#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rvb h LEU 3 N 0.00 0.41 -0.27 1.04 5.85 -1.99 -1.05 115.31 119.30 1rvb h LEU 3 Ca 0.00 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1rvb h LEU 3 Cb 0.00 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1rvb h LEU 3 CO 0.00 0.29 0.13 -0.09 -0.34 0.00 0.00 178.44 178.43 1rvb h ARG 4 N 0.53 0.40 -0.45 1.25 2.43 -2.00 0.26 114.38 116.80 1rvb h ARG 4 Ca 0.21 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.22 1rvb h ARG 4 Cb 0.08 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1rvb h ARG 4 CO -0.12 0.39 -0.10 0.66 -1.51 0.00 0.00 179.97 179.29 1rvb h SER 5 N 0.31 0.87 -0.19 -3.80 4.64 -1.96 -1.17 113.55 112.24 1rvb h SER 5 Ca 0.09 -0.36 -0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1rvb h SER 5 Cb 0.13 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 1rvb h SER 5 CO -0.01 1.03 0.11 0.44 -0.87 0.00 0.00 176.83 177.53 1rvb h ASP 6 N 0.71 0.24 -0.68 4.97 3.32 -1.11 -0.43 116.42 123.42 1rvb h ASP 6 Ca 0.12 -0.07 0.04 0.00 0.02 0.00 0.00 57.03 57.13 1rvb h ASP 6 Cb 0.64 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 40.09 1rvb h ASP 6 CO 0.04 0.24 0.42 0.25 -1.72 0.00 0.00 179.24 178.47 1rvb h LEU 7 N 0.22 0.67 -0.76 1.55 5.85 -0.84 -0.63 115.31 121.39 1rvb h LEU 7 Ca 0.07 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.72 1rvb h LEU 7 Cb 0.05 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1rvb h LEU 7 CO -0.01 0.46 0.12 0.40 -0.34 0.00 0.00 178.44 179.06 1rvb h ILE 8 N 0.81 1.26 -0.13 4.05 2.04 -0.89 -1.40 117.51 123.25 1rvb h ILE 8 Ca 0.28 -1.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.12 1rvb h ILE 8 Cb 0.05 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1rvb h ILE 8 CO -0.12 0.38 0.00 0.78 0.00 0.00 0.00 178.15 179.19 1rvb h ASN 9 N 1.00 0.22 -1.00 1.72 2.35 -0.64 -2.50 115.58 116.73 1rvb h ASN 9 Ca 0.20 -0.30 0.07 0.00 -0.55 0.00 0.00 56.30 55.72 1rvb h ASN 9 Cb 0.41 -0.06 -0.07 0.00 0.05 0.00 0.00 38.32 38.66 1rvb h ASN 9 CO 0.01 0.47 0.64 0.00 -1.65 0.00 0.00 177.43 176.90 1rvb h ALA 10 N 0.76 1.39 -0.54 -0.83 0.00 -1.01 -2.12 119.26 116.92 1rvb h ALA 10 Ca 0.04 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1rvb h ALA 10 Cb 0.35 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1rvb h ALA 10 CO 0.01 0.43 0.10 -0.07 0.00 0.00 0.00 179.25 179.72 1rvb h LEU 11 N 1.17 0.84 -0.14 0.00 3.38 -1.15 -1.71 115.31 117.70 1rvb h LEU 11 Ca 0.43 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 1rvb h LEU 11 Cb 0.18 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1rvb h LEU 11 CO -0.18 0.88 0.07 1.88 0.09 0.00 0.00 178.44 181.18 1rvb h TYR 12 N 0.77 0.20 0.82 1.13 0.05 -0.95 -2.42 116.97 116.58 1rvb h TYR 12 Ca 0.17 -0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.90 1rvb h TYR 12 Cb 0.38 -0.06 0.01 0.00 1.01 0.00 0.00 36.73 38.07 1rvb h TYR 12 CO 0.03 0.24 -0.39 -0.44 -1.05 0.00 0.00 178.16 176.55 1rvb h ASP 13 N 0.10 -0.93 -0.50 3.88 3.32 -1.36 -1.12 116.42 119.81 1rvb h ASP 13 Ca 0.05 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.23 1rvb h ASP 13 Cb 0.12 0.24 -0.10 0.00 0.22 0.00 0.00 39.33 39.81 1rvb h ASP 13 CO -0.01 -0.60 -0.18 -0.08 -1.72 0.00 0.00 179.24 176.65 1rvb h GLU 14 N -1.23 -0.07 -0.30 3.56 4.57 -1.40 0.15 114.58 119.86 1rvb h GLU 14 Ca -0.11 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.01 1rvb h GLU 14 Cb 0.85 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.43 1rvb h GLU 14 CO 0.19 -0.04 -0.06 -0.97 -1.18 0.00 0.00 179.01 176.94 1rvb h ASN 15 N -0.07 0.46 1.39 1.04 -1.24 -1.46 0.56 115.58 116.26 1rvb h ASN 15 Ca 0.24 -0.10 -0.04 0.00 0.71 0.00 0.00 56.30 57.11 1rvb h ASN 15 Cb 0.43 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.36 1rvb h ASN 15 CO -0.55 0.57 -0.19 -0.61 -1.29 0.00 0.00 177.43 175.36 1rvb h GLN 16 N 0.46 0.00 0.00 6.67 4.15 0.14 -3.29 115.11 123.24 1rvb h GLN 16 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1rvb h GLN 16 Cb 0.39 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.08 1rvb h GLN 16 CO 0.02 0.19 -1.72 1.63 -1.93 0.00 0.00 178.83 177.02 1rvb n LYS 17 N -3.22 0.55 -4.60 1.69 5.02 0.38 -4.99 118.16 113.00 1rvb n LYS 17 Ca 0.02 -0.13 -0.22 0.00 -2.02 0.00 0.00 58.31 55.95 1rvb n LYS 17 Cb 0.52 -1.55 -0.15 0.00 -0.02 0.00 0.00 35.03 33.82 1rvb n LYS 17 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1rvb s TYR 18 N -3.42 1.25 -0.16 2.13 2.02 0.12 -5.07 117.35 114.23 1rvb s TYR 18 Ca -0.05 -0.30 0.00 0.00 -0.37 0.00 0.00 57.07 56.36 1rvb s TYR 18 Cb 0.14 -0.85 0.03 0.00 -0.40 0.00 0.00 41.96 40.88 1rvb s TYR 18 CO 0.89 -0.09 -0.13 -0.51 -1.57 0.00 0.00 175.55 174.14 1rvb s ASP 19 N -0.03 2.77 0.15 2.29 1.01 -1.26 -4.75 116.67 116.86 1rvb s ASP 19 Ca -0.00 -0.55 -0.30 0.00 0.71 0.00 0.00 52.55 52.41 1rvb s ASP 19 Cb -0.08 -1.15 -0.07 0.00 1.01 0.00 0.00 42.92 42.63 1rvb s ASP 19 CO 0.01 -0.08 1.12 -0.69 0.21 0.00 0.00 175.17 175.73 1rvb s VAL 20 N 1.50 3.90 0.00 -1.27 1.01 -1.26 -4.95 120.40 119.33 1rvb s VAL 20 Ca 0.04 1.57 0.00 0.00 0.00 0.00 0.00 61.98 63.59 1rvb s VAL 20 Cb -0.13 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.24 1rvb s VAL 20 CO -0.10 0.24 0.25 0.00 0.00 0.00 0.00 175.10 175.49 1rvb n GLY 22 N 0.05 -0.06 3.82 0.00 0.00 -1.26 -3.87 105.19 103.86 1rvb n GLY 22 Ca 0.00 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.67 1rvb n GLY 22 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1rvb s ILE 23 N -2.00 4.73 0.01 -0.61 -4.36 -0.02 -4.92 121.20 114.03 1rvb s ILE 23 Ca 0.00 -0.74 0.06 0.00 -0.26 0.00 0.00 60.65 59.70 1rvb s ILE 23 Cb 0.00 -3.32 -0.02 0.00 1.25 0.00 0.00 42.46 40.37 1rvb s ILE 23 CO 0.00 0.08 -0.18 -0.51 0.24 0.00 0.00 174.94 174.57 1rvb s ILE 24 N -1.49 1.41 0.32 8.37 2.07 -1.26 -0.83 121.20 129.79 1rvb s ILE 24 Ca 0.31 -0.91 -0.02 0.00 -1.41 0.00 0.00 60.65 58.62 1rvb s ILE 24 Cb -0.12 -1.21 -0.04 0.00 0.13 0.00 0.00 42.46 41.23 1rvb s ILE 24 CO 0.24 0.28 0.55 -0.94 -1.91 0.00 0.00 174.94 173.15 1rvb s SER 25 N -0.74 6.35 0.57 4.50 1.04 -0.60 -4.97 113.70 119.85 1rvb s SER 25 Ca 0.06 0.56 0.27 0.00 0.48 0.00 0.00 55.95 57.32 1rvb s SER 25 Cb -0.07 -2.08 1.56 0.00 0.10 0.00 0.00 66.02 65.52 1rvb s SER 25 CO 0.00 -0.25 2.05 0.00 0.98 0.00 0.00 173.24 176.02 1rvb h ALA 26 N 1.17 2.01 -0.03 5.32 0.00 -2.01 0.41 119.26 126.13 1rvb h ALA 26 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1rvb h ALA 26 Cb 1.21 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1rvb h ALA 26 CO 0.64 -0.42 0.00 0.39 0.00 0.00 0.00 179.25 179.86 1rvb n GLU 27 N -3.93 1.14 -0.77 0.00 4.71 -1.26 -4.91 120.64 115.61 1rvb n GLU 27 Ca 0.04 -0.20 0.00 0.00 -0.01 0.00 0.00 57.16 56.99 1rvb n GLU 27 Cb 0.42 -1.29 0.00 0.00 -1.01 0.00 0.00 31.44 29.56 1rvb n GLU 27 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1rvb n GLY 28 N 0.84 0.69 3.68 0.62 0.00 0.13 -5.04 105.19 106.11 1rvb n GLY 28 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1rvb n GLY 28 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rvb s LYS 29 N -0.23 4.28 -0.19 1.61 2.20 -1.25 -3.87 119.74 122.29 1rvb s LYS 29 Ca 0.00 0.65 -0.08 0.00 -0.36 0.00 0.00 55.97 56.18 1rvb s LYS 29 Cb 0.00 -3.53 -0.04 0.00 -1.51 0.00 0.00 37.83 32.75 1rvb s LYS 29 CO 0.00 -0.11 0.07 0.42 -0.36 0.00 0.00 175.35 175.37 1rvb s ILE 30 N 1.47 4.78 -0.17 5.43 1.01 0.61 -1.56 121.20 132.78 1rvb s ILE 30 Ca 0.30 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.86 1rvb s ILE 30 Cb -0.16 -3.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 1rvb s ILE 30 CO 0.12 0.45 0.01 -0.31 0.00 0.00 0.00 174.94 175.21 1rvb s TYR 31 N 0.50 3.12 0.92 3.97 1.51 -0.01 -0.81 117.35 126.55 1rvb s TYR 31 Ca 0.03 -0.16 -0.11 0.00 -1.01 0.00 0.00 57.07 55.82 1rvb s TYR 31 Cb -0.13 -2.03 0.14 0.00 -0.11 0.00 0.00 41.96 39.84 1rvb s TYR 31 CO 0.01 0.01 1.09 -1.25 -1.11 0.00 0.00 175.55 174.30 1rvb s PRO 32 N 0.47 1.04 0.25 -1.71 0.04 -1.26 -0.85 135.00 132.99 1rvb s PRO 32 Ca -0.00 1.00 -0.17 0.00 0.04 0.00 0.00 61.00 61.86 1rvb s PRO 32 Cb -0.13 -1.77 -0.08 0.00 0.04 0.00 0.00 34.50 32.55 1rvb s PRO 32 CO 0.02 -2.44 0.71 -0.51 0.04 0.00 0.00 177.00 174.82 1rvb s LEU 33 N -6.39 4.25 0.71 -3.56 1.43 -1.25 -4.75 118.68 109.11 1rvb s LEU 33 Ca 0.64 1.34 -0.10 0.00 -1.03 0.00 0.00 54.13 54.98 1rvb s LEU 33 Cb -0.20 -3.73 0.04 0.00 0.03 0.00 0.00 46.19 42.33 1rvb s LEU 33 CO 0.58 -0.04 1.07 -0.83 0.23 0.00 0.00 176.35 177.36 1rvb s GLY 34 N -1.87 1.62 0.18 -3.19 0.00 -1.26 -4.74 107.32 98.05 1rvb s GLY 34 Ca 0.46 -0.57 0.18 0.00 0.00 0.00 0.00 44.72 44.79 1rvb s GLY 34 CO 0.20 -0.19 1.08 1.48 0.00 0.00 0.00 173.10 175.67 1rvb h SER 35 N -0.66 0.00 -3.79 1.64 4.64 -1.94 -3.46 113.55 109.98 1rvb h SER 35 Ca -0.45 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.34 1rvb h SER 35 Cb 1.28 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.44 1rvb h SER 35 CO 0.63 0.38 0.69 1.51 -0.87 0.00 0.00 176.83 179.17 1rvb s ASP 36 N -5.88 6.67 0.45 4.97 -4.77 -1.26 -4.90 116.67 111.95 1rvb s ASP 36 Ca 0.00 2.75 0.33 0.00 -3.30 0.00 0.00 52.55 52.33 1rvb s ASP 36 Cb 0.08 -2.65 1.49 0.00 -1.09 0.00 0.00 42.92 40.76 1rvb s ASP 36 CO 0.78 -0.63 1.59 0.00 0.70 0.00 0.00 175.17 177.61 1rvb h THR 37 N 3.13 0.05 -0.71 2.11 1.03 -2.00 0.66 112.91 117.17 1rvb h THR 37 Ca -0.49 -0.01 0.06 0.00 -0.01 0.00 0.00 66.41 65.96 1rvb h THR 37 Cb 1.23 0.01 -0.04 0.00 -1.07 0.00 0.00 68.15 68.28 1rvb h THR 37 CO 0.68 0.01 0.47 0.50 -0.01 0.00 0.00 175.52 177.16 1rvb h LYS 38 N 0.03 0.74 0.28 0.00 3.64 -1.98 -0.66 116.57 118.62 1rvb h LYS 38 Ca 0.86 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 60.19 1rvb h LYS 38 Cb 2.81 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 34.47 1rvb h LYS 38 CO -0.42 0.49 -0.13 0.28 -2.27 0.00 0.00 179.45 177.39 1rvb h VAL 39 N 0.76 0.74 -0.37 2.00 2.07 -1.20 -2.88 116.25 117.36 1rvb h VAL 39 Ca 0.30 -0.63 -0.04 0.00 0.82 0.00 0.00 66.70 67.16 1rvb h VAL 39 Cb 0.23 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1rvb h VAL 39 CO -0.10 0.12 0.07 -0.07 0.02 0.00 0.00 177.57 177.62 1rvb h LEU 40 N -0.73 0.51 -0.36 2.57 3.38 -1.57 -0.73 115.31 118.38 1rvb h LEU 40 Ca -0.04 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1rvb h LEU 40 Cb 0.49 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 1rvb h LEU 40 CO 0.06 0.53 0.15 -1.28 0.09 0.00 0.00 178.44 178.00 1rvb h SER 41 N 0.54 0.20 -0.38 -0.43 0.87 -1.15 -1.23 113.55 111.97 1rvb h SER 41 Ca 0.12 0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.66 1rvb h SER 41 Cb 0.24 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 1rvb h SER 41 CO -0.00 0.15 0.01 0.74 -0.53 0.00 0.00 176.83 177.20 1rvb h THR 42 N 0.32 1.26 0.08 2.23 2.02 -1.18 -2.91 112.91 114.73 1rvb h THR 42 Ca 0.16 -0.97 -0.00 0.00 0.77 0.00 0.00 66.41 66.37 1rvb h THR 42 Cb 0.11 1.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1rvb h THR 42 CO -0.14 0.32 -0.04 0.40 0.37 0.00 0.00 175.52 176.43 1rvb h ILE 43 N 0.48 0.93 -0.37 3.11 5.03 -0.82 -2.25 117.51 123.63 1rvb h ILE 43 Ca 0.11 -0.04 0.00 0.00 -0.12 0.00 0.00 64.86 64.81 1rvb h ILE 43 Cb 0.45 0.96 -0.02 0.00 -3.03 0.00 0.00 36.82 35.17 1rvb h ILE 43 CO 0.02 0.01 0.24 -0.26 -0.68 0.00 0.00 178.15 177.48 1rvb h PHE 44 N -0.13 0.47 -0.12 1.37 0.04 -1.27 0.17 116.94 117.47 1rvb h PHE 44 Ca -0.01 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1rvb h PHE 44 Cb 0.10 -0.16 -0.00 0.00 2.20 0.00 0.00 35.95 38.09 1rvb h PHE 44 CO -0.07 0.30 0.02 1.49 -0.60 0.00 0.00 178.31 179.45 1rvb h GLU 45 N 0.50 0.19 -0.25 1.51 4.81 -1.29 -2.36 114.58 117.69 1rvb h GLU 45 Ca 0.14 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 1rvb h GLU 45 Cb -0.06 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 1rvb h GLU 45 CO -0.03 0.37 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.46 1rvb h LEU 46 N -0.03 0.38 -1.14 1.64 3.38 -0.73 -2.64 115.31 116.17 1rvb h LEU 46 Ca 0.04 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1rvb h LEU 46 Cb 0.27 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1rvb h LEU 46 CO 0.00 0.51 -0.19 0.15 0.09 0.00 0.00 178.44 179.01 1rvb h PHE 47 N 0.38 0.41 0.10 1.13 3.57 -0.55 -3.23 116.94 118.75 1rvb h PHE 47 Ca 0.08 -0.07 -0.27 0.00 3.53 0.00 0.00 57.97 61.24 1rvb h PHE 47 Cb 0.40 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.03 1rvb h PHE 47 CO 0.01 0.55 -1.23 0.77 -2.23 0.00 0.00 178.31 176.18 1rvb h SER 48 N 0.35 0.33 -0.72 0.41 0.02 -1.08 -3.40 113.55 109.47 1rvb h SER 48 Ca 0.06 -0.37 0.13 0.00 -0.84 0.00 0.00 61.79 60.77 1rvb h SER 48 Cb 0.53 -0.11 -0.13 0.00 0.14 0.00 0.00 62.40 62.83 1rvb h SER 48 CO 0.03 1.29 -0.31 0.03 -1.14 0.00 0.00 176.83 176.73 1rvb h ARG 49 N 0.06 -0.09 -0.57 3.45 3.08 -1.51 -1.46 114.38 117.33 1rvb h ARG 49 Ca -0.12 0.01 0.04 0.00 0.07 0.00 0.00 59.98 59.97 1rvb h ARG 49 Cb 1.94 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 31.97 1rvb h ARG 49 CO 0.18 -0.06 0.33 -1.35 -1.07 0.00 0.00 179.97 178.00 1rvb h PRO 50 N -0.09 0.61 0.01 0.04 0.11 -1.76 -1.48 132.00 129.44 1rvb h PRO 50 Ca 0.29 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1rvb h PRO 50 Cb 0.57 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.53 1rvb h PRO 50 CO -0.77 0.41 -0.02 0.82 -0.21 0.00 0.00 178.00 178.23 1rvb h ILE 51 N 0.63 0.95 -0.57 4.15 2.04 -1.52 -0.14 117.51 123.06 1rvb h ILE 51 Ca 0.24 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.13 1rvb h ILE 51 Cb 0.08 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1rvb h ILE 51 CO -0.13 0.00 0.33 0.40 0.00 0.00 0.00 178.15 178.75 1rvb h ILE 52 N -0.04 1.04 -0.37 -0.67 2.04 -1.18 -1.58 117.51 116.74 1rvb h ILE 52 Ca 0.01 -0.22 -0.10 0.00 1.00 0.00 0.00 64.86 65.54 1rvb h ILE 52 Cb 0.05 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 1rvb h ILE 52 CO -0.01 0.12 -0.19 -1.13 0.00 0.00 0.00 178.15 176.94 1rvb h ASN 53 N 0.65 0.71 0.33 1.72 -1.24 -1.04 -0.99 115.58 115.73 1rvb h ASN 53 Ca 0.23 -0.24 -0.02 0.00 0.71 0.00 0.00 56.30 56.99 1rvb h ASN 53 Cb 0.05 -0.19 0.00 0.00 0.73 0.00 0.00 38.32 38.91 1rvb h ASN 53 CO -0.11 0.90 -0.16 0.50 -1.29 0.00 0.00 177.43 177.26 1rvb h LYS 54 N 0.63 -0.43 -0.44 6.67 3.64 -0.54 -1.99 116.57 124.12 1rvb h LYS 54 Ca 0.10 0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.43 1rvb h LYS 54 Cb 0.66 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1rvb h LYS 54 CO 0.05 -0.19 -0.03 0.82 -2.27 0.00 0.00 179.45 177.83 1rvb h ILE 55 N -0.62 1.24 -0.06 2.00 1.08 -1.30 -2.66 117.51 117.19 1rvb h ILE 55 Ca -0.05 -1.00 -0.00 0.00 -0.39 0.00 0.00 64.86 63.42 1rvb h ILE 55 Cb 0.45 0.93 -0.00 0.00 -3.07 0.00 0.00 36.82 35.13 1rvb h ILE 55 CO 0.08 0.35 0.03 0.00 -0.69 0.00 0.00 178.15 177.92 1rvb h ALA 56 N 1.29 0.08 -0.47 1.87 0.00 -1.13 -2.92 119.26 117.98 1rvb h ALA 56 Ca 0.13 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1rvb h ALA 56 Cb 0.46 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1rvb h ALA 56 CO 0.02 -0.36 0.23 0.93 0.00 0.00 0.00 179.25 180.07 1rvb h GLU 57 N -0.01 0.44 0.00 0.00 5.08 -1.29 -0.74 114.58 118.07 1rvb h GLU 57 Ca 0.02 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1rvb h GLU 57 Cb 0.11 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1rvb h GLU 57 CO -0.00 0.29 0.16 -0.22 -1.00 0.00 0.00 179.01 178.24 1rvb h LYS 58 N 0.46 0.00 -0.08 2.33 3.64 -1.29 -1.59 116.57 120.03 1rvb h LYS 58 Ca 0.20 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1rvb h LYS 58 Cb 0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1rvb h LYS 58 CO -0.15 0.00 0.00 0.72 -2.27 0.00 0.00 179.45 177.75 1rvb n HIS 59 N -2.19 0.11 -1.29 1.91 8.25 -0.38 -5.00 115.22 116.63 1rvb n HIS 59 Ca -0.01 -0.44 -0.00 0.00 -0.26 0.00 0.00 57.72 57.01 1rvb n HIS 59 Cb 0.19 -0.04 -0.00 0.00 1.12 0.00 0.00 29.99 31.26 1rvb n HIS 59 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rvb n GLY 60 N -0.18 0.38 3.65 -1.41 0.00 -0.60 -5.04 105.19 101.99 1rvb n GLY 60 Ca 0.03 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 1rvb n GLY 60 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rvb s TYR 61 N -2.00 3.25 0.25 1.61 2.02 -0.63 -4.42 117.35 117.43 1rvb s TYR 61 Ca 0.00 0.10 -0.26 0.00 -0.37 0.00 0.00 57.07 56.54 1rvb s TYR 61 Cb 0.00 -2.01 -0.09 0.00 -0.40 0.00 0.00 41.96 39.46 1rvb s TYR 61 CO 0.00 0.24 0.88 0.42 -1.57 0.00 0.00 175.55 175.52 1rvb s ILE 62 N 0.03 4.26 -0.14 2.71 1.09 0.75 -4.01 121.20 125.89 1rvb s ILE 62 Ca 0.05 1.79 0.01 0.00 -1.10 0.00 0.00 60.65 61.40 1rvb s ILE 62 Cb -0.12 -4.10 -0.00 0.00 -1.06 0.00 0.00 42.46 37.18 1rvb s ILE 62 CO 0.01 0.32 -0.17 -0.69 -0.10 0.00 0.00 174.94 174.32 1rvb s VAL 63 N -1.39 2.60 -0.04 2.92 1.01 -1.26 -1.97 120.40 122.26 1rvb s VAL 63 Ca 0.44 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.65 1rvb s VAL 63 Cb -0.21 -2.08 -0.00 0.00 0.00 0.00 0.00 36.38 34.09 1rvb s VAL 63 CO 0.26 0.53 -0.16 -1.61 0.00 0.00 0.00 175.10 174.11 1rvb s GLU 64 N 0.66 1.71 0.25 2.72 2.02 -0.05 -4.96 118.70 121.05 1rvb s GLU 64 Ca -0.08 -0.57 0.07 0.00 0.02 0.00 0.00 54.97 54.40 1rvb s GLU 64 Cb -0.16 -1.49 -0.03 0.00 0.10 0.00 0.00 34.13 32.55 1rvb s GLU 64 CO 0.02 0.22 0.24 -1.21 0.02 0.00 0.00 175.26 174.55 1rvb s GLU 65 N 0.09 3.05 0.59 1.61 2.02 -1.26 -0.77 118.70 124.03 1rvb s GLU 65 Ca -0.05 -0.99 -0.18 0.00 0.02 0.00 0.00 54.97 53.78 1rvb s GLU 65 Cb -0.11 -2.64 -0.03 0.00 0.10 0.00 0.00 34.13 31.44 1rvb s GLU 65 CO 0.02 0.40 1.12 -2.14 0.02 0.00 0.00 175.26 174.69 1rvb s PRO 66 N -3.88 3.11 -0.15 0.39 0.02 -1.26 -5.00 135.00 128.23 1rvb s PRO 66 Ca 0.33 1.52 -0.15 0.00 0.02 0.00 0.00 61.00 62.73 1rvb s PRO 66 Cb -0.08 -1.98 -0.11 0.00 0.02 0.00 0.00 34.50 32.34 1rvb s PRO 66 CO 0.26 -1.02 0.14 0.87 -0.33 0.00 0.00 177.00 176.91 1rvb h LYS 67 N 0.69 0.00 -6.61 5.54 1.57 -1.98 -3.45 116.57 112.33 1rvb h LYS 67 Ca -0.49 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 57.77 1rvb h LYS 67 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1rvb h LYS 67 CO 0.56 0.48 0.49 -0.65 -0.57 0.00 0.00 179.45 179.76 1rvb s GLN 68 N -2.14 4.55 0.10 3.15 1.11 -1.26 -4.94 119.66 120.23 1rvb s GLN 68 Ca -0.17 1.72 0.15 0.00 0.01 0.00 0.00 55.36 57.08 1rvb s GLN 68 Cb 0.02 -3.30 0.67 0.00 -1.01 0.00 0.00 33.01 29.39 1rvb s GLN 68 CO 0.37 -0.00 1.47 1.04 0.01 0.00 0.00 175.29 178.18 1rvb n GLN 69 N 2.73 0.07 -1.49 2.91 6.02 -1.26 -2.92 117.38 123.43 1rvb n GLN 69 Ca 0.04 0.38 -0.15 0.00 -0.01 0.00 0.00 57.00 57.26 1rvb n GLN 69 Cb 0.46 -1.65 0.09 0.00 1.02 0.00 0.00 30.24 30.17 1rvb n GLN 69 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1rvb n ASN 70 N -1.78 4.02 -4.58 1.08 0.23 -1.26 -5.01 115.26 107.96 1rvb n ASN 70 Ca 0.02 -3.80 -0.34 0.00 -0.53 0.00 0.00 54.58 49.93 1rvb n ASN 70 Cb 0.14 -0.46 -0.11 0.00 -2.08 0.00 0.00 39.78 37.27 1rvb n ASN 70 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 1rvb s HIS 71 N -3.49 2.95 0.15 -2.53 3.76 -1.15 -4.86 115.29 110.13 1rvb s HIS 71 Ca 0.48 0.02 -0.09 0.00 -0.15 0.00 0.00 55.06 55.32 1rvb s HIS 71 Cb 0.41 -1.72 -0.06 0.00 1.11 0.00 0.00 32.58 32.31 1rvb s HIS 71 CO 0.00 0.33 0.46 -0.47 -0.85 0.00 0.00 174.74 174.21 1rvb s TYR 72 N -0.78 3.51 0.47 1.40 6.14 -0.62 -4.67 117.35 122.80 1rvb s TYR 72 Ca 0.12 0.79 0.08 0.00 0.64 0.00 0.00 57.07 58.70 1rvb s TYR 72 Cb -0.11 -2.18 0.02 0.00 0.42 0.00 0.00 41.96 40.11 1rvb s TYR 72 CO 0.01 0.40 0.51 -1.25 0.64 0.00 0.00 175.55 175.87 1rvb s PRO 73 N -2.41 2.49 0.16 4.97 0.04 -1.26 -1.04 135.00 137.95 1rvb s PRO 73 Ca 0.40 -1.59 -0.15 0.00 0.04 0.00 0.00 61.00 59.70 1rvb s PRO 73 Cb -0.13 -2.46 0.07 0.00 0.04 0.00 0.00 34.50 32.03 1rvb s PRO 73 CO 0.21 -0.43 1.76 -0.44 0.04 0.00 0.00 177.00 178.14 1rvb h ASP 74 N 0.72 0.21 -3.55 6.66 3.32 -1.71 -3.39 116.42 118.68 1rvb h ASP 74 Ca -0.38 0.03 -0.46 0.00 0.02 0.00 0.00 57.03 56.24 1rvb h ASP 74 Cb 1.28 -0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.50 1rvb h ASP 74 CO 0.51 0.16 -0.80 -0.36 -1.72 0.00 0.00 179.24 177.04 1rvb s PHE 75 N -6.15 1.11 -0.23 4.55 0.08 -0.84 -4.24 117.98 112.25 1rvb s PHE 75 Ca -0.13 -0.35 -0.04 0.00 0.12 0.00 0.00 56.93 56.53 1rvb s PHE 75 Cb 0.12 -0.84 0.00 0.00 -0.57 0.00 0.00 43.02 41.73 1rvb s PHE 75 CO 0.72 -0.20 -0.04 0.99 -0.10 0.00 0.00 175.22 176.59 1rvb s THR 76 N 0.60 3.28 -0.07 0.64 2.01 0.05 -1.15 115.64 120.99 1rvb s THR 76 Ca -0.11 -0.64 0.00 0.00 0.31 0.00 0.00 61.69 61.26 1rvb s THR 76 Cb -0.13 -2.54 -0.03 0.00 0.01 0.00 0.00 72.50 69.80 1rvb s THR 76 CO 0.02 0.35 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.48 1rvb s LEU 77 N 1.44 3.26 -0.16 4.42 1.02 -0.22 -0.87 118.68 127.58 1rvb s LEU 77 Ca 0.04 0.01 -0.30 0.00 0.02 0.00 0.00 54.13 53.91 1rvb s LEU 77 Cb -0.15 -1.72 0.13 0.00 0.02 0.00 0.00 46.19 44.47 1rvb s LEU 77 CO -0.03 0.37 1.05 -0.72 0.02 0.00 0.00 176.35 177.03 1rvb s TYR 78 N -0.83 -0.30 0.07 0.29 1.13 -0.83 -0.75 117.35 116.13 1rvb s TYR 78 Ca 0.13 0.46 -0.18 0.00 -1.41 0.00 0.00 57.07 56.07 1rvb s TYR 78 Cb -0.11 0.47 -0.07 0.00 -1.10 0.00 0.00 41.96 41.16 1rvb s TYR 78 CO 0.02 -0.32 0.55 0.15 -2.51 0.00 0.00 175.55 173.44 1rvb s LYS 79 N -1.47 4.13 0.55 -3.49 1.02 -1.26 -0.18 119.74 119.04 1rvb s LYS 79 Ca 0.01 0.66 0.24 0.00 0.02 0.00 0.00 55.97 56.90 1rvb s LYS 79 Cb -0.01 -3.19 1.48 0.00 -0.52 0.00 0.00 37.83 35.59 1rvb s LYS 79 CO -0.01 0.62 2.09 -1.35 -0.92 0.00 0.00 175.35 175.78 1rvb h PRO 80 N 4.41 0.00 0.00 -1.68 0.11 -1.98 -0.94 132.00 131.91 1rvb h PRO 80 Ca -0.50 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 1rvb h PRO 80 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1rvb h PRO 80 CO 0.63 0.00 -0.47 0.66 -0.21 0.00 0.00 178.00 178.61 1rvb h SER 81 N 0.00 0.00 -2.29 -2.05 4.64 -1.95 -3.37 113.55 108.53 1rvb h SER 81 Ca 0.11 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.80 1rvb h SER 81 Cb 0.48 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.17 1rvb h SER 81 CO -0.00 0.47 -0.40 -0.62 -0.87 0.00 0.00 176.83 175.41 1rvb n GLU 82 N -3.30 2.87 0.19 4.77 -0.58 -0.36 -4.91 120.64 119.32 1rvb n GLU 82 Ca 0.01 -4.68 0.06 0.00 -0.42 0.00 0.00 57.16 52.14 1rvb n GLU 82 Cb 0.68 -2.29 0.54 0.00 -0.57 0.00 0.00 31.44 29.79 1rvb n GLU 82 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1rvb h PRO 83 N 4.25 0.11 -1.01 3.49 0.13 -1.73 -2.65 132.00 134.59 1rvb h PRO 83 Ca 0.20 -0.01 -0.47 0.00 -0.87 0.00 0.00 66.00 64.84 1rvb h PRO 83 Cb 0.64 -0.02 -0.27 0.00 0.13 0.00 0.00 31.00 31.47 1rvb h PRO 83 CO 0.91 0.15 0.60 0.09 -0.23 0.00 0.00 178.00 179.52 1rvb n ASN 84 N -4.44 3.94 -2.65 1.44 3.02 -1.26 -4.21 115.26 111.11 1rvb n ASN 84 Ca -0.02 -3.45 -0.12 0.00 -0.03 0.00 0.00 54.58 50.96 1rvb n ASN 84 Cb 0.15 -0.82 0.02 0.00 -0.61 0.00 0.00 39.78 38.53 1rvb n ASN 84 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1rvb n LYS 85 N -0.94 1.54 -2.79 3.52 5.02 -1.00 -4.72 118.16 118.78 1rvb n LYS 85 Ca 0.54 -3.48 -0.36 0.00 -2.02 0.00 0.00 58.31 52.99 1rvb n LYS 85 Cb 1.48 -1.43 -0.07 0.00 -0.02 0.00 0.00 35.03 35.00 1rvb n LYS 85 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1rvb s LYS 86 N -3.17 4.51 -0.06 1.97 1.02 -0.57 -4.78 119.74 118.66 1rvb s LYS 86 Ca 0.31 1.28 0.02 0.00 0.02 0.00 0.00 55.97 57.60 1rvb s LYS 86 Cb 0.45 -2.68 -0.03 0.00 -0.52 0.00 0.00 37.83 35.05 1rvb s LYS 86 CO -0.00 0.22 -0.11 0.42 -0.92 0.00 0.00 175.35 174.96 1rvb s ILE 87 N -1.73 3.38 -0.08 2.17 1.01 0.08 -0.54 121.20 125.49 1rvb s ILE 87 Ca 0.52 -0.60 0.02 0.00 0.00 0.00 0.00 60.65 60.60 1rvb s ILE 87 Cb -0.17 -2.36 -0.02 0.00 0.01 0.00 0.00 42.46 39.92 1rvb s ILE 87 CO 0.22 0.59 -0.12 0.00 0.00 0.00 0.00 174.94 175.63 1rvb s ALA 88 N -0.70 2.74 -0.04 9.38 0.00 -0.29 -1.05 121.76 131.80 1rvb s ALA 88 Ca 0.11 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 51.17 1rvb s ALA 88 Cb -0.11 -1.11 0.00 0.00 0.00 0.00 0.00 23.12 21.90 1rvb s ALA 88 CO 0.01 0.48 -0.14 0.42 0.00 0.00 0.00 175.76 176.53 1rvb s ILE 89 N -0.47 1.17 -0.02 0.00 1.01 -0.30 -0.26 121.20 122.33 1rvb s ILE 89 Ca 0.06 -0.56 0.02 0.00 0.00 0.00 0.00 60.65 60.17 1rvb s ILE 89 Cb -0.12 -1.03 0.00 0.00 0.01 0.00 0.00 42.46 41.33 1rvb s ILE 89 CO 0.02 0.35 -0.09 -0.62 0.00 0.00 0.00 174.94 174.60 1rvb s ASP 90 N 0.18 1.13 -0.19 3.58 2.15 -0.75 -1.99 116.67 120.79 1rvb s ASP 90 Ca -0.05 -0.17 -0.09 0.00 0.43 0.00 0.00 52.55 52.67 1rvb s ASP 90 Cb -0.11 -0.28 -0.05 0.00 -0.30 0.00 0.00 42.92 42.18 1rvb s ASP 90 CO 0.02 0.07 0.10 -0.63 -0.17 0.00 0.00 175.17 174.55 1rvb s ILE 91 N 0.15 5.13 0.03 4.11 1.01 -1.26 -0.81 121.20 129.57 1rvb s ILE 91 Ca -0.02 0.09 0.04 0.00 0.00 0.00 0.00 60.65 60.76 1rvb s ILE 91 Cb -0.08 -3.33 -0.02 0.00 0.01 0.00 0.00 42.46 39.04 1rvb s ILE 91 CO 0.00 0.45 -0.13 -0.54 0.00 0.00 0.00 174.94 174.73 1rvb s LYS 92 N 0.35 0.88 0.06 2.79 -0.14 0.00 -4.95 119.74 118.73 1rvb s LYS 92 Ca 0.06 -0.69 0.01 0.00 -1.36 0.00 0.00 55.97 53.99 1rvb s LYS 92 Cb -0.12 -0.86 -0.03 0.00 -1.68 0.00 0.00 37.83 35.14 1rvb s LYS 92 CO -0.01 0.21 -0.06 0.95 -0.76 0.00 0.00 175.35 175.69 1rvb s THR 93 N -0.79 0.48 0.29 2.17 -4.23 -1.26 -0.44 115.64 111.86 1rvb s THR 93 Ca 0.01 -1.59 -0.20 0.00 -1.18 0.00 0.00 61.69 58.74 1rvb s THR 93 Cb -0.07 -1.23 0.02 0.00 1.34 0.00 0.00 72.50 72.56 1rvb s THR 93 CO 0.01 -0.74 0.71 0.28 -0.54 0.00 0.00 174.62 174.34 1rvb s THR 94 N -2.90 0.00 0.30 3.99 -1.32 -0.80 -4.91 115.64 109.99 1rvb s THR 94 Ca 0.02 -1.03 0.06 0.00 -1.21 0.00 0.00 61.69 59.53 1rvb s THR 94 Cb 0.00 -2.12 -0.06 0.00 -1.51 0.00 0.00 72.50 68.82 1rvb s THR 94 CO -0.04 0.00 -0.03 -0.72 -2.21 0.00 0.00 174.62 171.62 1rvb s TYR 95 N -3.74 1.99 0.04 9.09 -0.85 -1.26 -2.47 117.35 120.15 1rvb s TYR 95 Ca 0.12 -0.75 0.03 0.00 -0.52 0.00 0.00 57.07 55.96 1rvb s TYR 95 Cb -0.05 -1.19 -0.02 0.00 0.38 0.00 0.00 41.96 41.07 1rvb s TYR 95 CO 0.08 0.24 -0.10 0.95 -1.52 0.00 0.00 175.55 175.20 1rvb s THR 96 N -3.05 0.77 0.00 -3.49 -4.23 -0.37 -4.90 115.64 100.39 1rvb s THR 96 Ca 0.31 -0.92 0.06 0.00 -1.18 0.00 0.00 61.69 59.96 1rvb s THR 96 Cb 0.05 -0.75 -0.24 0.00 1.34 0.00 0.00 72.50 72.91 1rvb s THR 96 CO 0.13 -0.14 0.85 0.78 -0.54 0.00 0.00 174.62 175.69 1rvb h ASN 97 N 4.90 0.12 -4.31 3.99 2.35 -1.92 -2.58 115.58 118.13 1rvb h ASN 97 Ca -0.36 -0.19 -0.47 0.00 -0.55 0.00 0.00 56.30 54.74 1rvb h ASN 97 Cb 1.19 -0.04 -0.25 0.00 0.05 0.00 0.00 38.32 39.27 1rvb h ASN 97 CO 0.43 1.16 -0.80 -0.54 -1.65 0.00 0.00 177.43 176.03 1rvb s LYS 98 N -2.63 1.02 0.64 0.81 1.02 -1.26 -4.73 119.74 114.60 1rvb s LYS 98 Ca -0.05 -0.78 0.30 0.00 0.02 0.00 0.00 55.97 55.46 1rvb s LYS 98 Cb 0.08 -1.04 1.61 0.00 -0.52 0.00 0.00 37.83 37.96 1rvb s LYS 98 CO 0.83 0.26 1.94 1.49 -0.92 0.00 0.00 175.35 178.95 1rvb h GLU 99 N 4.96 0.00 -0.10 1.68 4.81 -1.99 -3.17 114.58 120.76 1rvb h GLU 99 Ca -0.39 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.80 1rvb h GLU 99 Cb 1.18 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 1rvb h GLU 99 CO 0.44 0.00 -0.25 0.09 -0.73 0.00 0.00 179.01 178.56 1rvb n ASN 100 N -3.21 2.19 -4.92 1.04 3.02 -1.26 -5.00 115.26 107.13 1rvb n ASN 100 Ca 0.01 -3.64 -0.27 0.00 -0.03 0.00 0.00 54.58 50.66 1rvb n ASN 100 Cb 0.45 -0.54 0.05 0.00 -0.61 0.00 0.00 39.78 39.13 1rvb n ASN 100 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1rvb s GLU 101 N -3.13 2.65 0.44 3.52 2.02 -1.20 -5.02 118.70 117.97 1rvb s GLU 101 Ca 0.39 -0.04 -0.21 0.00 0.02 0.00 0.00 54.97 55.12 1rvb s GLU 101 Cb 0.36 -2.20 -0.10 0.00 0.10 0.00 0.00 34.13 32.29 1rvb s GLU 101 CO -0.02 -0.94 1.00 0.15 0.02 0.00 0.00 175.26 175.47 1rvb s LYS 102 N -5.13 4.06 0.26 1.61 1.02 -1.26 -4.68 119.74 115.62 1rvb s LYS 102 Ca 0.57 1.27 0.04 0.00 0.02 0.00 0.00 55.97 57.87 1rvb s LYS 102 Cb -0.11 -2.22 -0.06 0.00 -0.52 0.00 0.00 37.83 34.93 1rvb s LYS 102 CO 0.46 -0.19 0.01 0.96 -0.92 0.00 0.00 175.35 175.67 1rvb s ILE 103 N -2.01 1.13 0.07 2.17 -4.36 0.24 -4.91 121.20 113.53 1rvb s ILE 103 Ca 0.63 -2.04 -0.19 0.00 -0.26 0.00 0.00 60.65 58.80 1rvb s ILE 103 Cb -0.14 -2.50 0.04 0.00 1.25 0.00 0.00 42.46 41.11 1rvb s ILE 103 CO 0.18 -0.21 0.44 -1.59 0.24 0.00 0.00 174.94 174.00 1rvb s LYS 104 N -3.86 1.01 0.21 0.37 -2.85 -1.26 -2.34 119.74 111.01 1rvb s LYS 104 Ca 0.31 -0.44 0.06 0.00 -1.00 0.00 0.00 55.97 54.91 1rvb s LYS 104 Cb 0.06 0.45 -0.05 0.00 -2.06 0.00 0.00 37.83 36.24 1rvb s LYS 104 CO 0.11 -0.37 -0.10 -0.06 0.10 0.00 0.00 175.35 175.03 1rvb s PHE 105 N -2.91 1.62 -0.12 1.78 0.40 -1.26 -4.84 117.98 112.64 1rvb s PHE 105 Ca -0.03 -0.69 -0.10 0.00 -0.60 0.00 0.00 56.93 55.52 1rvb s PHE 105 Cb 0.00 -0.82 -0.05 0.00 0.51 0.00 0.00 43.02 42.66 1rvb s PHE 105 CO -0.05 0.22 0.22 0.95 0.70 0.00 0.00 175.22 177.26 1rvb s THR 106 N -3.13 5.36 -0.18 0.64 -4.23 -1.26 -2.10 115.64 110.75 1rvb s THR 106 Ca 0.23 0.39 0.16 0.00 -1.18 0.00 0.00 61.69 61.29 1rvb s THR 106 Cb 0.02 -3.51 0.44 0.00 1.34 0.00 0.00 72.50 70.78 1rvb s THR 106 CO 0.06 0.54 1.33 0.18 -0.54 0.00 0.00 174.62 176.19 1rvb n LEU 107 N 2.51 3.35 0.00 4.79 4.77 0.24 -4.96 117.00 127.69 1rvb n LEU 107 Ca -0.17 -3.19 0.00 0.00 -0.03 0.00 0.00 56.01 52.62 1rvb n LEU 107 Cb 0.53 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1rvb n LEU 107 CO 0.35 0.80 0.00 0.61 -1.33 0.00 0.00 177.39 177.82 1rvb n GLY 108 N -0.94 1.86 3.77 -0.72 0.00 -1.26 -4.73 105.19 103.17 1rvb n GLY 108 Ca 0.21 -1.97 -0.33 0.00 0.00 0.00 0.00 46.02 43.93 1rvb n GLY 108 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rvb s GLY 109 N 0.00 2.18 0.00 -0.02 0.00 -1.26 0.08 107.32 108.29 1rvb s GLY 109 Ca 0.00 0.56 0.09 0.00 0.00 0.00 0.00 44.72 45.37 1rvb s GLY 109 CO 0.00 0.91 1.03 1.58 0.00 0.00 0.00 173.10 176.62 1rvb n TYR 110 N -2.36 0.22 0.21 1.90 0.18 -0.68 -4.54 117.16 112.08 1rvb n TYR 110 Ca 0.10 -0.28 0.02 0.00 1.88 0.00 0.00 57.90 59.63 1rvb n TYR 110 Cb 0.52 -0.02 0.01 0.00 -0.38 0.00 0.00 39.34 39.47 1rvb n TYR 110 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1rvb n THR 111 N 0.43 0.00 0.00 -3.48 -2.24 -1.26 -4.67 114.28 103.07 1rvb n THR 111 Ca 0.08 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1rvb n THR 111 Cb 0.33 1.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 1rvb n THR 111 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1rvb n SER 112 N -0.04 0.00 0.25 3.42 3.41 -1.26 -4.65 113.62 114.75 1rvb n SER 112 Ca 0.02 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.76 1rvb n SER 112 Cb 0.11 0.00 0.77 0.00 -0.26 0.00 0.00 64.21 64.83 1rvb n SER 112 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 1rvb h PHE 113 N 0.00 0.00 0.00 7.33 -5.15 -1.58 0.12 116.94 117.65 1rvb h PHE 113 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 1rvb h PHE 113 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.17 1rvb h PHE 113 CO 0.00 0.00 0.00 0.44 -2.00 0.00 0.00 178.31 176.75 1rvb n ILE 114 N -4.18 0.77 -0.05 0.88 -5.35 -1.26 -3.27 119.36 106.90 1rvb n ILE 114 Ca -0.02 0.15 -0.06 0.00 -0.27 0.00 0.00 62.75 62.55 1rvb n ILE 114 Cb 0.15 -0.95 -0.05 0.00 -1.74 0.00 0.00 39.64 37.04 1rvb n ILE 114 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1rvb n ARG 115 N -1.87 0.75 -3.97 6.28 1.74 -0.76 -4.87 116.66 113.96 1rvb n ARG 115 Ca 0.04 0.05 -0.31 0.00 -0.77 0.00 0.00 57.85 56.85 1rvb n ARG 115 Cb 0.24 -1.21 -0.14 0.00 -1.02 0.00 0.00 32.46 30.33 1rvb n ARG 115 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1rvb s ASN 116 N -4.79 4.73 0.37 0.55 2.47 0.33 -5.01 114.94 113.59 1rvb s ASN 116 Ca -0.12 -2.36 0.10 0.00 0.42 0.00 0.00 52.86 50.89 1rvb s ASN 116 Cb 0.03 -1.66 0.33 0.00 -1.45 0.00 0.00 41.25 38.50 1rvb s ASN 116 CO 0.26 -0.36 0.70 -3.20 -3.72 0.00 0.00 177.10 170.77 1rvb n ASN 117 N 4.00 0.00 0.00 -4.21 5.15 -1.20 -1.46 115.26 117.53 1rvb n ASN 117 Ca 0.04 0.39 0.00 0.00 -0.60 0.00 0.00 54.58 54.41 1rvb n ASN 117 Cb 0.40 -0.09 0.00 0.00 -0.53 0.00 0.00 39.78 39.55 1rvb n ASN 117 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1rvb n THR 118 N -2.14 0.03 -2.44 -0.44 -2.24 -1.26 -0.96 114.28 104.83 1rvb n THR 118 Ca 0.08 -0.32 -0.42 0.00 -2.27 0.00 0.00 64.05 61.12 1rvb n THR 118 Cb 0.78 1.36 -0.03 0.00 -2.10 0.00 0.00 70.33 70.35 1rvb n THR 118 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1rvb s LYS 119 N -0.03 4.32 -1.42 -0.78 2.20 -0.54 -3.86 119.74 119.64 1rvb s LYS 119 Ca 0.00 1.69 -0.07 0.00 -0.36 0.00 0.00 55.97 57.23 1rvb s LYS 119 Cb 0.00 -3.61 0.04 0.00 -1.51 0.00 0.00 37.83 32.75 1rvb s LYS 119 CO 0.00 -0.52 0.84 0.09 -0.36 0.00 0.00 175.35 175.40 1rvb n ASN 120 N 5.56 -3.01 -3.86 1.43 4.13 -1.26 -2.54 115.26 115.72 1rvb n ASN 120 Ca 0.12 -0.80 -0.12 0.00 1.68 0.00 0.00 54.58 55.46 1rvb n ASN 120 Cb 0.46 -3.96 -0.14 0.00 -1.54 0.00 0.00 39.78 34.61 1rvb n ASN 120 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 1rvb s ILE 121 N -3.49 0.00 0.12 2.41 2.07 -1.25 -1.60 121.20 119.47 1rvb s ILE 121 Ca 0.34 -0.02 -0.20 0.00 -1.41 0.00 0.00 60.65 59.36 1rvb s ILE 121 Cb -0.17 -0.08 -0.05 0.00 0.13 0.00 0.00 42.46 42.30 1rvb s ILE 121 CO 0.82 -0.01 1.72 0.58 -1.91 0.00 0.00 174.94 176.15 1rvb h VAL 122 N 5.07 0.87 -3.23 4.00 2.07 -1.42 -3.44 116.25 120.17 1rvb h VAL 122 Ca -0.24 -0.02 -0.50 0.00 0.82 0.00 0.00 66.70 66.75 1rvb h VAL 122 Cb 1.21 0.81 -0.17 0.00 -1.52 0.00 0.00 31.29 31.61 1rvb h VAL 122 CO 0.48 0.01 -0.77 -0.31 0.02 0.00 0.00 177.57 177.00 1rvb s TYR 123 N -6.19 1.78 0.22 1.57 2.02 -1.26 -5.11 117.35 110.38 1rvb s TYR 123 Ca -0.13 -0.49 -0.31 0.00 -0.37 0.00 0.00 57.07 55.76 1rvb s TYR 123 Cb 0.10 -0.88 -0.14 0.00 -0.40 0.00 0.00 41.96 40.64 1rvb s TYR 123 CO 0.68 0.33 1.31 -2.30 -1.57 0.00 0.00 175.55 174.00 1rvb n PRO 124 N 0.19 1.74 -0.34 -1.71 -0.02 -1.26 -4.85 135.00 128.74 1rvb n PRO 124 Ca -0.12 0.62 0.23 0.00 -2.02 0.00 0.00 63.50 62.20 1rvb n PRO 124 Cb 0.58 -2.21 0.46 0.00 -0.02 0.00 0.00 33.50 32.30 1rvb n PRO 124 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1rvb h PHE 125 N 3.82 0.94 0.00 6.00 3.57 -1.37 0.20 116.94 130.10 1rvb h PHE 125 Ca -0.44 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.10 1rvb h PHE 125 Cb 1.30 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.79 1rvb h PHE 125 CO 0.55 -0.13 0.00 -0.40 -2.23 0.00 0.00 178.31 176.10 1rvb n ASP 126 N -5.02 0.51 -0.03 0.41 5.68 -1.26 -2.06 116.55 114.77 1rvb n ASP 126 Ca 0.31 0.67 0.14 0.00 -0.50 0.00 0.00 54.79 55.40 1rvb n ASP 126 Cb 0.94 -0.76 0.54 0.00 -1.14 0.00 0.00 41.12 40.69 1rvb n ASP 126 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1rvb n GLN 127 N -2.11 0.23 -3.63 0.11 6.02 0.06 -4.82 117.38 113.24 1rvb n GLN 127 Ca 0.01 -0.07 -0.37 0.00 -0.01 0.00 0.00 57.00 56.56 1rvb n GLN 127 Cb 0.14 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.84 1rvb n GLN 127 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1rvb s TYR 128 N -2.82 3.68 -0.34 1.08 1.51 -0.87 -1.51 117.35 118.07 1rvb s TYR 128 Ca 0.19 0.83 0.04 0.00 -1.01 0.00 0.00 57.07 57.11 1rvb s TYR 128 Cb 0.19 -2.16 -0.01 0.00 -0.11 0.00 0.00 41.96 39.86 1rvb s TYR 128 CO 0.55 0.66 0.36 0.44 -1.11 0.00 0.00 175.55 176.45 1rvb n ILE 129 N 1.76 0.00 -3.69 2.71 -5.35 0.29 -4.86 119.36 110.22 1rvb n ILE 129 Ca -0.15 -0.44 -0.14 0.00 -0.27 0.00 0.00 62.75 61.74 1rvb n ILE 129 Cb 0.53 1.04 -0.08 0.00 -1.74 0.00 0.00 39.64 39.39 1rvb n ILE 129 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1rvb s ALA 130 N -0.97 -1.13 -0.25 -1.28 0.00 -1.24 -5.06 121.76 111.82 1rvb s ALA 130 Ca 0.03 0.89 -0.02 0.00 0.00 0.00 0.00 51.96 52.86 1rvb s ALA 130 Cb 0.03 -0.23 0.08 0.00 0.00 0.00 0.00 23.12 23.00 1rvb s ALA 130 CO 0.12 -0.27 0.07 -1.01 0.00 0.00 0.00 175.76 174.67 1rvb s HIS 131 N -0.75 1.21 0.12 0.00 3.76 -1.26 -1.14 115.29 117.23 1rvb s HIS 131 Ca -0.08 -1.22 0.02 0.00 -0.15 0.00 0.00 55.06 53.63 1rvb s HIS 131 Cb -0.03 -1.29 -0.04 0.00 1.11 0.00 0.00 32.58 32.33 1rvb s HIS 131 CO 0.04 -0.75 0.21 -1.58 -0.85 0.00 0.00 174.74 171.81 1rvb s TRP 132 N 1.79 3.39 -0.10 1.40 0.51 0.64 -0.61 118.94 125.96 1rvb s TRP 132 Ca 0.05 0.12 0.03 0.00 -2.12 0.00 0.00 56.10 54.18 1rvb s TRP 132 Cb -0.17 -1.66 0.01 0.00 -0.81 0.00 0.00 33.47 30.84 1rvb s TRP 132 CO -0.19 0.54 -0.18 0.42 -0.51 0.00 0.00 176.95 177.02 1rvb s ILE 133 N -1.63 1.66 -0.28 2.03 -1.09 0.67 -1.80 121.20 120.76 1rvb s ILE 133 Ca 0.33 -0.77 -0.07 0.00 -2.23 0.00 0.00 60.65 57.91 1rvb s ILE 133 Cb -0.12 -1.47 -0.00 0.00 -1.58 0.00 0.00 42.46 39.29 1rvb s ILE 133 CO 0.27 0.47 0.08 -0.63 -1.23 0.00 0.00 174.94 173.89 1rvb s ILE 134 N 0.63 4.04 -0.08 2.92 1.01 0.01 -1.24 121.20 128.51 1rvb s ILE 134 Ca -0.14 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 59.98 1rvb s ILE 134 Cb -0.16 -3.03 -0.02 0.00 0.01 0.00 0.00 42.46 39.25 1rvb s ILE 134 CO 0.04 0.16 -0.11 -0.83 0.00 0.00 0.00 174.94 174.19 1rvb s GLY 135 N 1.53 1.59 -0.06 6.18 0.00 -0.09 -0.82 107.32 115.65 1rvb s GLY 135 Ca 0.04 -0.92 0.04 0.00 0.00 0.00 0.00 44.72 43.87 1rvb s GLY 135 CO 0.03 -0.57 -0.17 -0.19 0.00 0.00 0.00 173.10 172.19 1rvb s TYR 136 N -0.46 2.64 -0.10 1.90 1.51 0.42 -1.78 117.35 121.48 1rvb s TYR 136 Ca 0.06 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.75 1rvb s TYR 136 Cb -0.12 -1.66 0.01 0.00 -0.11 0.00 0.00 41.96 40.09 1rvb s TYR 136 CO 0.02 0.01 -0.15 0.08 -1.11 0.00 0.00 175.55 174.40 1rvb s VAL 137 N -0.39 1.47 0.08 0.71 1.01 0.34 -1.91 120.40 121.71 1rvb s VAL 137 Ca 0.04 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.44 1rvb s VAL 137 Cb -0.12 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1rvb s VAL 137 CO 0.02 0.43 -0.16 -0.72 0.00 0.00 0.00 175.10 174.68 1rvb s TYR 138 N 0.88 1.36 -0.26 5.22 1.13 -1.03 -0.49 117.35 124.16 1rvb s TYR 138 Ca -0.09 -0.45 -0.14 0.00 -1.41 0.00 0.00 57.07 54.98 1rvb s TYR 138 Cb -0.15 -0.76 -0.04 0.00 -1.10 0.00 0.00 41.96 39.91 1rvb s TYR 138 CO 0.00 0.10 0.32 0.99 -2.51 0.00 0.00 175.55 174.45 1rvb s THR 139 N -1.28 5.22 1.02 -3.49 2.01 -0.68 -1.23 115.64 117.22 1rvb s THR 139 Ca 0.00 0.48 -0.12 0.00 0.31 0.00 0.00 61.69 62.36 1rvb s THR 139 Cb -0.10 -3.65 0.20 0.00 0.01 0.00 0.00 72.50 68.96 1rvb s THR 139 CO 0.03 0.21 1.07 -0.13 -0.69 0.00 0.00 174.62 175.11 1rvb s ARG 140 N 1.81 0.22 0.25 4.92 0.52 -0.97 -0.40 118.95 125.30 1rvb s ARG 140 Ca 0.13 0.87 -0.01 0.00 -0.52 0.00 0.00 55.73 56.20 1rvb s ARG 140 Cb -0.15 -1.69 -0.04 0.00 0.52 0.00 0.00 34.95 33.59 1rvb s ARG 140 CO 0.09 -2.96 0.45 0.08 0.02 0.00 0.00 175.30 172.98 1rvb s VAL 141 N -2.72 5.15 0.25 3.52 1.01 -1.23 -4.45 120.40 121.94 1rvb s VAL 141 Ca 0.66 -0.33 -0.05 0.00 0.00 0.00 0.00 61.98 62.26 1rvb s VAL 141 Cb -0.21 -3.76 0.20 0.00 0.00 0.00 0.00 36.38 32.60 1rvb s VAL 141 CO 0.60 -0.28 1.86 0.00 0.00 0.00 0.00 175.10 177.27 1rvb h ALA 142 N 1.66 1.20 -2.42 5.51 0.00 -1.95 -3.43 119.26 119.83 1rvb h ALA 142 Ca -0.48 -0.15 -0.54 0.00 0.00 0.00 0.00 54.91 53.74 1rvb h ALA 142 Cb 1.20 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1rvb h ALA 142 CO 0.66 0.61 0.78 -0.08 0.00 0.00 0.00 179.25 181.22 1rvb s THR 143 N -5.64 3.67 -2.22 0.00 -1.32 -1.26 -4.93 115.64 103.94 1rvb s THR 143 Ca -0.12 1.10 0.28 0.00 -1.21 0.00 0.00 61.69 61.75 1rvb s THR 143 Cb 0.16 -3.71 0.52 0.00 -1.51 0.00 0.00 72.50 67.97 1rvb s THR 143 CO 0.82 0.03 1.77 0.54 -2.21 0.00 0.00 174.62 175.56 1rvb n ARG 144 N 4.93 1.34 -3.90 7.08 1.74 -1.26 -4.79 116.66 121.80 1rvb n ARG 144 Ca 0.12 -0.70 -0.35 0.00 -0.77 0.00 0.00 57.85 56.15 1rvb n ARG 144 Cb 0.44 -1.49 -0.13 0.00 -1.02 0.00 0.00 32.46 30.26 1rvb n ARG 144 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1rvb s LYS 145 N -2.15 2.38 0.78 5.56 1.02 -1.26 -5.01 119.74 121.06 1rvb s LYS 145 Ca 0.35 -1.32 -0.12 0.00 0.02 0.00 0.00 55.97 54.90 1rvb s LYS 145 Cb 0.21 -3.22 0.06 0.00 -0.52 0.00 0.00 37.83 34.35 1rvb s LYS 145 CO 0.39 -0.67 1.13 -1.12 -0.92 0.00 0.00 175.35 174.16 1rvb s SER 146 N 1.30 4.78 0.28 2.83 0.01 -1.26 -5.03 113.70 116.60 1rvb s SER 146 Ca -0.04 1.03 -0.29 0.00 1.31 0.00 0.00 55.95 57.96 1rvb s SER 146 Cb -0.20 -1.69 -0.09 0.00 0.21 0.00 0.00 66.02 64.25 1rvb s SER 146 CO -0.01 -1.76 1.06 -0.55 0.41 0.00 0.00 173.24 172.39 1rvb s SER 147 N -4.32 7.33 -0.28 2.44 0.15 -1.26 -4.99 113.70 112.77 1rvb s SER 147 Ca 0.60 2.18 0.08 0.00 0.70 0.00 0.00 55.95 59.51 1rvb s SER 147 Cb -0.12 -2.62 0.45 0.00 -1.71 0.00 0.00 66.02 62.02 1rvb s SER 147 CO 0.51 -0.09 1.26 0.18 1.20 0.00 0.00 173.24 176.30 1rvb n LEU 148 N 1.17 4.25 -4.25 3.45 4.32 -1.26 -4.83 117.00 119.85 1rvb n LEU 148 Ca -0.01 -4.37 -0.14 0.00 -0.02 0.00 0.00 56.01 51.47 1rvb n LEU 148 Cb 0.46 -0.46 -0.10 0.00 -1.62 0.00 0.00 43.42 41.70 1rvb n LEU 148 CO 0.52 1.78 -0.29 -1.59 -1.22 0.00 0.00 177.39 176.59 1rvb s LYS 149 N -3.46 1.19 0.43 3.23 -2.85 -1.26 -5.14 119.74 111.88 1rvb s LYS 149 Ca 0.47 -1.60 0.03 0.00 -1.00 0.00 0.00 55.97 53.87 1rvb s LYS 149 Cb 0.40 -0.16 0.00 0.00 -2.06 0.00 0.00 37.83 36.01 1rvb s LYS 149 CO -0.00 -0.22 0.61 0.95 0.10 0.00 0.00 175.35 176.79 1rvb s THR 150 N -3.78 3.73 0.20 3.79 -4.23 -1.26 -4.38 115.64 109.70 1rvb s THR 150 Ca 0.30 -0.73 0.01 0.00 -1.18 0.00 0.00 61.69 60.09 1rvb s THR 150 Cb 0.07 -3.34 -0.05 0.00 1.34 0.00 0.00 72.50 70.52 1rvb s THR 150 CO 0.07 -0.19 0.04 -0.31 -0.54 0.00 0.00 174.62 173.69 1rvb s TYR 151 N -2.44 1.27 0.32 3.99 1.51 0.01 -4.98 117.35 117.03 1rvb s TYR 151 Ca 0.49 -1.11 0.09 0.00 -1.01 0.00 0.00 57.07 55.53 1rvb s TYR 151 Cb -0.10 -0.72 -0.06 0.00 -0.11 0.00 0.00 41.96 40.97 1rvb s TYR 151 CO 0.35 -0.31 -0.09 0.54 -1.11 0.00 0.00 175.55 174.93 1rvb s ASN 152 N -3.20 3.48 0.54 2.29 2.20 -1.26 -0.28 114.94 118.71 1rvb s ASN 152 Ca 0.29 -1.18 0.45 0.00 -0.94 0.00 0.00 52.86 51.48 1rvb s ASN 152 Cb 0.07 -0.30 1.67 0.00 -2.00 0.00 0.00 41.25 40.68 1rvb s ASN 152 CO 0.07 -0.22 1.61 0.40 -2.94 0.00 0.00 177.10 176.02 1rvb h ILE 153 N 2.10 0.08 -0.00 0.54 2.04 -1.98 0.13 117.51 120.41 1rvb h ILE 153 Ca -0.41 -0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.32 1rvb h ILE 153 Cb 1.25 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1rvb h ILE 153 CO 0.69 0.00 -0.59 0.78 0.00 0.00 0.00 178.15 179.04 1rvb h ASN 154 N 0.01 0.01 -0.35 1.72 2.35 -1.95 -3.26 115.58 114.11 1rvb h ASN 154 Ca 0.87 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.62 1rvb h ASN 154 Cb 3.38 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 41.75 1rvb h ASN 154 CO -0.08 0.59 0.00 -0.62 -1.65 0.00 0.00 177.43 175.67 1rvb n GLU 155 N -3.84 2.89 -0.34 0.81 1.02 0.44 -4.57 120.64 117.04 1rvb n GLU 155 Ca -0.01 -1.70 0.17 0.00 -0.02 0.00 0.00 57.16 55.59 1rvb n GLU 155 Cb 0.59 -1.78 0.38 0.00 -0.02 0.00 0.00 31.44 30.60 1rvb n GLU 155 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1rvb h LEU 156 N 2.29 0.69 -0.59 -4.62 3.38 -1.67 -0.43 115.31 114.35 1rvb h LEU 156 Ca 0.00 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1rvb h LEU 156 Cb 1.14 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1rvb h LEU 156 CO 0.21 0.16 0.00 0.59 0.09 0.00 0.00 178.44 179.49 1rvb n ASN 157 N -4.82 0.69 -0.76 -0.43 5.03 -1.26 -3.24 115.26 110.47 1rvb n ASN 157 Ca 0.26 0.65 0.11 0.00 0.87 0.00 0.00 54.58 56.47 1rvb n ASN 157 Cb 0.70 -0.80 0.06 0.00 -1.02 0.00 0.00 39.78 38.72 1rvb n ASN 157 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1rvb n GLU 158 N -2.24 1.86 -2.73 3.52 1.02 -0.17 -4.94 120.64 116.96 1rvb n GLU 158 Ca 0.03 -1.54 -0.42 0.00 -0.02 0.00 0.00 57.16 55.20 1rvb n GLU 158 Cb 0.26 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.20 1rvb n GLU 158 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1rvb s ILE 159 N -2.12 4.76 0.27 -3.67 1.01 -1.20 -5.01 121.20 115.25 1rvb s ILE 159 Ca 0.24 1.93 -0.29 0.00 0.00 0.00 0.00 60.65 62.53 1rvb s ILE 159 Cb 0.19 -4.27 -0.10 0.00 0.01 0.00 0.00 42.46 38.29 1rvb s ILE 159 CO 0.39 -0.07 1.27 -2.16 0.00 0.00 0.00 174.94 174.37 1rvb s PRO 160 N 2.56 4.43 -0.07 2.79 0.04 -1.26 -5.02 135.00 138.46 1rvb s PRO 160 Ca 0.44 2.07 -0.11 0.00 0.04 0.00 0.00 61.00 63.44 1rvb s PRO 160 Cb -0.16 -3.14 -0.05 0.00 0.04 0.00 0.00 34.50 31.19 1rvb s PRO 160 CO 0.12 -0.13 0.27 0.15 0.04 0.00 0.00 177.00 177.44 1rvb s LYS 161 N -1.09 3.70 0.00 4.56 1.02 -1.26 -4.71 119.74 121.96 1rvb s LYS 161 Ca 0.51 0.12 0.23 0.00 0.02 0.00 0.00 55.97 56.85 1rvb s LYS 161 Cb -0.37 -3.22 1.38 0.00 -0.52 0.00 0.00 37.83 35.11 1rvb s LYS 161 CO 0.45 0.71 1.85 -0.35 -0.92 0.00 0.00 175.35 177.09 1rvb n PRO 162 N 2.00 0.94 -4.10 -1.68 -0.04 -1.26 -4.80 135.00 126.05 1rvb n PRO 162 Ca -0.17 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.15 1rvb n PRO 162 Cb 0.54 -1.39 -0.12 0.00 -0.04 0.00 0.00 33.50 32.49 1rvb n PRO 162 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1rvb s TYR 163 N -2.00 0.73 -0.15 0.54 1.13 -1.26 -3.51 117.35 112.83 1rvb s TYR 163 Ca 0.35 -0.43 0.12 0.00 -1.41 0.00 0.00 57.07 55.70 1rvb s TYR 163 Cb 0.16 -0.44 -0.23 0.00 -1.10 0.00 0.00 41.96 40.35 1rvb s TYR 163 CO 0.27 -0.05 0.24 1.17 -2.51 0.00 0.00 175.55 174.66 1rvb n LYS 164 N 1.68 0.67 -3.54 -3.49 4.81 0.47 -4.89 118.16 113.86 1rvb n LYS 164 Ca -0.21 0.13 -0.17 0.00 -0.87 0.00 0.00 58.31 57.18 1rvb n LYS 164 Cb 0.55 -1.62 -0.06 0.00 0.02 0.00 0.00 35.03 33.92 1rvb n LYS 164 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 1rvb s GLY 165 N -5.51 -0.57 -0.01 3.14 0.00 -1.26 -4.96 107.32 98.15 1rvb s GLY 165 Ca -0.13 1.38 0.03 0.00 0.00 0.00 0.00 44.72 46.01 1rvb s GLY 165 CO 0.79 1.03 -0.11 0.14 0.00 0.00 0.00 173.10 174.95 1rvb s VAL 166 N -1.02 0.88 0.05 1.40 1.01 -1.26 -1.68 120.40 119.77 1rvb s VAL 166 Ca -0.10 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.47 1rvb s VAL 166 Cb -0.01 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.61 1rvb s VAL 166 CO 0.09 0.25 -0.16 -0.54 0.00 0.00 0.00 175.10 174.74 1rvb s LYS 167 N -0.23 1.02 0.07 2.72 1.02 0.35 -4.97 119.74 119.72 1rvb s LYS 167 Ca 0.04 -0.85 0.02 0.00 0.02 0.00 0.00 55.97 55.20 1rvb s LYS 167 Cb -0.05 -1.07 -0.03 0.00 -0.52 0.00 0.00 37.83 36.16 1rvb s LYS 167 CO -0.00 0.26 -0.08 0.54 -0.92 0.00 0.00 175.35 175.15 1rvb s VAL 168 N -0.92 0.67 0.08 3.17 0.11 -1.26 -0.50 120.40 121.75 1rvb s VAL 168 Ca 0.03 -1.51 -0.19 0.00 -2.93 0.00 0.00 61.98 57.38 1rvb s VAL 168 Cb -0.08 -1.16 0.04 0.00 -1.53 0.00 0.00 36.38 33.65 1rvb s VAL 168 CO 0.02 -0.60 0.45 0.72 -3.33 0.00 0.00 175.10 172.35 1rvb s PHE 169 N -2.44 -0.30 -0.07 1.54 -0.12 -0.73 -4.98 117.98 110.88 1rvb s PHE 169 Ca 0.01 0.17 0.05 0.00 -0.05 0.00 0.00 56.93 57.11 1rvb s PHE 169 Cb -0.03 0.28 -0.00 0.00 -0.63 0.00 0.00 43.02 42.64 1rvb s PHE 169 CO -0.02 -0.65 -0.21 -1.17 -0.05 0.00 0.00 175.22 173.12 1rvb s LEU 170 N -2.32 1.99 0.08 -1.99 0.20 -1.26 -0.91 118.68 114.47 1rvb s LEU 170 Ca -0.02 -0.46 -0.21 0.00 0.69 0.00 0.00 54.13 54.13 1rvb s LEU 170 Cb 0.00 -1.22 0.05 0.00 -0.43 0.00 0.00 46.19 44.59 1rvb s LEU 170 CO -0.06 0.17 0.51 -1.58 -0.29 0.00 0.00 176.35 175.10 1rvb s GLN 171 N 0.14 1.08 0.32 1.98 2.00 -0.37 -4.95 119.66 119.86 1rvb s GLN 171 Ca -0.10 -0.37 -0.28 0.00 -2.00 0.00 0.00 55.36 52.61 1rvb s GLN 171 Cb -0.15 0.49 -0.10 0.00 0.80 0.00 0.00 33.01 34.06 1rvb s GLN 171 CO 0.05 -0.41 1.22 -0.51 -0.50 0.00 0.00 175.29 175.14 1rvb s ASP 172 N -2.27 6.90 0.14 6.67 1.11 -1.26 -0.23 116.67 127.72 1rvb s ASP 172 Ca -0.03 2.51 -0.18 0.00 0.18 0.00 0.00 52.55 55.03 1rvb s ASP 172 Cb -0.00 -2.64 0.02 0.00 1.07 0.00 0.00 42.92 41.37 1rvb s ASP 172 CO -0.06 -0.43 1.71 0.50 1.18 0.00 0.00 175.17 178.07 1rvb h LYS 173 N 3.42 0.05 -0.86 8.23 3.64 -1.18 -2.89 116.57 126.99 1rvb h LYS 173 Ca -0.48 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 58.91 1rvb h LYS 173 Cb 1.22 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.99 1rvb h LYS 173 CO 0.65 0.04 0.57 0.11 -2.27 0.00 0.00 179.45 178.55 1rvb h TRP 174 N 0.06 1.06 -0.01 1.91 5.08 -1.92 -2.18 115.95 119.95 1rvb h TRP 174 Ca 0.13 0.03 -0.02 0.00 1.08 0.00 0.00 58.89 60.11 1rvb h TRP 174 Cb 0.18 -0.36 -0.00 0.00 -3.00 0.00 0.00 29.16 25.99 1rvb h TRP 174 CO -0.23 0.64 -0.07 0.28 -1.28 0.00 0.00 178.44 177.78 1rvb h VAL 175 N 1.12 1.06 -0.13 0.12 2.07 -1.90 -2.87 116.25 115.71 1rvb h VAL 175 Ca 0.33 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1rvb h VAL 175 Cb -0.06 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1rvb h VAL 175 CO -0.08 0.08 0.00 2.30 0.02 0.00 0.00 177.57 179.88 1rvb n ILE 176 N -4.45 0.27 -2.15 4.57 -5.35 -1.00 -3.15 119.36 108.10 1rvb n ILE 176 Ca -0.03 -0.63 -0.35 0.00 -0.27 0.00 0.00 62.75 61.47 1rvb n ILE 176 Cb 0.15 1.09 0.01 0.00 -1.74 0.00 0.00 39.64 39.15 1rvb n ILE 176 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1rvb s ALA 177 N -1.14 2.64 0.00 -1.28 0.00 -0.85 -1.35 121.76 119.77 1rvb s ALA 177 Ca 0.20 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.01 1rvb s ALA 177 Cb 0.13 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1rvb s ALA 177 CO 0.19 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.44 1rvb n GLY 178 N 0.19 4.03 0.36 0.00 0.00 -0.02 -4.26 105.19 105.48 1rvb n GLY 178 Ca 0.12 -2.14 0.04 0.00 0.00 0.00 0.00 46.02 44.04 1rvb n GLY 178 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rvb n ASP 179 N -1.25 1.77 -4.56 1.61 5.75 -1.26 -4.77 116.55 113.83 1rvb n ASP 179 Ca 0.00 -1.39 -0.34 0.00 -0.01 0.00 0.00 54.79 53.06 1rvb n ASP 179 Cb 0.00 -0.01 -0.12 0.00 -1.03 0.00 0.00 41.12 39.97 1rvb n ASP 179 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1rvb s LEU 180 N -0.74 3.08 0.50 -2.12 1.43 -1.26 -4.61 118.68 114.96 1rvb s LEU 180 Ca 0.11 -0.06 -0.23 0.00 -1.03 0.00 0.00 54.13 52.91 1rvb s LEU 180 Cb 0.07 -1.66 -0.07 0.00 0.03 0.00 0.00 46.19 44.56 1rvb s LEU 180 CO 0.11 0.35 1.36 0.00 0.23 0.00 0.00 176.35 178.40 1rvb n ALA 181 N 2.29 1.64 0.11 4.21 0.00 -1.26 -2.26 120.51 125.24 1rvb n ALA 181 Ca -0.18 0.18 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1rvb n ALA 181 Cb 0.53 -2.35 0.01 0.00 0.00 0.00 0.00 19.45 17.64 1rvb n ALA 181 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1rvb h GLY 182 N 1.78 0.00 -3.38 0.00 0.00 -0.01 -3.40 103.07 98.04 1rvb h GLY 182 Ca -0.50 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.76 1rvb h GLY 182 CO 0.58 0.00 -0.10 -1.35 0.00 0.00 0.00 176.54 175.68 1rvb s SER 183 N -6.00 -0.24 0.00 0.19 1.04 -1.23 -4.90 113.70 102.56 1rvb s SER 183 Ca 0.01 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.26 1rvb s SER 183 Cb 0.08 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1rvb s SER 183 CO 0.76 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.83 1rvb n GLY 184 N 0.12 0.59 0.29 7.32 0.00 -1.26 -3.42 105.19 108.83 1rvb n GLY 184 Ca -0.17 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.05 1rvb n GLY 184 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1rvb h ASN 185 N 0.00 0.00 -0.53 1.61 7.08 -2.00 -2.02 115.58 119.71 1rvb h ASN 185 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1rvb h ASN 185 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 1rvb h ASN 185 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 177.43 175.70 1rvb n THR 186 N -2.95 1.80 -3.90 6.14 -2.24 -1.26 -5.01 114.28 106.86 1rvb n THR 186 Ca -0.02 -1.29 -0.28 0.00 -2.27 0.00 0.00 64.05 60.19 1rvb n THR 186 Cb 0.14 0.11 -0.00 0.00 -2.10 0.00 0.00 70.33 68.48 1rvb n THR 186 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1rvb n THR 187 N 0.74 -1.45 -3.67 4.28 -2.24 -0.76 -4.74 114.28 106.43 1rvb n THR 187 Ca 0.23 -0.36 -0.32 0.00 -2.27 0.00 0.00 64.05 61.33 1rvb n THR 187 Cb 0.83 -1.25 -0.05 0.00 -2.10 0.00 0.00 70.33 67.76 1rvb n THR 187 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1rvb s ASN 188 N -4.05 6.50 0.23 3.42 0.02 -1.22 -1.68 114.94 118.16 1rvb s ASN 188 Ca 0.26 0.60 -0.30 0.00 -1.02 0.00 0.00 52.86 52.40 1rvb s ASN 188 Cb -0.14 -2.09 -0.09 0.00 0.02 0.00 0.00 41.25 38.94 1rvb s ASN 188 CO 0.61 0.07 1.13 -0.63 0.02 0.00 0.00 177.10 178.30 1rvb s ILE 189 N -1.62 3.58 0.20 0.60 1.01 0.11 0.55 121.20 125.62 1rvb s ILE 189 Ca 0.40 1.46 0.01 0.00 0.00 0.00 0.00 60.65 62.52 1rvb s ILE 189 Cb -0.12 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.38 1rvb s ILE 189 CO 0.24 0.30 0.36 -0.83 0.00 0.00 0.00 174.94 175.01 1rvb s GLY 190 N -0.43 1.64 0.60 6.18 0.00 -0.96 -0.59 107.32 113.75 1rvb s GLY 190 Ca 0.48 -0.97 0.09 0.00 0.00 0.00 0.00 44.72 44.32 1rvb s GLY 190 CO 0.39 -0.95 0.83 -1.14 0.00 0.00 0.00 173.10 172.23 1rvb n SER 191 N -0.82 2.08 -4.74 1.64 3.41 -0.89 -0.84 113.62 113.45 1rvb n SER 191 Ca -0.06 -2.53 -0.33 0.00 -0.26 0.00 0.00 58.87 55.69 1rvb n SER 191 Cb 0.55 -0.45 0.08 0.00 -0.26 0.00 0.00 64.21 64.13 1rvb n SER 191 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1rvb s ILE 192 N -2.68 2.74 -0.68 -1.33 -4.36 -0.45 -4.14 121.20 110.30 1rvb s ILE 192 Ca 0.62 0.33 -0.09 0.00 -0.26 0.00 0.00 60.65 61.26 1rvb s ILE 192 Cb -0.05 -2.82 0.18 0.00 1.25 0.00 0.00 42.46 41.02 1rvb s ILE 192 CO 0.40 -0.23 0.56 -2.28 0.24 0.00 0.00 174.94 173.63 1rvb s HIS 193 N -2.27 3.55 0.20 1.37 5.65 -1.26 -4.48 115.29 118.04 1rvb s HIS 193 Ca 0.69 -2.25 0.03 0.00 0.25 0.00 0.00 55.06 53.78 1rvb s HIS 193 Cb -0.24 -3.52 -0.01 0.00 -1.18 0.00 0.00 32.58 27.63 1rvb s HIS 193 CO 0.46 -0.93 0.20 0.00 -0.65 0.00 0.00 174.74 173.82 1rvb n ALA 194 N 3.96 0.25 -2.07 1.58 0.00 -0.99 -4.84 120.51 118.39 1rvb n ALA 194 Ca 0.07 -1.09 -0.31 0.00 0.00 0.00 0.00 53.44 52.11 1rvb n ALA 194 Cb 0.42 0.88 -0.04 0.00 0.00 0.00 0.00 19.45 20.71 1rvb n ALA 194 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1rvb s HIS 195 N -3.07 3.44 0.26 0.00 3.76 -1.26 -0.60 115.29 117.83 1rvb s HIS 195 Ca 0.22 1.21 -0.07 0.00 -0.15 0.00 0.00 55.06 56.27 1rvb s HIS 195 Cb 0.01 -2.57 0.46 0.00 1.11 0.00 0.00 32.58 31.59 1rvb s HIS 195 CO 0.15 -0.13 1.59 -0.92 -0.85 0.00 0.00 174.74 174.58 1rvb h TYR 196 N 1.40 -0.29 -0.89 1.40 3.20 -1.95 0.13 116.97 119.97 1rvb h TYR 196 Ca -0.47 0.07 0.22 0.00 3.14 0.00 0.00 58.73 61.69 1rvb h TYR 196 Cb 1.18 0.27 -0.13 0.00 1.54 0.00 0.00 36.73 39.59 1rvb h TYR 196 CO 0.62 -0.35 0.37 -0.22 -1.64 0.00 0.00 178.16 176.93 1rvb h LYS 197 N 0.02 0.36 -0.18 1.82 3.64 -2.00 -0.84 116.57 119.39 1rvb h LYS 197 Ca 0.45 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.75 1rvb h LYS 197 Cb 0.76 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1rvb h LYS 197 CO -0.85 0.24 -0.16 -0.44 -2.27 0.00 0.00 179.45 175.97 1rvb h ASP 198 N 0.37 0.28 -0.16 4.20 3.32 -1.34 0.45 116.42 123.54 1rvb h ASP 198 Ca 0.56 -0.07 -0.20 0.00 0.02 0.00 0.00 57.03 57.34 1rvb h ASP 198 Cb 1.07 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.55 1rvb h ASP 198 CO -0.55 0.46 -0.66 -0.26 -1.72 0.00 0.00 179.24 176.52 1rvb h PHE 199 N 0.28 1.02 0.34 4.55 -1.00 -1.16 0.54 116.94 121.50 1rvb h PHE 199 Ca 0.05 -0.40 -0.02 0.00 2.81 0.00 0.00 57.97 60.41 1rvb h PHE 199 Cb 0.44 -0.17 0.00 0.00 3.61 0.00 0.00 35.95 39.83 1rvb h PHE 199 CO 0.01 1.22 -0.16 0.28 -1.61 0.00 0.00 178.31 178.05 1rvb h VAL 200 N 0.57 0.67 0.00 -0.55 2.07 -1.12 -2.99 116.25 114.90 1rvb h VAL 200 Ca -0.02 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1rvb h VAL 200 Cb 1.27 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 1rvb h VAL 200 CO 0.14 0.08 0.00 -0.33 0.02 0.00 0.00 177.57 177.48 1rvb h GLU 201 N -0.69 0.00 -2.67 1.57 5.08 -0.94 -3.47 114.58 113.45 1rvb h GLU 201 Ca -0.05 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.18 1rvb h GLU 201 Cb 0.48 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.78 1rvb h GLU 201 CO 0.08 0.00 -0.23 0.41 -1.00 0.00 0.00 179.01 178.27 1rvb n GLY 202 N -0.09 0.43 3.50 -3.84 0.00 0.06 -4.97 105.19 100.29 1rvb n GLY 202 Ca 0.01 -0.36 -0.44 0.00 0.00 0.00 0.00 46.02 45.24 1rvb n GLY 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rvb s LYS 203 N -5.38 3.99 0.00 1.61 1.02 -0.50 -4.93 119.74 115.55 1rvb s LYS 203 Ca 0.19 -2.27 0.00 0.00 0.02 0.00 0.00 55.97 53.90 1rvb s LYS 203 Cb -0.08 -5.20 0.00 0.00 -0.52 0.00 0.00 37.83 32.03 1rvb s LYS 203 CO 0.25 -1.93 0.00 0.41 -0.92 0.00 0.00 175.35 173.16 1rvb n GLY 204 N 4.74 0.69 0.01 -3.33 0.00 -1.19 -4.93 105.19 101.18 1rvb n GLY 204 Ca 0.39 -1.92 0.03 0.00 0.00 0.00 0.00 46.02 44.52 1rvb n GLY 204 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1rvb n ILE 205 N -0.99 0.08 -2.96 -0.61 -5.35 -1.26 -5.02 119.36 103.24 1rvb n ILE 205 Ca 0.00 -0.20 -0.36 0.00 -0.27 0.00 0.00 62.75 61.92 1rvb n ILE 205 Cb 0.00 0.14 -0.06 0.00 -1.74 0.00 0.00 39.64 37.98 1rvb n ILE 205 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1rvb s PHE 206 N -2.48 3.63 -0.35 4.28 0.08 -1.26 -4.97 117.98 116.90 1rvb s PHE 206 Ca -0.03 1.54 0.21 0.00 0.12 0.00 0.00 56.93 58.77 1rvb s PHE 206 Cb 0.05 -2.74 0.25 0.00 -0.57 0.00 0.00 43.02 40.00 1rvb s PHE 206 CO 0.32 0.25 1.55 -0.44 -0.10 0.00 0.00 175.22 176.80 1rvb h ASP 207 N 3.16 0.00 -5.02 1.36 3.32 -1.96 -3.48 116.42 113.80 1rvb h ASP 207 Ca -0.48 0.00 0.08 0.00 0.02 0.00 0.00 57.03 56.66 1rvb h ASP 207 Cb 1.19 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.65 1rvb h ASP 207 CO 0.65 0.16 0.33 -0.94 -1.72 0.00 0.00 179.24 177.72 1rvb s SER 208 N -6.28 -0.34 0.33 6.45 1.04 -1.26 -5.01 113.70 108.63 1rvb s SER 208 Ca 0.06 -0.30 0.07 0.00 0.48 0.00 0.00 55.95 56.26 1rvb s SER 208 Cb 0.06 0.58 0.58 0.00 0.10 0.00 0.00 66.02 67.34 1rvb s SER 208 CO 0.69 -1.02 1.79 -0.08 0.98 0.00 0.00 173.24 175.61 1rvb h GLU 209 N 2.00 0.28 -0.66 4.02 4.81 -1.93 -1.82 114.58 121.28 1rvb h GLU 209 Ca -0.25 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 58.84 1rvb h GLU 209 Cb 1.26 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.59 1rvb h GLU 209 CO 0.29 0.53 0.24 0.22 -0.73 0.00 0.00 179.01 179.56 1rvb h ASP 210 N 0.25 0.90 -0.26 1.04 3.58 -1.99 -0.75 116.42 119.19 1rvb h ASP 210 Ca 0.04 -0.14 -0.14 0.00 0.42 0.00 0.00 57.03 57.22 1rvb h ASP 210 Cb 0.61 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.42 1rvb h ASP 210 CO 0.04 0.82 -0.37 -0.08 -2.88 0.00 0.00 179.24 176.78 1rvb h GLU 211 N 0.95 0.70 -0.37 0.28 4.81 -1.83 -1.66 114.58 117.46 1rvb h GLU 211 Ca 0.22 -0.41 0.06 0.00 -0.13 0.00 0.00 59.36 59.09 1rvb h GLU 211 Cb 0.22 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.58 1rvb h GLU 211 CO -0.02 1.03 0.06 0.35 -0.73 0.00 0.00 179.01 179.71 1rvb h PHE 212 N 0.43 0.10 -0.12 0.92 3.57 -1.02 0.15 116.94 120.98 1rvb h PHE 212 Ca 0.03 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 1rvb h PHE 212 Cb 0.95 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.70 1rvb h PHE 212 CO 0.08 0.00 0.01 -0.07 -2.23 0.00 0.00 178.31 176.11 1rvb h LEU 213 N 0.18 0.19 -0.61 0.59 3.38 -1.11 -2.39 115.31 115.54 1rvb h LEU 213 Ca 0.18 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1rvb h LEU 213 Cb 0.21 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1rvb h LEU 213 CO -0.24 0.42 0.39 -0.78 0.09 0.00 0.00 178.44 178.31 1rvb h ASP 214 N -0.04 0.72 0.16 -0.43 3.58 -1.09 -0.12 116.42 119.19 1rvb h ASP 214 Ca 0.03 -0.04 0.02 0.00 0.42 0.00 0.00 57.03 57.46 1rvb h ASP 214 Cb 0.31 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.15 1rvb h ASP 214 CO 0.00 0.55 -0.31 0.22 -2.88 0.00 0.00 179.24 176.82 1rvb h TYR 215 N 0.83 -0.83 0.00 0.28 5.03 -0.93 -2.69 116.97 118.66 1rvb h TYR 215 Ca 0.22 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.55 1rvb h TYR 215 Cb -0.06 0.35 -0.00 0.00 1.55 0.00 0.00 36.73 38.57 1rvb h TYR 215 CO -0.03 -0.42 -0.01 -1.49 -1.32 0.00 0.00 178.16 174.90 1rvb h TRP 216 N -0.55 0.00 0.00 -3.82 4.06 -1.19 -2.42 115.95 112.03 1rvb h TRP 216 Ca 0.02 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.97 1rvb h TRP 216 Cb 0.56 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.72 1rvb h TRP 216 CO -0.26 0.01 0.00 0.00 -3.56 0.00 0.00 178.44 174.63 1rvb h ARG 217 N 0.00 0.00 -0.02 0.49 3.08 -0.79 -3.30 114.38 113.84 1rvb h ARG 217 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1rvb h ARG 217 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1rvb h ARG 217 CO 0.00 0.00 0.00 0.09 -1.07 0.00 0.00 179.97 178.99 1rvb n ASN 218 N -2.66 1.72 -4.75 7.04 3.02 -1.04 -5.02 115.26 113.58 1rvb n ASN 218 Ca 0.04 -1.65 -0.41 0.00 -0.03 0.00 0.00 54.58 52.53 1rvb n ASN 218 Cb 0.44 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.56 1rvb n ASN 218 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1rvb s TYR 219 N -0.67 3.40 0.19 3.10 5.04 -0.93 -4.98 117.35 122.50 1rvb s TYR 219 Ca 0.02 1.49 -0.09 0.00 -2.44 0.00 0.00 57.07 56.05 1rvb s TYR 219 Cb 0.01 -3.44 -0.07 0.00 0.35 0.00 0.00 41.96 38.81 1rvb s TYR 219 CO 0.01 -1.17 0.50 -1.21 -1.34 0.00 0.00 175.55 172.34 1rvb s GLU 220 N -0.85 3.77 0.23 4.97 0.41 -1.26 -5.03 118.70 120.94 1rvb s GLU 220 Ca 0.50 0.19 -0.07 0.00 -0.41 0.00 0.00 54.97 55.19 1rvb s GLU 220 Cb -0.34 -2.74 0.20 0.00 -1.78 0.00 0.00 34.13 29.47 1rvb s GLU 220 CO 0.41 0.38 1.83 0.00 -0.49 0.00 0.00 175.26 177.39 1rvb h ARG 221 N 2.77 1.22 -6.56 1.61 3.08 -1.96 -3.45 114.38 111.10 1rvb h ARG 221 Ca -0.47 -0.18 -0.65 0.00 0.07 0.00 0.00 59.98 58.75 1rvb h ARG 221 Cb 1.17 -0.22 -0.16 0.00 0.08 0.00 0.00 29.97 30.84 1rvb h ARG 221 CO 0.70 0.93 -0.75 0.95 -1.07 0.00 0.00 179.97 180.73 1rvb s THR 222 N -5.71 3.13 0.48 2.04 -4.23 -1.26 -5.01 115.64 105.09 1rvb s THR 222 Ca -0.12 -1.50 0.22 0.00 -1.18 0.00 0.00 61.69 59.10 1rvb s THR 222 Cb 0.16 -2.49 0.27 0.00 1.34 0.00 0.00 72.50 71.78 1rvb s THR 222 CO 0.83 0.02 2.10 0.77 -0.54 0.00 0.00 174.62 177.80 1rvb h SER 223 N 3.37 0.00 -0.64 3.99 4.64 -1.98 -1.10 113.55 121.84 1rvb h SER 223 Ca -0.48 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.85 1rvb h SER 223 Cb 1.18 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.24 1rvb h SER 223 CO 0.51 0.09 0.41 -0.61 -0.87 0.00 0.00 176.83 176.36 1rvb h GLN 224 N 0.00 0.80 0.00 4.77 4.15 -1.97 0.58 115.11 123.43 1rvb h GLN 224 Ca -0.00 -0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.25 1rvb h GLN 224 Cb 0.20 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 1rvb h GLN 224 CO 0.01 0.53 -0.66 -0.07 -1.93 0.00 0.00 178.83 176.72 1rvb h LEU 225 N 0.82 0.00 -0.38 -2.39 3.38 -1.77 -3.30 115.31 111.68 1rvb h LEU 225 Ca 0.24 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.08 1rvb h LEU 225 Cb -0.04 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1rvb h LEU 225 CO -0.08 0.57 -0.64 0.03 0.09 0.00 0.00 178.44 178.41 1rvb h ARG 226 N 0.00 0.00 0.00 1.13 3.08 -0.69 -3.27 114.38 114.63 1rvb h ARG 226 Ca -0.02 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1rvb h ARG 226 Cb 1.45 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.50 1rvb h ARG 226 CO 0.07 0.64 -0.02 -0.91 -1.07 0.00 0.00 179.97 178.68 1rvb h ASN 227 N 0.00 0.00 -0.54 7.04 4.21 -0.98 -0.09 115.58 125.22 1rvb h ASN 227 Ca -0.01 0.00 -0.18 0.00 1.21 0.00 0.00 56.30 57.32 1rvb h ASN 227 Cb 1.32 0.00 -0.11 0.00 -1.12 0.00 0.00 38.32 38.41 1rvb h ASN 227 CO 0.08 0.02 0.15 0.47 -1.29 0.00 0.00 177.43 176.86 1rvb n ASP 228 N -3.31 3.84 0.00 5.81 8.00 -1.23 -4.79 116.55 124.87 1rvb n ASP 228 Ca -0.02 -3.37 0.00 0.00 0.71 0.00 0.00 54.79 52.11 1rvb n ASP 228 Cb 0.13 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 40.55 1rvb n ASP 228 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1rvb n LYS 229 N -0.62 0.00 -3.53 -1.24 4.81 -0.40 -5.06 118.16 112.12 1rvb n LYS 229 Ca 0.36 0.00 -0.17 0.00 -0.87 0.00 0.00 58.31 57.63 1rvb n LYS 229 Cb 1.20 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 36.19 1rvb n LYS 229 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 1rvb s TYR 230 N 0.16 -0.66 0.00 5.64 -0.85 -0.18 -4.79 117.35 116.67 1rvb s TYR 230 Ca 0.00 1.19 0.00 0.00 -0.52 0.00 0.00 57.07 57.74 1rvb s TYR 230 Cb 0.00 0.40 0.00 0.00 0.38 0.00 0.00 41.96 42.74 1rvb s TYR 230 CO 0.00 -0.57 0.27 0.09 -1.52 0.00 0.00 175.55 173.82 1rvb n ASN 231 N 1.09 0.55 -3.21 -0.18 3.02 -1.26 -4.73 115.26 110.55 1rvb n ASN 231 Ca -0.18 -0.78 -0.08 0.00 -0.03 0.00 0.00 54.58 53.51 1rvb n ASN 231 Cb 0.57 0.42 0.01 0.00 -0.61 0.00 0.00 39.78 40.17 1rvb n ASN 231 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1rvb s ASN 232 N -0.42 -0.07 0.20 6.41 2.20 -1.26 -4.80 114.94 117.20 1rvb s ASN 232 Ca 0.00 -0.97 -0.11 0.00 -0.94 0.00 0.00 52.86 50.84 1rvb s ASN 232 Cb 0.00 0.80 0.16 0.00 -2.00 0.00 0.00 41.25 40.21 1rvb s ASN 232 CO 0.00 -1.55 1.83 -0.29 -2.94 0.00 0.00 177.10 174.15 1rvb h ILE 233 N 2.00 1.07 0.17 0.54 6.09 -1.98 -1.09 117.51 124.31 1rvb h ILE 233 Ca -0.28 -0.26 0.01 0.00 -1.37 0.00 0.00 64.86 62.96 1rvb h ILE 233 Cb 1.25 0.25 -0.03 0.00 0.47 0.00 0.00 36.82 38.75 1rvb h ILE 233 CO 0.36 0.14 -0.32 0.28 -3.07 0.00 0.00 178.15 175.53 1rvb h SER 234 N 0.75 -0.90 0.10 2.19 0.02 -1.99 0.35 113.55 114.06 1rvb h SER 234 Ca 0.26 0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 61.29 1rvb h SER 234 Cb 0.04 0.33 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 1rvb h SER 234 CO -0.11 -0.42 -0.09 -0.33 -1.14 0.00 0.00 176.83 174.74 1rvb h GLU 235 N -0.57 0.00 -0.23 3.45 5.08 -1.91 -0.36 114.58 120.04 1rvb h GLU 235 Ca 0.02 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.26 1rvb h GLU 235 Cb 0.58 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 1rvb h GLU 235 CO -0.16 0.09 -0.33 -0.92 -1.00 0.00 0.00 179.01 176.69 1rvb h TYR 236 N 0.00 0.78 -0.50 4.33 3.20 -0.26 0.21 116.97 124.73 1rvb h TYR 236 Ca -0.00 -0.26 -0.07 0.00 3.14 0.00 0.00 58.73 61.54 1rvb h TYR 236 Cb 0.16 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 1rvb h TYR 236 CO 0.00 1.00 0.01 0.00 -1.64 0.00 0.00 178.16 177.53 1rvb h ARG 237 N 0.33 0.83 -0.19 1.82 3.08 -0.22 -0.68 114.38 119.36 1rvb h ARG 237 Ca 0.02 -0.22 -0.10 0.00 0.07 0.00 0.00 59.98 59.75 1rvb h ARG 237 Cb 0.91 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1rvb h ARG 237 CO 0.08 0.83 -0.32 -0.97 -1.07 0.00 0.00 179.97 178.52 1rvb h ASN 238 N 0.78 0.39 -0.10 7.04 -0.73 -0.97 -2.30 115.58 119.68 1rvb h ASN 238 Ca 0.15 -0.14 -0.09 0.00 1.87 0.00 0.00 56.30 58.09 1rvb h ASN 238 Cb 0.45 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 38.92 1rvb h ASN 238 CO 0.02 0.69 -0.21 -0.25 -0.37 0.00 0.00 177.43 177.31 1rvb h TRP 239 N 0.33 0.56 -0.16 0.67 7.01 -0.11 -1.84 115.95 122.40 1rvb h TRP 239 Ca 0.04 -0.11 -0.03 0.00 2.11 0.00 0.00 58.89 60.90 1rvb h TRP 239 Cb 0.72 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.64 1rvb h TRP 239 CO 0.02 0.68 -0.02 0.82 -2.79 0.00 0.00 178.44 177.15 1rvb h ILE 240 N 0.45 1.27 -0.57 2.65 1.08 -0.80 -0.36 117.51 121.25 1rvb h ILE 240 Ca 0.07 -0.94 0.07 0.00 -0.39 0.00 0.00 64.86 63.68 1rvb h ILE 240 Cb 0.61 1.57 -0.06 0.00 -3.07 0.00 0.00 36.82 35.87 1rvb h ILE 240 CO 0.04 0.28 0.23 0.22 -0.69 0.00 0.00 178.15 178.23 1rvb h TYR 241 N 0.02 0.41 0.00 1.37 3.20 -1.22 -1.35 116.97 119.41 1rvb h TYR 241 Ca 0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.94 1rvb h TYR 241 Cb 0.43 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1rvb h TYR 241 CO 0.04 0.14 0.00 0.54 -1.64 0.00 0.00 178.16 177.25 1rvb n ARG 242 N -4.96 0.00 -0.04 1.82 1.74 -0.71 -4.81 116.66 109.70 1rvb n ARG 242 Ca 0.07 0.42 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 1rvb n ARG 242 Cb 0.22 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1rvb n ARG 242 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rvb n GLY 243 N -1.03 1.13 3.22 -0.13 0.00 -0.51 -4.47 105.19 103.39 1rvb n GLY 243 Ca 0.01 -0.04 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 1rvb n GLY 243 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rvb n ARG 244 N -1.88 -6.08 0.00 1.61 1.74 -0.15 -5.03 116.66 106.87 1rvb n ARG 244 Ca 0.00 0.77 0.00 0.00 -0.77 0.00 0.00 57.85 57.85 1rvb n ARG 244 Cb 0.00 -5.56 0.00 0.00 -1.02 0.00 0.00 32.46 25.88 1rvb n ARG 244 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47