#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dmx s ASN 2 N 0.00 0.10 0.35 6.12 2.20 -1.26 -5.03 114.94 117.42 3dmx s ASN 2 Ca 0.00 -1.12 0.06 0.00 -0.94 0.00 0.00 52.86 50.85 3dmx s ASN 2 Cb 0.00 0.80 0.72 0.00 -2.00 0.00 0.00 41.25 40.78 3dmx s ASN 2 CO 0.00 -1.58 1.94 -0.29 -2.94 0.00 0.00 177.10 174.23 3dmx h ILE 3 N 2.02 1.00 -0.06 0.54 6.09 -1.96 0.56 117.51 125.71 3dmx h ILE 3 Ca -0.30 -0.27 -0.01 0.00 -1.37 0.00 0.00 64.86 62.91 3dmx h ILE 3 Cb 1.25 0.15 -0.00 0.00 0.47 0.00 0.00 36.82 38.69 3dmx h ILE 3 CO 0.38 0.14 -0.01 -0.26 -3.07 0.00 0.00 178.15 175.34 3dmx h PHE 4 N 0.78 0.13 -0.41 2.19 0.04 -1.99 -1.26 116.94 116.42 3dmx h PHE 4 Ca 0.34 -0.02 -0.07 0.00 2.80 0.00 0.00 57.97 61.01 3dmx h PHE 4 Cb 0.31 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.41 3dmx h PHE 4 CO -0.00 0.41 -0.05 0.93 -0.60 0.00 0.00 178.31 179.00 3dmx h GLU 5 N -0.20 0.69 0.24 1.51 5.08 -1.85 -0.94 114.58 119.12 3dmx h GLU 5 Ca 0.02 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 3dmx h GLU 5 Cb 0.37 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3dmx h GLU 5 CO 0.00 0.74 -0.12 1.98 -1.00 0.00 0.00 179.01 180.62 3dmx h MET 6 N 0.64 -0.32 -0.16 2.33 4.05 -0.84 -1.81 114.93 118.82 3dmx h MET 6 Ca 0.12 0.02 -0.10 0.00 -0.28 0.00 0.00 59.70 59.47 3dmx h MET 6 Cb 0.48 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.34 3dmx h MET 6 CO 0.02 -0.10 -0.33 -0.07 0.23 0.00 0.00 176.91 176.67 3dmx h LEU 7 N -0.48 0.32 -0.74 3.39 3.38 -1.16 -1.73 115.31 118.29 3dmx h LEU 7 Ca -0.03 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 57.86 3dmx h LEU 7 Cb 0.36 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 3dmx h LEU 7 CO 0.05 0.64 0.46 -0.09 0.09 0.00 0.00 178.44 179.59 3dmx h ARG 8 N 0.27 0.86 0.05 1.13 9.65 -1.05 0.23 114.38 125.52 3dmx h ARG 8 Ca 0.04 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 58.86 3dmx h ARG 8 Cb 0.72 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 29.10 3dmx h ARG 8 CO 0.05 0.57 -0.02 0.82 2.80 0.00 0.00 179.97 184.19 3dmx h ILE 9 N 0.88 1.04 -0.13 1.20 2.04 -0.91 -0.85 117.51 120.78 3dmx h ILE 9 Ca 0.30 -0.28 -0.10 0.00 1.00 0.00 0.00 64.86 65.78 3dmx h ILE 9 Cb 0.05 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 3dmx h ILE 9 CO -0.12 0.07 -0.39 0.44 0.00 0.00 0.00 178.15 178.15 3dmx h ASP 10 N -0.19 0.29 0.00 1.72 3.32 -0.99 -3.31 116.42 117.26 3dmx h ASP 10 Ca -0.01 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 56.86 3dmx h ASP 10 Cb 0.17 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3dmx h ASP 10 CO 0.01 0.65 -1.98 -0.62 -1.72 0.00 0.00 179.24 175.58 3dmx n GLU 11 N -4.04 0.68 -0.25 3.56 -0.58 0.77 -5.08 120.64 115.71 3dmx n GLU 11 Ca -0.01 -0.15 0.03 0.00 -0.42 0.00 0.00 57.16 56.61 3dmx n GLU 11 Cb 0.47 -1.47 -0.01 0.00 -0.57 0.00 0.00 31.44 29.85 3dmx n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dmx n GLY 12 N 1.48 -1.92 2.72 0.62 0.00 -0.33 -4.36 105.19 103.40 3dmx n GLY 12 Ca -0.09 -1.34 -0.22 0.00 0.00 0.00 0.00 46.02 44.37 3dmx n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dmx s LEU 13 N 0.00 0.39 -0.04 0.99 2.96 -1.26 -4.23 118.68 117.50 3dmx s LEU 13 Ca 0.00 -0.05 0.01 0.00 -0.22 0.00 0.00 54.13 53.87 3dmx s LEU 13 Cb 0.00 -0.30 0.02 0.00 0.50 0.00 0.00 46.19 46.41 3dmx s LEU 13 CO 0.00 -0.23 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.63 3dmx s ARG 14 N 2.06 0.73 0.00 1.98 0.52 -0.87 -5.01 118.95 118.36 3dmx s ARG 14 Ca 0.05 -0.10 0.25 0.00 -0.52 0.00 0.00 55.73 55.41 3dmx s ARG 14 Cb -0.12 -0.75 0.52 0.00 0.52 0.00 0.00 34.95 35.12 3dmx s ARG 14 CO -0.04 -0.06 1.44 1.28 0.02 0.00 0.00 175.30 177.93 3dmx n LEU 15 N 3.92 2.04 -4.41 2.53 4.77 -1.26 -0.01 117.00 124.58 3dmx n LEU 15 Ca -0.25 -0.68 -0.28 0.00 -0.03 0.00 0.00 56.01 54.77 3dmx n LEU 15 Cb 0.51 -0.02 -0.12 0.00 -2.33 0.00 0.00 43.42 41.46 3dmx n LEU 15 CO 0.24 0.35 -0.55 -0.54 -1.33 0.00 0.00 177.39 175.56 3dmx s LYS 16 N -2.16 1.48 0.13 3.23 1.02 -1.26 -0.97 119.74 121.21 3dmx s LYS 16 Ca 0.29 -1.39 -0.34 0.00 0.02 0.00 0.00 55.97 54.55 3dmx s LYS 16 Cb 0.20 -1.91 -0.14 0.00 -0.52 0.00 0.00 37.83 35.46 3dmx s LYS 16 CO 0.39 0.44 1.59 -0.89 -0.92 0.00 0.00 175.35 175.96 3dmx n ILE 17 N 0.69 0.06 -4.27 2.17 5.41 -0.79 -4.71 119.36 117.91 3dmx n ILE 17 Ca -0.16 -0.01 -0.15 0.00 1.00 0.00 0.00 62.75 63.43 3dmx n ILE 17 Cb 0.54 -1.53 -0.10 0.00 -0.71 0.00 0.00 39.64 37.84 3dmx n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 3dmx s TYR 18 N 1.22 1.39 -0.18 1.39 1.13 0.02 -4.96 117.35 117.36 3dmx s TYR 18 Ca 0.81 -1.23 -0.10 0.00 -1.41 0.00 0.00 57.07 55.13 3dmx s TYR 18 Cb -0.70 -0.77 -0.05 0.00 -1.10 0.00 0.00 41.96 39.34 3dmx s TYR 18 CO 0.40 -0.43 0.15 0.15 -2.51 0.00 0.00 175.55 173.31 3dmx s LYS 19 N -4.07 4.07 0.03 -3.49 1.02 -1.26 0.37 119.74 116.41 3dmx s LYS 19 Ca 0.37 -0.17 -0.01 0.00 0.02 0.00 0.00 55.97 56.18 3dmx s LYS 19 Cb 0.07 -3.38 0.01 0.00 -0.52 0.00 0.00 37.83 34.01 3dmx s LYS 19 CO 0.12 0.38 0.03 -0.40 -0.92 0.00 0.00 175.35 174.56 3dmx n ASP 20 N 3.25 -0.70 0.28 2.83 5.68 0.46 -4.79 116.55 123.56 3dmx n ASP 20 Ca -0.16 -0.67 0.16 0.00 -0.50 0.00 0.00 54.79 53.61 3dmx n ASP 20 Cb 0.52 -0.03 0.79 0.00 -1.14 0.00 0.00 41.12 41.27 3dmx n ASP 20 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3dmx h THR 21 N -1.37 0.26 -0.04 2.12 1.35 -1.99 -1.28 112.91 111.96 3dmx h THR 21 Ca -0.01 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 3dmx h THR 21 Cb 0.03 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 3dmx h THR 21 CO 0.01 0.07 0.00 -0.62 -0.25 0.00 0.00 175.52 174.72 3dmx n GLU 22 N -3.32 2.01 -0.65 4.72 -0.58 -1.26 -4.95 120.64 116.62 3dmx n GLU 22 Ca -0.01 -1.47 0.00 0.00 -0.42 0.00 0.00 57.16 55.26 3dmx n GLU 22 Cb 0.25 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 3dmx n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dmx n GLY 23 N 1.27 0.63 3.84 0.62 0.00 -0.48 -5.07 105.19 106.00 3dmx n GLY 23 Ca 0.17 -0.42 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 3dmx n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dmx s TYR 24 N -2.00 3.59 0.22 1.61 2.02 -1.26 -4.72 117.35 116.81 3dmx s TYR 24 Ca 0.00 0.58 -0.32 0.00 -0.37 0.00 0.00 57.07 56.96 3dmx s TYR 24 Cb 0.00 -2.05 -0.12 0.00 -0.40 0.00 0.00 41.96 39.39 3dmx s TYR 24 CO 0.00 0.64 1.66 0.66 -1.57 0.00 0.00 175.55 176.94 3dmx n TYR 25 N 2.25 2.67 -3.82 2.71 4.01 -1.23 -0.40 117.16 123.36 3dmx n TYR 25 Ca -0.18 0.13 -0.09 0.00 -0.16 0.00 0.00 57.90 57.60 3dmx n TYR 25 Cb 0.54 -2.63 -0.07 0.00 -0.31 0.00 0.00 39.34 36.87 3dmx n TYR 25 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3dmx s THR 26 N 0.84 0.13 0.13 -0.72 2.01 0.16 -1.18 115.64 117.00 3dmx s THR 26 Ca 0.73 -1.07 -0.11 0.00 0.31 0.00 0.00 61.69 61.55 3dmx s THR 26 Cb -0.54 -1.32 0.01 0.00 0.01 0.00 0.00 72.50 70.66 3dmx s THR 26 CO 0.37 -0.57 0.29 -0.51 -0.69 0.00 0.00 174.62 173.51 3dmx s ILE 27 N -3.85 0.09 0.00 1.82 2.07 -0.37 -0.80 121.20 120.16 3dmx s ILE 27 Ca 0.05 -1.07 0.00 0.00 -1.41 0.00 0.00 60.65 58.22 3dmx s ILE 27 Cb 0.04 -1.47 0.00 0.00 0.13 0.00 0.00 42.46 41.16 3dmx s ILE 27 CO -0.11 -0.43 0.00 0.61 -1.91 0.00 0.00 174.94 173.11 3dmx n GLY 28 N -0.17 2.61 3.12 1.50 0.00 0.98 -0.79 105.19 112.43 3dmx n GLY 28 Ca -0.13 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 3dmx n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dmx n ILE 29 N 0.00 5.03 -3.06 -0.61 5.41 -1.26 -2.05 119.36 122.82 3dmx n ILE 29 Ca 0.00 -5.74 -0.21 0.00 1.00 0.00 0.00 62.75 57.80 3dmx n ILE 29 Cb 0.00 -2.26 0.04 0.00 -0.71 0.00 0.00 39.64 36.71 3dmx n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3dmx n GLY 30 N 1.79 -0.45 3.51 7.39 0.00 -1.23 -4.89 105.19 111.30 3dmx n GLY 30 Ca 0.25 0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 3dmx n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3dmx s HIS 31 N -3.17 2.50 0.13 1.61 5.04 0.03 -4.92 115.29 116.50 3dmx s HIS 31 Ca 0.33 -0.25 -0.31 0.00 -1.54 0.00 0.00 55.06 53.29 3dmx s HIS 31 Cb -0.15 -4.44 -0.10 0.00 0.04 0.00 0.00 32.58 27.93 3dmx s HIS 31 CO 0.41 -1.83 1.72 -1.17 -2.34 0.00 0.00 174.74 171.53 3dmx s LEU 32 N 4.86 4.38 -0.19 8.88 2.96 -1.26 -1.24 118.68 137.07 3dmx s LEU 32 Ca 0.29 2.68 -0.12 0.00 -0.22 0.00 0.00 54.13 56.76 3dmx s LEU 32 Cb -0.12 -3.58 -0.21 0.00 0.50 0.00 0.00 46.19 42.79 3dmx s LEU 32 CO 0.13 -0.94 0.15 0.18 -1.32 0.00 0.00 176.35 174.56 3dmx n LEU 33 N 5.11 2.32 -3.58 -0.68 4.77 -0.32 -4.95 117.00 119.66 3dmx n LEU 33 Ca 0.16 0.26 -0.08 0.00 -0.03 0.00 0.00 56.01 56.33 3dmx n LEU 33 Cb 0.38 -1.00 -0.04 0.00 -2.33 0.00 0.00 43.42 40.43 3dmx n LEU 33 CO 0.64 0.62 0.87 0.28 -1.33 0.00 0.00 177.39 178.47 3dmx s THR 34 N -2.48 0.00 -2.04 -5.08 -1.32 -1.21 -4.88 115.64 98.63 3dmx s THR 34 Ca -0.28 0.00 0.27 0.00 -1.21 0.00 0.00 61.69 60.46 3dmx s THR 34 Cb 0.08 -1.00 0.33 0.00 -1.51 0.00 0.00 72.50 70.40 3dmx s THR 34 CO 0.65 0.00 1.57 0.29 -2.21 0.00 0.00 174.62 174.93 3dmx n LYS 35 N 0.37 1.16 -2.17 7.08 5.02 -1.26 -3.47 118.16 124.89 3dmx n LYS 35 Ca -0.06 -0.72 -0.41 0.00 -2.02 0.00 0.00 58.31 55.10 3dmx n LYS 35 Cb 0.59 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 34.09 3dmx n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3dmx s SER 36 N -2.33 6.84 0.00 4.39 0.15 -1.26 -4.93 113.70 116.56 3dmx s SER 36 Ca 0.28 2.57 0.21 0.00 0.70 0.00 0.00 55.95 59.71 3dmx s SER 36 Cb 0.20 -2.63 1.16 0.00 -1.71 0.00 0.00 66.02 63.03 3dmx s SER 36 CO 0.46 -0.51 1.66 -0.81 1.20 0.00 0.00 173.24 175.24 3dmx n PRO 37 N 1.49 0.47 -2.81 5.44 -0.04 -1.26 -4.70 135.00 133.59 3dmx n PRO 37 Ca 0.02 0.05 -0.42 0.00 -0.04 0.00 0.00 63.50 63.11 3dmx n PRO 37 Cb 0.42 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.35 3dmx n PRO 37 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3dmx s SER 38 N -2.30 6.81 0.29 3.54 0.15 -1.26 -4.94 113.70 115.99 3dmx s SER 38 Ca 0.26 0.89 -0.02 0.00 0.70 0.00 0.00 55.95 57.78 3dmx s SER 38 Cb 0.14 -2.47 0.43 0.00 -1.71 0.00 0.00 66.02 62.42 3dmx s SER 38 CO 0.28 -0.70 1.90 0.25 1.20 0.00 0.00 173.24 176.18 3dmx h LEU 39 N 9.64 0.86 -0.93 3.45 5.85 -2.00 -2.31 115.31 129.87 3dmx h LEU 39 Ca -0.22 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.42 3dmx h LEU 39 Cb 1.08 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.84 3dmx h LEU 39 CO 0.94 0.72 0.59 0.78 -0.34 0.00 0.00 178.44 181.12 3dmx h ASN 40 N 0.96 1.10 -0.73 1.25 2.35 -1.98 0.06 115.58 118.60 3dmx h ASN 40 Ca 0.24 -0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 3dmx h ASN 40 Cb 0.07 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.13 3dmx h ASN 40 CO -0.03 0.83 0.32 0.00 -1.65 0.00 0.00 177.43 176.89 3dmx h ALA 41 N 1.32 0.94 -0.54 -0.83 0.00 -1.86 -1.27 119.26 117.02 3dmx h ALA 41 Ca 0.34 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 3dmx h ALA 41 Cb -0.09 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 3dmx h ALA 41 CO -0.07 0.53 0.16 0.00 0.00 0.00 0.00 179.25 179.88 3dmx h ALA 42 N 1.16 0.71 -0.71 0.00 0.00 -0.89 -1.76 119.26 117.77 3dmx h ALA 42 Ca 0.25 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3dmx h ALA 42 Cb 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3dmx h ALA 42 CO -0.03 0.39 0.27 0.87 0.00 0.00 0.00 179.25 180.75 3dmx h LYS 43 N 0.76 1.06 -0.28 0.00 1.57 -0.78 -0.54 116.57 118.36 3dmx h LYS 43 Ca 0.17 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3dmx h LYS 43 Cb 0.30 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 3dmx h LYS 43 CO -0.00 0.87 0.14 1.03 -0.57 0.00 0.00 179.45 180.92 3dmx h SER 44 N 1.03 0.36 -0.73 0.86 0.87 -1.03 -0.72 113.55 114.19 3dmx h SER 44 Ca 0.24 -0.11 0.02 0.00 -1.23 0.00 0.00 61.79 60.70 3dmx h SER 44 Cb 0.21 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 62.04 3dmx h SER 44 CO -0.02 0.37 0.47 -0.33 -0.53 0.00 0.00 176.83 176.79 3dmx h GLU 45 N 0.32 0.92 0.09 2.24 4.39 -1.00 -1.76 114.58 119.79 3dmx h GLU 45 Ca 0.10 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 3dmx h GLU 45 Cb 0.10 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 28.54 3dmx h GLU 45 CO -0.01 0.61 -0.06 1.25 -1.16 0.00 0.00 179.01 179.64 3dmx h LEU 46 N 0.95 -0.14 -0.87 1.33 5.85 -0.86 -0.56 115.31 121.00 3dmx h LEU 46 Ca 0.28 0.01 0.07 0.00 0.84 0.00 0.00 57.88 59.07 3dmx h LEU 46 Cb -0.06 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 40.95 3dmx h LEU 46 CO -0.08 -0.09 0.54 0.44 -0.34 0.00 0.00 178.44 178.90 3dmx h ASP 47 N -0.15 0.83 -0.72 1.25 3.32 -0.94 -0.81 116.42 119.21 3dmx h ASP 47 Ca -0.01 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 3dmx h ASP 47 Cb 0.12 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 3dmx h ASP 47 CO 0.00 0.52 0.23 0.50 -1.72 0.00 0.00 179.24 178.78 3dmx h LYS 48 N 0.96 1.12 -0.38 3.56 3.64 -1.15 0.19 116.57 124.51 3dmx h LYS 48 Ca 0.39 -0.24 -0.14 0.00 -1.27 0.00 0.00 60.65 59.39 3dmx h LYS 48 Cb 0.21 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 3dmx h LYS 48 CO -0.19 0.96 -0.30 0.00 -2.27 0.00 0.00 179.45 177.65 3dmx h ALA 49 N 1.11 0.74 0.01 5.00 0.00 -0.31 -3.31 119.26 122.50 3dmx h ALA 49 Ca 0.23 -0.41 -0.29 0.00 0.00 0.00 0.00 54.91 54.44 3dmx h ALA 49 Cb 0.30 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 3dmx h ALA 49 CO -0.01 0.66 -1.70 0.82 0.00 0.00 0.00 179.25 179.02 3dmx h ILE 50 N 0.71 0.86 0.00 0.00 1.08 -1.10 -3.49 117.51 115.57 3dmx h ILE 50 Ca 0.08 -2.70 0.00 0.00 -0.39 0.00 0.00 64.86 61.85 3dmx h ILE 50 Cb 0.85 2.44 0.00 0.00 -3.07 0.00 0.00 36.82 37.05 3dmx h ILE 50 CO 0.07 0.53 0.00 0.61 -0.69 0.00 0.00 178.15 178.68 3dmx n GLY 51 N 1.58 0.81 3.51 5.37 0.00 0.66 -5.07 105.19 112.05 3dmx n GLY 51 Ca -0.17 -0.60 -0.10 0.00 0.00 0.00 0.00 46.02 45.15 3dmx n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3dmx s ARG 52 N -1.89 1.36 -0.67 1.61 1.70 -1.09 -5.05 118.95 114.93 3dmx s ARG 52 Ca 0.00 -0.75 -0.27 0.00 -0.47 0.00 0.00 55.73 54.24 3dmx s ARG 52 Cb 0.00 0.55 0.02 0.00 -0.57 0.00 0.00 34.95 34.94 3dmx s ARG 52 CO 0.00 -0.59 1.41 1.21 -1.08 0.00 0.00 175.30 176.26 3dmx s ASN 53 N -2.83 6.00 -0.04 -2.89 3.84 -1.26 -4.37 114.94 113.39 3dmx s ASN 53 Ca 0.06 -0.11 0.16 0.00 0.21 0.00 0.00 52.86 53.17 3dmx s ASN 53 Cb -0.01 -2.55 -0.21 0.00 -0.55 0.00 0.00 41.25 37.93 3dmx s ASN 53 CO -0.06 -1.89 0.59 0.35 -2.79 0.00 0.00 177.10 173.30 3dmx n THR 54 N 6.65 1.34 -4.12 -5.21 -2.24 -1.26 -4.99 114.28 104.44 3dmx n THR 54 Ca 0.09 -0.76 -0.30 0.00 -2.27 0.00 0.00 64.05 60.81 3dmx n THR 54 Cb 0.50 -0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 67.92 3dmx n THR 54 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3dmx n ASN 55 N -2.89 -0.90 0.00 3.42 5.15 -1.26 -3.25 115.26 115.52 3dmx n ASN 55 Ca -0.17 -1.07 0.00 0.00 -0.60 0.00 0.00 54.58 52.74 3dmx n ASN 55 Cb 0.98 -2.62 0.00 0.00 -0.53 0.00 0.00 39.78 37.61 3dmx n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dmx n GLY 56 N -1.91 0.80 3.07 8.20 0.00 -1.26 -5.03 105.19 109.06 3dmx n GLY 56 Ca -0.20 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 3dmx n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dmx s VAL 57 N -3.05 1.19 0.29 1.61 1.01 -1.20 -1.89 120.40 118.36 3dmx s VAL 57 Ca 0.00 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.46 3dmx s VAL 57 Cb 0.00 -1.04 -0.06 0.00 0.00 0.00 0.00 36.38 35.28 3dmx s VAL 57 CO 0.00 0.35 0.01 0.27 0.00 0.00 0.00 175.10 175.74 3dmx s ILE 58 N 0.20 1.29 0.58 2.22 -4.36 -0.15 -4.81 121.20 116.18 3dmx s ILE 58 Ca -0.06 -2.04 -0.04 0.00 -0.26 0.00 0.00 60.65 58.26 3dmx s ILE 58 Cb -0.11 -2.61 0.02 0.00 1.25 0.00 0.00 42.46 41.00 3dmx s ILE 58 CO 0.02 -0.15 0.86 0.42 0.24 0.00 0.00 174.94 176.33 3dmx s THR 59 N -3.23 3.31 0.21 8.37 -4.23 -1.26 -4.77 115.64 114.04 3dmx s THR 59 Ca 0.33 -0.25 -0.09 0.00 -1.18 0.00 0.00 61.69 60.49 3dmx s THR 59 Cb 0.07 -3.30 0.16 0.00 1.34 0.00 0.00 72.50 70.76 3dmx s THR 59 CO 0.13 -0.28 1.86 0.50 -0.54 0.00 0.00 174.62 176.29 3dmx h LYS 60 N -0.10 0.90 -0.59 3.99 3.64 -1.99 -0.88 116.57 121.54 3dmx h LYS 60 Ca -0.45 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 58.90 3dmx h LYS 60 Cb 1.27 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 32.85 3dmx h LYS 60 CO 0.59 0.59 0.36 -0.44 -2.27 0.00 0.00 179.45 178.28 3dmx h ASP 61 N 0.92 0.59 -0.46 4.20 3.32 -1.99 -0.02 116.42 122.99 3dmx h ASP 61 Ca 0.29 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.30 3dmx h ASP 61 Cb 0.00 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 3dmx h ASP 61 CO -0.10 0.42 0.11 -0.33 -1.72 0.00 0.00 179.24 177.62 3dmx h GLU 62 N 0.72 0.73 -0.67 3.56 5.08 -1.87 -0.74 114.58 121.39 3dmx h GLU 62 Ca 0.23 -0.17 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 3dmx h GLU 62 Cb 0.01 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 3dmx h GLU 62 CO -0.09 0.72 0.41 0.00 -1.00 0.00 0.00 179.01 179.05 3dmx h ALA 63 N 0.98 0.87 -0.33 3.43 0.00 -0.75 -1.86 119.26 121.60 3dmx h ALA 63 Ca 0.14 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3dmx h ALA 63 Cb 0.32 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3dmx h ALA 63 CO 0.00 0.16 -0.15 0.93 0.00 0.00 0.00 179.25 180.19 3dmx h GLU 64 N 0.80 0.58 0.06 0.00 5.08 -0.80 -0.90 114.58 119.40 3dmx h GLU 64 Ca 0.27 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3dmx h GLU 64 Cb 0.04 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3dmx h GLU 64 CO -0.11 0.71 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.36 3dmx h LYS 65 N 0.53 -0.08 -0.92 2.33 3.64 -0.64 -0.62 116.57 120.80 3dmx h LYS 65 Ca 0.09 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.51 3dmx h LYS 65 Cb 0.57 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.35 3dmx h LYS 65 CO 0.04 0.06 0.60 -0.07 -2.27 0.00 0.00 179.45 177.80 3dmx h LEU 66 N -0.20 0.99 -0.18 5.20 3.38 -1.25 -2.24 115.31 121.02 3dmx h LEU 66 Ca -0.01 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.97 3dmx h LEU 66 Cb 0.17 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3dmx h LEU 66 CO 0.01 0.67 0.07 0.15 0.09 0.00 0.00 178.44 179.43 3dmx h PHE 67 N 1.15 0.12 -0.52 1.13 3.57 -0.86 0.80 116.94 122.33 3dmx h PHE 67 Ca 0.37 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.93 3dmx h PHE 67 Cb 0.02 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 3dmx h PHE 67 CO -0.01 0.06 0.26 -0.91 -2.23 0.00 0.00 178.31 175.48 3dmx h ASN 68 N 0.16 0.38 -0.64 0.41 2.35 -0.90 -0.17 115.58 117.16 3dmx h ASN 68 Ca 0.08 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 3dmx h ASN 68 Cb 0.04 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 3dmx h ASN 68 CO -0.07 0.26 0.38 1.56 -1.65 0.00 0.00 177.43 177.91 3dmx h GLN 69 N 0.51 0.88 -0.62 0.81 4.20 -0.99 -1.42 115.11 118.48 3dmx h GLN 69 Ca 0.23 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.77 3dmx h GLN 69 Cb 0.13 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 3dmx h GLN 69 CO -0.16 0.64 0.08 -0.44 -0.67 0.00 0.00 178.83 178.28 3dmx h ASP 70 N 0.87 1.01 -0.27 1.46 3.32 -0.33 0.84 116.42 123.33 3dmx h ASP 70 Ca 0.23 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 3dmx h ASP 70 Cb -0.01 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 3dmx h ASP 70 CO -0.04 1.03 0.11 0.58 -1.72 0.00 0.00 179.24 179.20 3dmx h VAL 71 N 0.95 1.17 -0.39 -1.35 2.07 -0.87 -1.25 116.25 116.58 3dmx h VAL 71 Ca 0.19 -0.50 0.04 0.00 0.82 0.00 0.00 66.70 67.25 3dmx h VAL 71 Cb 0.46 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 3dmx h VAL 71 CO 0.02 0.17 0.15 0.44 0.02 0.00 0.00 177.57 178.37 3dmx h ASP 72 N 0.28 0.18 -0.93 0.57 5.19 -1.08 -1.82 116.42 118.82 3dmx h ASP 72 Ca 0.09 0.04 0.03 0.00 -0.62 0.00 0.00 57.03 56.57 3dmx h ASP 72 Cb 0.16 0.01 -0.05 0.00 0.18 0.00 0.00 39.33 39.64 3dmx h ASP 72 CO -0.01 0.14 0.61 0.00 -3.12 0.00 0.00 179.24 176.86 3dmx h ALA 73 N 1.24 1.40 -0.21 3.45 0.00 -0.66 -0.01 119.26 124.47 3dmx h ALA 73 Ca 0.18 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3dmx h ALA 73 Cb 0.14 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3dmx h ALA 73 CO -0.17 0.52 0.04 0.00 0.00 0.00 0.00 179.25 179.64 3dmx h ALA 74 N 1.45 0.28 0.09 0.00 0.00 -0.67 -0.01 119.26 120.41 3dmx h ALA 74 Ca 0.36 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3dmx h ALA 74 Cb -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3dmx h ALA 74 CO -0.10 -0.06 -0.04 0.28 0.00 0.00 0.00 179.25 179.33 3dmx h VAL 75 N 0.15 0.93 -0.94 0.00 2.07 -1.10 -1.55 116.25 115.82 3dmx h VAL 75 Ca 0.06 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.58 3dmx h VAL 75 Cb 0.30 0.98 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 3dmx h VAL 75 CO 0.00 0.02 0.61 0.03 0.02 0.00 0.00 177.57 178.25 3dmx h ARG 76 N -0.14 1.06 -0.45 1.57 -0.00 -0.95 -1.44 114.38 114.01 3dmx h ARG 76 Ca -0.01 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.98 59.39 3dmx h ARG 76 Cb 0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 29.97 29.83 3dmx h ARG 76 CO 0.02 0.70 0.21 0.78 0.00 0.00 0.00 179.97 181.68 3dmx h GLY 77 N 1.09 0.71 0.82 0.04 0.00 -0.71 -1.93 103.07 103.09 3dmx h GLY 77 Ca 0.40 -0.36 0.02 0.00 0.00 0.00 0.00 47.33 47.40 3dmx h GLY 77 CO -0.15 0.34 0.11 -2.22 0.00 0.00 0.00 176.54 174.62 3dmx h ILE 78 N 0.59 0.95 0.00 2.60 2.04 -0.76 -2.48 117.51 120.46 3dmx h ILE 78 Ca 0.16 -0.08 -0.05 0.00 1.00 0.00 0.00 64.86 65.88 3dmx h ILE 78 Cb 0.13 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3dmx h ILE 78 CO -0.02 0.04 -0.23 -0.07 0.00 0.00 0.00 178.15 177.88 3dmx h LEU 79 N 0.24 0.00 -0.15 1.44 3.38 -1.09 -2.41 115.31 116.71 3dmx h LEU 79 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3dmx h LEU 79 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3dmx h LEU 79 CO -0.11 0.23 -0.41 0.54 0.09 0.00 0.00 178.44 178.78 3dmx n ARG 80 N -3.67 0.27 -3.36 1.13 1.74 -0.74 -4.81 116.66 107.22 3dmx n ARG 80 Ca -0.01 -0.15 -0.39 0.00 -0.77 0.00 0.00 57.85 56.53 3dmx n ARG 80 Cb 0.35 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.22 3dmx n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3dmx s ASN 81 N -2.84 6.42 0.43 0.55 3.84 -0.92 -4.98 114.94 117.45 3dmx s ASN 81 Ca 0.15 0.50 0.12 0.00 0.21 0.00 0.00 52.86 53.85 3dmx s ASN 81 Cb 0.18 -2.24 0.94 0.00 -0.55 0.00 0.00 41.25 39.58 3dmx s ASN 81 CO 0.64 -0.12 1.99 0.00 -2.79 0.00 0.00 177.10 176.82 3dmx h ALA 82 N 7.54 1.66 0.24 1.71 0.00 -1.88 -1.16 119.26 127.37 3dmx h ALA 82 Ca -0.35 -0.15 -0.34 0.00 0.00 0.00 0.00 54.91 54.08 3dmx h ALA 82 Cb 1.16 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.92 3dmx h ALA 82 CO 0.71 0.25 -1.51 0.87 0.00 0.00 0.00 179.25 179.57 3dmx h LYS 83 N 0.14 0.51 0.22 0.00 1.57 -1.93 -3.40 116.57 113.68 3dmx h LYS 83 Ca 0.03 -0.87 -0.33 0.00 -1.87 0.00 0.00 60.65 57.60 3dmx h LYS 83 Cb 0.27 0.33 0.03 0.00 0.08 0.00 0.00 32.23 32.93 3dmx h LYS 83 CO 0.02 1.42 -1.52 -0.07 -0.57 0.00 0.00 179.45 178.72 3dmx h LEU 84 N 0.14 0.74 -0.18 2.94 3.38 -1.75 -3.38 115.31 117.20 3dmx h LEU 84 Ca -0.26 -0.86 0.04 0.00 0.09 0.00 0.00 57.88 56.89 3dmx h LEU 84 Cb 2.16 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 42.62 3dmx h LEU 84 CO 0.26 1.68 -0.09 0.50 0.09 0.00 0.00 178.44 180.89 3dmx h LYS 85 N 0.13 -0.06 -0.89 1.13 3.64 -1.04 -0.58 116.57 118.89 3dmx h LYS 85 Ca -0.26 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.14 3dmx h LYS 85 Cb 2.13 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 33.92 3dmx h LYS 85 CO 0.24 -0.04 0.59 -1.35 -2.27 0.00 0.00 179.45 176.62 3dmx h PRO 86 N -0.07 1.14 -0.21 1.90 0.11 -1.78 0.12 132.00 133.21 3dmx h PRO 86 Ca 0.10 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 66.09 3dmx h PRO 86 Cb 0.21 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 3dmx h PRO 86 CO -0.22 0.75 -0.05 0.28 -0.21 0.00 0.00 178.00 178.55 3dmx h VAL 87 N 1.17 1.28 -0.30 3.15 2.07 -1.62 -2.19 116.25 119.81 3dmx h VAL 87 Ca 0.33 -1.03 0.02 0.00 0.82 0.00 0.00 66.70 66.84 3dmx h VAL 87 Cb -0.09 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 3dmx h VAL 87 CO -0.08 0.31 0.16 0.22 0.02 0.00 0.00 177.57 178.20 3dmx h TYR 88 N 0.13 0.29 -0.12 1.57 3.20 -0.77 -2.12 116.97 119.14 3dmx h TYR 88 Ca 0.05 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.97 3dmx h TYR 88 Cb 0.50 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 3dmx h TYR 88 CO 0.05 0.16 0.09 -0.44 -1.64 0.00 0.00 178.16 176.38 3dmx h ASP 89 N 0.33 0.02 1.42 -2.11 3.32 -0.70 -1.99 116.42 116.71 3dmx h ASP 89 Ca 0.13 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3dmx h ASP 89 Cb 0.03 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3dmx h ASP 89 CO -0.08 0.01 0.00 0.77 -1.72 0.00 0.00 179.24 178.22 3dmx h SER 90 N 0.02 0.00 -3.56 6.45 4.64 -0.72 -3.46 113.55 116.92 3dmx h SER 90 Ca 0.06 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.88 3dmx h SER 90 Cb 0.20 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.29 3dmx h SER 90 CO -0.00 0.00 0.04 -0.76 -0.87 0.00 0.00 176.83 175.24 3dmx s LEU 91 N -5.30 3.91 0.88 5.97 1.43 -0.75 -5.06 118.68 119.76 3dmx s LEU 91 Ca 0.07 1.02 -0.12 0.00 -1.03 0.00 0.00 54.13 54.07 3dmx s LEU 91 Cb 0.09 -3.88 0.12 0.00 0.03 0.00 0.00 46.19 42.55 3dmx s LEU 91 CO 0.57 -0.33 1.11 1.51 0.23 0.00 0.00 176.35 179.44 3dmx s ASP 92 N -3.11 3.71 0.37 2.29 -4.77 -1.26 -4.82 116.67 109.07 3dmx s ASP 92 Ca 0.49 1.23 0.05 0.00 -3.30 0.00 0.00 52.55 51.02 3dmx s ASP 92 Cb -0.10 -1.89 0.70 0.00 -1.09 0.00 0.00 42.92 40.53 3dmx s ASP 92 CO 0.30 -2.46 1.95 0.00 0.70 0.00 0.00 175.17 175.67 3dmx h ALA 93 N -1.43 1.50 -0.06 2.11 0.00 -1.98 -0.23 119.26 119.18 3dmx h ALA 93 Ca -0.50 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 3dmx h ALA 93 Cb 1.30 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 3dmx h ALA 93 CO 0.59 0.37 -0.01 0.28 0.00 0.00 0.00 179.25 180.48 3dmx h VAL 94 N 0.53 1.28 0.00 0.00 2.07 -1.94 -2.55 116.25 115.65 3dmx h VAL 94 Ca 0.13 -0.88 -0.08 0.00 0.82 0.00 0.00 66.70 66.69 3dmx h VAL 94 Cb 0.17 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 3dmx h VAL 94 CO -0.01 0.24 -0.36 0.03 0.02 0.00 0.00 177.57 177.50 3dmx h ARG 95 N -0.21 0.00 -0.95 1.57 3.08 -1.77 -2.16 114.38 113.94 3dmx h ARG 95 Ca 0.02 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.09 3dmx h ARG 95 Cb 0.39 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.39 3dmx h ARG 95 CO 0.01 0.36 0.63 0.00 -1.07 0.00 0.00 179.97 179.89 3dmx h ARG 96 N 0.00 1.21 -0.67 0.04 3.08 -0.94 -1.31 114.38 115.80 3dmx h ARG 96 Ca -0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3dmx h ARG 96 Cb 0.65 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 30.39 3dmx h ARG 96 CO 0.05 0.80 0.43 0.00 -1.07 0.00 0.00 179.97 180.18 3dmx h ALA 97 N 1.42 0.85 -0.95 0.04 0.00 -0.96 -0.76 119.26 118.89 3dmx h ALA 97 Ca 0.36 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.22 3dmx h ALA 97 Cb -0.08 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.40 3dmx h ALA 97 CO -0.09 0.29 0.62 0.00 0.00 0.00 0.00 179.25 180.07 3dmx h ALA 98 N 1.23 1.30 -0.27 0.00 0.00 -1.17 0.01 119.26 120.36 3dmx h ALA 98 Ca 0.24 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 3dmx h ALA 98 Cb -0.08 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.31 3dmx h ALA 98 CO -0.05 0.64 0.16 0.00 0.00 0.00 0.00 179.25 179.99 3dmx h ALA 99 N 1.39 0.35 -0.68 0.00 0.00 -0.75 -2.08 119.26 117.49 3dmx h ALA 99 Ca 0.35 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 3dmx h ALA 99 Cb -0.14 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3dmx h ALA 99 CO -0.07 -0.13 0.36 0.82 0.00 0.00 0.00 179.25 180.22 3dmx h ILE 100 N 0.33 1.22 -0.16 0.00 2.04 -0.75 -2.40 117.51 117.78 3dmx h ILE 100 Ca 0.10 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.44 3dmx h ILE 100 Cb 0.04 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.43 3dmx h ILE 100 CO -0.02 0.24 -0.13 -1.13 0.00 0.00 0.00 178.15 177.11 3dmx h ASN 101 N 0.93 -0.41 -0.32 1.72 -0.73 -0.78 0.19 115.58 116.18 3dmx h ASN 101 Ca 0.24 0.09 0.06 0.00 1.87 0.00 0.00 56.30 58.55 3dmx h ASN 101 Cb 0.06 0.21 -0.06 0.00 0.27 0.00 0.00 38.32 38.80 3dmx h ASN 101 CO -0.04 -0.17 -0.06 0.24 -0.37 0.00 0.00 177.43 177.04 3dmx h MET 102 N -0.14 0.02 -0.60 6.67 2.86 -1.21 -1.72 114.93 120.82 3dmx h MET 102 Ca 0.10 -0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.67 3dmx h MET 102 Cb 0.29 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 3dmx h MET 102 CO -0.25 0.02 0.11 0.28 1.06 0.00 0.00 176.91 178.13 3dmx h VAL 103 N 0.02 1.26 -0.71 -2.22 2.07 -1.03 -0.37 116.25 115.27 3dmx h VAL 103 Ca 0.15 -0.97 0.12 0.00 0.82 0.00 0.00 66.70 66.83 3dmx h VAL 103 Cb 0.23 0.73 -0.09 0.00 -1.52 0.00 0.00 31.29 30.64 3dmx h VAL 103 CO -0.31 0.36 0.27 0.15 0.02 0.00 0.00 177.57 178.06 3dmx h PHE 104 N 0.88 0.47 0.16 1.57 3.04 -0.31 0.15 116.94 122.90 3dmx h PHE 104 Ca 0.18 0.03 -0.28 0.00 3.98 0.00 0.00 57.97 61.89 3dmx h PHE 104 Cb 0.40 -0.10 0.03 0.00 2.56 0.00 0.00 35.95 38.84 3dmx h PHE 104 CO 0.03 0.08 -1.19 0.37 -2.02 0.00 0.00 178.31 175.57 3dmx h GLN 105 N 0.43 0.52 0.00 1.11 4.15 -0.79 -3.40 115.11 117.13 3dmx h GLN 105 Ca 0.38 -0.78 0.00 0.00 0.77 0.00 0.00 58.65 59.02 3dmx h GLN 105 Cb 0.54 0.27 0.00 0.00 0.21 0.00 0.00 27.48 28.50 3dmx h GLN 105 CO -0.37 1.36 -0.17 -1.33 -1.93 0.00 0.00 178.83 176.39 3dmx n MET 106 N -3.87 5.83 0.00 1.69 2.81 -0.20 -5.12 117.12 118.27 3dmx n MET 106 Ca -0.15 -0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.74 3dmx n MET 106 Cb 0.97 -0.66 0.00 0.00 -0.71 0.00 0.00 33.22 32.82 3dmx n MET 106 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3dmx n GLY 107 N 1.09 -1.86 0.17 3.03 0.00 0.50 -4.08 105.19 104.04 3dmx n GLY 107 Ca 0.01 -1.49 -0.05 0.00 0.00 0.00 0.00 46.02 44.49 3dmx n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3dmx h GLU 108 N 0.00 0.00 -0.09 1.61 4.81 -1.94 -2.29 114.58 116.68 3dmx h GLU 108 Ca 0.00 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3dmx h GLU 108 Cb 0.00 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 3dmx h GLU 108 CO 0.00 0.00 0.05 1.15 -0.73 0.00 0.00 179.01 179.48 3dmx h THR 109 N 0.00 1.08 -0.57 0.32 2.02 -1.98 -0.38 112.91 113.40 3dmx h THR 109 Ca 0.19 -0.22 0.08 0.00 0.77 0.00 0.00 66.41 67.23 3dmx h THR 109 Cb 0.29 1.06 -0.06 0.00 -1.74 0.00 0.00 68.15 67.69 3dmx h THR 109 CO -0.41 0.07 0.22 1.23 0.37 0.00 0.00 175.52 177.00 3dmx h GLY 110 N 0.07 0.78 0.85 2.16 0.00 -1.65 -2.81 103.07 102.48 3dmx h GLY 110 Ca 0.03 -0.13 -0.08 0.00 0.00 0.00 0.00 47.33 47.16 3dmx h GLY 110 CO -0.01 0.01 -0.17 -2.08 0.00 0.00 0.00 176.54 174.29 3dmx h VAL 111 N 0.42 1.32 -0.05 4.60 2.07 -1.25 -3.12 116.25 120.23 3dmx h VAL 111 Ca 0.28 -1.31 0.02 0.00 0.82 0.00 0.00 66.70 66.51 3dmx h VAL 111 Cb 0.30 1.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.73 3dmx h VAL 111 CO -0.26 0.40 0.26 0.00 0.02 0.00 0.00 177.57 177.99 3dmx h ALA 112 N 0.68 1.38 -0.01 1.67 0.00 -0.82 0.19 119.26 122.35 3dmx h ALA 112 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3dmx h ALA 112 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3dmx h ALA 112 CO 0.05 -0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.42 3dmx n GLY 113 N -1.23 -0.50 2.11 0.00 0.00 -1.11 -4.07 105.19 100.39 3dmx n GLY 113 Ca -0.01 -0.32 -0.17 0.00 0.00 0.00 0.00 46.02 45.52 3dmx n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3dmx n PHE 114 N -0.42 0.75 -0.18 1.61 3.01 0.65 -4.76 117.46 118.13 3dmx n PHE 114 Ca 0.21 -1.66 -0.01 0.00 1.01 0.00 0.00 57.45 57.01 3dmx n PHE 114 Cb 0.23 -1.32 0.08 0.00 -0.01 0.00 0.00 39.48 38.46 3dmx n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 3dmx h THR 115 N 1.77 0.55 -0.25 4.37 2.02 -1.81 0.35 112.91 119.91 3dmx h THR 115 Ca 0.25 -0.04 -0.19 0.00 0.77 0.00 0.00 66.41 67.21 3dmx h THR 115 Cb 1.10 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.93 3dmx h THR 115 CO 0.50 0.02 -0.58 0.78 0.37 0.00 0.00 175.52 176.61 3dmx h ASN 116 N 0.12 0.90 -0.39 4.18 2.35 -1.95 -1.92 115.58 118.87 3dmx h ASN 116 Ca 0.29 -0.50 -0.00 0.00 -0.55 0.00 0.00 56.30 55.53 3dmx h ASN 116 Cb 0.45 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 3dmx h ASN 116 CO -0.47 1.28 0.23 0.28 -1.65 0.00 0.00 177.43 177.10 3dmx h SER 117 N 0.61 0.48 -0.58 5.81 0.02 -1.80 -2.34 113.55 115.74 3dmx h SER 117 Ca 0.00 -0.06 0.02 0.00 -0.84 0.00 0.00 61.79 60.92 3dmx h SER 117 Cb 1.18 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 63.56 3dmx h SER 117 CO 0.12 0.40 0.36 -0.07 -1.14 0.00 0.00 176.83 176.50 3dmx h LEU 118 N 0.51 0.59 -0.24 5.07 3.38 -0.80 0.07 115.31 123.90 3dmx h LEU 118 Ca 0.14 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.13 3dmx h LEU 118 Cb 0.01 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3dmx h LEU 118 CO -0.03 0.41 0.10 -0.09 0.09 0.00 0.00 178.44 178.93 3dmx h ARG 119 N 0.71 0.21 -0.56 1.13 2.43 -1.27 -0.89 114.38 116.14 3dmx h ARG 119 Ca 0.23 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.35 3dmx h ARG 119 Cb 0.00 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 3dmx h ARG 119 CO -0.09 0.14 0.19 0.52 -1.51 0.00 0.00 179.97 179.22 3dmx h MET 120 N 0.22 0.83 -0.28 0.20 2.86 -0.95 -0.42 114.93 117.39 3dmx h MET 120 Ca 0.10 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 3dmx h MET 120 Cb 0.05 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 3dmx h MET 120 CO -0.09 0.71 0.11 -0.07 1.06 0.00 0.00 176.91 178.63 3dmx h LEU 121 N 0.82 0.39 -1.32 1.22 3.38 -0.68 -0.62 115.31 118.49 3dmx h LEU 121 Ca 0.19 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 3dmx h LEU 121 Cb 0.21 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3dmx h LEU 121 CO -0.01 0.45 -0.04 -0.61 0.09 0.00 0.00 178.44 178.32 3dmx h GLN 122 N 0.30 0.41 0.00 1.13 4.15 -0.75 -1.43 115.11 118.92 3dmx h GLN 122 Ca 0.09 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.43 3dmx h GLN 122 Cb 0.18 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.81 3dmx h GLN 122 CO -0.01 0.47 0.00 1.04 -1.93 0.00 0.00 178.83 178.40 3dmx n GLN 123 N -4.29 0.03 -3.06 1.69 6.02 -0.20 -4.91 117.38 112.66 3dmx n GLN 123 Ca 0.01 0.16 -0.21 0.00 -0.01 0.00 0.00 57.00 56.95 3dmx n GLN 123 Cb 0.24 -1.54 0.04 0.00 1.02 0.00 0.00 30.24 30.00 3dmx n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3dmx n LYS 124 N -1.59 -5.07 -2.88 -1.09 5.02 -0.54 -4.93 118.16 107.08 3dmx n LYS 124 Ca 0.05 0.84 -0.44 0.00 -2.02 0.00 0.00 58.31 56.74 3dmx n LYS 124 Cb 0.25 -5.60 0.00 0.00 -0.02 0.00 0.00 35.03 29.67 3dmx n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3dmx n ARG 125 N -3.96 3.78 -0.15 1.97 1.74 -0.33 -4.89 116.66 114.81 3dmx n ARG 125 Ca -0.09 -4.08 -0.08 0.00 -0.77 0.00 0.00 57.85 52.83 3dmx n ARG 125 Cb 0.60 -2.76 0.01 0.00 -1.02 0.00 0.00 32.46 29.29 3dmx n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 3dmx h TRP 126 N 6.19 0.63 -0.46 -1.55 -0.00 -1.88 0.22 115.95 119.09 3dmx h TRP 126 Ca 0.28 -0.02 -0.08 0.00 -0.00 0.00 0.00 58.89 59.07 3dmx h TRP 126 Cb 0.74 -0.20 -0.02 0.00 -0.00 0.00 0.00 29.16 29.68 3dmx h TRP 126 CO 1.04 0.48 -0.02 -0.44 -0.00 0.00 0.00 178.44 179.50 3dmx h ASP 127 N 0.60 0.82 -0.34 -3.49 5.19 -1.90 -0.09 116.42 117.21 3dmx h ASP 127 Ca 0.16 -0.32 -0.03 0.00 -0.62 0.00 0.00 57.03 56.22 3dmx h ASP 127 Cb 0.06 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.33 3dmx h ASP 127 CO -0.03 0.94 0.10 -0.33 -3.12 0.00 0.00 179.24 176.80 3dmx h GLU 128 N 0.68 0.54 -0.43 3.56 5.08 -1.88 -1.43 114.58 120.70 3dmx h GLU 128 Ca 0.13 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.42 3dmx h GLU 128 Cb 0.53 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 3dmx h GLU 128 CO 0.03 0.58 0.17 0.00 -1.00 0.00 0.00 179.01 178.78 3dmx h ALA 129 N 0.94 0.52 -0.44 3.43 0.00 -0.47 -0.96 119.26 122.28 3dmx h ALA 129 Ca 0.11 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.09 3dmx h ALA 129 Cb 0.27 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3dmx h ALA 129 CO -0.00 -0.22 0.25 0.00 0.00 0.00 0.00 179.25 179.28 3dmx h ALA 130 N 1.27 0.56 -0.45 0.00 0.00 -0.77 0.21 119.26 120.09 3dmx h ALA 130 Ca 0.20 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3dmx h ALA 130 Cb 0.18 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3dmx h ALA 130 CO -0.19 -0.07 0.27 0.28 0.00 0.00 0.00 179.25 179.53 3dmx h VAL 131 N 0.51 1.14 -0.45 0.00 2.07 -0.98 -2.95 116.25 115.60 3dmx h VAL 131 Ca 0.18 -0.33 -0.06 0.00 0.82 0.00 0.00 66.70 67.31 3dmx h VAL 131 Cb 0.03 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 3dmx h VAL 131 CO -0.09 0.15 0.04 -1.13 0.02 0.00 0.00 177.57 176.56 3dmx h ASN 132 N 0.59 0.74 -0.64 0.57 -0.73 -0.78 -3.00 115.58 112.33 3dmx h ASN 132 Ca 0.16 -0.28 0.09 0.00 1.87 0.00 0.00 56.30 58.14 3dmx h ASN 132 Cb 0.00 -0.20 -0.04 0.00 0.27 0.00 0.00 38.32 38.36 3dmx h ASN 132 CO -0.03 0.84 0.42 -0.07 -0.37 0.00 0.00 177.43 178.22 3dmx h LEU 133 N 0.62 0.43 -0.27 0.34 3.38 -0.88 -1.91 115.31 117.02 3dmx h LEU 133 Ca 0.13 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3dmx h LEU 133 Cb 0.43 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3dmx h LEU 133 CO 0.01 0.26 0.00 0.00 0.09 0.00 0.00 178.44 178.81 3dmx n ALA 134 N -2.50 2.06 -2.03 1.53 0.00 -1.12 -4.09 120.51 114.35 3dmx n ALA 134 Ca 0.10 0.02 -0.42 0.00 0.00 0.00 0.00 53.44 53.15 3dmx n ALA 134 Cb 0.35 -1.44 -0.00 0.00 0.00 0.00 0.00 19.45 18.36 3dmx n ALA 134 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3dmx n LYS 135 N -2.28 3.59 -3.65 0.00 5.02 -0.72 -4.66 118.16 115.46 3dmx n LYS 135 Ca 0.04 -3.16 -0.14 0.00 -2.02 0.00 0.00 58.31 53.03 3dmx n LYS 135 Cb 0.36 -2.96 -0.07 0.00 -0.02 0.00 0.00 35.03 32.34 3dmx n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3dmx s SER 136 N 1.48 -0.36 0.26 4.39 1.04 -1.26 -5.01 113.70 114.24 3dmx s SER 136 Ca 0.46 0.23 -0.02 0.00 0.48 0.00 0.00 55.95 57.10 3dmx s SER 136 Cb 0.13 0.42 0.48 0.00 0.10 0.00 0.00 66.02 67.15 3dmx s SER 136 CO -0.04 -0.58 1.78 -0.09 0.98 0.00 0.00 173.24 175.29 3dmx h ARG 137 N 3.29 0.65 -0.26 4.02 2.43 -1.93 -2.26 114.38 120.32 3dmx h ARG 137 Ca -0.30 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 58.90 3dmx h ARG 137 Cb 1.18 -0.15 -0.08 0.00 -0.42 0.00 0.00 29.97 30.51 3dmx h ARG 137 CO 0.41 0.43 -0.36 2.35 -1.51 0.00 0.00 179.97 181.29 3dmx h TRP 138 N 0.67 -1.02 -0.37 2.20 7.01 -1.95 0.74 115.95 123.24 3dmx h TRP 138 Ca 0.44 0.05 -0.01 0.00 2.11 0.00 0.00 58.89 61.48 3dmx h TRP 138 Cb 0.56 0.48 -0.02 0.00 -2.10 0.00 0.00 29.16 28.08 3dmx h TRP 138 CO -0.08 -0.42 0.20 -0.92 -2.79 0.00 0.00 178.44 174.43 3dmx h TYR 139 N -0.36 0.51 -0.50 2.65 3.20 -1.77 -0.60 116.97 120.10 3dmx h TYR 139 Ca 0.12 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.92 3dmx h TYR 139 Cb 0.57 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 3dmx h TYR 139 CO -0.50 0.40 0.07 -0.91 -1.64 0.00 0.00 178.16 175.58 3dmx h ASN 140 N 0.47 0.74 0.38 -2.11 4.21 -0.83 -0.93 115.58 117.50 3dmx h ASN 140 Ca 0.13 -0.15 -0.32 0.00 1.21 0.00 0.00 56.30 57.17 3dmx h ASN 140 Cb 0.07 -0.19 0.01 0.00 -1.12 0.00 0.00 38.32 37.08 3dmx h ASN 140 CO -0.02 0.76 -1.53 1.56 -1.29 0.00 0.00 177.43 176.91 3dmx h GLN 141 N 0.75 0.35 -2.12 0.81 1.08 -0.79 -3.39 115.11 111.80 3dmx h GLN 141 Ca 0.16 -0.59 -0.58 0.00 -1.45 0.00 0.00 58.65 56.18 3dmx h GLN 141 Cb 0.35 0.22 -0.41 0.00 -0.05 0.00 0.00 27.48 27.60 3dmx h GLN 141 CO 0.01 1.25 -0.79 0.25 -0.95 0.00 0.00 178.83 178.59 3dmx n THR 142 N -3.55 1.21 -0.16 -0.54 -2.24 -0.24 -4.98 114.28 103.77 3dmx n THR 142 Ca -0.17 -4.77 -0.10 0.00 -2.27 0.00 0.00 64.05 56.74 3dmx n THR 142 Cb 1.06 -2.01 -0.00 0.00 -2.10 0.00 0.00 70.33 67.28 3dmx n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3dmx h PRO 143 N 4.06 0.83 -0.39 -0.78 0.13 -1.37 -0.64 132.00 133.84 3dmx h PRO 143 Ca 0.15 -0.27 -0.03 0.00 -0.87 0.00 0.00 66.00 64.98 3dmx h PRO 143 Cb 0.74 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.78 3dmx h PRO 143 CO 0.69 0.89 0.13 -0.91 -0.23 0.00 0.00 178.00 178.56 3dmx h ASN 144 N 0.68 0.57 -0.20 1.44 2.35 -1.94 0.16 115.58 118.64 3dmx h ASN 144 Ca 0.13 -0.20 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 3dmx h ASN 144 Cb 0.52 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 3dmx h ASN 144 CO 0.03 0.62 0.04 -0.09 -1.65 0.00 0.00 177.43 176.38 3dmx h ARG 145 N 0.49 0.32 -0.82 0.81 1.12 -1.95 -2.50 114.38 111.83 3dmx h ARG 145 Ca 0.13 -0.08 0.01 0.00 -1.11 0.00 0.00 59.98 58.93 3dmx h ARG 145 Cb 0.25 -0.04 -0.04 0.00 -0.01 0.00 0.00 29.97 30.13 3dmx h ARG 145 CO -0.00 0.45 0.54 0.00 -3.11 0.00 0.00 179.97 177.85 3dmx h ALA 146 N 0.85 1.05 -0.74 2.80 0.00 -0.98 -1.76 119.26 120.47 3dmx h ALA 146 Ca 0.06 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.97 3dmx h ALA 146 Cb 0.28 -0.33 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 3dmx h ALA 146 CO 0.00 0.45 0.44 0.87 0.00 0.00 0.00 179.25 181.01 3dmx h LYS 147 N 1.11 0.80 -0.30 0.00 1.57 -0.61 0.30 116.57 119.44 3dmx h LYS 147 Ca 0.30 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 3dmx h LYS 147 Cb -0.12 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.00 3dmx h LYS 147 CO -0.07 0.53 0.15 0.00 -0.57 0.00 0.00 179.45 179.48 3dmx h ARG 148 N 0.82 0.42 -0.48 3.15 3.08 -0.97 -0.08 114.38 120.33 3dmx h ARG 148 Ca 0.32 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 60.22 3dmx h ARG 148 Cb 0.15 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 3dmx h ARG 148 CO -0.17 0.40 -0.06 0.28 -1.07 0.00 0.00 179.97 179.35 3dmx h VAL 149 N 0.35 1.27 -0.53 2.04 2.07 -0.88 -1.96 116.25 118.60 3dmx h VAL 149 Ca 0.10 -1.17 -0.07 0.00 0.82 0.00 0.00 66.70 66.38 3dmx h VAL 149 Cb 0.11 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 3dmx h VAL 149 CO -0.01 0.40 0.06 0.40 0.02 0.00 0.00 177.57 178.44 3dmx h ILE 150 N 0.73 1.26 -0.78 4.57 2.04 -0.37 -1.69 117.51 123.27 3dmx h ILE 150 Ca 0.13 -1.01 0.03 0.00 1.00 0.00 0.00 64.86 65.01 3dmx h ILE 150 Cb 0.60 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 3dmx h ILE 150 CO 0.04 0.36 0.52 0.74 0.00 0.00 0.00 178.15 179.81 3dmx h THR 151 N 0.79 1.14 -0.44 -0.27 2.02 -0.82 0.26 112.91 115.58 3dmx h THR 151 Ca 0.16 -0.34 -0.04 0.00 0.77 0.00 0.00 66.41 66.96 3dmx h THR 151 Cb 0.45 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 3dmx h THR 151 CO 0.02 0.18 0.12 0.74 0.37 0.00 0.00 175.52 176.94 3dmx h THR 152 N 0.98 1.23 -0.68 3.16 2.02 -0.98 -0.64 112.91 118.00 3dmx h THR 152 Ca 0.31 -0.78 -0.07 0.00 0.77 0.00 0.00 66.41 66.64 3dmx h THR 152 Cb 0.02 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 3dmx h THR 152 CO -0.09 0.28 0.14 -0.26 0.37 0.00 0.00 175.52 175.96 3dmx h PHE 153 N 0.57 1.15 -0.41 3.16 0.04 -0.60 -0.00 116.94 120.85 3dmx h PHE 153 Ca 0.14 -0.14 -0.12 0.00 2.80 0.00 0.00 57.97 60.65 3dmx h PHE 153 Cb 0.30 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 3dmx h PHE 153 CO 0.02 0.95 -0.20 -0.09 -0.60 0.00 0.00 178.31 178.38 3dmx h ARG 154 N 1.03 0.87 0.00 1.51 2.43 -0.24 -3.37 114.38 116.61 3dmx h ARG 154 Ca 0.21 -0.38 -0.17 0.00 -0.81 0.00 0.00 59.98 58.83 3dmx h ARG 154 Cb 0.40 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 3dmx h ARG 154 CO 0.01 1.02 -1.98 0.25 -1.51 0.00 0.00 179.97 177.76 3dmx n THR 155 N -4.21 0.64 -1.74 0.20 -2.24 -0.27 -4.76 114.28 101.90 3dmx n THR 155 Ca -0.01 -0.57 -0.14 0.00 -2.27 0.00 0.00 64.05 61.06 3dmx n THR 155 Cb 0.44 -0.28 -0.04 0.00 -2.10 0.00 0.00 70.33 68.35 3dmx n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dmx n GLY 156 N 1.78 0.80 3.54 3.38 0.00 -0.02 -5.01 105.19 109.66 3dmx n GLY 156 Ca -0.16 -0.35 -0.25 0.00 0.00 0.00 0.00 46.02 45.26 3dmx n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dmx s THR 157 N -2.58 1.90 -0.55 2.61 -4.23 -1.26 -4.82 115.64 106.70 3dmx s THR 157 Ca 0.00 -2.09 0.10 0.00 -1.18 0.00 0.00 61.69 58.52 3dmx s THR 157 Cb 0.00 -2.76 0.57 0.00 1.34 0.00 0.00 72.50 71.65 3dmx s THR 157 CO 0.00 -0.12 1.37 0.79 -0.54 0.00 0.00 174.62 176.12 3dmx n TRP 158 N -0.80 1.42 -0.09 3.99 7.02 -1.26 -4.51 117.44 123.20 3dmx n TRP 158 Ca -0.05 -0.49 0.11 0.00 -1.02 0.00 0.00 57.50 56.05 3dmx n TRP 158 Cb 0.65 -0.37 0.49 0.00 -2.42 0.00 0.00 31.31 29.66 3dmx n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3dmx h ASP 159 N 2.78 0.39 0.73 -0.99 3.32 -1.96 0.61 116.42 121.31 3dmx h ASP 159 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3dmx h ASP 159 Cb 1.49 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.97 3dmx h ASP 159 CO 0.33 0.24 0.00 0.00 -1.72 0.00 0.00 179.24 178.08 3dmx n ALA 160 N -2.51 1.90 0.00 3.45 0.00 -1.26 -3.55 120.51 118.53 3dmx n ALA 160 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3dmx n ALA 160 Cb 0.36 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.47 3dmx n ALA 160 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3dmx n TYR 161 N -1.64 0.00 -0.16 0.00 4.02 -0.36 -4.80 117.16 114.22 3dmx n TYR 161 Ca 0.04 0.00 0.16 0.00 -0.01 0.00 0.00 57.90 58.10 3dmx n TYR 161 Cb 0.24 0.00 0.52 0.00 -0.02 0.00 0.00 39.34 40.08 3dmx n TYR 161 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 3dmx h LYS 162 N 0.00 0.37 0.00 -0.72 1.63 -0.99 -2.47 116.57 114.38 3dmx h LYS 162 Ca 0.00 -0.02 -0.21 0.00 -0.85 0.00 0.00 60.65 59.57 3dmx h LYS 162 Cb 0.00 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 31.51 3dmx h LYS 162 CO 0.00 0.24 -1.42 -0.97 -3.45 0.00 0.00 179.45 173.85 3dmx h ASN 163 N 0.38 0.00 -0.03 4.20 -1.24 -1.86 -3.52 115.58 113.51 3dmx h ASN 163 Ca 0.37 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.38 3dmx h ASN 163 Cb 0.90 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.95 3dmx h ASN 163 CO -0.11 0.75 0.00 0.00 -1.29 0.00 0.00 177.43 176.78