#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 -1.34 0.00 2.12 4.01 -1.26 -1.80 118.16 119.90 1by1 n LYS 2 Ca 0.00 1.18 0.00 0.00 -0.51 0.00 0.00 58.31 58.98 1by1 n LYS 2 Cb 0.00 -5.49 0.00 0.00 -0.51 0.00 0.00 35.03 29.03 1by1 n LYS 2 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1by1 n GLY 3 N -0.61 1.17 2.78 0.72 0.00 -1.26 -4.72 105.19 103.27 1by1 n GLY 3 Ca -0.19 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.62 -3.32 -3.35 1.61 7.35 -0.74 -4.87 117.46 112.52 1by1 n PHE 4 Ca 0.00 1.34 -0.38 0.00 -0.76 0.00 0.00 57.45 57.65 1by1 n PHE 4 Cb 0.00 -3.97 -0.06 0.00 0.35 0.00 0.00 39.48 35.80 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 -2.52 6.71 0.00 -2.13 2.15 -1.24 -4.91 116.67 114.72 1by1 s ASP 5 Ca 0.24 0.84 0.00 0.00 0.43 0.00 0.00 52.55 54.06 1by1 s ASP 5 Cb -0.07 -2.28 0.00 0.00 -0.30 0.00 0.00 42.92 40.27 1by1 s ASP 5 CO 0.73 0.06 0.00 0.41 -0.17 0.00 0.00 175.17 176.20 1by1 n THR 6 N 3.34 0.00 -1.12 1.71 -1.04 -1.26 -5.03 114.28 110.88 1by1 n THR 6 Ca -0.08 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.89 1by1 n THR 6 Cb 0.52 -0.66 -0.02 0.00 -1.82 0.00 0.00 70.33 68.35 1by1 n THR 6 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1by1 n THR 7 N -2.46 0.00 -1.59 12.58 -1.04 -1.26 -4.98 114.28 115.54 1by1 n THR 7 Ca 0.00 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.63 1by1 n THR 7 Cb 0.16 -0.72 0.04 0.00 -1.82 0.00 0.00 70.33 67.99 1by1 n THR 7 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1by1 n ALA 8 N 1.07 -0.07 -1.67 2.41 0.00 -1.26 -4.80 120.51 116.20 1by1 n ALA 8 Ca -0.04 0.04 -0.54 0.00 0.00 0.00 0.00 53.44 52.90 1by1 n ALA 8 Cb 0.21 -2.05 -0.06 0.00 0.00 0.00 0.00 19.45 17.55 1by1 n ALA 8 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1by1 n ILE 9 N -1.51 0.23 -1.72 0.00 3.06 -1.26 -4.44 119.36 113.72 1by1 n ILE 9 Ca 0.13 -0.04 0.00 0.00 -2.50 0.00 0.00 62.75 60.33 1by1 n ILE 9 Cb 0.46 -1.19 0.00 0.00 0.54 0.00 0.00 39.64 39.45 1by1 n ILE 9 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 1by1 n ASN 10 N 4.52 -8.98 -4.70 9.51 4.13 -1.26 -4.80 115.26 113.68 1by1 n ASN 10 Ca 0.23 1.28 -0.42 0.00 1.68 0.00 0.00 54.58 57.34 1by1 n ASN 10 Cb 0.18 -4.80 -0.03 0.00 -1.54 0.00 0.00 39.78 33.59 1by1 n ASN 10 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 1by1 s LYS 11 N -2.74 4.22 0.23 3.52 -2.85 -1.26 -4.96 119.74 115.90 1by1 s LYS 11 Ca 0.00 2.30 -0.30 0.00 -1.00 0.00 0.00 55.97 56.97 1by1 s LYS 11 Cb 0.00 -3.45 -0.09 0.00 -2.06 0.00 0.00 37.83 32.23 1by1 s LYS 11 CO 0.00 -0.67 1.30 -1.12 0.10 0.00 0.00 175.35 174.96 1by1 s SER 12 N 1.93 6.90 0.49 0.03 0.01 -1.26 -4.90 113.70 116.90 1by1 s SER 12 Ca 0.71 2.45 0.20 0.00 1.31 0.00 0.00 55.95 60.63 1by1 s SER 12 Cb -0.40 -2.62 1.25 0.00 0.21 0.00 0.00 66.02 64.46 1by1 s SER 12 CO 0.31 -0.50 2.01 0.22 0.41 0.00 0.00 173.24 175.70 1by1 h TYR 13 N 4.84 0.15 -0.45 2.43 3.20 -2.00 -1.70 116.97 123.45 1by1 h TYR 13 Ca -0.46 0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.46 1by1 h TYR 13 Cb 1.22 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 39.39 1by1 h TYR 13 CO 0.60 0.07 0.21 -0.92 -1.64 0.00 0.00 178.16 176.49 1by1 h TYR 14 N 0.14 0.38 0.00 -3.82 3.20 -2.00 -0.67 116.97 114.22 1by1 h TYR 14 Ca 0.22 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.11 1by1 h TYR 14 Cb 0.69 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.85 1by1 h TYR 14 CO -0.00 0.18 0.00 -0.97 -1.64 0.00 0.00 178.16 175.73 1by1 h ASN 15 N 0.42 0.00 0.86 -2.11 -0.73 -1.70 -2.66 115.58 109.67 1by1 h ASN 15 Ca 0.20 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 58.15 1by1 h ASN 15 Cb 0.13 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.69 1by1 h ASN 15 CO -0.16 0.00 -1.21 0.58 -0.37 0.00 0.00 177.43 176.27 1by1 h VAL 16 N 0.00 1.23 -0.20 2.57 2.07 -1.05 -3.13 116.25 117.74 1by1 h VAL 16 Ca 0.00 -2.93 -0.04 0.00 0.82 0.00 0.00 66.70 64.55 1by1 h VAL 16 Cb 0.42 2.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.78 1by1 h VAL 16 CO 0.00 0.70 -0.01 0.58 0.02 0.00 0.00 177.57 178.86 1by1 h VAL 17 N 0.00 1.26 -0.45 2.57 2.07 -0.91 -1.81 116.25 118.98 1by1 h VAL 17 Ca -0.11 -0.92 -0.09 0.00 0.82 0.00 0.00 66.70 66.40 1by1 h VAL 17 Cb 1.79 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 33.02 1by1 h VAL 17 CO 0.10 0.28 -0.09 -0.07 0.02 0.00 0.00 177.57 177.81 1by1 h LEU 18 N 0.10 0.79 -0.01 2.57 -0.00 -1.69 -2.67 115.31 114.40 1by1 h LEU 18 Ca 0.05 -0.23 0.03 0.00 -0.00 0.00 0.00 57.88 57.74 1by1 h LEU 18 Cb 0.42 -0.21 -0.05 0.00 -0.00 0.00 0.00 40.66 40.82 1by1 h LEU 18 CO 0.01 0.91 -0.29 1.56 -0.00 0.00 0.00 178.44 180.64 1by1 h GLN 19 N 0.73 -0.41 0.36 1.13 4.20 -1.46 1.10 115.11 120.76 1by1 h GLN 19 Ca 0.13 0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 1by1 h GLN 19 Cb 0.57 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.42 1by1 h GLN 19 CO 0.04 -0.27 -0.50 -0.97 -0.67 0.00 0.00 178.83 176.45 1by1 h ASN 20 N -0.43 -1.43 -0.68 1.46 -1.24 -1.20 -2.29 115.58 109.77 1by1 h ASN 20 Ca 0.07 0.13 0.08 0.00 0.71 0.00 0.00 56.30 57.29 1by1 h ASN 20 Cb 0.52 0.49 -0.07 0.00 0.73 0.00 0.00 38.32 39.99 1by1 h ASN 20 CO -0.25 -0.61 0.34 0.40 -1.29 0.00 0.00 177.43 176.01 1by1 h ILE 21 N -0.90 0.86 -0.43 2.57 1.08 -1.25 -2.56 117.51 116.88 1by1 h ILE 21 Ca -0.04 -0.20 0.06 0.00 -0.39 0.00 0.00 64.86 64.29 1by1 h ILE 21 Cb 0.81 0.23 -0.09 0.00 -3.07 0.00 0.00 36.82 34.70 1by1 h ILE 21 CO -0.14 0.11 -0.50 -0.07 -0.69 0.00 0.00 178.15 176.86 1by1 h LEU 22 N 0.58 -1.67 -0.45 1.44 3.38 0.17 0.60 115.31 119.37 1by1 h LEU 22 Ca 0.33 0.24 0.09 0.00 0.09 0.00 0.00 57.88 58.63 1by1 h LEU 22 Cb 0.33 0.71 -0.09 0.00 0.09 0.00 0.00 40.66 41.70 1by1 h LEU 22 CO -0.25 -0.38 -0.14 -0.33 0.09 0.00 0.00 178.44 177.43 1by1 h GLU 23 N -0.35 -0.03 -0.99 1.13 5.08 -1.04 0.39 114.58 118.77 1by1 h GLU 23 Ca 0.11 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.53 1by1 h GLU 23 Cb 0.59 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.78 1by1 h GLU 23 CO -0.60 -0.02 0.64 1.15 -1.00 0.00 0.00 179.01 179.18 1by1 h THR 24 N -0.03 1.11 -0.19 1.13 2.02 -0.71 -1.50 112.91 114.74 1by1 h THR 24 Ca 0.22 -0.41 -0.13 0.00 0.77 0.00 0.00 66.41 66.86 1by1 h THR 24 Cb 0.36 -0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.59 1by1 h THR 24 CO -0.48 0.22 -0.43 -0.33 0.37 0.00 0.00 175.52 174.86 1by1 h GLU 25 N 1.18 0.46 -0.83 6.66 5.08 0.24 -2.86 114.58 124.52 1by1 h GLU 25 Ca 0.42 -0.24 0.18 0.00 -1.00 0.00 0.00 59.36 58.72 1by1 h GLU 25 Cb 0.12 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.32 1by1 h GLU 25 CO -0.15 0.81 0.55 -0.97 -1.00 0.00 0.00 179.01 178.25 1by1 h ASN 26 N 0.38 0.35 -0.08 1.42 -1.24 0.76 0.41 115.58 117.58 1by1 h ASN 26 Ca 0.03 0.03 -0.08 0.00 0.71 0.00 0.00 56.30 56.99 1by1 h ASN 26 Cb 0.91 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.91 1by1 h ASN 26 CO 0.08 0.16 -0.18 -0.33 -1.29 0.00 0.00 177.43 175.86 1by1 h GLU 27 N 0.36 0.47 0.25 6.67 4.39 -1.40 1.30 114.58 126.62 1by1 h GLU 27 Ca 0.42 -0.15 -0.34 0.00 0.34 0.00 0.00 59.36 59.63 1by1 h GLU 27 Cb 1.07 -0.04 0.04 0.00 -0.10 0.00 0.00 28.75 29.72 1by1 h GLU 27 CO -0.13 0.64 -1.49 -0.92 -1.16 0.00 0.00 179.01 175.95 1by1 h TYR 28 N 0.43 0.96 -0.02 4.33 3.20 -0.54 -2.88 116.97 122.45 1by1 h TYR 28 Ca 0.07 -0.70 -0.06 0.00 3.14 0.00 0.00 58.73 61.18 1by1 h TYR 28 Cb 0.57 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.80 1by1 h TYR 28 CO 0.02 1.56 -0.22 0.77 -1.64 0.00 0.00 178.16 178.64 1by1 h SER 29 N 0.14 0.23 0.77 -2.11 0.02 -0.21 -3.12 113.55 109.28 1by1 h SER 29 Ca -0.26 -0.71 0.00 0.00 -0.84 0.00 0.00 61.79 59.98 1by1 h SER 29 Cb 2.17 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 64.64 1by1 h SER 29 CO 0.27 0.91 0.00 0.07 -1.14 0.00 0.00 176.83 176.94 1by1 h LYS 30 N -0.42 0.00 0.10 3.45 5.09 0.15 -2.39 116.57 122.55 1by1 h LYS 30 Ca -0.02 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 60.71 1by1 h LYS 30 Cb 0.92 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.26 1by1 h LYS 30 CO 0.04 0.00 -0.05 0.93 -2.09 0.00 0.00 179.45 178.29 1by1 h GLU 31 N 0.00 -0.13 -0.67 0.07 4.39 -1.51 -2.90 114.58 113.83 1by1 h GLU 31 Ca 0.00 0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.68 1by1 h GLU 31 Cb 0.39 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.04 1by1 h GLU 31 CO 0.00 0.36 0.31 -0.07 -1.16 0.00 0.00 179.01 178.46 1by1 h LEU 32 N -0.89 0.88 -0.85 1.33 3.38 -1.50 -2.31 115.31 115.35 1by1 h LEU 32 Ca -0.01 -0.14 0.15 0.00 0.09 0.00 0.00 57.88 57.97 1by1 h LEU 32 Cb 0.55 -0.23 -0.10 0.00 0.09 0.00 0.00 40.66 40.98 1by1 h LEU 32 CO 0.02 0.77 0.43 -0.61 0.09 0.00 0.00 178.44 179.14 1by1 h GLN 33 N 0.93 0.58 0.00 1.13 -0.00 -1.54 0.32 115.11 116.53 1by1 h GLN 33 Ca 0.23 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.84 1by1 h GLN 33 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 27.48 27.48 1by1 h GLN 33 CO -0.03 0.38 0.00 2.41 0.00 0.00 0.00 178.83 181.60 1by1 n THR 34 N -4.89 0.00 -0.33 2.39 -1.04 -0.88 -1.81 114.28 107.72 1by1 n THR 34 Ca 0.17 1.35 0.15 0.00 -2.04 0.00 0.00 64.05 63.68 1by1 n THR 34 Cb 0.45 -2.25 0.38 0.00 -1.82 0.00 0.00 70.33 67.09 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 0.67 0.00 12.58 2.07 -1.46 0.14 116.25 130.26 1by1 h VAL 35 Ca 0.00 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1by1 h VAL 35 Cb 0.00 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.72 1by1 h VAL 35 CO 0.00 0.12 0.00 0.18 0.02 0.00 0.00 177.57 177.89 1by1 n LEU 36 N -4.72 0.00 0.03 2.57 4.77 0.09 -0.81 117.00 118.93 1by1 n LEU 36 Ca 0.23 0.88 0.06 0.00 -0.03 0.00 0.00 56.01 57.16 1by1 n LEU 36 Cb 0.64 -0.38 0.28 0.00 -2.33 0.00 0.00 43.42 41.62 1by1 n LEU 36 CO 0.23 -0.38 0.70 -1.20 -1.33 0.00 0.00 177.39 175.41 1by1 n SER 37 N -1.95 0.12 -0.03 -1.43 7.64 -0.75 0.15 113.62 117.37 1by1 n SER 37 Ca 0.00 0.53 -0.01 0.00 1.01 0.00 0.00 58.87 60.41 1by1 n SER 37 Cb 0.00 -0.56 -0.00 0.00 -1.01 0.00 0.00 64.21 62.64 1by1 n SER 37 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1by1 h THR 38 N 0.00 0.00 0.00 0.44 2.02 -0.25 -3.45 112.91 111.67 1by1 h THR 38 Ca 0.00 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.68 1by1 h THR 38 Cb 0.20 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 1by1 h THR 38 CO 0.00 0.00 -0.10 0.00 0.37 0.00 0.00 175.52 175.79 1by1 n TYR 39 N -3.41 0.00 0.09 3.16 0.18 -0.04 -4.78 117.16 112.35 1by1 n TYR 39 Ca -0.01 0.00 0.02 0.00 1.88 0.00 0.00 57.90 59.79 1by1 n TYR 39 Cb 0.05 0.00 -0.02 0.00 -0.38 0.00 0.00 39.34 38.99 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 0.00 -0.99 -3.48 5.85 -0.40 -3.38 115.31 112.91 1by1 h LEU 40 Ca 0.00 0.00 0.16 0.00 0.84 0.00 0.00 57.88 58.88 1by1 h LEU 40 Cb 0.00 0.00 -0.17 0.00 0.37 0.00 0.00 40.66 40.86 1by1 h LEU 40 CO 0.00 0.49 -0.35 -1.14 -0.34 0.00 0.00 178.44 177.09 1by1 n ARG 41 N -3.03 -0.20 0.26 1.25 0.00 0.41 -0.79 116.66 114.56 1by1 n ARG 41 Ca -0.03 1.53 -0.17 0.00 -0.00 0.00 0.00 57.85 59.18 1by1 n ARG 41 Cb 0.76 -2.27 -0.09 0.00 0.00 0.00 0.00 32.46 30.86 1by1 n ARG 41 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1by1 h PRO 42 N 0.00 -0.86 0.00 -0.14 0.11 -1.85 -2.05 132.00 127.21 1by1 h PRO 42 Ca 0.38 0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.54 1by1 h PRO 42 Cb 0.62 0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1by1 h PRO 42 CO -0.99 -0.57 0.00 -0.11 -0.21 0.00 0.00 178.00 176.11 1by1 n LEU 43 N -5.52 0.00 -0.07 2.35 7.94 -0.79 -3.49 117.00 117.42 1by1 n LEU 43 Ca -0.11 0.45 0.25 0.00 -1.11 0.00 0.00 56.01 55.49 1by1 n LEU 43 Cb 0.42 -0.45 0.58 0.00 0.53 0.00 0.00 43.42 44.50 1by1 n LEU 43 CO 0.27 -0.28 1.22 -0.61 -1.11 0.00 0.00 177.39 176.89 1by1 h GLN 44 N 0.00 0.00 -0.73 1.96 -0.00 -0.19 1.07 115.11 117.22 1by1 h GLN 44 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1by1 h GLN 44 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.65 1by1 h GLN 44 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 178.83 181.24 1by1 n THR 45 N -3.43 0.87 -1.60 2.39 -1.04 -1.23 -4.85 114.28 105.40 1by1 n THR 45 Ca 0.16 -0.48 -0.18 0.00 -2.04 0.00 0.00 64.05 61.51 1by1 n THR 45 Cb 1.12 -0.30 -0.07 0.00 -1.82 0.00 0.00 70.33 69.26 1by1 n THR 45 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1by1 n SER 46 N 0.24 -5.17 -4.53 8.00 7.64 0.37 -4.86 113.62 115.31 1by1 n SER 46 Ca 0.10 0.40 -0.46 0.00 1.01 0.00 0.00 58.87 59.92 1by1 n SER 46 Cb 0.52 -4.24 -0.05 0.00 -1.01 0.00 0.00 64.21 59.43 1by1 n SER 46 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1by1 n GLU 47 N -2.50 1.51 0.00 1.43 2.13 -1.19 -0.39 120.64 121.62 1by1 n GLU 47 Ca -0.18 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.04 1by1 n GLU 47 Cb 0.60 -2.88 0.00 0.00 0.27 0.00 0.00 31.44 29.43 1by1 n GLU 47 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1by1 n LYS 48 N 8.52 0.00 -1.20 5.31 4.81 -1.26 -4.81 118.16 129.53 1by1 n LYS 48 Ca 0.36 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.71 1by1 n LYS 48 Cb 0.35 -0.77 0.13 0.00 0.02 0.00 0.00 35.03 34.76 1by1 n LYS 48 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1by1 n LEU 49 N 0.00 3.97 -4.78 3.14 4.77 0.47 -5.00 117.00 119.58 1by1 n LEU 49 Ca 0.00 -4.23 -0.37 0.00 -0.03 0.00 0.00 56.01 51.38 1by1 n LEU 49 Cb 0.00 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.53 1by1 n LEU 49 CO 0.00 1.66 0.08 -0.44 -1.33 0.00 0.00 177.39 177.36 1by1 s SER 50 N -3.21 6.66 0.41 -1.43 0.01 -0.32 -4.19 113.70 111.63 1by1 s SER 50 Ca 0.45 0.78 0.00 0.00 1.31 0.00 0.00 55.95 58.49 1by1 s SER 50 Cb 0.40 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 64.39 1by1 s SER 50 CO -0.02 0.17 0.00 -1.20 0.41 0.00 0.00 173.24 172.61 1by1 n SER 51 N 2.84 -8.51 0.00 2.44 7.64 -1.26 -4.55 113.62 112.22 1by1 n SER 51 Ca -0.12 1.20 0.00 0.00 1.01 0.00 0.00 58.87 60.96 1by1 n SER 51 Cb 0.52 -4.48 0.00 0.00 -1.01 0.00 0.00 64.21 59.24 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 -0.16 0.00 0.10 -0.43 0.00 -1.26 -4.38 120.51 114.38 1by1 n ALA 52 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.64 1by1 n ALA 52 Cb 0.00 0.00 0.76 0.00 0.00 0.00 0.00 19.45 20.21 1by1 n ALA 52 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1by1 h ASN 53 N 0.00 0.00 0.18 0.00 4.21 -1.80 -2.30 115.58 115.87 1by1 h ASN 53 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1by1 h ASN 53 Cb 0.00 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.17 1by1 h ASN 53 CO 0.00 0.00 -0.39 0.40 -1.29 0.00 0.00 177.43 176.15 1by1 h ILE 54 N 0.00 0.00 -1.59 2.81 1.08 -1.76 -0.77 117.51 117.27 1by1 h ILE 54 Ca 0.18 0.00 0.46 0.00 -0.39 0.00 0.00 64.86 65.11 1by1 h ILE 54 Cb 0.95 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.64 1by1 h ILE 54 CO -0.00 0.00 1.16 0.28 -0.69 0.00 0.00 178.15 178.90 1by1 h SER 55 N -0.63 0.00 0.00 1.72 0.02 -1.79 0.66 113.55 113.53 1by1 h SER 55 Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1by1 h SER 55 Cb 0.60 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.14 1by1 h SER 55 CO -0.16 0.00 0.00 -1.22 -1.14 0.00 0.00 176.83 174.31 1by1 n TYR 56 N -4.03 0.00 0.00 3.45 4.01 -0.35 -4.83 117.16 115.42 1by1 n TYR 56 Ca 0.35 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.09 1by1 n TYR 56 Cb 1.65 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.68 1by1 n TYR 56 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1by1 n LEU 57 N 0.00 0.99 -0.24 7.72 4.77 -0.86 -4.59 117.00 124.79 1by1 n LEU 57 Ca 0.00 0.04 0.01 0.00 -0.03 0.00 0.00 56.01 56.03 1by1 n LEU 57 Cb 0.00 -0.11 0.05 0.00 -2.33 0.00 0.00 43.42 41.03 1by1 n LEU 57 CO 0.00 -0.11 0.38 0.23 -1.33 0.00 0.00 177.39 176.57 1by1 n MET 58 N -1.34 -0.12 -0.63 3.23 2.81 -1.25 0.85 117.12 120.67 1by1 n MET 58 Ca 0.00 0.97 0.50 0.00 -1.81 0.00 0.00 57.70 57.36 1by1 n MET 58 Cb 0.00 -1.45 0.80 0.00 -0.71 0.00 0.00 33.22 31.87 1by1 n MET 58 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1by1 h GLY 59 N 0.00 0.00 0.00 3.03 0.00 0.14 1.22 103.07 107.46 1by1 h GLY 59 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1by1 h GLY 59 CO -0.63 0.00 0.00 -2.01 0.00 0.00 0.00 176.54 173.90 1by1 n ASN 60 N -3.95 0.00 0.16 0.19 5.15 0.25 -4.01 115.26 113.04 1by1 n ASN 60 Ca 0.41 0.18 -0.14 0.00 -0.60 0.00 0.00 54.58 54.43 1by1 n ASN 60 Cb 1.89 -0.35 -0.07 0.00 -0.53 0.00 0.00 39.78 40.72 1by1 n ASN 60 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1by1 h LEU 61 N 0.00 -0.40 -2.01 1.20 7.12 -1.39 0.18 115.31 120.02 1by1 h LEU 61 Ca 0.00 0.03 0.10 0.00 0.13 0.00 0.00 57.88 58.14 1by1 h LEU 61 Cb 0.00 0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.24 1by1 h LEU 61 CO 0.00 -0.25 0.40 1.05 -0.13 0.00 0.00 178.44 179.51 1by1 h GLU 62 N -0.39 0.00 0.02 1.25 -0.00 0.13 -1.83 114.58 113.76 1by1 h GLU 62 Ca -0.02 0.00 -0.26 0.00 -0.00 0.00 0.00 59.36 59.08 1by1 h GLU 62 Cb 0.33 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 29.05 1by1 h GLU 62 CO 0.01 0.00 -1.42 0.39 -0.00 0.00 0.00 179.01 177.99 1by1 n GLU 63 N -3.65 0.60 -0.31 1.06 -0.58 -0.81 -4.09 120.64 112.87 1by1 n GLU 63 Ca 0.06 0.52 0.35 0.00 -0.42 0.00 0.00 57.16 57.66 1by1 n GLU 63 Cb 0.56 -1.74 0.73 0.00 -0.57 0.00 0.00 31.44 30.42 1by1 n GLU 63 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1by1 h ILE 64 N -0.81 0.29 0.09 -3.67 2.04 0.17 -1.34 117.51 114.28 1by1 h ILE 64 Ca -0.37 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1by1 h ILE 64 Cb 1.44 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1by1 h ILE 64 CO -0.16 0.00 -0.21 0.00 0.00 0.00 0.00 178.15 177.78 1by1 h SER 66 N -0.33 0.32 0.34 0.00 0.87 -1.48 -2.21 113.55 111.07 1by1 h SER 66 Ca -0.01 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 1by1 h SER 66 Cb 0.31 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.24 1by1 h SER 66 CO -0.09 0.15 -0.16 0.15 -0.53 0.00 0.00 176.83 176.35 1by1 h PHE 67 N 0.33 -0.42 -1.21 2.24 3.04 -0.88 -3.06 116.94 116.98 1by1 h PHE 67 Ca 0.40 -0.01 0.35 0.00 3.98 0.00 0.00 57.97 62.69 1by1 h PHE 67 Cb 1.06 0.14 -0.05 0.00 2.56 0.00 0.00 35.95 39.66 1by1 h PHE 67 CO -0.00 -0.09 1.06 1.96 -2.02 0.00 0.00 178.31 179.23 1by1 h GLN 68 N -0.88 0.00 0.28 1.11 1.08 0.24 1.67 115.11 118.61 1by1 h GLN 68 Ca -0.05 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.14 1by1 h GLN 68 Cb 0.53 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 1by1 h GLN 68 CO 0.08 0.00 -0.13 1.96 -0.95 0.00 0.00 178.83 179.78 1by1 h GLN 69 N 0.00 -0.36 0.00 1.46 4.20 -1.44 -3.34 115.11 115.62 1by1 h GLN 69 Ca 0.58 0.02 -0.11 0.00 0.06 0.00 0.00 58.65 59.21 1by1 h GLN 69 Cb 2.69 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 30.54 1by1 h GLN 69 CO -0.01 -0.24 -0.50 0.00 -0.67 0.00 0.00 178.83 177.41 1by1 h MET 70 N -1.10 0.00 -0.18 1.46 -0.00 -0.74 -2.64 114.93 111.72 1by1 h MET 70 Ca -0.04 0.00 0.02 0.00 -0.00 0.00 0.00 59.70 59.68 1by1 h MET 70 Cb 0.29 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 31.87 1by1 h MET 70 CO 0.06 0.50 -0.11 1.25 -0.00 0.00 0.00 176.91 178.61 1by1 h LEU 71 N 0.00 -0.41 0.12 -0.10 7.12 0.22 0.13 115.31 122.39 1by1 h LEU 71 Ca -0.01 0.06 -0.37 0.00 0.13 0.00 0.00 57.88 57.70 1by1 h LEU 71 Cb 0.93 0.18 -0.02 0.00 -0.53 0.00 0.00 40.66 41.22 1by1 h LEU 71 CO 0.07 -0.05 -2.02 0.52 -0.13 0.00 0.00 178.44 176.83 1by1 n VAL 72 N -3.41 1.77 0.32 1.05 0.31 -1.25 -4.13 118.33 112.99 1by1 n VAL 72 Ca 0.00 -0.65 0.14 0.00 -0.01 0.00 0.00 64.34 63.82 1by1 n VAL 72 Cb 0.05 -1.72 0.62 0.00 -0.91 0.00 0.00 33.84 31.88 1by1 n VAL 72 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1by1 h GLN 73 N 0.07 0.00 0.00 5.55 4.20 -1.48 -2.28 115.11 121.18 1by1 h GLN 73 Ca -0.43 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.24 1by1 h GLN 73 Cb 2.03 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.80 1by1 h GLN 73 CO 0.08 0.00 -0.57 0.77 -0.67 0.00 0.00 178.83 178.44 1by1 h SER 74 N 0.00 0.00 1.00 1.46 0.02 -0.91 -3.31 113.55 111.81 1by1 h SER 74 Ca 0.00 -0.10 -0.18 0.00 -0.84 0.00 0.00 61.79 60.67 1by1 h SER 74 Cb 0.30 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.82 1by1 h SER 74 CO 0.00 0.85 -0.87 0.17 -1.14 0.00 0.00 176.83 175.84 1by1 h LEU 75 N -1.00 0.00 0.04 5.07 8.10 -1.70 -3.28 115.31 122.53 1by1 h LEU 75 Ca -0.06 0.00 -0.06 0.00 0.11 0.00 0.00 57.88 57.87 1by1 h LEU 75 Cb 0.60 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.82 1by1 h LEU 75 CO -0.03 0.87 -0.27 -0.33 -4.11 0.00 0.00 178.44 174.57 1by1 h GLU 76 N 0.00 0.12 -0.78 0.17 4.39 -1.65 -2.43 114.58 114.41 1by1 h GLU 76 Ca -0.01 -0.18 0.22 0.00 0.34 0.00 0.00 59.36 59.73 1by1 h GLU 76 Cb 1.61 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 30.29 1by1 h GLU 76 CO 0.11 1.03 0.56 0.93 -1.16 0.00 0.00 179.01 180.48 1by1 h GLU 77 N -0.70 0.03 0.00 2.33 4.39 -1.68 0.62 114.58 119.56 1by1 h GLU 77 Ca -0.04 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 1by1 h GLU 77 Cb 1.16 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.80 1by1 h GLU 77 CO 0.05 0.02 -0.17 0.00 -1.16 0.00 0.00 179.01 177.75 1by1 h THR 79 N -1.00 0.49 -0.77 0.00 1.35 -0.94 -1.47 112.91 110.58 1by1 h THR 79 Ca -0.03 0.00 0.13 0.00 -0.55 0.00 0.00 66.41 65.96 1by1 h THR 79 Cb 0.47 0.49 -0.14 0.00 -1.73 0.00 0.00 68.15 67.25 1by1 h THR 79 CO -0.02 0.00 -0.35 0.11 -0.25 0.00 0.00 175.52 175.02 1by1 h LYS 80 N -0.11 -0.08 -6.28 4.72 6.56 0.09 -3.20 116.57 118.27 1by1 h LYS 80 Ca 0.18 0.01 -0.30 0.00 -1.06 0.00 0.00 60.65 59.47 1by1 h LYS 80 Cb 0.37 0.02 0.17 0.00 -0.57 0.00 0.00 32.23 32.22 1by1 h LYS 80 CO -0.42 -0.06 -0.53 1.28 -2.06 0.00 0.00 179.45 177.66 1by1 n LEU 81 N -5.46 -1.56 -2.96 2.94 4.77 -0.55 -4.53 117.00 109.65 1by1 n LEU 81 Ca 0.07 -0.35 -0.03 0.00 -0.03 0.00 0.00 56.01 55.67 1by1 n LEU 81 Cb 0.38 -0.83 -0.00 0.00 -2.33 0.00 0.00 43.42 40.64 1by1 n LEU 81 CO -0.05 -3.30 1.13 -2.65 -1.33 0.00 0.00 177.39 171.19 1by1 n PRO 82 N -2.10 0.29 -1.27 3.23 -0.02 -1.26 -4.79 135.00 129.09 1by1 n PRO 82 Ca 0.05 -0.57 0.14 0.00 -2.02 0.00 0.00 63.50 61.10 1by1 n PRO 82 Cb 0.45 -2.00 -0.07 0.00 -0.02 0.00 0.00 33.50 31.86 1by1 n PRO 82 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1by1 n GLU 83 N 4.65 -2.62 0.00 -0.52 2.13 -1.21 -5.02 120.64 118.04 1by1 n GLU 83 Ca 0.06 2.10 0.00 0.00 0.66 0.00 0.00 57.16 59.98 1by1 n GLU 83 Cb 0.03 -3.19 0.00 0.00 0.27 0.00 0.00 31.44 28.54 1by1 n GLU 83 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1by1 n ALA 84 N -3.77 0.00 0.00 4.31 0.00 -1.26 -4.95 120.51 114.84 1by1 n ALA 84 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1by1 n ALA 84 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1by1 n ALA 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1by1 n GLN 85 N -1.73 0.00 -1.40 0.00 10.64 -1.26 -5.01 117.38 118.62 1by1 n GLN 85 Ca 0.00 0.00 -0.15 0.00 -1.83 0.00 0.00 57.00 55.02 1by1 n GLN 85 Cb 0.00 -0.61 -0.06 0.00 -0.86 0.00 0.00 30.24 28.71 1by1 n GLN 85 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 1by1 n GLN 86 N -1.89 -1.53 -3.91 2.61 6.02 -1.26 -4.91 117.38 112.50 1by1 n GLN 86 Ca 0.00 0.95 -0.30 0.00 -0.01 0.00 0.00 57.00 57.64 1by1 n GLN 86 Cb 0.16 -5.28 -0.14 0.00 1.02 0.00 0.00 30.24 25.99 1by1 n GLN 86 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1by1 s ARG 87 N -3.18 1.51 0.37 -1.09 0.52 -1.26 -2.68 118.95 113.14 1by1 s ARG 87 Ca 0.00 -2.03 0.15 0.00 -0.52 0.00 0.00 55.73 53.33 1by1 s ARG 87 Cb 0.00 -2.95 1.00 0.00 0.52 0.00 0.00 34.95 33.52 1by1 s ARG 87 CO 0.00 -1.03 1.78 0.28 0.02 0.00 0.00 175.30 176.34 1by1 h VAL 88 N 6.03 0.58 0.02 3.52 2.07 -1.89 -1.85 116.25 124.73 1by1 h VAL 88 Ca -0.06 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.32 1by1 h VAL 88 Cb 0.96 0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 1by1 h VAL 88 CO 0.56 0.09 -0.46 1.23 0.02 0.00 0.00 177.57 179.01 1by1 h GLY 89 N 0.49 -0.90 -1.43 2.17 0.00 -1.93 -1.19 103.07 100.28 1by1 h GLY 89 Ca 0.58 0.56 0.49 0.00 0.00 0.00 0.00 47.33 48.96 1by1 h GLY 89 CO -0.32 -0.25 1.06 -1.33 0.00 0.00 0.00 176.54 175.70 1by1 h GLY 90 N -0.62 0.79 0.00 4.60 0.00 -1.75 0.78 103.07 106.87 1by1 h GLY 90 Ca 0.03 -0.06 -0.12 0.00 0.00 0.00 0.00 47.33 47.18 1by1 h GLY 90 CO -0.32 -0.26 -0.78 0.00 0.00 0.00 0.00 176.54 175.18 1by1 h PHE 92 N -1.00 0.00 0.00 0.00 0.04 0.00 0.23 116.94 116.21 1by1 h PHE 92 Ca -0.18 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.58 1by1 h PHE 92 Cb 0.92 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.07 1by1 h PHE 92 CO 0.02 0.00 -0.07 -0.07 -0.60 0.00 0.00 178.31 177.59 1by1 h LEU 93 N 0.00 0.00 -0.18 1.54 4.07 0.37 -1.72 115.31 119.38 1by1 h LEU 93 Ca 0.16 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.92 1by1 h LEU 93 Cb 0.67 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.39 1by1 h LEU 93 CO -0.00 0.07 -0.93 -1.13 -1.08 0.00 0.00 178.44 175.37 1by1 h ASN 94 N 0.00 0.12 0.41 -0.43 -1.24 -0.65 -3.18 115.58 110.61 1by1 h ASN 94 Ca -0.00 -0.11 0.00 0.00 0.71 0.00 0.00 56.30 56.90 1by1 h ASN 94 Cb 0.57 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.58 1by1 h ASN 94 CO 0.01 0.98 -0.49 0.18 -1.29 0.00 0.00 177.43 176.82 1by1 n LEU 95 N -3.53 0.65 -0.10 0.34 4.77 -1.02 -4.42 117.00 113.69 1by1 n LEU 95 Ca -0.02 -0.09 -0.13 0.00 -0.03 0.00 0.00 56.01 55.73 1by1 n LEU 95 Cb 0.86 -0.21 -0.09 0.00 -2.33 0.00 0.00 43.42 41.65 1by1 n LEU 95 CO 0.47 0.15 0.50 0.24 -1.33 0.00 0.00 177.39 177.42 1by1 h MET 96 N 0.24 -0.40 -0.77 3.23 2.86 -1.30 0.71 114.93 119.50 1by1 h MET 96 Ca 0.00 0.03 0.29 0.00 -2.06 0.00 0.00 59.70 57.95 1by1 h MET 96 Cb 0.50 0.09 -0.14 0.00 0.06 0.00 0.00 31.60 32.11 1by1 h MET 96 CO 0.00 -0.27 0.28 -2.30 1.06 0.00 0.00 176.91 175.68 1by1 n PRO 97 N -5.22 -0.05 -0.07 -0.22 -0.02 -1.26 0.55 135.00 128.70 1by1 n PRO 97 Ca -0.04 1.10 -0.09 0.00 -2.02 0.00 0.00 63.50 62.45 1by1 n PRO 97 Cb 0.33 -1.89 -0.06 0.00 -0.02 0.00 0.00 33.50 31.86 1by1 n PRO 97 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1by1 h GLN 98 N 0.00 0.00 -1.06 -0.52 4.20 -1.60 -3.35 115.11 112.79 1by1 h GLN 98 Ca 0.59 0.00 0.28 0.00 0.06 0.00 0.00 58.65 59.58 1by1 h GLN 98 Cb 1.47 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 29.15 1by1 h GLN 98 CO -0.64 0.42 0.68 1.98 -0.67 0.00 0.00 178.83 180.60 1by1 h MET 99 N -1.00 0.36 -0.82 1.46 4.05 0.59 0.18 114.93 119.76 1by1 h MET 99 Ca -0.08 -0.02 0.01 0.00 -0.28 0.00 0.00 59.70 59.33 1by1 h MET 99 Cb 0.66 -0.08 -0.04 0.00 -0.80 0.00 0.00 31.60 31.33 1by1 h MET 99 CO -0.05 0.24 0.54 -0.22 0.23 0.00 0.00 176.91 177.64 1by1 h LYS 100 N 0.37 1.05 -0.06 0.39 3.64 -0.05 0.13 116.57 122.04 1by1 h LYS 100 Ca 0.61 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.90 1by1 h LYS 100 Cb 1.58 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 33.16 1by1 h LYS 100 CO -0.30 0.70 -0.04 1.15 -2.27 0.00 0.00 179.45 178.69 1by1 h THR 101 N 1.08 1.35 0.05 1.00 2.02 -0.78 -2.44 112.91 115.19 1by1 h THR 101 Ca 0.31 -1.10 -0.00 0.00 0.77 0.00 0.00 66.41 66.38 1by1 h THR 101 Cb -0.09 1.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 1by1 h THR 101 CO -0.08 0.30 -0.02 -0.07 0.37 0.00 0.00 175.52 176.02 1by1 h LEU 102 N -0.29 -0.06 0.10 2.58 3.38 -1.33 -1.20 115.31 118.50 1by1 h LEU 102 Ca 0.01 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1by1 h LEU 102 Cb 0.50 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1by1 h LEU 102 CO 0.01 0.04 -0.17 0.22 0.09 0.00 0.00 178.44 178.63 1by1 h TYR 103 N -0.16 -0.50 -0.74 1.13 5.03 -1.03 0.80 116.97 121.51 1by1 h TYR 103 Ca -0.01 0.01 0.17 0.00 2.58 0.00 0.00 58.73 61.48 1by1 h TYR 103 Cb 0.14 0.20 -0.12 0.00 1.55 0.00 0.00 36.73 38.50 1by1 h TYR 103 CO -0.05 -0.21 0.09 -0.07 -1.32 0.00 0.00 178.16 176.60 1by1 h LEU 104 N -0.29 -0.17 0.25 2.82 3.38 -1.48 0.27 115.31 120.09 1by1 h LEU 104 Ca -0.01 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1by1 h LEU 104 Cb 0.27 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1by1 h LEU 104 CO -0.06 -0.11 -0.12 0.74 0.09 0.00 0.00 178.44 178.97 1by1 h THR 105 N 0.18 0.81 0.20 0.22 2.02 -0.90 -2.14 112.91 113.30 1by1 h THR 105 Ca 0.41 -0.53 0.01 0.00 0.77 0.00 0.00 66.41 67.07 1by1 h THR 105 Cb 0.72 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 68.21 1by1 h THR 105 CO -0.58 0.11 -0.36 0.22 0.37 0.00 0.00 175.52 175.28 1by1 h TYR 106 N -0.62 -1.00 -0.52 3.16 3.20 0.15 1.11 116.97 122.45 1by1 h TYR 106 Ca -0.03 0.02 0.10 0.00 3.14 0.00 0.00 58.73 61.95 1by1 h TYR 106 Cb 0.44 0.41 -0.08 0.00 1.54 0.00 0.00 36.73 39.04 1by1 h TYR 106 CO 0.01 -0.48 0.07 0.00 -1.64 0.00 0.00 178.16 176.12 1by1 h ALA 108 N 1.43 0.85 0.00 0.00 0.00 -1.07 -3.18 119.26 117.29 1by1 h ALA 108 Ca 0.27 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1by1 h ALA 108 Cb 0.39 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1by1 h ALA 108 CO -0.38 0.34 -0.91 -0.91 0.00 0.00 0.00 179.25 177.40 1by1 h ASN 109 N 0.00 0.00 -1.00 0.00 4.21 0.25 -3.39 115.58 115.66 1by1 h ASN 109 Ca -0.00 -0.08 0.19 0.00 1.21 0.00 0.00 56.30 57.62 1by1 h ASN 109 Cb 1.12 0.00 -0.19 0.00 -1.12 0.00 0.00 38.32 38.14 1by1 h ASN 109 CO 0.04 0.04 -0.26 1.57 -1.29 0.00 0.00 177.43 177.52 1by1 n HIS 110 N -2.49 0.32 -0.34 1.19 -0.00 0.43 0.13 115.22 114.47 1by1 n HIS 110 Ca 0.01 1.22 0.07 0.00 0.46 0.00 0.00 57.72 59.48 1by1 n HIS 110 Cb 0.51 -1.05 0.26 0.00 -0.12 0.00 0.00 29.99 29.59 1by1 n HIS 110 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1by1 h PRO 111 N 0.00 0.94 0.05 1.57 0.11 -1.80 -1.83 132.00 131.03 1by1 h PRO 111 Ca 0.46 -0.06 -0.26 0.00 0.11 0.00 0.00 66.00 66.26 1by1 h PRO 111 Cb 0.71 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.59 1by1 h PRO 111 CO -1.02 0.62 -1.29 1.03 -0.21 0.00 0.00 178.00 177.13 1by1 h SER 112 N 0.96 0.17 -0.65 -2.05 0.87 0.22 -3.36 113.55 109.71 1by1 h SER 112 Ca 0.46 -0.21 0.11 0.00 -1.23 0.00 0.00 61.79 60.92 1by1 h SER 112 Cb 0.45 -0.05 -0.12 0.00 -0.44 0.00 0.00 62.40 62.23 1by1 h SER 112 CO -0.22 1.17 -0.35 0.00 -0.53 0.00 0.00 176.83 176.90 1by1 h ALA 113 N 0.80 -0.03 -0.40 6.23 0.00 0.20 1.24 119.26 127.31 1by1 h ALA 113 Ca -0.14 0.18 0.12 0.00 0.00 0.00 0.00 54.91 55.07 1by1 h ALA 113 Cb 1.91 0.82 -0.02 0.00 0.00 0.00 0.00 17.79 20.50 1by1 h ALA 113 CO 0.14 -0.68 0.32 0.28 0.00 0.00 0.00 179.25 179.31 1by1 h VAL 114 N -0.14 0.68 0.01 0.00 2.07 -1.69 -1.39 116.25 115.78 1by1 h VAL 114 Ca 0.25 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.57 1by1 h VAL 114 Cb 0.56 0.77 0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1by1 h VAL 114 CO -0.72 0.00 -0.76 -1.13 0.02 0.00 0.00 177.57 174.98 1by1 h ASN 115 N 0.00 0.66 -0.97 0.57 -1.24 0.13 -3.06 115.58 111.66 1by1 h ASN 115 Ca 0.19 -0.76 0.23 0.00 0.71 0.00 0.00 56.30 56.67 1by1 h ASN 115 Cb 0.82 -0.20 -0.08 0.00 0.73 0.00 0.00 38.32 39.59 1by1 h ASN 115 CO -0.00 1.33 0.63 0.58 -1.29 0.00 0.00 177.43 178.68 1by1 h VAL 116 N 0.05 0.62 0.23 2.57 2.07 0.31 0.64 116.25 122.75 1by1 h VAL 116 Ca -0.10 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1by1 h VAL 116 Cb 1.45 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1by1 h VAL 116 CO 0.15 0.08 -0.11 -0.07 0.02 0.00 0.00 177.57 177.63 1by1 h LEU 117 N 0.42 -0.27 -1.83 2.57 3.38 -1.57 0.38 115.31 118.39 1by1 h LEU 117 Ca 0.52 -0.18 0.21 0.00 0.09 0.00 0.00 57.88 58.53 1by1 h LEU 117 Cb 1.29 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 1by1 h LEU 117 CO -0.23 0.25 0.68 0.74 0.09 0.00 0.00 178.44 179.97 1by1 h THR 118 N -1.00 0.34 0.00 0.22 2.02 -1.31 1.30 112.91 114.48 1by1 h THR 118 Ca -0.03 0.00 -0.25 0.00 0.77 0.00 0.00 66.41 66.90 1by1 h THR 118 Cb 0.43 0.48 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 1by1 h THR 118 CO 0.05 0.00 -1.59 -0.33 0.37 0.00 0.00 175.52 174.02 1by1 h GLU 119 N 0.00 0.00 -0.65 6.66 5.08 -0.84 -3.34 114.58 121.48 1by1 h GLU 119 Ca 0.34 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.33 1by1 h GLU 119 Cb 1.70 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.73 1by1 h GLU 119 CO -0.00 0.43 0.18 0.72 -1.00 0.00 0.00 179.01 179.34 1by1 n HIS 120 N -3.00 2.07 0.07 4.33 8.25 0.36 -4.69 115.22 122.62 1by1 n HIS 120 Ca -0.14 -1.92 -0.13 0.00 -0.26 0.00 0.00 57.72 55.27 1by1 n HIS 120 Cb 0.98 -0.73 -0.08 0.00 1.12 0.00 0.00 29.99 31.27 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 1.23 -0.13 1.14 0.41 0.87 0.90 -2.04 113.55 115.94 1by1 h SER 121 Ca 0.40 -0.21 -0.12 0.00 -1.23 0.00 0.00 61.79 60.64 1by1 h SER 121 Cb 1.90 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 63.87 1by1 h SER 121 CO 0.78 0.14 -0.90 -0.33 -0.53 0.00 0.00 176.83 175.98 1by1 h GLU 122 N -0.41 0.00 0.51 2.24 5.08 -1.85 -2.95 114.58 117.21 1by1 h GLU 122 Ca -0.02 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1by1 h GLU 122 Cb 0.33 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.59 1by1 h GLU 122 CO 0.03 0.37 -0.25 0.93 -1.00 0.00 0.00 179.01 179.09 1by1 h GLU 123 N 0.00 -0.66 -0.02 2.33 4.39 -1.84 0.15 114.58 118.92 1by1 h GLU 123 Ca -0.07 0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.61 1by1 h GLU 123 Cb 1.43 0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 30.22 1by1 h GLU 123 CO 0.05 -0.44 -0.30 -0.07 -1.16 0.00 0.00 179.01 177.09 1by1 h LEU 124 N -1.16 0.04 -0.62 1.33 3.38 -1.55 -2.15 115.31 114.58 1by1 h LEU 124 Ca -0.07 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 1by1 h LEU 124 Cb 0.53 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1by1 h LEU 124 CO 0.12 0.34 -0.56 1.23 0.09 0.00 0.00 178.44 179.65 1by1 h GLY 125 N 0.93 0.00 0.92 0.83 0.00 -1.56 -3.14 103.07 101.05 1by1 h GLY 125 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1by1 h GLY 125 CO 0.04 0.00 0.11 0.83 0.00 0.00 0.00 176.54 177.52 1by1 h GLU 126 N 0.00 0.34 -0.65 4.80 5.08 -0.01 1.17 114.58 125.31 1by1 h GLU 126 Ca -0.01 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1by1 h GLU 126 Cb 1.15 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.32 1by1 h GLU 126 CO 0.07 0.35 0.12 0.27 -1.00 0.00 0.00 179.01 178.82 1by1 h PHE 127 N 0.24 1.13 0.00 4.33 -5.15 -1.58 -2.70 116.94 113.20 1by1 h PHE 127 Ca 0.08 -0.15 0.00 0.00 -0.20 0.00 0.00 57.97 57.70 1by1 h PHE 127 Cb 0.13 -0.31 0.00 0.00 0.22 0.00 0.00 35.95 35.99 1by1 h PHE 127 CO -0.02 0.95 -0.17 1.98 -2.00 0.00 0.00 178.31 179.06 1by1 h MET 128 N 0.98 0.00 -0.73 6.09 4.05 -1.46 -3.35 114.93 120.52 1by1 h MET 128 Ca 0.20 0.00 0.16 0.00 -0.28 0.00 0.00 59.70 59.78 1by1 h MET 128 Cb 0.42 0.00 -0.12 0.00 -0.80 0.00 0.00 31.60 31.10 1by1 h MET 128 CO 0.01 0.00 0.03 1.05 0.23 0.00 0.00 176.91 178.23 1by1 h GLU 129 N 0.00 0.13 -0.66 0.39 4.11 0.18 0.42 114.58 119.14 1by1 h GLU 129 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1by1 h GLU 129 Cb 0.89 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1by1 h GLU 129 CO 0.00 0.08 0.00 -2.37 0.07 0.00 0.00 179.01 176.79 1by1 n THR 130 N -5.30 0.74 0.00 -1.06 5.66 -1.25 -4.27 114.28 108.79 1by1 n THR 130 Ca 0.13 -0.43 -0.01 0.00 -3.05 0.00 0.00 64.05 60.69 1by1 n THR 130 Cb 0.45 -0.23 -0.00 0.00 -1.55 0.00 0.00 70.33 69.00 1by1 n THR 130 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1by1 n LYS 131 N 0.22 0.04 0.00 1.09 4.76 0.14 -5.09 118.16 119.32 1by1 n LYS 131 Ca 0.09 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 1by1 n LYS 131 Cb 0.45 -0.32 0.00 0.00 -1.84 0.00 0.00 35.03 33.32 1by1 n LYS 131 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1by1 n GLY 132 N 2.97 -0.70 3.75 0.72 0.00 -0.78 -5.14 105.19 106.01 1by1 n GLY 132 Ca -0.01 0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1by1 n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1by1 s ALA 133 N 0.00 2.61 1.21 4.61 0.00 -1.25 -4.98 121.76 123.96 1by1 s ALA 133 Ca 0.00 1.17 -0.10 0.00 0.00 0.00 0.00 51.96 53.03 1by1 s ALA 133 Cb 0.00 -3.52 0.16 0.00 0.00 0.00 0.00 23.12 19.77 1by1 s ALA 133 CO 0.00 -1.33 0.37 -1.13 0.00 0.00 0.00 175.76 173.67 1by1 n SER 134 N -1.42 -2.93 -0.17 0.00 3.41 -1.26 -4.86 113.62 106.39 1by1 n SER 134 Ca 0.13 -0.37 -0.09 0.00 -0.26 0.00 0.00 58.87 58.27 1by1 n SER 134 Cb 0.48 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 1by1 n SER 134 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1by1 h SER 135 N -2.70 0.78 0.00 4.04 0.87 -2.06 -3.13 113.55 111.34 1by1 h SER 135 Ca -0.17 -0.27 -0.06 0.00 -1.23 0.00 0.00 61.79 60.06 1by1 h SER 135 Cb 0.56 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.29 1by1 h SER 135 CO 0.10 0.85 -0.10 -2.65 -0.53 0.00 0.00 176.83 174.50 1by1 n PRO 136 N -4.41 1.20 0.00 2.24 -0.02 -1.26 -4.96 135.00 127.78 1by1 n PRO 136 Ca 0.01 -0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.17 1by1 n PRO 136 Cb 0.26 -1.37 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 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 1.91 0.82 0.68 -1.23 0.00 -1.19 -2.85 105.19 103.35 1by1 n GLY 137 Ca 0.14 -0.63 0.12 0.00 0.00 0.00 0.00 46.02 45.65 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 0.14 0.54 -0.61 3.06 -1.26 -4.02 119.36 117.21 1by1 n ILE 138 Ca 0.00 -0.40 0.11 0.00 -2.50 0.00 0.00 62.75 59.96 1by1 n ILE 138 Cb 0.00 0.69 0.44 0.00 0.54 0.00 0.00 39.64 41.30 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 0.61 0.39 -0.35 9.51 4.32 -1.13 -3.88 117.00 126.47 1by1 n LEU 139 Ca 0.17 0.58 0.29 0.00 -0.02 0.00 0.00 56.01 57.03 1by1 n LEU 139 Cb 0.42 -0.50 0.47 0.00 -1.62 0.00 0.00 43.42 42.19 1by1 n LEU 139 CO 0.15 -0.34 0.85 0.52 -1.22 0.00 0.00 177.39 177.35 1by1 n VAL 140 N -1.91 -0.13 -0.25 4.08 0.31 -1.19 -0.01 118.33 119.23 1by1 n VAL 140 Ca 0.04 1.16 0.03 0.00 -0.01 0.00 0.00 64.34 65.55 1by1 n VAL 140 Cb 0.25 -1.90 0.11 0.00 -0.91 0.00 0.00 33.84 31.39 1by1 n VAL 140 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1by1 h LEU 141 N 0.00 -0.50 0.23 7.52 4.07 -1.93 1.05 115.31 125.76 1by1 h LEU 141 Ca 0.59 0.20 0.01 0.00 0.08 0.00 0.00 57.88 58.76 1by1 h LEU 141 Cb 2.02 0.39 -0.04 0.00 1.08 0.00 0.00 40.66 44.11 1by1 h LEU 141 CO -0.25 -0.20 -0.49 0.74 -1.08 0.00 0.00 178.44 177.16 1by1 h THR 142 N 0.05 0.05 -0.05 0.22 2.02 -0.77 0.83 112.91 115.26 1by1 h THR 142 Ca 0.37 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.53 1by1 h THR 142 Cb 0.61 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1by1 h THR 142 CO -0.69 0.00 -0.03 0.71 0.37 0.00 0.00 175.52 175.89 1by1 h THR 143 N -0.80 1.34 -0.24 3.16 1.35 -1.50 -0.76 112.91 115.46 1by1 h THR 143 Ca -0.01 -1.06 -0.03 0.00 -0.55 0.00 0.00 66.41 64.76 1by1 h THR 143 Cb 0.77 1.94 -0.01 0.00 -1.73 0.00 0.00 68.15 69.12 1by1 h THR 143 CO -0.21 0.29 0.03 1.23 -0.25 0.00 0.00 175.52 176.61 1by1 h GLY 144 N -0.29 0.37 -2.34 5.82 0.00 0.12 -2.56 103.07 104.19 1by1 h GLY 144 Ca 0.01 -0.18 -0.06 0.00 0.00 0.00 0.00 47.33 47.10 1by1 h GLY 144 CO 0.01 0.17 0.04 1.04 0.00 0.00 0.00 176.54 177.80 1by1 n LEU 145 N -4.38 4.62 -0.15 3.11 4.77 0.29 -4.54 117.00 120.72 1by1 n LEU 145 Ca 0.00 -3.14 0.09 0.00 -0.03 0.00 0.00 56.01 52.94 1by1 n LEU 145 Cb 0.17 -0.62 0.48 0.00 -2.33 0.00 0.00 43.42 41.13 1by1 n LEU 145 CO 0.37 0.76 0.82 -0.24 -1.33 0.00 0.00 177.39 177.77 1by1 n SER 146 N -0.35 0.46 -2.73 -1.43 2.88 -0.29 -4.25 113.62 107.90 1by1 n SER 146 Ca 0.28 -1.52 -0.07 0.00 -1.33 0.00 0.00 58.87 56.22 1by1 n SER 146 Cb 1.05 -0.03 0.07 0.00 -0.75 0.00 0.00 64.21 64.56 1by1 n SER 146 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1by1 n LYS 147 N -0.48 0.72 -0.07 -1.46 4.81 -1.26 -5.03 118.16 115.39 1by1 n LYS 147 Ca 0.14 -1.58 -0.22 0.00 -0.87 0.00 0.00 58.31 55.78 1by1 n LYS 147 Cb 0.13 -1.06 -0.12 0.00 0.02 0.00 0.00 35.03 34.01 1by1 n LYS 147 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1by1 n PRO 148 N 1.11 0.64 -0.33 1.64 -0.04 -1.26 -4.33 135.00 132.42 1by1 n PRO 148 Ca 0.06 0.42 0.09 0.00 -0.04 0.00 0.00 63.50 64.03 1by1 n PRO 148 Cb 0.67 -1.70 0.26 0.00 -0.04 0.00 0.00 33.50 32.70 1by1 n PRO 148 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1by1 n PHE 149 N -4.04 0.85 0.30 0.54 3.72 -1.26 -4.25 117.46 113.32 1by1 n PHE 149 Ca -0.35 -0.40 0.18 0.00 -0.05 0.00 0.00 57.45 56.82 1by1 n PHE 149 Cb 0.84 -0.04 0.78 0.00 -0.94 0.00 0.00 39.48 40.12 1by1 n PHE 149 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 1by1 h MET 150 N 3.33 0.00 0.00 -1.08 4.05 -1.97 -2.49 114.93 116.77 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 0.85 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.65 1by1 h MET 150 CO 0.04 0.00 0.00 0.54 0.23 0.00 0.00 176.91 177.72 1by1 n ARG 151 N -2.97 0.34 0.10 0.39 5.12 -1.26 -3.48 116.66 114.90 1by1 n ARG 151 Ca -0.00 0.01 0.10 0.00 -1.93 0.00 0.00 57.85 56.03 1by1 n ARG 151 Cb 0.24 -1.50 0.44 0.00 -1.16 0.00 0.00 32.46 30.47 1by1 n ARG 151 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1by1 n LEU 152 N -1.33 0.46 0.30 0.55 4.77 -0.94 -2.67 117.00 118.14 1by1 n LEU 152 Ca 0.13 0.64 0.19 0.00 -0.03 0.00 0.00 56.01 56.93 1by1 n LEU 152 Cb 0.25 -0.61 1.01 0.00 -2.33 0.00 0.00 43.42 41.75 1by1 n LEU 152 CO 0.23 -0.57 1.16 0.44 -1.33 0.00 0.00 177.39 177.31 1by1 h ASP 153 N 0.00 0.00 0.00 -1.43 5.19 -1.80 -1.74 116.42 116.64 1by1 h ASP 153 Ca 0.00 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.37 1by1 h ASP 153 Cb 0.24 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.74 1by1 h ASP 153 CO 0.00 0.00 -1.74 0.29 -3.12 0.00 0.00 179.24 174.67 1by1 n LYS 154 N -3.43 0.66 -0.40 3.56 5.02 -1.09 -4.68 118.16 117.80 1by1 n LYS 154 Ca -0.02 -0.12 -0.08 0.00 -2.02 0.00 0.00 58.31 56.07 1by1 n LYS 154 Cb 0.17 -1.36 -0.06 0.00 -0.02 0.00 0.00 35.03 33.75 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 -1.68 -0.32 2.13 -1.99 -1.38 0.28 116.97 114.01 1by1 h TYR 155 Ca -0.06 0.12 0.09 0.00 2.00 0.00 0.00 58.73 60.88 1by1 h TYR 155 Cb 0.89 0.87 -0.01 0.00 2.00 0.00 0.00 36.73 40.47 1by1 h TYR 155 CO 0.00 -0.38 0.81 -1.35 -0.00 0.00 0.00 178.16 177.23 1by1 h PRO 156 N -0.01 0.00 0.49 4.88 0.11 -1.84 -1.27 132.00 134.37 1by1 h PRO 156 Ca 0.21 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.29 1by1 h PRO 156 Cb 0.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.58 1by1 h PRO 156 CO -0.95 0.00 -0.24 1.15 -0.21 0.00 0.00 178.00 177.76 1by1 h THR 157 N 0.00 0.42 -0.62 -1.15 2.02 -0.77 -2.07 112.91 110.73 1by1 h THR 157 Ca 0.15 -0.38 0.09 0.00 0.77 0.00 0.00 66.41 67.04 1by1 h THR 157 Cb 1.76 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 68.69 1by1 h THR 157 CO -0.00 0.05 0.42 -0.07 0.37 0.00 0.00 175.52 176.29 1by1 h LEU 158 N -0.92 0.43 -1.62 2.58 3.38 -1.36 0.22 115.31 118.02 1by1 h LEU 158 Ca -0.07 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1by1 h LEU 158 Cb 0.60 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1by1 h LEU 158 CO 0.11 0.26 0.03 -0.07 0.09 0.00 0.00 178.44 178.87 1by1 h LEU 159 N 0.48 0.25 0.00 1.67 3.38 -1.39 -0.48 115.31 119.22 1by1 h LEU 159 Ca 0.29 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1by1 h LEU 159 Cb 0.49 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1by1 h LEU 159 CO -0.08 0.27 -0.59 1.17 0.09 0.00 0.00 178.44 179.29 1by1 n LYS 160 N -4.41 0.46 -0.32 1.13 4.81 0.43 -3.61 118.16 116.65 1by1 n LYS 160 Ca -0.00 0.47 -0.05 0.00 -0.87 0.00 0.00 58.31 57.87 1by1 n LYS 160 Cb 0.15 -1.65 0.08 0.00 0.02 0.00 0.00 35.03 33.64 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 1.22 -0.15 1.64 5.08 -0.80 -1.88 114.58 118.69 1by1 h GLU 161 Ca 0.00 -0.16 -0.19 0.00 -1.00 0.00 0.00 59.36 58.01 1by1 h GLU 161 Cb 0.59 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1by1 h GLU 161 CO 0.00 0.92 -0.69 1.25 -1.00 0.00 0.00 179.01 179.49 1by1 h LEU 162 N 1.21 0.70 -1.01 1.33 5.85 -1.25 -3.23 115.31 118.91 1by1 h LEU 162 Ca 0.30 -0.43 -0.10 0.00 0.84 0.00 0.00 57.88 58.49 1by1 h LEU 162 Cb 0.08 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1by1 h LEU 162 CO -0.04 1.19 -0.48 -0.08 -0.34 0.00 0.00 178.44 178.68 1by1 h GLU 163 N 0.43 0.00 -0.71 1.25 4.81 -1.28 -3.10 114.58 115.98 1by1 h GLU 163 Ca -0.02 0.00 0.21 0.00 -0.13 0.00 0.00 59.36 59.41 1by1 h GLU 163 Cb 1.27 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.63 1by1 h GLU 163 CO 0.13 0.48 0.78 0.00 -0.73 0.00 0.00 179.01 179.67 1by1 h ARG 164 N 0.00 0.00 0.00 1.92 3.08 -1.37 -3.45 114.38 114.57 1by1 h ARG 164 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1by1 h ARG 164 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.93 1by1 h ARG 164 CO 0.06 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.68 1by1 n HIS 165 N -3.55 0.00 -0.69 3.04 8.25 -1.17 -1.40 115.22 119.70 1by1 n HIS 165 Ca 0.15 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.68 1by1 n HIS 165 Cb 1.02 0.00 0.13 0.00 1.12 0.00 0.00 29.99 32.26 1by1 n HIS 165 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1by1 n MET 166 N 0.00 2.20 0.00 -0.41 -0.00 -1.26 -5.02 117.12 112.63 1by1 n MET 166 Ca 0.00 -2.31 0.00 0.00 -0.00 0.00 0.00 57.70 55.39 1by1 n MET 166 Cb 0.00 -1.42 0.00 0.00 -0.00 0.00 0.00 33.22 31.80 1by1 n MET 166 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1by1 n GLU 167 N -0.82 0.00 -1.65 3.17 1.02 -0.49 -4.80 120.64 117.07 1by1 n GLU 167 Ca 0.13 0.00 -0.52 0.00 -0.02 0.00 0.00 57.16 56.75 1by1 n GLU 167 Cb 0.57 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.93 1by1 n GLU 167 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1by1 n ASP 168 N 0.95 2.89 -2.18 1.62 8.00 -1.26 -4.08 116.55 122.48 1by1 n ASP 168 Ca 0.00 0.90 -0.03 0.00 0.71 0.00 0.00 54.79 56.38 1by1 n ASP 168 Cb 0.00 -1.28 -0.02 0.00 -0.02 0.00 0.00 41.12 39.80 1by1 n ASP 168 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1by1 n TYR 169 N 6.86 -3.44 -3.06 1.24 4.02 -1.26 -5.03 117.16 116.49 1by1 n TYR 169 Ca 0.27 2.02 -0.17 0.00 -0.01 0.00 0.00 57.90 60.02 1by1 n TYR 169 Cb 0.23 -3.33 -0.01 0.00 -0.02 0.00 0.00 39.34 36.21 1by1 n TYR 169 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 176.86 177.43 1by1 n HIS 170 N 1.30 -0.83 0.33 -0.72 -0.00 -1.26 -4.90 115.22 109.14 1by1 n HIS 170 Ca -0.19 -3.26 0.13 0.00 0.46 0.00 0.00 57.72 54.86 1by1 n HIS 170 Cb 0.30 0.17 0.59 0.00 -0.12 0.00 0.00 29.99 30.94 1by1 n HIS 170 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1by1 h THR 171 N 1.76 0.00 -0.13 3.57 1.03 -1.96 -2.67 112.91 114.51 1by1 h THR 171 Ca 0.03 -0.23 0.00 0.00 -0.01 0.00 0.00 66.41 66.21 1by1 h THR 171 Cb 0.98 0.98 0.00 0.00 -1.07 0.00 0.00 68.15 69.04 1by1 h THR 171 CO 0.40 0.00 0.00 0.47 -0.01 0.00 0.00 175.52 176.38 1by1 n ASP 172 N -2.45 1.10 0.21 0.00 8.00 -1.26 -4.15 116.55 117.99 1by1 n ASP 172 Ca 0.01 -2.05 0.18 0.00 0.71 0.00 0.00 54.79 53.64 1by1 n ASP 172 Cb 0.20 -0.23 0.80 0.00 -0.02 0.00 0.00 41.12 41.87 1by1 n ASP 172 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 1by1 h ARG 173 N 0.81 0.00 -1.27 -1.24 -0.00 -1.90 -1.57 114.38 109.22 1by1 h ARG 173 Ca 0.00 0.00 0.37 0.00 -0.00 0.00 0.00 59.98 60.35 1by1 h ARG 173 Cb 0.36 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 30.28 1by1 h ARG 173 CO 0.03 0.00 0.99 -0.56 -0.00 0.00 0.00 179.97 180.43 1by1 h GLN 174 N 0.00 0.00 -0.17 0.08 3.07 -1.88 1.28 115.11 117.49 1by1 h GLN 174 Ca 0.10 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.72 1by1 h GLN 174 Cb 0.81 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.36 1by1 h GLN 174 CO -0.00 0.00 -0.38 -0.44 0.09 0.00 0.00 178.83 178.09 1by1 h ASP 175 N 0.00 0.39 -0.42 0.06 5.19 -1.65 -3.03 116.42 116.96 1by1 h ASP 175 Ca 0.60 -0.16 -0.10 0.00 -0.62 0.00 0.00 57.03 56.75 1by1 h ASP 175 Cb 2.57 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 41.96 1by1 h ASP 175 CO -0.01 0.74 -0.12 0.40 -3.12 0.00 0.00 179.24 177.14 1by1 h ILE 176 N 0.31 1.27 -0.50 0.35 2.04 0.14 -2.62 117.51 118.51 1by1 h ILE 176 Ca 0.03 -1.23 0.15 0.00 1.00 0.00 0.00 64.86 64.81 1by1 h ILE 176 Cb 0.82 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 1by1 h ILE 176 CO 0.07 0.42 0.37 1.56 0.00 0.00 0.00 178.15 180.56 1by1 h GLN 177 N 0.65 0.00 0.13 2.37 4.20 -1.38 0.80 115.11 121.87 1by1 h GLN 177 Ca 0.10 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.53 1by1 h GLN 177 Cb 0.66 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.45 1by1 h GLN 177 CO 0.05 0.00 -1.24 -0.22 -0.67 0.00 0.00 178.83 176.74 1by1 h LYS 178 N 0.00 0.41 0.14 1.46 3.11 -1.45 -2.29 116.57 117.94 1by1 h LYS 178 Ca 0.24 -0.62 -0.01 0.00 -2.81 0.00 0.00 60.65 57.46 1by1 h LYS 178 Cb 0.98 0.22 0.00 0.00 -1.00 0.00 0.00 32.23 32.42 1by1 h LYS 178 CO -0.00 1.27 -0.07 0.77 -2.81 0.00 0.00 179.45 178.61 1by1 h SER 179 N 0.15 -0.16 -0.72 4.20 0.02 -0.82 -2.32 113.55 113.89 1by1 h SER 179 Ca -0.16 -0.38 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 1by1 h SER 179 Cb 1.94 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 64.48 1by1 h SER 179 CO 0.22 0.42 0.46 0.00 -1.14 0.00 0.00 176.83 176.78 1by1 h MET 180 N -0.88 0.98 0.00 3.45 -0.00 -1.07 0.60 114.93 118.01 1by1 h MET 180 Ca -0.02 -0.07 0.00 0.00 -0.00 0.00 0.00 59.70 59.61 1by1 h MET 180 Cb 0.53 -0.21 0.00 0.00 -0.00 0.00 0.00 31.60 31.91 1by1 h MET 180 CO 0.03 0.67 0.00 0.00 -0.00 0.00 0.00 176.91 177.61 1by1 h ALA 181 N 1.50 1.00 0.11 -3.00 0.00 -1.48 -1.68 119.26 115.70 1by1 h ALA 181 Ca 0.26 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.82 1by1 h ALA 181 Cb -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1by1 h ALA 181 CO -0.05 0.00 -1.97 0.00 0.00 0.00 0.00 179.25 177.23 1by1 n ALA 182 N -2.04 0.98 0.01 0.00 0.00 -0.33 -2.51 120.51 116.61 1by1 n ALA 182 Ca 0.01 -0.62 -0.09 0.00 0.00 0.00 0.00 53.44 52.74 1by1 n ALA 182 Cb 0.33 -0.69 0.07 0.00 0.00 0.00 0.00 19.45 19.15 1by1 n ALA 182 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1by1 h PHE 183 N 0.06 0.67 0.24 0.00 3.04 -0.90 -3.24 116.94 116.82 1by1 h PHE 183 Ca -0.41 -0.23 -0.34 0.00 3.98 0.00 0.00 57.97 60.97 1by1 h PHE 183 Cb 2.03 -0.13 0.03 0.00 2.56 0.00 0.00 35.95 40.45 1by1 h PHE 183 CO 0.07 0.95 -1.50 -0.22 -2.02 0.00 0.00 178.31 175.59 1by1 h LYS 184 N 0.42 0.52 -0.95 1.11 3.64 -1.48 -3.29 116.57 116.54 1by1 h LYS 184 Ca 0.01 -0.88 0.28 0.00 -1.27 0.00 0.00 60.65 58.79 1by1 h LYS 184 Cb 1.06 0.33 -0.04 0.00 -0.41 0.00 0.00 32.23 33.17 1by1 h LYS 184 CO 0.10 1.42 0.92 -0.91 -2.27 0.00 0.00 179.45 178.71 1by1 h ASN 185 N 0.14 0.00 -0.43 4.20 2.35 -1.52 0.54 115.58 120.86 1by1 h ASN 185 Ca -0.26 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.47 1by1 h ASN 185 Cb 2.16 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 40.51 1by1 h ASN 185 CO 0.26 0.00 0.19 -0.07 -1.65 0.00 0.00 177.43 176.16 1by1 h LEU 186 N 0.00 0.58 0.13 1.61 3.38 -1.63 -0.25 115.31 119.13 1by1 h LEU 186 Ca 0.45 -0.15 -0.29 0.00 0.09 0.00 0.00 57.88 57.98 1by1 h LEU 186 Cb 2.29 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 42.90 1by1 h LEU 186 CO -0.00 0.58 -1.28 -1.28 0.09 0.00 0.00 178.44 176.55 1by1 h SER 187 N 0.55 0.57 -0.32 -0.43 0.87 -0.21 -2.87 113.55 111.72 1by1 h SER 187 Ca 0.15 -0.59 0.04 0.00 -1.23 0.00 0.00 61.79 60.16 1by1 h SER 187 Cb 0.16 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 61.90 1by1 h SER 187 CO -0.01 1.45 0.09 0.00 -0.53 0.00 0.00 176.83 177.82 1by1 h ALA 188 N 0.47 0.35 -0.47 6.23 0.00 -1.03 -1.05 119.26 123.75 1by1 h ALA 188 Ca -0.16 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1by1 h ALA 188 Cb 1.98 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.81 1by1 h ALA 188 CO 0.22 -0.32 -0.15 1.96 0.00 0.00 0.00 179.25 180.96 1by1 h GLN 189 N 0.21 0.94 -0.27 0.00 7.50 -1.13 -2.99 115.11 119.37 1by1 h GLN 189 Ca 0.14 -0.38 -0.03 0.00 0.50 0.00 0.00 58.65 58.89 1by1 h GLN 189 Cb 0.14 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 27.61 1by1 h GLN 189 CO -0.17 1.04 0.05 0.00 -1.50 0.00 0.00 178.83 178.25 1by1 h GLN 191 N 0.39 0.15 0.00 0.00 4.20 -1.04 -0.94 115.11 117.86 1by1 h GLN 191 Ca 0.09 -0.01 -0.38 0.00 0.06 0.00 0.00 58.65 58.42 1by1 h GLN 191 Cb 0.18 -0.03 -0.07 0.00 0.30 0.00 0.00 27.48 27.86 1by1 h GLN 191 CO -0.00 0.10 -2.42 0.39 -0.67 0.00 0.00 178.83 176.23 1by1 n GLU 192 N -4.38 0.68 0.11 1.46 1.02 -0.93 -4.35 120.64 114.25 1by1 n GLU 192 Ca 0.27 0.09 0.19 0.00 -0.02 0.00 0.00 57.16 57.69 1by1 n GLU 192 Cb 1.16 -1.51 0.76 0.00 -0.02 0.00 0.00 31.44 31.82 1by1 n GLU 192 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1by1 h VAL 193 N 0.00 0.54 -0.52 2.62 2.07 -0.59 0.11 116.25 120.48 1by1 h VAL 193 Ca -0.56 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.06 1by1 h VAL 193 Cb 2.00 0.75 -0.08 0.00 -1.52 0.00 0.00 31.29 32.44 1by1 h VAL 193 CO -0.05 0.00 0.03 0.03 0.02 0.00 0.00 177.57 177.61 1by1 h ARG 194 N 0.00 0.15 0.00 1.57 3.08 -1.41 -3.09 114.38 114.68 1by1 h ARG 194 Ca 0.17 -0.01 -0.37 0.00 0.07 0.00 0.00 59.98 59.84 1by1 h ARG 194 Cb 0.81 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.76 1by1 h ARG 194 CO -0.00 0.10 -2.33 1.63 -1.07 0.00 0.00 179.97 178.30 1by1 n LYS 195 N -5.20 0.68 -1.42 0.04 5.02 -0.83 -4.55 118.16 111.90 1by1 n LYS 195 Ca 0.06 0.05 -0.48 0.00 -2.02 0.00 0.00 58.31 55.92 1by1 n LYS 195 Cb 0.28 -1.55 -0.12 0.00 -0.02 0.00 0.00 35.03 33.62 1by1 n LYS 195 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1by1 n ARG 196 N -2.87 0.18 -1.22 1.97 3.00 0.32 0.17 116.66 118.21 1by1 n ARG 196 Ca -0.33 0.03 -0.10 0.00 -0.00 0.00 0.00 57.85 57.44 1by1 n ARG 196 Cb 1.12 -1.73 -0.04 0.00 0.00 0.00 0.00 32.46 31.80 1by1 n ARG 196 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 1by1 n LYS 197 N 8.19 -1.48 0.08 -0.14 2.85 -1.26 -4.76 118.16 121.63 1by1 n LYS 197 Ca 0.58 0.70 -0.15 0.00 -1.05 0.00 0.00 58.31 58.39 1by1 n LYS 197 Cb 0.06 -4.85 -0.14 0.00 -0.65 0.00 0.00 35.03 29.46 1by1 n LYS 197 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1by1 h GLU 198 N 0.00 0.22 0.57 -1.58 5.08 -0.52 -3.37 114.58 114.98 1by1 h GLU 198 Ca -0.21 -0.38 -0.03 0.00 -1.00 0.00 0.00 59.36 57.74 1by1 h GLU 198 Cb 0.85 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 1by1 h GLU 198 CO 0.31 1.12 -0.34 1.25 -1.00 0.00 0.00 179.01 180.35 1by1 h LEU 199 N 0.06 -0.84 0.00 1.33 7.12 -1.85 -3.48 115.31 117.65 1by1 h LEU 199 Ca -0.18 0.04 0.00 0.00 0.13 0.00 0.00 57.88 57.88 1by1 h LEU 199 Cb 1.97 0.24 0.00 0.00 -0.53 0.00 0.00 40.66 42.34 1by1 h LEU 199 CO 0.17 -0.52 0.00 -1.84 -0.13 0.00 0.00 178.44 176.12 1by1 n GLU 200 N -4.48 0.00 -3.63 1.25 0.28 -1.26 -5.08 120.64 107.72 1by1 n GLU 200 Ca -0.10 0.00 -0.25 0.00 -0.16 0.00 0.00 57.16 56.65 1by1 n GLU 200 Cb 0.35 0.00 0.01 0.00 1.43 0.00 0.00 31.44 33.23 1by1 n GLU 200 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1by1 n LEU 201 N -2.56 -2.70 0.00 -1.84 4.77 -1.26 -4.96 117.00 108.44 1by1 n LEU 201 Ca 0.00 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 1by1 n LEU 201 Cb 0.00 -1.85 0.00 0.00 -2.33 0.00 0.00 43.42 39.24 1by1 n LEU 201 CO 0.00 0.07 0.00 1.67 -1.33 0.00 0.00 177.39 177.80 1by1 n GLN 202 N -1.97 0.00 0.00 3.23 -0.06 -1.26 -4.45 117.38 112.86 1by1 n GLN 202 Ca -0.23 0.00 0.14 0.00 -2.00 0.00 0.00 57.00 54.92 1by1 n GLN 202 Cb 0.67 -0.25 0.71 0.00 -4.06 0.00 0.00 30.24 27.31 1by1 n GLN 202 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 1by1 n ILE 203 N -2.10 0.02 0.33 1.69 5.41 -1.26 -3.14 119.36 120.31 1by1 n ILE 203 Ca 0.00 0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.87 1by1 n ILE 203 Cb 0.00 -0.51 0.13 0.00 -0.71 0.00 0.00 39.64 38.55 1by1 n ILE 203 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1by1 h LEU 204 N 0.00 0.00 -8.62 1.39 3.38 -1.97 -3.44 115.31 106.06 1by1 h LEU 204 Ca 0.00 -0.07 -0.60 0.00 0.09 0.00 0.00 57.88 57.30 1by1 h LEU 204 Cb 0.35 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.99 1by1 h LEU 204 CO 0.00 0.03 0.60 -0.89 0.09 0.00 0.00 178.44 178.27 1by1 s THR 205 N -3.24 4.43 0.59 0.22 2.01 -1.19 -5.04 115.64 113.42 1by1 s THR 205 Ca 0.04 0.63 -0.10 0.00 0.31 0.00 0.00 61.69 62.58 1by1 s THR 205 Cb 0.10 -4.48 0.15 0.00 0.01 0.00 0.00 72.50 68.28 1by1 s THR 205 CO 0.72 -0.93 0.49 -0.62 -0.69 0.00 0.00 174.62 173.59 1by1 n GLU 206 N 7.30 -2.22 -0.07 4.92 1.02 -1.26 -5.00 120.64 125.33 1by1 n GLU 206 Ca 0.05 -0.79 -0.15 0.00 -0.02 0.00 0.00 57.16 56.25 1by1 n GLU 206 Cb 0.48 -0.78 -0.05 0.00 -0.02 0.00 0.00 31.44 31.07 1by1 n GLU 206 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1by1 n ALA 207 N -3.94 2.06 -1.84 0.62 0.00 -1.26 -4.97 120.51 111.18 1by1 n ALA 207 Ca -0.09 -0.57 -0.42 0.00 0.00 0.00 0.00 53.44 52.35 1by1 n ALA 207 Cb 0.27 0.31 -0.03 0.00 0.00 0.00 0.00 19.45 20.01 1by1 n ALA 207 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1by1 s ILE 208 N -2.26 3.16 -1.36 0.00 -1.09 -1.26 -5.34 121.20 113.04 1by1 s ILE 208 Ca -0.20 0.35 0.11 0.00 -2.23 0.00 0.00 60.65 58.68 1by1 s ILE 208 Cb 0.08 -3.23 0.09 0.00 -1.58 0.00 0.00 42.46 37.82 1by1 s ILE 208 CO 0.25 -0.02 0.85 0.54 -1.23 0.00 0.00 174.94 175.33