 0.96 -0.23 -0.14 0.00 -0.00 0.00 0.00 43.42 44.01 1by1 n LEU 71 CO 0.47 -1.19 -0.75 0.58 -0.00 0.00 0.00 177.39 176.51 1by1 h VAL 72 N 0.00 0.69 0.00 1.96 2.07 -1.73 -3.36 116.25 115.87 1by1 h VAL 72 Ca 0.13 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 65.25 1by1 h VAL 72 Cb 0.32 2.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1by1 h VAL 72 CO -0.74 0.87 0.00 1.56 0.02 0.00 0.00 177.57 179.28 1by1 h GLN 73 N 0.07 0.00 0.00 1.57 1.08 -1.42 -2.21 115.11 114.20 1by1 h GLN 73 Ca -0.40 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 56.79 1by1 h GLN 73 Cb 2.04 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 29.47 1by1 h GLN 73 CO 0.10 0.00 -0.21 1.03 -0.95 0.00 0.00 178.83 178.80 1by1 h SER 74 N 0.00 0.00 0.02 1.46 0.87 0.12 -3.24 113.55 112.78 1by1 h SER 74 Ca 0.00 -0.03 -0.20 0.00 -1.23 0.00 0.00 61.79 60.32 1by1 h SER 74 Cb 0.49 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 1by1 h SER 74 CO 0.00 0.62 -0.73 0.17 -0.53 0.00 0.00 176.83 176.36 1by1 h LEU 75 N -1.00 0.74 -0.19 2.23 8.10 -1.71 -3.30 115.31 120.18 1by1 h LEU 75 Ca -0.01 -0.48 -0.04 0.00 0.11 0.00 0.00 57.88 57.46 1by1 h LEU 75 Cb 0.24 -0.22 -0.01 0.00 -0.44 0.00 0.00 40.66 40.23 1by1 h LEU 75 CO -0.00 1.25 -0.05 -0.33 -4.11 0.00 0.00 178.44 175.19 1by1 h GLU 76 N 0.43 0.37 -0.56 0.17 4.39 -1.62 -2.75 114.58 115.02 1by1 h GLU 76 Ca -0.04 -0.14 0.16 0.00 0.34 0.00 0.00 59.36 59.68 1by1 h GLU 76 Cb 1.34 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.94 1by1 h GLU 76 CO 0.14 0.63 0.58 0.93 -1.16 0.00 0.00 179.01 180.13 1by1 h GLU 77 N 0.09 0.00 0.00 2.33 5.08 -1.63 0.34 114.58 120.79 1by1 h GLU 77 Ca 0.05 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 1by1 h GLU 77 Cb 0.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1by1 h GLU 77 CO 0.02 0.00 -0.53 0.00 -1.00 0.00 0.00 179.01 177.50 1by1 h THR 79 N -1.00 0.80 -0.29 0.00 1.35 -1.05 -2.83 112.91 109.90 1by1 h THR 79 Ca -0.13 0.00 0.05 0.00 -0.55 0.00 0.00 66.41 65.78 1by1 h THR 79 Cb 0.97 0.80 -0.08 0.00 -1.73 0.00 0.00 68.15 68.12 1by1 h THR 79 CO -0.08 0.00 -0.49 0.11 -0.25 0.00 0.00 175.52 174.81 1by1 h LYS 80 N -0.09 -0.43 -7.18 4.72 6.56 -0.53 -3.12 116.57 116.50 1by1 h LYS 80 Ca 0.05 0.03 -0.52 0.00 -1.06 0.00 0.00 60.65 59.15 1by1 h LYS 80 Cb 0.16 0.10 0.12 0.00 -0.57 0.00 0.00 32.23 32.04 1by1 h LYS 80 CO -0.12 -0.29 0.39 -0.48 -2.06 0.00 0.00 179.45 176.89 1by1 s LEU 81 N -10.39 3.40 -0.12 2.94 0.05 -1.07 -4.59 118.68 108.91 1by1 s LEU 81 Ca -0.15 2.15 -0.01 0.00 0.05 0.00 0.00 54.13 56.17 1by1 s LEU 81 Cb 0.09 -4.57 -0.04 0.00 -2.05 0.00 0.00 46.19 39.62 1by1 s LEU 81 CO 0.63 -1.81 0.66 -2.65 -0.55 0.00 0.00 176.35 172.63 1by1 n PRO 82 N -2.40 0.00 -1.54 1.48 -0.02 -1.26 -4.73 135.00 126.54 1by1 n PRO 82 Ca 0.12 0.00 -0.51 0.00 -2.02 0.00 0.00 63.50 61.08 1by1 n PRO 82 Cb 0.51 -0.52 -0.05 0.00 -0.02 0.00 0.00 33.50 33.42 1by1 n PRO 82 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1by1 n GLU 83 N 2.46 0.78 -0.05 -0.52 0.28 -1.18 -4.90 120.64 117.51 1by1 n GLU 83 Ca 0.08 0.28 -0.15 0.00 -0.16 0.00 0.00 57.16 57.21 1by1 n GLU 83 Cb 0.22 -1.73 -0.13 0.00 1.43 0.00 0.00 31.44 31.23 1by1 n GLU 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1by1 h ALA 84 N 3.14 -0.01 0.00 -1.84 0.00 -1.84 -3.44 119.26 115.27 1by1 h ALA 84 Ca -0.43 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 53.96 1by1 h ALA 84 Cb 1.37 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1by1 h ALA 84 CO 0.68 0.05 -0.01 1.04 0.00 0.00 0.00 179.25 181.01 1by1 n GLN 85 N -4.54 0.00 -3.47 0.00 6.02 -1.26 -5.07 117.38 109.06 1by1 n GLN 85 Ca -0.10 -0.03 -0.30 0.00 -0.01 0.00 0.00 57.00 56.55 1by1 n GLN 85 Cb 0.52 -0.01 0.02 0.00 1.02 0.00 0.00 30.24 31.79 1by1 n GLN 85 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1by1 n GLN 86 N 0.00 -1.88 -3.87 -1.09 6.02 -1.26 -4.93 117.38 110.37 1by1 n GLN 86 Ca 0.00 1.37 -0.28 0.00 -0.01 0.00 0.00 57.00 58.08 1by1 n GLN 86 Cb 0.51 -2.73 -0.12 0.00 1.02 0.00 0.00 30.24 28.92 1by1 n GLN 86 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1by1 s ARG 87 N -3.07 2.36 0.34 -1.09 1.70 -1.26 -4.43 118.95 113.51 1by1 s ARG 87 Ca 0.26 -3.26 0.03 0.00 -0.47 0.00 0.00 55.73 52.30 1by1 s ARG 87 Cb -0.03 -3.30 0.65 0.00 -0.57 0.00 0.00 34.95 31.70 1by1 s ARG 87 CO 0.86 -1.29 1.97 0.28 -1.08 0.00 0.00 175.30 176.04 1by1 h VAL 88 N 4.43 1.09 0.59 4.99 2.07 -1.94 -2.88 116.25 124.60 1by1 h VAL 88 Ca 0.15 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1by1 h VAL 88 Cb 0.77 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1by1 h VAL 88 CO 0.70 0.16 -0.50 1.23 0.02 0.00 0.00 177.57 179.18 1by1 h GLY 89 N 0.86 -1.29 -0.52 2.17 0.00 -1.92 0.24 103.07 102.62 1by1 h GLY 89 Ca 0.30 0.58 0.33 0.00 0.00 0.00 0.00 47.33 48.54 1by1 h GLY 89 CO -0.09 -0.40 0.71 -1.33 0.00 0.00 0.00 176.54 175.43 1by1 h GLY 90 N -1.06 1.40 0.14 4.60 0.00 -1.89 1.13 103.07 107.40 1by1 h GLY 90 Ca -0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 1by1 h GLY 90 CO -0.01 -0.28 -0.05 0.00 0.00 0.00 0.00 176.54 176.19 1by1 h PHE 92 N -0.99 0.00 0.00 0.00 0.04 0.48 0.18 116.94 116.64 1by1 h PHE 92 Ca -0.01 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.70 1by1 h PHE 92 Cb 0.36 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 1by1 h PHE 92 CO 0.07 0.00 -0.27 -0.07 -0.60 0.00 0.00 178.31 177.44 1by1 h LEU 93 N 0.00 0.00 -0.11 1.54 4.07 0.12 -2.09 115.31 118.83 1by1 h LEU 93 Ca 0.11 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 57.91 1by1 h LEU 93 Cb 0.56 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.28 1by1 h LEU 93 CO -0.00 0.27 -0.75 -1.13 -1.08 0.00 0.00 178.44 175.74 1by1 h ASN 94 N 0.00 0.00 0.25 -0.43 -0.73 -0.67 -3.15 115.58 110.85 1by1 h ASN 94 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1by1 h ASN 94 Cb 0.59 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.18 1by1 h ASN 94 CO 0.03 0.75 -0.22 -0.11 -0.37 0.00 0.00 177.43 177.52 1by1 n LEU 95 N -3.35 0.94 0.04 0.34 -0.00 -0.98 -4.25 117.00 109.75 1by1 n LEU 95 Ca 0.01 -0.22 -0.11 0.00 -0.00 0.00 0.00 56.01 55.69 1by1 n LEU 95 Cb 0.82 -0.13 -0.04 0.00 -0.00 0.00 0.00 43.42 44.06 1by1 n LEU 95 CO 0.44 0.18 0.78 0.24 -0.00 0.00 0.00 177.39 179.02 1by1 h MET 96 N 1.14 -0.20 -0.88 1.96 2.86 -1.34 0.27 114.93 118.74 1by1 h MET 96 Ca 0.00 0.01 0.20 0.00 -2.06 0.00 0.00 59.70 57.85 1by1 h MET 96 Cb 0.48 0.04 -0.16 0.00 0.06 0.00 0.00 31.60 32.02 1by1 h MET 96 CO 0.00 -0.13 -0.11 -1.35 1.06 0.00 0.00 176.91 176.38 1by1 h PRO 97 N -0.20 0.03 0.16 -0.22 0.11 -1.79 1.17 132.00 131.25 1by1 h PRO 97 Ca 0.06 -0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.92 1by1 h PRO 97 Cb 0.28 -0.01 0.02 0.00 0.11 0.00 0.00 31.00 31.40 1by1 h PRO 97 CO -0.15 0.02 -1.14 1.96 -0.21 0.00 0.00 178.00 178.48 1by1 h GLN 98 N 0.03 0.33 -0.36 1.05 4.20 -1.80 -3.23 115.11 115.33 1by1 h GLN 98 Ca 0.46 -0.57 0.02 0.00 0.06 0.00 0.00 58.65 58.63 1by1 h GLN 98 Cb 0.81 0.21 -0.03 0.00 0.30 0.00 0.00 27.48 28.77 1by1 h GLN 98 CO -0.85 1.27 0.18 1.98 -0.67 0.00 0.00 178.83 180.74 1by1 h MET 99 N -0.24 0.37 -0.81 1.46 4.05 0.52 -1.95 114.93 118.32 1by1 h MET 99 Ca -0.22 -0.02 0.04 0.00 -0.28 0.00 0.00 59.70 59.22 1by1 h MET 99 Cb 1.79 -0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 32.45 1by1 h MET 99 CO 0.15 0.24 0.51 -0.22 0.23 0.00 0.00 176.91 177.82 1by1 h LYS 100 N 0.38 0.95 -0.78 0.39 3.64 0.12 1.09 116.57 122.35 1by1 h LYS 100 Ca 0.15 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.44 1by1 h LYS 100 Cb 0.05 -0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 31.62 1by1 h LYS 100 CO -0.10 0.63 0.37 1.15 -2.27 0.00 0.00 179.45 179.23 1by1 h THR 101 N 0.98 1.25 0.01 1.00 2.02 -1.46 -2.99 112.91 113.72 1by1 h THR 101 Ca 0.33 -0.70 -0.15 0.00 0.77 0.00 0.00 66.41 66.66 1by1 h THR 101 Cb 0.06 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.70 1by1 h THR 101 CO -0.13 0.30 -0.83 -0.07 0.37 0.00 0.00 175.52 175.15 1by1 h LEU 102 N 1.12 0.03 -0.04 2.58 3.38 -0.68 -3.21 115.31 118.48 1by1 h LEU 102 Ca 0.27 -0.71 0.01 0.00 0.09 0.00 0.00 57.88 57.54 1by1 h LEU 102 Cb 0.12 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1by1 h LEU 102 CO -0.03 1.33 -0.06 1.88 0.09 0.00 0.00 178.44 181.64 1by1 h TYR 103 N -0.95 -0.19 -0.56 1.13 -1.99 0.11 0.80 116.97 115.33 1by1 h TYR 103 Ca -0.22 0.01 0.09 0.00 2.00 0.00 0.00 58.73 60.61 1by1 h TYR 103 Cb 1.23 0.09 -0.07 0.00 2.00 0.00 0.00 36.73 39.98 1by1 h TYR 103 CO 0.16 -0.06 0.15 -0.07 -0.00 0.00 0.00 178.16 178.35 1by1 h LEU 104 N -0.05 0.08 -0.95 3.88 4.07 -1.73 -0.41 115.31 120.21 1by1 h LEU 104 Ca 0.01 0.09 0.09 0.00 0.08 0.00 0.00 57.88 58.14 1by1 h LEU 104 Cb 0.07 0.10 -0.07 0.00 1.08 0.00 0.00 40.66 41.84 1by1 h LEU 104 CO -0.07 0.06 0.59 0.74 -1.08 0.00 0.00 178.44 178.69 1by1 h THR 105 N 0.30 1.00 -0.85 0.22 2.02 -1.41 -1.38 112.91 112.82 1by1 h THR 105 Ca 0.28 -0.35 0.08 0.00 0.77 0.00 0.00 66.41 67.19 1by1 h THR 105 Cb 0.37 -0.11 -0.07 0.00 -1.74 0.00 0.00 68.15 66.61 1by1 h THR 105 CO -0.33 0.19 0.51 0.22 0.37 0.00 0.00 175.52 176.47 1by1 h TYR 106 N 1.02 0.93 -0.74 3.16 3.20 0.23 0.17 116.97 124.95 1by1 h TYR 106 Ca 0.44 0.03 0.08 0.00 3.14 0.00 0.00 58.73 62.41 1by1 h TYR 106 Cb 0.30 -0.29 -0.06 0.00 1.54 0.00 0.00 36.73 38.21 1by1 h TYR 106 CO -0.02 0.43 0.41 0.00 -1.64 0.00 0.00 178.16 177.34 1by1 h ALA 108 N 1.40 1.00 0.00 0.00 0.00 -1.16 -3.13 119.26 117.37 1by1 h ALA 108 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1by1 h ALA 108 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1by1 h ALA 108 CO -0.22 0.00 -0.24 -0.97 0.00 0.00 0.00 179.25 177.82 1by1 h ASN 109 N 0.00 0.00 0.01 0.00 -0.00 0.13 -3.34 115.58 112.38 1by1 h ASN 109 Ca 0.00 -0.07 0.02 0.00 -0.00 0.00 0.00 56.30 56.25 1by1 h ASN 109 Cb 0.84 0.00 -0.05 0.00 -0.00 0.00 0.00 38.32 39.12 1by1 h ASN 109 CO 0.00 0.03 -0.46 0.45 -0.00 0.00 0.00 177.43 177.46 1by1 h HIS 110 N 0.00 -1.34 -0.55 0.67 3.86 -1.11 1.24 115.15 117.92 1by1 h HIS 110 Ca 0.00 0.04 -0.10 0.00 -1.16 0.00 0.00 60.37 59.16 1by1 h HIS 110 Cb 0.78 0.58 -0.02 0.00 1.06 0.00 0.00 27.41 29.81 1by1 h HIS 110 CO 0.00 -0.49 -0.04 -1.00 0.86 0.00 0.00 177.93 177.27 1by1 h PRO 111 N -0.58 0.97 -0.50 2.45 0.13 -1.80 -3.06 132.00 129.61 1by1 h PRO 111 Ca 0.01 -0.31 -0.06 0.00 -0.87 0.00 0.00 66.00 64.77 1by1 h PRO 111 Cb 0.61 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.64 1by1 h PRO 111 CO -0.30 0.98 0.07 0.77 -0.23 0.00 0.00 178.00 179.29 1by1 h SER 112 N 0.88 0.80 0.01 1.44 0.02 -1.60 -2.79 113.55 112.32 1by1 h SER 112 Ca 0.15 -0.26 0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1by1 h SER 112 Cb 0.57 -0.21 -0.06 0.00 0.14 0.00 0.00 62.40 62.84 1by1 h SER 112 CO 0.03 0.86 -0.48 0.00 -1.14 0.00 0.00 176.83 176.10 1by1 h ALA 113 N 0.97 -0.83 -0.38 3.77 0.00 0.16 0.54 119.26 123.49 1by1 h ALA 113 Ca 0.15 -0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.10 1by1 h ALA 113 Cb 0.41 0.86 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1by1 h ALA 113 CO 0.01 -1.05 0.30 0.28 0.00 0.00 0.00 179.25 178.80 1by1 h VAL 114 N -0.64 0.70 0.01 0.00 2.07 -1.53 -1.55 116.25 115.31 1by1 h VAL 114 Ca 0.03 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.49 1by1 h VAL 114 Cb 0.70 0.79 0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1by1 h VAL 114 CO -0.34 0.00 -0.24 -1.13 0.02 0.00 0.00 177.57 175.88 1by1 h ASN 115 N 0.00 0.20 -0.75 0.57 -0.73 -0.59 -2.68 115.58 111.59 1by1 h ASN 115 Ca 0.18 -0.82 0.06 0.00 1.87 0.00 0.00 56.30 57.59 1by1 h ASN 115 Cb 0.78 -0.06 -0.05 0.00 0.27 0.00 0.00 38.32 39.26 1by1 h ASN 115 CO -0.00 0.99 0.50 0.58 -0.37 0.00 0.00 177.43 179.12 1by1 h VAL 116 N -0.57 1.04 0.09 2.57 2.07 0.71 -0.31 116.25 121.86 1by1 h VAL 116 Ca -0.03 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 1by1 h VAL 116 Cb 1.04 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1by1 h VAL 116 CO 0.05 0.15 -0.04 -0.07 0.02 0.00 0.00 177.57 177.68 1by1 h LEU 117 N 0.82 -0.10 -1.76 2.57 3.38 -1.37 1.04 115.31 119.88 1by1 h LEU 117 Ca 0.32 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.50 1by1 h LEU 117 Cb 0.21 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1by1 h LEU 117 CO -0.11 -0.04 0.71 0.74 0.09 0.00 0.00 178.44 179.84 1by1 h THR 118 N -0.19 0.28 0.00 0.22 2.02 -1.47 1.53 112.91 115.31 1by1 h THR 118 Ca -0.01 0.00 -0.23 0.00 0.77 0.00 0.00 66.41 66.94 1by1 h THR 118 Cb 0.09 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 66.91 1by1 h THR 118 CO 0.02 0.00 -1.43 -0.33 0.37 0.00 0.00 175.52 174.15 1by1 h GLU 119 N 0.00 0.00 -0.39 6.66 4.39 -1.01 -3.35 114.58 120.89 1by1 h GLU 119 Ca 0.34 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.82 1by1 h GLU 119 Cb 1.75 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 30.27 1by1 h GLU 119 CO -0.00 0.48 -0.12 0.72 -1.16 0.00 0.00 179.01 178.93 1by1 n HIS 120 N -3.04 1.23 0.03 4.33 8.25 0.43 -4.68 115.22 121.77 1by1 n HIS 120 Ca -0.11 -1.71 0.07 0.00 -0.26 0.00 0.00 57.72 55.72 1by1 n HIS 120 Cb 0.94 -0.51 0.50 0.00 1.12 0.00 0.00 29.99 32.04 1by1 n HIS 120 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1by1 h SER 121 N 1.11 0.34 0.28 0.41 0.87 0.10 -0.40 113.55 116.26 1by1 h SER 121 Ca 0.24 -0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.46 1by1 h SER 121 Cb 1.61 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 63.47 1by1 h SER 121 CO 0.44 0.23 -1.83 -0.33 -0.53 0.00 0.00 176.83 174.82 1by1 h GLU 122 N 0.39 0.21 0.79 2.24 5.08 -1.84 -2.94 114.58 118.51 1by1 h GLU 122 Ca 0.15 -0.36 -0.04 0.00 -1.00 0.00 0.00 59.36 58.11 1by1 h GLU 122 Cb 0.13 0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.52 1by1 h GLU 122 CO -0.04 1.04 -0.38 0.93 -1.00 0.00 0.00 179.01 179.57 1by1 h GLU 123 N 0.06 -1.02 -0.75 2.33 4.39 -1.79 0.88 114.58 118.68 1by1 h GLU 123 Ca -0.35 0.07 -0.04 0.00 0.34 0.00 0.00 59.36 59.38 1by1 h GLU 123 Cb 2.03 0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 30.88 1by1 h GLU 123 CO 0.11 -0.67 0.32 -0.07 -1.16 0.00 0.00 179.01 177.54 1by1 h LEU 124 N -1.23 1.01 -1.63 1.33 4.07 -1.28 -2.13 115.31 115.45 1by1 h LEU 124 Ca -0.11 -0.16 0.00 0.00 0.08 0.00 0.00 57.88 57.69 1by1 h LEU 124 Cb 0.82 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.30 1by1 h LEU 124 CO 0.18 0.89 0.00 1.23 -1.08 0.00 0.00 178.44 179.66 1by1 h GLY 125 N 1.07 0.00 0.46 0.83 0.00 -1.52 -2.75 103.07 101.16 1by1 h GLY 125 Ca 0.25 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.53 1by1 h GLY 125 CO -0.02 0.00 -0.20 0.83 0.00 0.00 0.00 176.54 177.15 1by1 h GLU 126 N 0.00 0.16 -0.21 4.80 4.39 -0.12 -3.18 114.58 120.43 1by1 h GLU 126 Ca 0.00 -0.15 -0.11 0.00 0.34 0.00 0.00 59.36 59.44 1by1 h GLU 126 Cb 0.43 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1by1 h GLU 126 CO 0.00 0.86 -0.33 0.27 -1.16 0.00 0.00 179.01 178.65 1by1 h PHE 127 N -0.48 0.49 0.00 4.33 -5.15 -1.46 -2.49 116.94 112.18 1by1 h PHE 127 Ca -0.02 -0.12 0.00 0.00 -0.20 0.00 0.00 57.97 57.63 1by1 h PHE 127 Cb 0.92 -0.11 0.00 0.00 0.22 0.00 0.00 35.95 36.97 1by1 h PHE 127 CO 0.17 0.71 0.00 0.00 -2.00 0.00 0.00 178.31 177.19 1by1 n MET 128 N -4.07 0.41 0.18 6.09 0.00 -1.05 -3.40 117.12 115.28 1by1 n MET 128 Ca -0.01 0.06 0.12 0.00 0.00 0.00 0.00 57.70 57.87 1by1 n MET 128 Cb 0.45 -1.50 0.64 0.00 0.00 0.00 0.00 33.22 32.81 1by1 n MET 128 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 1by1 h GLU 129 N 0.00 0.00 -0.78 3.17 4.39 -1.42 -1.37 114.58 118.57 1by1 h GLU 129 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1by1 h GLU 129 Cb 0.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1by1 h GLU 129 CO 0.00 0.00 0.00 -2.37 -1.16 0.00 0.00 179.01 175.48 1by1 n THR 130 N -2.32 1.27 0.10 1.13 5.66 -1.22 -4.41 114.28 114.50 1by1 n THR 130 Ca -0.02 -0.65 0.00 0.00 -3.05 0.00 0.00 64.05 60.33 1by1 n THR 130 Cb 0.04 -0.37 0.00 0.00 -1.55 0.00 0.00 70.33 68.45 1by1 n THR 130 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1by1 n LYS 131 N 0.31 0.00 0.00 1.09 3.00 -0.54 -5.02 118.16 116.99 1by1 n LYS 131 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.44 1by1 n LYS 131 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.71 1by1 n LYS 131 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1by1 n GLY 132 N 0.71 0.98 5.03 3.14 0.00 -1.04 -5.05 105.19 108.96 1by1 n GLY 132 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1by1 n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1by1 n ALA 133 N -0.51 -0.85 -0.30 4.61 0.00 -1.26 -4.73 120.51 117.47 1by1 n ALA 133 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1by1 n ALA 133 Cb 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.19 1by1 n ALA 133 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1by1 n SER 134 N -3.84 0.00 0.09 0.00 2.88 -1.26 -5.01 113.62 106.48 1by1 n SER 134 Ca 0.00 0.17 0.00 0.00 -1.33 0.00 0.00 58.87 57.71 1by1 n SER 134 Cb 0.09 -0.35 0.00 0.00 -0.75 0.00 0.00 64.21 63.20 1by1 n SER 134 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1by1 n SER 135 N -1.88 -0.76 -2.07 -3.46 7.64 -1.26 -4.92 113.62 106.90 1by1 n SER 135 Ca 0.00 0.33 -0.09 0.00 1.01 0.00 0.00 58.87 60.12 1by1 n SER 135 Cb 0.00 0.87 -0.13 0.00 -1.01 0.00 0.00 64.21 63.94 1by1 n SER 135 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1by1 n PRO 136 N -3.01 1.55 0.00 1.43 -0.02 -1.26 -4.92 135.00 128.77 1by1 n PRO 136 Ca 0.00 -0.75 0.00 0.00 -2.02 0.00 0.00 63.50 60.73 1by1 n PRO 136 Cb 0.00 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1by1 n PRO 136 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1by1 n GLY 137 N 2.55 2.83 0.02 -1.23 0.00 -1.26 -2.09 105.19 106.00 1by1 n GLY 137 Ca 0.32 0.31 0.01 0.00 0.00 0.00 0.00 46.02 46.66 1by1 n GLY 137 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1by1 n ILE 138 N 0.00 0.00 1.23 -0.61 3.06 -1.26 -4.32 119.36 117.46 1by1 n ILE 138 Ca 0.00 -0.48 0.12 0.00 -2.50 0.00 0.00 62.75 59.89 1by1 n ILE 138 Cb 0.00 1.01 0.63 0.00 0.54 0.00 0.00 39.64 41.82 1by1 n ILE 138 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 1by1 n LEU 139 N -0.63 0.00 -0.64 9.51 7.99 -0.89 -3.89 117.00 128.44 1by1 n LEU 139 Ca 0.00 0.19 0.50 0.00 -0.01 0.00 0.00 56.01 56.70 1by1 n LEU 139 Cb 0.03 -0.19 0.78 0.00 -0.11 0.00 0.00 43.42 43.93 1by1 n LEU 139 CO 0.02 -0.05 1.46 0.58 -1.51 0.00 0.00 177.39 177.90 1by1 h VAL 140 N 0.00 0.02 -0.98 4.08 2.07 -1.79 -1.60 116.25 118.05 1by1 h VAL 140 Ca 0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 1by1 h VAL 140 Cb 0.15 0.03 -0.16 0.00 -1.52 0.00 0.00 31.29 29.78 1by1 h VAL 140 CO 0.00 0.00 -0.37 0.18 0.02 0.00 0.00 177.57 177.40 1by1 n LEU 141 N -3.87 -0.61 0.00 2.57 4.32 -1.25 0.15 117.00 118.30 1by1 n LEU 141 Ca 0.42 1.70 0.00 0.00 -0.02 0.00 0.00 56.01 58.11 1by1 n LEU 141 Cb 1.94 -0.40 0.00 0.00 -1.62 0.00 0.00 43.42 43.34 1by1 n LEU 141 CO 0.42 -1.54 0.41 0.35 -1.22 0.00 0.00 177.39 175.82 1by1 n THR 142 N -5.45 0.00 -0.18 -5.08 -2.24 -0.60 0.47 114.28 101.19 1by1 n THR 142 Ca 0.10 1.33 -0.10 0.00 -2.27 0.00 0.00 64.05 63.11 1by1 n THR 142 Cb 0.40 -2.01 0.01 0.00 -2.10 0.00 0.00 70.33 66.63 1by1 n THR 142 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1by1 h THR 143 N 0.00 1.27 -0.58 4.28 1.35 -1.69 -1.46 112.91 116.09 1by1 h THR 143 Ca 0.00 -1.23 -0.00 0.00 -0.55 0.00 0.00 66.41 64.63 1by1 h THR 143 Cb 0.00 0.96 -0.03 0.00 -1.73 0.00 0.00 68.15 67.36 1by1 h THR 143 CO 0.00 0.43 0.36 1.23 -0.25 0.00 0.00 175.52 177.29 1by1 h GLY 144 N 0.87 0.83 -3.26 5.82 0.00 0.14 -2.77 103.07 104.71 1by1 h GLY 144 Ca 0.14 -0.33 -0.09 0.00 0.00 0.00 0.00 47.33 47.05 1by1 h GLY 144 CO 0.04 0.32 0.10 1.04 0.00 0.00 0.00 176.54 178.05 1by1 n LEU 145 N -4.65 5.56 0.00 3.11 4.77 0.18 -4.73 117.00 121.23 1by1 n LEU 145 Ca 0.04 -3.09 0.00 0.00 -0.03 0.00 0.00 56.01 52.93 1by1 n LEU 145 Cb 0.04 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 1by1 n LEU 145 CO 0.36 0.73 0.38 -0.24 -1.33 0.00 0.00 177.39 177.29 1by1 n SER 146 N 0.09 0.00 -4.48 -1.43 2.88 -0.55 -4.33 113.62 105.81 1by1 n SER 146 Ca 0.32 0.77 -0.43 0.00 -1.33 0.00 0.00 58.87 58.20 1by1 n SER 146 Cb 1.23 -0.27 -0.12 0.00 -0.75 0.00 0.00 64.21 64.30 1by1 n SER 146 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1by1 n LYS 147 N -1.82 0.24 0.00 -1.46 5.02 -1.26 -4.83 118.16 114.04 1by1 n LYS 147 Ca 0.00 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1by1 n LYS 147 Cb 0.00 -1.89 0.00 0.00 -0.02 0.00 0.00 35.03 33.12 1by1 n LYS 147 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1by1 n PRO 148 N 8.46 0.00 -0.38 1.97 -0.04 -1.26 -4.73 135.00 139.02 1by1 n PRO 148 Ca 0.58 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 64.15 1by1 n PRO 148 Cb 0.12 -0.21 0.31 0.00 -0.04 0.00 0.00 33.50 33.69 1by1 n PRO 148 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1by1 n PHE 149 N -0.79 0.98 0.27 0.54 -1.74 -1.26 -4.50 117.46 110.96 1by1 n PHE 149 Ca 0.00 -0.51 0.16 0.00 -0.56 0.00 0.00 57.45 56.54 1by1 n PHE 149 Cb 0.00 -0.02 0.78 0.00 1.52 0.00 0.00 39.48 41.76 1by1 n PHE 149 CO 0.00 0.00 0.00 1.98 -0.56 0.00 0.00 176.76 178.18 1by1 h MET 150 N 4.10 0.00 0.00 3.97 4.05 -1.95 0.59 114.93 125.68 1by1 h MET 150 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1by1 h MET 150 Cb 1.01 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.81 1by1 h MET 150 CO 0.02 0.00 -0.38 -0.09 0.23 0.00 0.00 176.91 176.69 1by1 h ARG 151 N 0.00 0.00 0.00 0.39 2.43 -1.93 -3.27 114.38 112.00 1by1 h ARG 151 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1by1 h ARG 151 Cb 0.80 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 1by1 h ARG 151 CO -0.00 0.00 -0.04 1.25 -1.51 0.00 0.00 179.97 179.67 1by1 h LEU 152 N 0.00 0.00 -1.81 3.80 5.85 -0.14 -3.21 115.31 119.79 1by1 h LEU 152 Ca 0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1by1 h LEU 152 Cb 0.75 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.78 1by1 h LEU 152 CO 0.00 0.00 0.00 -0.78 -0.34 0.00 0.00 178.44 177.32 1by1 h ASP 153 N 0.00 0.00 0.00 1.25 1.82 -1.61 -2.82 116.42 115.06 1by1 h ASP 153 Ca 0.00 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.55 1by1 h ASP 153 Cb 0.79 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.78 1by1 h ASP 153 CO 0.00 0.00 -1.62 0.29 -1.61 0.00 0.00 179.24 176.30 1by1 n LYS 154 N -2.79 1.27 -0.29 0.28 5.02 -1.22 -4.67 118.16 115.76 1by1 n LYS 154 Ca -0.01 -0.06 0.01 0.00 -2.02 0.00 0.00 58.31 56.23 1by1 n LYS 154 Cb 0.17 -1.27 0.07 0.00 -0.02 0.00 0.00 35.03 33.98 1by1 n LYS 154 CO 0.00 0.00 0.00 1.88 -0.52 0.00 0.00 177.40 178.76 1by1 h TYR 155 N 0.00 -0.67 -0.94 2.13 -1.99 -1.50 0.26 116.97 114.26 1by1 h TYR 155 Ca -0.14 0.08 0.27 0.00 2.00 0.00 0.00 58.73 60.94 1by1 h TYR 155 Cb 1.07 0.42 -0.04 0.00 2.00 0.00 0.00 36.73 40.18 1by1 h TYR 155 CO 0.00 -0.37 1.06 -1.35 -0.00 0.00 0.00 178.16 177.50 1by1 h PRO 156 N -0.04 0.00 -0.26 4.88 0.11 -1.83 0.39 132.00 135.25 1by1 h PRO 156 Ca 0.36 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.49 1by1 h PRO 156 Cb 0.60 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.68 1by1 h PRO 156 CO -0.85 0.00 0.11 1.15 -0.21 0.00 0.00 178.00 178.20 1by1 h THR 157 N 0.00 0.96 -0.08 -1.15 2.02 -0.80 0.81 112.91 114.68 1by1 h THR 157 Ca 0.45 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.54 1by1 h THR 157 Cb 2.56 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 69.67 1by1 h THR 157 CO -0.00 0.04 0.04 -0.07 0.37 0.00 0.00 175.52 175.90 1by1 h LEU 158 N 0.24 0.10 -2.38 2.58 3.38 -0.37 0.27 115.31 119.15 1by1 h LEU 158 Ca 0.11 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1by1 h LEU 158 Cb 0.06 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1by1 h LEU 158 CO -0.10 0.20 -0.02 -0.07 0.09 0.00 0.00 178.44 178.54 1by1 h LEU 159 N -0.01 0.00 0.00 1.67 3.38 -1.35 0.88 115.31 119.89 1by1 h LEU 159 Ca 0.03 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1by1 h LEU 159 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1by1 h LEU 159 CO -0.00 0.02 -0.72 1.17 0.09 0.00 0.00 178.44 179.00 1by1 n LYS 160 N -3.24 0.48 0.08 1.13 4.81 0.28 -4.08 118.16 117.61 1by1 n LYS 160 Ca -0.02 0.53 -0.23 0.00 -0.87 0.00 0.00 58.31 57.72 1by1 n LYS 160 Cb 0.16 -1.70 -0.15 0.00 0.02 0.00 0.00 35.03 33.36 1by1 n LYS 160 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1by1 h GLU 161 N -1.00 0.40 -0.16 1.64 5.08 -0.50 -3.29 114.58 116.75 1by1 h GLU 161 Ca -0.09 -0.68 -0.09 0.00 -1.00 0.00 0.00 59.36 57.50 1by1 h GLU 161 Cb 0.72 0.25 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 1by1 h GLU 161 CO -0.05 1.32 -0.30 1.25 -1.00 0.00 0.00 179.01 180.23 1by1 h LEU 162 N -0.05 0.32 -0.38 1.33 5.85 -0.93 -3.04 115.31 118.41 1by1 h LEU 162 Ca -0.28 -0.11 -0.10 0.00 0.84 0.00 0.00 57.88 58.23 1by1 h LEU 162 Cb 1.98 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.90 1by1 h LEU 162 CO 0.18 0.61 -0.49 -0.33 -0.34 0.00 0.00 178.44 178.07 1by1 h GLU 163 N 0.28 0.00 0.30 1.25 5.08 -1.68 -3.34 114.58 116.48 1by1 h GLU 163 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1by1 h GLU 163 Cb 0.67 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.89 1by1 h GLU 163 CO 0.05 0.49 -0.40 0.00 -1.00 0.00 0.00 179.01 178.15 1by1 h ARG 164 N 0.00 -0.72 -5.87 2.33 3.08 -1.59 -3.46 114.38 108.15 1by1 h ARG 164 Ca -0.00 0.05 -0.36 0.00 0.07 0.00 0.00 59.98 59.74 1by1 h ARG 164 Cb 1.22 0.16 0.13 0.00 0.08 0.00 0.00 29.97 31.56 1by1 h ARG 164 CO 0.06 -0.48 -0.87 1.58 -1.07 0.00 0.00 179.97 179.19 1by1 n HIS 165 N -5.48 -2.13 -2.14 3.04 -0.00 -1.25 -3.86 115.22 103.40 1by1 n HIS 165 Ca -0.09 0.74 -0.00 0.00 0.46 0.00 0.00 57.72 58.82 1by1 n HIS 165 Cb 0.39 -4.08 0.00 0.00 -0.12 0.00 0.00 29.99 26.18 1by1 n HIS 165 CO 0.00 0.00 0.00 -0.12 0.46 0.00 0.00 176.34 176.68 1by1 n MET 166 N -3.87 -0.59 -0.41 1.57 1.56 -1.26 -4.93 117.12 109.19 1by1 n MET 166 Ca -0.16 0.94 0.04 0.00 -0.27 0.00 0.00 57.70 58.25 1by1 n MET 166 Cb 0.63 -3.26 0.19 0.00 2.15 0.00 0.00 33.22 32.93 1by1 n MET 166 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 1by1 n GLU 167 N -1.23 2.77 0.01 2.12 -0.58 -1.25 -4.19 120.64 118.29 1by1 n GLU 167 Ca 0.00 -1.48 0.07 0.00 -0.42 0.00 0.00 57.16 55.33 1by1 n GLU 167 Cb 0.47 -1.81 0.30 0.00 -0.57 0.00 0.00 31.44 29.82 1by1 n GLU 167 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1by1 n ASP 168 N 0.32 0.05 -0.08 1.62 -0.08 -1.26 -1.95 116.55 115.16 1by1 n ASP 168 Ca 0.13 0.51 0.01 0.00 -1.51 0.00 0.00 54.79 53.94 1by1 n ASP 168 Cb 0.67 -0.52 0.03 0.00 2.34 0.00 0.00 41.12 43.63 1by1 n ASP 168 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1by1 n TYR 169 N -1.55 0.06 -3.02 -0.67 9.36 -1.26 -5.07 117.16 115.00 1by1 n TYR 169 Ca 0.03 -0.54 -0.01 0.00 3.32 0.00 0.00 57.90 60.71 1by1 n TYR 169 Cb 0.16 -0.06 -0.01 0.00 -0.63 0.00 0.00 39.34 38.80 1by1 n TYR 169 CO 0.00 0.00 0.00 -2.39 0.22 0.00 0.00 176.86 174.69 1by1 n HIS 170 N -0.45 -0.76 -3.65 2.98 1.44 -0.82 -5.04 115.22 108.92 1by1 n HIS 170 Ca 0.03 0.43 -0.02 0.00 -2.01 0.00 0.00 57.72 56.14 1by1 n HIS 170 Cb 0.30 -1.51 -0.07 0.00 0.12 0.00 0.00 29.99 28.84 1by1 n HIS 170 CO 0.00 0.00 0.00 -0.08 -2.81 0.00 0.00 176.34 173.45 1by1 s THR 171 N -0.29 0.00 0.00 0.61 -1.32 -1.26 -4.97 115.64 108.41 1by1 s THR 171 Ca -0.04 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.44 1by1 s THR 171 Cb 0.00 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 1by1 s THR 171 CO 0.14 0.00 0.00 -0.67 -2.21 0.00 0.00 174.62 171.88 1by1 n ASP 172 N 1.99 0.00 0.25 8.08 -0.08 -1.26 -4.86 116.55 120.67 1by1 n ASP 172 Ca -0.12 0.00 0.17 0.00 -1.51 0.00 0.00 54.79 53.33 1by1 n ASP 172 Cb 0.57 -0.16 0.76 0.00 2.34 0.00 0.00 41.12 44.63 1by1 n ASP 172 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 1by1 h ARG 173 N 2.50 0.00 -1.36 -0.67 1.12 -1.90 -3.06 114.38 111.00 1by1 h ARG 173 Ca 0.00 0.00 0.40 0.00 -1.11 0.00 0.00 59.98 59.27 1by1 h ARG 173 Cb 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 29.91 1by1 h ARG 173 CO 0.00 0.00 1.03 -0.56 -3.11 0.00 0.00 179.97 177.33 1by1 h GLN 174 N 0.00 0.00 -0.14 0.20 3.07 -1.98 1.33 115.11 117.58 1by1 h GLN 174 Ca 0.00 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.61 1by1 h GLN 174 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.88 1by1 h GLN 174 CO 0.00 0.00 -0.46 0.22 0.09 0.00 0.00 178.83 178.68 1by1 h ASP 175 N 0.00 0.39 -0.59 0.06 1.82 -1.95 -2.98 116.42 113.17 1by1 h ASP 175 Ca 0.65 -0.18 -0.04 0.00 -0.39 0.00 0.00 57.03 57.07 1by1 h ASP 175 Cb 2.71 -0.11 -0.03 0.00 0.68 0.00 0.00 39.33 42.58 1by1 h ASP 175 CO -0.01 0.80 0.24 0.40 -1.61 0.00 0.00 179.24 179.06 1by1 h ILE 176 N 0.29 1.22 -0.02 2.25 2.04 0.15 0.24 117.51 123.69 1by1 h ILE 176 Ca 0.02 -0.71 -0.03 0.00 1.00 0.00 0.00 64.86 65.14 1by1 h ILE 176 Cb 0.93 0.49 -0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1by1 h ILE 176 CO 0.08 0.28 -0.11 1.56 0.00 0.00 0.00 178.15 179.96 1by1 h GLN 177 N 0.90 0.02 0.07 2.37 4.20 -1.38 -1.78 115.11 119.51 1by1 h GLN 177 Ca 0.21 -0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.62 1by1 h GLN 177 Cb 0.19 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 1by1 h GLN 177 CO -0.02 0.14 -1.54 -0.22 -0.67 0.00 0.00 178.83 176.52 1by1 h LYS 178 N 0.02 0.15 -0.60 1.46 1.63 -1.34 -2.65 116.57 115.24 1by1 h LYS 178 Ca 0.00 -0.25 -0.04 0.00 -0.85 0.00 0.00 60.65 59.51 1by1 h LYS 178 Cb 0.21 0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.91 1by1 h LYS 178 CO 0.01 0.94 0.20 1.03 -3.45 0.00 0.00 179.45 178.18 1by1 h SER 179 N 0.04 0.86 -0.07 4.20 0.87 -0.55 -1.12 113.55 117.78 1by1 h SER 179 Ca -0.23 -0.20 -0.16 0.00 -1.23 0.00 0.00 61.79 59.96 1by1 h SER 179 Cb 1.98 -0.22 0.01 0.00 -0.44 0.00 0.00 62.40 63.72 1by1 h SER 179 CO 0.13 0.83 -0.59 0.00 -0.53 0.00 0.00 176.83 176.67 1by1 h MET 180 N 0.84 0.53 0.00 2.24 -0.00 -1.47 -2.71 114.93 114.37 1by1 h MET 180 Ca 0.19 -0.47 0.00 0.00 -0.00 0.00 0.00 59.70 59.42 1by1 h MET 180 Cb 0.27 0.11 0.00 0.00 -0.00 0.00 0.00 31.60 31.98 1by1 h MET 180 CO -0.01 1.10 0.00 0.00 -0.00 0.00 0.00 176.91 178.00 1by1 h ALA 181 N 0.43 1.00 0.00 -3.00 0.00 -1.36 0.27 119.26 116.60 1by1 h ALA 181 Ca -0.05 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1by1 h ALA 181 Cb 1.25 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1by1 h ALA 181 CO 0.12 0.00 -0.70 0.00 0.00 0.00 0.00 179.25 178.67 1by1 h ALA 182 N 2.05 0.09 -0.66 0.00 0.00 -1.18 -2.98 119.26 116.57 1by1 h ALA 182 Ca 0.00 -0.70 -0.08 0.00 0.00 0.00 0.00 54.91 54.14 1by1 h ALA 182 Cb 0.23 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1by1 h ALA 182 CO 0.00 0.52 0.11 0.74 0.00 0.00 0.00 179.25 180.62 1by1 h PHE 183 N -1.00 1.13 -0.23 0.00 0.04 -1.44 -3.08 116.94 112.36 1by1 h PHE 183 Ca -0.11 -0.15 -0.12 0.00 2.80 0.00 0.00 57.97 60.38 1by1 h PHE 183 Cb 0.74 -0.31 -0.00 0.00 2.20 0.00 0.00 35.95 38.58 1by1 h PHE 183 CO -0.09 0.95 -0.34 -0.22 -0.60 0.00 0.00 178.31 178.01 1by1 h LYS 184 N 1.01 0.64 -0.99 1.51 3.64 -0.67 -2.99 116.57 118.72 1by1 h LYS 184 Ca 0.20 -0.38 0.29 0.00 -1.27 0.00 0.00 60.65 59.49 1by1 h LYS 184 Cb 0.42 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.23 1by1 h LYS 184 CO 0.01 0.99 0.83 -0.91 -2.27 0.00 0.00 179.45 178.11 1by1 h ASN 185 N 0.35 0.00 -0.27 4.20 4.21 -1.43 0.68 115.58 123.33 1by1 h ASN 185 Ca 0.02 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.44 1by1 h ASN 185 Cb 0.92 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.12 1by1 h ASN 185 CO 0.08 0.00 -0.21 -0.07 -1.29 0.00 0.00 177.43 175.94 1by1 h LEU 186 N 0.00 0.65 -0.78 1.61 3.38 -1.53 -2.00 115.31 116.64 1by1 h LEU 186 Ca 0.47 -0.45 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 1by1 h LEU 186 Cb 2.13 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 42.69 1by1 h LEU 186 CO -0.00 0.96 -0.54 -1.28 0.09 0.00 0.00 178.44 177.67 1by1 h SER 187 N 0.34 0.21 -0.28 -0.43 0.87 0.21 0.63 113.55 115.10 1by1 h SER 187 Ca 0.05 -0.11 -0.06 0.00 -1.23 0.00 0.00 61.79 60.44 1by1 h SER 187 Cb 0.76 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 1by1 h SER 187 CO 0.06 0.71 -0.06 0.00 -0.53 0.00 0.00 176.83 177.01 1by1 h ALA 188 N 1.29 0.38 0.12 6.23 0.00 -0.99 -3.10 119.26 123.20 1by1 h ALA 188 Ca 0.00 -0.27 -0.27 0.00 0.00 0.00 0.00 54.91 54.37 1by1 h ALA 188 Cb 1.00 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.70 1by1 h ALA 188 CO 0.08 0.19 -1.22 1.96 0.00 0.00 0.00 179.25 180.26 1by1 h GLN 189 N 0.29 0.30 -1.22 0.00 1.08 -1.31 -3.26 115.11 110.99 1by1 h GLN 189 Ca 0.07 -0.49 0.36 0.00 -1.45 0.00 0.00 58.65 57.14 1by1 h GLN 189 Cb 0.53 0.18 -0.10 0.00 -0.05 0.00 0.00 27.48 28.04 1by1 h GLN 189 CO 0.03 1.22 0.81 0.00 -0.95 0.00 0.00 178.83 179.94 1by1 h GLN 191 N 0.19 0.04 0.00 0.00 1.08 -1.58 -3.37 115.11 111.46 1by1 h GLN 191 Ca 0.69 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.89 1by1 h GLN 191 Cb 2.16 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 29.58 1by1 h GLN 191 CO -0.27 0.02 0.00 0.39 -0.95 0.00 0.00 178.83 178.02 1by1 n GLU 192 N -5.40 0.00 -1.96 1.46 1.02 0.02 -4.96 120.64 110.82 1by1 n GLU 192 Ca 0.09 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.12 1by1 n GLU 192 Cb 0.37 -0.26 -0.02 0.00 -0.02 0.00 0.00 31.44 31.51 1by1 n GLU 192 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1by1 n VAL 193 N -2.27 -0.31 -0.03 2.62 0.31 -0.74 -4.82 118.33 113.09 1by1 n VAL 193 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 1by1 n VAL 193 Cb 0.00 -1.41 -0.10 0.00 -0.91 0.00 0.00 33.84 31.42 1by1 n VAL 193 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1by1 h ARG 194 N 0.00 -0.04 0.00 5.55 3.08 -1.93 -3.32 114.38 117.72 1by1 h ARG 194 Ca -0.26 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.70 1by1 h ARG 194 Cb 1.01 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.05 1by1 h ARG 194 CO 0.33 0.64 -0.46 0.87 -1.07 0.00 0.00 179.97 180.29 1by1 h LYS 195 N -0.85 0.00 -6.04 0.04 6.56 -1.99 -3.37 116.57 110.91 1by1 h LYS 195 Ca -0.00 0.00 -0.58 0.00 -1.06 0.00 0.00 60.65 59.00 1by1 h LYS 195 Cb 0.71 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.37 1by1 h LYS 195 CO 0.01 0.46 1.45 -2.13 -2.06 0.00 0.00 179.45 177.18 1by1 n ARG 196 N -3.27 2.08 -0.22 3.15 0.00 -1.25 -0.74 116.66 116.41 1by1 n ARG 196 Ca 0.02 0.61 0.00 0.00 -0.00 0.00 0.00 57.85 58.47 1by1 n ARG 196 Cb 0.68 -3.18 0.00 0.00 0.00 0.00 0.00 32.46 29.96 1by1 n ARG 196 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1by1 n LYS 197 N 8.54 0.00 0.10 -0.14 4.81 -1.26 -4.86 118.16 125.35 1by1 n LYS 197 Ca 0.29 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.61 1by1 n LYS 197 Cb 0.43 -1.66 -0.07 0.00 0.02 0.00 0.00 35.03 33.75 1by1 n LYS 197 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 1by1 h GLU 198 N 2.31 -0.31 -1.74 1.64 4.11 -1.11 -3.13 114.58 116.35 1by1 h GLU 198 Ca 0.00 0.02 0.52 0.00 0.07 0.00 0.00 59.36 59.97 1by1 h GLU 198 Cb 0.00 0.07 -0.09 0.00 0.50 0.00 0.00 28.75 29.24 1by1 h GLU 198 CO 0.00 0.05 1.23 1.25 0.07 0.00 0.00 179.01 181.61 1by1 h LEU 199 N -0.87 0.05 0.00 3.06 6.46 -1.88 -3.45 115.31 118.68 1by1 h LEU 199 Ca -0.03 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1by1 h LEU 199 Cb 0.51 0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.47 1by1 h LEU 199 CO 0.05 -0.04 0.00 -1.84 -0.62 0.00 0.00 178.44 175.99 1by1 n GLU 200 N -4.13 0.00 -2.22 1.25 0.28 -1.19 -4.85 120.64 109.79 1by1 n GLU 200 Ca 0.40 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 57.38 1by1 n GLU 200 Cb 1.80 0.00 0.02 0.00 1.43 0.00 0.00 31.44 34.69 1by1 n GLU 200 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1by1 n LEU 201 N 0.00 -0.81 0.00 -1.84 7.94 -1.26 -4.98 117.00 116.05 1by1 n LEU 201 Ca 0.00 -1.83 0.00 0.00 -1.11 0.00 0.00 56.01 53.07 1by1 n LEU 201 Cb 0.00 0.73 0.00 0.00 0.53 0.00 0.00 43.42 44.68 1by1 n LEU 201 CO 0.00 1.23 0.01 0.00 -1.11 0.00 0.00 177.39 177.52 1by1 n GLN 202 N -0.48 0.00 0.17 1.96 6.02 -1.26 -4.39 117.38 119.39 1by1 n GLN 202 Ca -0.14 0.02 0.13 0.00 -0.01 0.00 0.00 57.00 57.01 1by1 n GLN 202 Cb 0.64 -0.55 0.41 0.00 1.02 0.00 0.00 30.24 31.76 1by1 n GLN 202 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1by1 h ILE 203 N 0.00 0.00 -3.47 5.09 5.03 -1.99 -3.43 117.51 118.73 1by1 h ILE 203 Ca 0.00 -0.57 -0.55 0.00 -0.12 0.00 0.00 64.86 63.63 1by1 h ILE 203 Cb 0.00 1.51 0.10 0.00 -3.03 0.00 0.00 36.82 35.40 1by1 h ILE 203 CO 0.00 0.00 0.76 0.18 -0.68 0.00 0.00 178.15 178.41 1by1 n LEU 204 N -2.61 4.29 -3.03 1.44 4.77 -1.26 -1.77 117.00 118.83 1by1 n LEU 204 Ca 0.04 1.19 -0.19 0.00 -0.03 0.00 0.00 56.01 57.01 1by1 n LEU 204 Cb 0.39 -1.57 -0.00 0.00 -2.33 0.00 0.00 43.42 39.91 1by1 n LEU 204 CO 0.29 0.00 -0.07 0.35 -1.33 0.00 0.00 177.39 176.63 1by1 n THR 205 N 1.20 -0.97 -1.38 -5.08 -2.24 -1.26 -4.85 114.28 99.69 1by1 n THR 205 Ca 0.05 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.43 1by1 n THR 205 Cb 0.37 -1.96 0.01 0.00 -2.10 0.00 0.00 70.33 66.65 1by1 n THR 205 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1by1 n GLU 206 N -3.46 0.32 -0.83 -0.78 -0.58 -0.73 -4.88 120.64 109.70 1by1 n GLU 206 Ca -0.07 0.12 -0.00 0.00 -0.42 0.00 0.00 57.16 56.79 1by1 n GLU 206 Cb 0.57 -1.33 0.29 0.00 -0.57 0.00 0.00 31.44 30.40 1by1 n GLU 206 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1by1 n ALA 207 N -1.20 4.04 -2.28 0.62 0.00 -1.26 -4.97 120.51 115.47 1by1 n ALA 207 Ca 0.11 -2.40 -0.04 0.00 0.00 0.00 0.00 53.44 51.10 1by1 n ALA 207 Cb 0.43 -1.02 0.01 0.00 0.00 0.00 0.00 19.45 18.86 1by1 n ALA 207 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1by1 n ILE 208 N -0.30 -7.16 -0.66 0.00 2.08 -1.26 -5.31 119.36 106.75 1by1 n ILE 208 Ca 0.33 0.47 0.00 0.00 0.56 0.00 0.00 62.75 64.11 1by1 n ILE 208 Cb 1.19 -5.87 0.00 0.00 -0.75 0.00 0.00 39.64 34.21 1by1 n ILE 208 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97