#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bgq n ALA 2 N 0.00 -1.03 -1.19 -5.12 0.00 -1.26 -4.91 120.51 107.00 1bgq n ALA 2 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1bgq n ALA 2 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 1bgq n ALA 2 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bgq n SER 3 N 0.00 -0.64 -3.62 0.00 7.64 -1.26 -4.61 113.62 111.12 1bgq n SER 3 Ca 0.00 -0.97 -0.04 0.00 1.01 0.00 0.00 58.87 58.87 1bgq n SER 3 Cb 0.00 -0.37 -0.06 0.00 -1.01 0.00 0.00 64.21 62.77 1bgq n SER 3 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1bgq s GLU 4 N -3.99 0.48 0.15 1.43 2.02 -0.97 -4.96 118.70 112.86 1bgq s GLU 4 Ca 0.27 1.26 -0.08 0.00 0.02 0.00 0.00 54.97 56.44 1bgq s GLU 4 Cb -0.02 0.63 -0.06 0.00 0.10 0.00 0.00 34.13 34.78 1bgq s GLU 4 CO 0.20 -0.25 0.45 0.99 0.02 0.00 0.00 175.26 176.67 1bgq s THR 5 N 2.78 5.06 -0.01 3.63 2.01 -1.26 -1.54 115.64 126.30 1bgq s THR 5 Ca -0.03 0.32 -0.04 0.00 0.31 0.00 0.00 61.69 62.26 1bgq s THR 5 Cb -0.12 -3.63 0.00 0.00 0.01 0.00 0.00 72.50 68.76 1bgq s THR 5 CO -0.17 0.08 0.08 -0.36 -0.69 0.00 0.00 174.62 173.57 1bgq s PHE 6 N -1.63 0.01 0.35 4.92 0.40 -0.22 -5.00 117.98 116.81 1bgq s PHE 6 Ca 0.41 -0.01 -0.16 0.00 -0.60 0.00 0.00 56.93 56.57 1bgq s PHE 6 Cb -0.12 -0.03 -0.09 0.00 0.51 0.00 0.00 43.02 43.28 1bgq s PHE 6 CO 0.22 -0.15 0.79 -1.21 0.70 0.00 0.00 175.22 175.56 1bgq s GLU 7 N -0.66 4.03 0.14 0.44 0.41 -1.26 -0.91 118.70 120.90 1bgq s GLU 7 Ca -0.07 0.75 -0.21 0.00 -0.41 0.00 0.00 54.97 55.03 1bgq s GLU 7 Cb -0.04 -2.37 -0.08 0.00 -1.78 0.00 0.00 34.13 29.86 1bgq s GLU 7 CO 0.00 0.10 0.68 -0.06 -0.49 0.00 0.00 175.26 175.49 1bgq s PHE 8 N -2.06 3.80 0.24 1.61 0.08 0.12 -4.46 117.98 117.32 1bgq s PHE 8 Ca 0.56 1.42 -0.31 0.00 0.12 0.00 0.00 56.93 58.71 1bgq s PHE 8 Cb -0.10 -2.61 -0.13 0.00 -0.57 0.00 0.00 43.02 39.61 1bgq s PHE 8 CO 0.18 0.50 1.54 0.94 -0.10 0.00 0.00 175.22 178.27 1bgq n GLN 9 N 1.40 2.38 -0.35 0.44 0.00 0.06 -4.79 117.38 116.52 1bgq n GLN 9 Ca -0.07 0.85 0.12 0.00 -0.00 0.00 0.00 57.00 57.90 1bgq n GLN 9 Cb 0.50 -2.59 0.24 0.00 0.00 0.00 0.00 30.24 28.39 1bgq n GLN 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1bgq h ALA 10 N 4.98 1.00 -0.14 1.69 0.00 -1.94 -1.23 119.26 123.61 1bgq h ALA 10 Ca -0.45 0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1bgq h ALA 10 Cb 1.25 0.65 -0.01 0.00 0.00 0.00 0.00 17.79 19.67 1bgq h ALA 10 CO 0.81 -0.51 -0.23 0.93 0.00 0.00 0.00 179.25 180.25 1bgq h GLU 11 N 0.00 0.25 -0.38 0.00 3.07 -1.92 -2.35 114.58 113.25 1bgq h GLU 11 Ca 0.56 -0.08 -0.11 0.00 -0.50 0.00 0.00 59.36 59.23 1bgq h GLU 11 Cb 1.07 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.94 1bgq h GLU 11 CO -0.96 0.48 -0.23 0.82 -1.40 0.00 0.00 179.01 177.72 1bgq h ILE 12 N 0.23 1.27 -0.80 3.13 2.04 -1.52 -0.77 117.51 121.09 1bgq h ILE 12 Ca 0.04 -1.33 -0.04 0.00 1.00 0.00 0.00 64.86 64.52 1bgq h ILE 12 Cb 0.55 1.22 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 1bgq h ILE 12 CO 0.04 0.44 0.33 0.74 0.00 0.00 0.00 178.15 179.70 1bgq h THR 13 N 0.66 1.26 0.50 -0.27 2.02 -1.21 -0.96 112.91 114.91 1bgq h THR 13 Ca 0.09 -0.81 -0.02 0.00 0.77 0.00 0.00 66.41 66.44 1bgq h THR 13 Cb 0.73 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1bgq h THR 13 CO 0.06 0.33 -0.24 1.56 0.37 0.00 0.00 175.52 177.60 1bgq h GLN 14 N 1.16 -0.65 -0.61 6.66 4.20 -0.99 -2.10 115.11 122.78 1bgq h GLN 14 Ca 0.27 0.04 0.12 0.00 0.06 0.00 0.00 58.65 59.14 1bgq h GLN 14 Cb 0.20 0.15 -0.12 0.00 0.30 0.00 0.00 27.48 28.01 1bgq h GLN 14 CO -0.02 -0.36 -0.14 1.25 -0.67 0.00 0.00 178.83 178.89 1bgq h LEU 15 N -0.85 -0.54 -0.30 1.46 5.85 -1.00 -0.23 115.31 119.69 1bgq h LEU 15 Ca -0.07 0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.87 1bgq h LEU 15 Cb 0.59 0.37 -0.04 0.00 0.37 0.00 0.00 40.66 41.95 1bgq h LEU 15 CO 0.11 -0.20 0.09 0.24 -0.34 0.00 0.00 178.44 178.35 1bgq h MET 16 N 0.01 0.20 -0.80 1.25 2.86 -1.07 0.21 114.93 117.59 1bgq h MET 16 Ca 0.30 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.96 1bgq h MET 16 Cb 0.46 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.02 1bgq h MET 16 CO -0.62 0.14 0.51 1.03 1.06 0.00 0.00 176.91 179.02 1bgq h SER 17 N 0.21 0.83 0.44 1.22 0.87 -0.61 0.25 113.55 116.77 1bgq h SER 17 Ca 0.14 -0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.68 1bgq h SER 17 Cb 0.12 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1bgq h SER 17 CO -0.16 0.57 -0.24 0.25 -0.53 0.00 0.00 176.83 176.72 1bgq h LEU 18 N 0.98 -0.59 0.15 2.23 6.46 -0.13 -1.97 115.31 122.44 1bgq h LEU 18 Ca 0.32 0.03 -0.00 0.00 -0.12 0.00 0.00 57.88 58.11 1bgq h LEU 18 Cb 0.03 0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.12 1bgq h LEU 18 CO -0.12 -0.39 -0.10 0.40 -0.62 0.00 0.00 178.44 177.60 1bgq h ILE 19 N -0.63 0.78 0.00 4.05 1.08 -0.21 0.70 117.51 123.28 1bgq h ILE 19 Ca -0.05 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 1bgq h ILE 19 Cb 0.51 0.78 0.00 0.00 -3.07 0.00 0.00 36.82 35.04 1bgq h ILE 19 CO 0.07 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.53 1bgq n ILE 20 N -5.21 1.18 0.08 -0.67 3.06 0.04 -2.86 119.36 114.98 1bgq n ILE 20 Ca -0.08 0.29 0.03 0.00 -2.50 0.00 0.00 62.75 60.49 1bgq n ILE 20 Cb 0.14 -1.14 -0.04 0.00 0.54 0.00 0.00 39.64 39.14 1bgq n ILE 20 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 1bgq n ASN 21 N -1.43 2.61 -4.69 9.51 3.02 -0.74 -4.99 115.26 118.55 1bgq n ASN 21 Ca 0.03 -0.20 -0.42 0.00 -0.03 0.00 0.00 54.58 53.96 1bgq n ASN 21 Cb 0.10 1.18 -0.03 0.00 -0.61 0.00 0.00 39.78 40.41 1bgq n ASN 21 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1bgq s THR 22 N -2.11 2.97 -1.12 3.41 -1.32 0.18 -4.84 115.64 112.81 1bgq s THR 22 Ca -0.01 0.43 0.09 0.00 -1.21 0.00 0.00 61.69 60.99 1bgq s THR 22 Cb 0.04 -3.28 0.10 0.00 -1.51 0.00 0.00 72.50 67.85 1bgq s THR 22 CO 0.23 -0.00 1.26 1.33 -2.21 0.00 0.00 174.62 175.23 1bgq n VAL 23 N 4.73 1.21 0.00 5.08 0.24 -1.26 -4.92 118.33 123.41 1bgq n VAL 23 Ca 0.16 0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.76 1bgq n VAL 23 Cb 0.40 -1.15 0.00 0.00 -1.47 0.00 0.00 33.84 31.63 1bgq n VAL 23 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bgq n TYR 24 N -1.44 0.00 -3.67 6.34 9.36 -1.26 -4.89 117.16 121.60 1bgq n TYR 24 Ca 0.03 0.00 -0.38 0.00 3.32 0.00 0.00 57.90 60.86 1bgq n TYR 24 Cb 0.10 0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 38.71 1bgq n TYR 24 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 1bgq s SER 25 N 0.00 5.48 0.00 2.98 1.04 -1.26 -4.43 113.70 117.51 1bgq s SER 25 Ca 0.00 -2.17 0.00 0.00 0.48 0.00 0.00 55.95 54.26 1bgq s SER 25 Cb 0.00 -1.92 0.00 0.00 0.10 0.00 0.00 66.02 64.20 1bgq s SER 25 CO 0.00 -0.57 0.00 -3.20 0.98 0.00 0.00 173.24 170.45 1bgq n ASN 26 N 4.48 0.00 0.32 7.02 5.15 -1.26 -5.04 115.26 125.93 1bgq n ASN 26 Ca -0.02 0.00 0.18 0.00 -0.60 0.00 0.00 54.58 54.15 1bgq n ASN 26 Cb 0.41 0.00 0.97 0.00 -0.53 0.00 0.00 39.78 40.63 1bgq n ASN 26 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1bgq h LYS 27 N 0.00 0.00 0.00 1.20 1.57 -1.95 -2.53 116.57 114.86 1bgq h LYS 27 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1bgq h LYS 27 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1bgq h LYS 27 CO 0.00 0.00 0.00 -0.85 -0.57 0.00 0.00 179.45 178.03 1bgq n GLU 28 N -3.06 0.01 0.28 3.15 0.28 -1.26 -2.84 120.64 117.20 1bgq n GLU 28 Ca -0.02 0.39 0.18 0.00 -0.16 0.00 0.00 57.16 57.56 1bgq n GLU 28 Cb 0.27 -1.50 0.83 0.00 1.43 0.00 0.00 31.44 32.47 1bgq n GLU 28 CO 0.00 0.00 0.00 -0.84 -0.16 0.00 0.00 177.13 176.13 1bgq h ILE 29 N 0.00 0.00 -0.62 3.84 3.07 -1.86 -3.03 117.51 118.91 1bgq h ILE 29 Ca 0.00 -0.30 0.06 0.00 1.55 0.00 0.00 64.86 66.18 1bgq h ILE 29 Cb 0.06 1.24 -0.04 0.00 -0.27 0.00 0.00 36.82 37.81 1bgq h ILE 29 CO 0.00 0.00 0.41 2.19 -1.05 0.00 0.00 178.15 179.70 1bgq h PHE 30 N 0.00 0.61 -0.54 0.16 -0.00 -1.79 -1.93 116.94 113.45 1bgq h PHE 30 Ca 0.00 0.02 -0.10 0.00 -0.00 0.00 0.00 57.97 57.88 1bgq h PHE 30 Cb 0.31 -0.20 -0.02 0.00 -0.00 0.00 0.00 35.95 36.04 1bgq h PHE 30 CO 0.00 0.32 -0.07 1.25 -0.00 0.00 0.00 178.31 179.81 1bgq h LEU 31 N 0.61 0.99 -0.64 2.10 5.85 -1.82 -1.20 115.31 121.19 1bgq h LEU 31 Ca 0.27 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1bgq h LEU 31 Cb 0.29 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1bgq h LEU 31 CO -0.08 1.08 0.31 -0.09 -0.34 0.00 0.00 178.44 179.32 1bgq h ARG 32 N 0.89 0.93 -0.38 1.25 2.43 -1.54 -0.33 114.38 117.64 1bgq h ARG 32 Ca 0.15 -0.14 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 1bgq h ARG 32 Cb 0.62 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1bgq h ARG 32 CO 0.04 0.74 -0.02 0.93 -1.51 0.00 0.00 179.97 180.15 1bgq h GLU 33 N 0.89 0.68 -0.51 0.20 4.39 -1.25 -1.86 114.58 117.12 1bgq h GLU 33 Ca 0.22 -0.23 -0.10 0.00 0.34 0.00 0.00 59.36 59.59 1bgq h GLU 33 Cb 0.12 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 1bgq h GLU 33 CO -0.03 0.79 -0.09 -0.07 -1.16 0.00 0.00 179.01 178.46 1bgq h LEU 34 N 0.50 0.96 -1.28 1.33 4.07 -1.06 -1.79 115.31 118.04 1bgq h LEU 34 Ca 0.10 -0.35 -0.07 0.00 0.08 0.00 0.00 57.88 57.64 1bgq h LEU 34 Cb 0.50 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.97 1bgq h LEU 34 CO 0.02 1.09 -0.32 0.40 -1.08 0.00 0.00 178.44 178.55 1bgq h ILE 35 N 0.83 1.25 -0.36 1.22 2.04 -1.03 -1.79 117.51 119.67 1bgq h ILE 35 Ca 0.13 -1.17 -0.12 0.00 1.00 0.00 0.00 64.86 64.71 1bgq h ILE 35 Cb 0.64 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 1bgq h ILE 35 CO 0.04 0.34 -0.24 -1.28 0.00 0.00 0.00 178.15 177.02 1bgq h SER 36 N 0.06 0.82 -0.76 1.72 0.87 -0.98 -1.45 113.55 113.83 1bgq h SER 36 Ca 0.01 -0.43 -0.05 0.00 -1.23 0.00 0.00 61.79 60.08 1bgq h SER 36 Cb 0.60 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 62.30 1bgq h SER 36 CO 0.04 1.08 0.26 0.78 -0.53 0.00 0.00 176.83 178.47 1bgq h ASN 37 N 0.57 1.09 -0.56 6.23 4.21 -1.04 -1.79 115.58 124.29 1bgq h ASN 37 Ca 0.07 -0.19 0.00 0.00 1.21 0.00 0.00 56.30 57.39 1bgq h ASN 37 Cb 0.80 -0.28 -0.03 0.00 -1.12 0.00 0.00 38.32 37.69 1bgq h ASN 37 CO 0.06 0.99 0.37 0.00 -1.29 0.00 0.00 177.43 177.56 1bgq h ALA 38 N 1.14 0.71 -0.36 -0.83 0.00 -1.19 -0.36 119.26 118.37 1bgq h ALA 38 Ca 0.25 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1bgq h ALA 38 Cb 0.27 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1bgq h ALA 38 CO -0.01 0.15 0.11 1.03 0.00 0.00 0.00 179.25 180.52 1bgq h SER 39 N 0.75 0.53 -0.54 0.00 0.87 -0.96 -1.55 113.55 112.65 1bgq h SER 39 Ca 0.20 -0.21 -0.06 0.00 -1.23 0.00 0.00 61.79 60.49 1bgq h SER 39 Cb -0.08 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 61.71 1bgq h SER 39 CO -0.04 0.60 0.13 0.44 -0.53 0.00 0.00 176.83 177.43 1bgq h ASP 40 N 0.43 0.86 0.31 6.23 3.32 -1.13 -0.34 116.42 126.10 1bgq h ASP 40 Ca 0.12 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 56.92 1bgq h ASP 40 Cb 0.27 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1bgq h ASP 40 CO -0.00 0.85 -0.33 0.00 -1.72 0.00 0.00 179.24 178.03 1bgq h ALA 41 N 1.26 1.42 0.03 3.45 0.00 -0.84 -0.63 119.26 123.94 1bgq h ALA 41 Ca 0.19 -0.31 -0.21 0.00 0.00 0.00 0.00 54.91 54.57 1bgq h ALA 41 Cb 0.34 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1bgq h ALA 41 CO 0.00 0.43 -0.99 -0.07 0.00 0.00 0.00 179.25 178.62 1bgq h LEU 42 N 0.03 0.13 -0.42 0.00 3.38 -0.57 0.26 115.31 118.12 1bgq h LEU 42 Ca 0.00 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 1bgq h LEU 42 Cb 0.60 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1bgq h LEU 42 CO 0.04 1.04 -0.05 0.44 0.09 0.00 0.00 178.44 180.01 1bgq h ASP 43 N 0.04 0.76 -0.34 -0.43 3.32 -0.54 -2.07 116.42 117.16 1bgq h ASP 43 Ca -0.04 -0.33 0.07 0.00 0.02 0.00 0.00 57.03 56.74 1bgq h ASP 43 Cb 1.70 -0.21 -0.06 0.00 0.22 0.00 0.00 39.33 40.98 1bgq h ASP 43 CO 0.14 0.91 -0.05 0.11 -1.72 0.00 0.00 179.24 178.63 1bgq h LYS 44 N 0.59 0.03 -0.06 3.56 6.56 -1.13 0.87 116.57 127.00 1bgq h LYS 44 Ca 0.11 -0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 59.55 1bgq h LYS 44 Cb 0.55 -0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.19 1bgq h LYS 44 CO 0.03 0.02 -0.64 0.97 -2.06 0.00 0.00 179.45 177.77 1bgq h ILE 45 N 0.04 1.40 0.06 1.86 6.09 -1.49 -0.98 117.51 124.49 1bgq h ILE 45 Ca 0.16 -2.07 -0.00 0.00 -1.37 0.00 0.00 64.86 61.58 1bgq h ILE 45 Cb 0.24 2.06 0.00 0.00 0.47 0.00 0.00 36.82 39.60 1bgq h ILE 45 CO -0.32 0.61 -0.03 -0.09 -3.07 0.00 0.00 178.15 175.25 1bgq h ARG 46 N 0.17 -0.08 -0.01 2.19 2.43 -0.91 0.49 114.38 118.66 1bgq h ARG 46 Ca -0.01 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1bgq h ARG 46 Cb 1.16 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1bgq h ARG 46 CO 0.10 0.14 -0.00 -0.92 -1.51 0.00 0.00 179.97 177.78 1bgq h TYR 47 N -0.30 -0.00 -0.60 2.20 3.20 -0.78 -2.27 116.97 118.42 1bgq h TYR 47 Ca -0.01 0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.90 1bgq h TYR 47 Cb 0.26 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 1bgq h TYR 47 CO -0.00 -0.00 0.40 -0.22 -1.64 0.00 0.00 178.16 176.69 1bgq h LYS 48 N 0.00 0.67 0.00 1.82 3.64 -1.14 -0.18 116.57 121.39 1bgq h LYS 48 Ca 0.01 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1bgq h LYS 48 Cb 0.01 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1bgq h LYS 48 CO -0.01 0.45 0.00 0.66 -2.27 0.00 0.00 179.45 178.27 1bgq h SER 49 N 0.69 0.00 -0.68 4.20 4.64 -0.31 -2.64 113.55 119.45 1bgq h SER 49 Ca 0.24 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.61 1bgq h SER 49 Cb 0.09 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.13 1bgq h SER 49 CO -0.07 0.00 0.39 -0.07 -0.87 0.00 0.00 176.83 176.21 1bgq h LEU 50 N 0.00 0.59 -0.80 5.97 3.38 -0.73 -1.93 115.31 121.79 1bgq h LEU 50 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1bgq h LEU 50 Cb 0.30 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1bgq h LEU 50 CO 0.00 0.38 -0.38 -1.20 0.09 0.00 0.00 178.44 177.34 1bgq n SER 51 N -4.76 1.55 -3.18 -0.43 7.64 -1.17 -4.68 113.62 108.60 1bgq n SER 51 Ca 0.08 -1.28 -0.23 0.00 1.01 0.00 0.00 58.87 58.46 1bgq n SER 51 Cb 0.16 0.52 -0.06 0.00 -1.01 0.00 0.00 64.21 63.82 1bgq n SER 51 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1bgq n ASP 52 N -0.24 0.21 -0.31 6.43 -0.08 -1.00 -5.00 116.55 116.54 1bgq n ASP 52 Ca 0.06 -2.76 0.23 0.00 -1.51 0.00 0.00 54.79 50.82 1bgq n ASP 52 Cb 0.33 -0.58 0.53 0.00 2.34 0.00 0.00 41.12 43.74 1bgq n ASP 52 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1bgq h PRO 53 N 3.84 0.35 -0.04 -0.67 0.13 -1.63 -1.85 132.00 132.13 1bgq h PRO 53 Ca 0.07 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 65.19 1bgq h PRO 53 Cb 0.90 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 1bgq h PRO 53 CO 0.46 0.23 0.17 0.87 -0.23 0.00 0.00 178.00 179.50 1bgq h LYS 54 N 0.36 0.00 0.00 0.86 1.57 -1.95 -2.18 116.57 115.24 1bgq h LYS 54 Ca 0.58 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.34 1bgq h LYS 54 Cb 1.53 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.83 1bgq h LYS 54 CO -0.26 0.00 -0.10 1.96 -0.57 0.00 0.00 179.45 180.48 1bgq h GLN 55 N 0.00 0.00 0.00 3.15 1.08 -1.70 -1.87 115.11 115.77 1bgq h GLN 55 Ca 0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1bgq h GLN 55 Cb 0.35 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.78 1bgq h GLN 55 CO -0.00 0.10 -0.40 1.28 -0.95 0.00 0.00 178.83 178.86 1bgq n LEU 56 N -3.77 0.49 0.23 1.46 4.77 -0.82 -4.08 117.00 115.28 1bgq n LEU 56 Ca -0.02 0.22 0.11 0.00 -0.03 0.00 0.00 56.01 56.29 1bgq n LEU 56 Cb 0.20 -0.29 0.71 0.00 -2.33 0.00 0.00 43.42 41.71 1bgq n LEU 56 CO 0.30 0.02 1.10 -0.33 -1.33 0.00 0.00 177.39 177.15 1bgq h GLU 57 N 0.00 0.00 0.00 3.23 5.08 -1.48 -1.05 114.58 120.37 1bgq h GLU 57 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1bgq h GLU 57 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1bgq h GLU 57 CO 0.00 0.00 0.00 1.79 -1.00 0.00 0.00 179.01 179.80 1bgq h THR 58 N 0.00 0.00 -0.39 1.13 1.35 -1.75 -3.38 112.91 109.87 1bgq h THR 58 Ca 0.04 -0.34 0.03 0.00 -0.55 0.00 0.00 66.41 65.59 1bgq h THR 58 Cb 0.15 1.23 -0.17 0.00 -1.73 0.00 0.00 68.15 67.64 1bgq h THR 58 CO -0.00 0.00 -0.20 -0.70 -0.25 0.00 0.00 175.52 174.37 1bgq s GLU 59 N -3.60 0.37 0.59 4.72 2.56 -0.54 -4.25 118.70 118.55 1bgq s GLU 59 Ca 0.01 -0.25 0.39 0.00 0.00 0.00 0.00 54.97 55.13 1bgq s GLU 59 Cb 0.09 0.01 2.08 0.00 2.00 0.00 0.00 34.13 38.32 1bgq s GLU 59 CO 0.46 -0.49 2.20 -1.35 -0.56 0.00 0.00 175.26 175.53 1bgq h PRO 60 N 5.13 0.00 -5.24 4.30 0.11 -1.44 -3.42 132.00 131.44 1bgq h PRO 60 Ca -0.00 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.49 1bgq h PRO 60 Cb 1.19 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.16 1bgq h PRO 60 CO -0.06 0.00 -0.21 -0.51 -0.21 0.00 0.00 178.00 177.02 1bgq s ASP 61 N -5.02 6.31 -0.27 -2.05 1.01 -1.26 -5.04 116.67 110.35 1bgq s ASP 61 Ca -0.04 0.37 -0.16 0.00 0.71 0.00 0.00 52.55 53.43 1bgq s ASP 61 Cb 0.11 -2.22 -0.03 0.00 1.01 0.00 0.00 42.92 41.79 1bgq s ASP 61 CO 0.39 -0.16 0.43 -0.76 0.21 0.00 0.00 175.17 175.28 1bgq s LEU 62 N 1.89 4.06 0.28 1.23 1.43 -1.26 -4.72 118.68 121.60 1bgq s LEU 62 Ca 0.16 0.35 -0.21 0.00 -1.03 0.00 0.00 54.13 53.41 1bgq s LEU 62 Cb -0.15 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.58 1bgq s LEU 62 CO 0.09 -0.23 0.72 0.72 0.23 0.00 0.00 176.35 177.88 1bgq s PHE 63 N 2.16 -0.16 -0.07 0.29 -0.12 -1.26 -4.49 117.98 114.33 1bgq s PHE 63 Ca 0.17 -0.31 0.02 0.00 -0.05 0.00 0.00 56.93 56.77 1bgq s PHE 63 Cb -0.16 0.70 0.01 0.00 -0.63 0.00 0.00 43.02 42.95 1bgq s PHE 63 CO 0.10 -1.25 -0.13 0.42 -0.05 0.00 0.00 175.22 174.31 1bgq s ILE 64 N -3.84 1.18 -0.07 -4.49 1.01 -0.66 -2.52 121.20 111.81 1bgq s ILE 64 Ca 0.12 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.27 1bgq s ILE 64 Cb -0.06 -1.07 0.02 0.00 0.01 0.00 0.00 42.46 41.36 1bgq s ILE 64 CO 0.07 0.36 -0.08 -0.60 0.00 0.00 0.00 174.94 174.70 1bgq s ARG 65 N 0.64 1.32 -0.22 2.79 3.52 0.19 -0.31 118.95 126.89 1bgq s ARG 65 Ca -0.15 -0.25 -0.06 0.00 -0.13 0.00 0.00 55.73 55.13 1bgq s ARG 65 Cb -0.16 -1.23 -0.03 0.00 -1.56 0.00 0.00 34.95 31.97 1bgq s ARG 65 CO 0.04 -0.08 0.04 0.42 -0.81 0.00 0.00 175.30 174.91 1bgq s ILE 66 N 1.01 4.19 -0.29 4.11 1.01 0.89 0.05 121.20 132.18 1bgq s ILE 66 Ca -0.09 -0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.35 1bgq s ILE 66 Cb -0.15 -2.93 0.09 0.00 0.01 0.00 0.00 42.46 39.48 1bgq s ILE 66 CO -0.00 0.38 0.04 -0.89 0.00 0.00 0.00 174.94 174.47 1bgq s THR 67 N 1.28 1.34 0.15 2.92 2.01 0.54 -0.80 115.64 123.09 1bgq s THR 67 Ca 0.04 -1.49 -0.28 0.00 0.31 0.00 0.00 61.69 60.27 1bgq s THR 67 Cb -0.15 -1.88 -0.07 0.00 0.01 0.00 0.00 72.50 70.42 1bgq s THR 67 CO 0.02 -0.46 0.89 -2.16 -0.69 0.00 0.00 174.62 172.23 1bgq s PRO 68 N 1.42 4.70 -0.59 4.92 0.04 -1.26 -1.14 135.00 143.09 1bgq s PRO 68 Ca 0.05 1.35 0.04 0.00 0.04 0.00 0.00 61.00 62.48 1bgq s PRO 68 Cb -0.18 -3.32 0.16 0.00 0.04 0.00 0.00 34.50 31.20 1bgq s PRO 68 CO -0.14 0.38 0.41 0.15 0.04 0.00 0.00 177.00 177.84 1bgq s LYS 69 N -0.58 1.93 0.13 4.56 1.02 0.62 -4.94 119.74 122.48 1bgq s LYS 69 Ca 0.42 -2.85 -0.28 0.00 0.02 0.00 0.00 55.97 53.28 1bgq s LYS 69 Cb -0.24 -2.83 -0.08 0.00 -0.52 0.00 0.00 37.83 34.16 1bgq s LYS 69 CO 0.29 -1.28 1.48 -1.35 -0.92 0.00 0.00 175.35 173.57 1bgq h PRO 70 N 5.70 -0.16 -0.99 -1.68 0.11 -1.92 -0.95 132.00 132.13 1bgq h PRO 70 Ca 0.14 0.01 0.35 0.00 0.11 0.00 0.00 66.00 66.60 1bgq h PRO 70 Cb 0.82 0.04 -0.16 0.00 0.11 0.00 0.00 31.00 31.80 1bgq h PRO 70 CO 0.61 -0.10 0.47 1.49 -0.21 0.00 0.00 178.00 180.25 1bgq h GLU 71 N -0.16 0.15 -0.60 1.05 4.81 -1.95 0.66 114.58 118.53 1bgq h GLU 71 Ca 0.10 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1bgq h GLU 71 Cb 0.43 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1bgq h GLU 71 CO -0.68 0.10 0.00 1.04 -0.73 0.00 0.00 179.01 178.74 1bgq n GLN 72 N -5.20 2.65 -4.05 1.92 3.00 -0.71 -4.96 117.38 110.04 1bgq n GLN 72 Ca 0.32 -2.51 -0.31 0.00 -0.01 0.00 0.00 57.00 54.49 1bgq n GLN 72 Cb 1.05 -1.54 -0.03 0.00 0.00 0.00 0.00 30.24 29.72 1bgq n GLN 72 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1bgq n LYS 73 N 1.56 -1.84 -4.33 -1.09 5.02 0.23 -4.86 118.16 112.85 1bgq n LYS 73 Ca 0.22 0.27 -0.24 0.00 -2.02 0.00 0.00 58.31 56.54 1bgq n LYS 73 Cb 0.61 -3.88 -0.13 0.00 -0.02 0.00 0.00 35.03 31.62 1bgq n LYS 73 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1bgq s VAL 74 N -3.96 1.65 -0.08 -0.18 1.01 -0.93 -1.95 120.40 115.97 1bgq s VAL 74 Ca 0.14 -1.47 0.01 0.00 0.00 0.00 0.00 61.98 60.66 1bgq s VAL 74 Cb -0.07 -1.50 0.02 0.00 0.00 0.00 0.00 36.38 34.84 1bgq s VAL 74 CO 0.93 -0.03 -0.08 -0.22 0.00 0.00 0.00 175.10 175.70 1bgq s LEU 75 N -1.78 1.31 -0.08 3.92 2.96 0.38 -0.28 118.68 125.11 1bgq s LEU 75 Ca 0.06 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 53.74 1bgq s LEU 75 Cb -0.10 -0.70 -0.03 0.00 0.50 0.00 0.00 46.19 45.87 1bgq s LEU 75 CO 0.04 -0.06 -0.10 -1.61 -1.32 0.00 0.00 176.35 173.30 1bgq s GLU 76 N 1.19 2.87 -0.22 1.98 2.02 -0.29 -0.50 118.70 125.76 1bgq s GLU 76 Ca -0.05 -0.61 0.02 0.00 0.02 0.00 0.00 54.97 54.34 1bgq s GLU 76 Cb -0.14 -2.57 0.05 0.00 0.10 0.00 0.00 34.13 31.57 1bgq s GLU 76 CO -0.02 0.54 -0.12 0.42 0.02 0.00 0.00 175.26 176.10 1bgq s ILE 77 N -0.49 1.87 0.18 -1.63 1.09 -0.73 -0.34 121.20 121.16 1bgq s ILE 77 Ca 0.07 -1.22 0.10 0.00 -1.10 0.00 0.00 60.65 58.50 1bgq s ILE 77 Cb -0.12 -1.93 -0.04 0.00 -1.06 0.00 0.00 42.46 39.31 1bgq s ILE 77 CO 0.02 0.15 -0.16 -0.60 -0.10 0.00 0.00 174.94 174.25 1bgq s ARG 78 N 1.28 1.83 0.01 2.79 3.52 0.11 -0.97 118.95 127.52 1bgq s ARG 78 Ca -0.03 -1.35 -0.08 0.00 -0.13 0.00 0.00 55.73 54.14 1bgq s ARG 78 Cb -0.17 -2.04 0.00 0.00 -1.56 0.00 0.00 34.95 31.18 1bgq s ARG 78 CO -0.08 0.43 0.15 0.16 -0.81 0.00 0.00 175.30 175.15 1bgq s ASP 79 N -2.69 0.02 -0.66 -2.12 1.47 -0.95 0.55 116.67 112.30 1bgq s ASP 79 Ca 0.23 -0.23 -0.01 0.00 1.18 0.00 0.00 52.55 53.71 1bgq s ASP 79 Cb -0.09 0.22 0.44 0.00 -0.34 0.00 0.00 42.92 43.15 1bgq s ASP 79 CO 0.13 -0.41 1.95 -1.54 0.68 0.00 0.00 175.17 175.98 1bgq n SER 80 N 1.29 7.41 -3.21 2.11 3.41 -1.05 -2.23 113.62 121.35 1bgq n SER 80 Ca -0.22 -3.79 0.00 0.00 -0.26 0.00 0.00 58.87 54.60 1bgq n SER 80 Cb 0.56 -0.93 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 1bgq n SER 80 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bgq n GLY 81 N -0.85 -1.64 0.28 5.00 0.00 -1.26 -4.65 105.19 102.07 1bgq n GLY 81 Ca 0.60 -1.49 0.14 0.00 0.00 0.00 0.00 46.02 45.27 1bgq n GLY 81 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1bgq h ILE 82 N -0.41 0.49 -1.68 -0.61 2.10 -1.27 -3.22 117.51 112.91 1bgq h ILE 82 Ca 0.00 -0.30 0.19 0.00 1.08 0.00 0.00 64.86 65.83 1bgq h ILE 82 Cb 0.00 1.20 -0.07 0.00 -1.09 0.00 0.00 36.82 36.86 1bgq h ILE 82 CO 0.00 0.06 -0.41 0.61 -1.08 0.00 0.00 178.15 177.34 1bgq n GLY 83 N -0.93 -2.11 3.13 8.18 0.00 -1.26 -4.42 105.19 107.78 1bgq n GLY 83 Ca -0.02 -1.31 -0.18 0.00 0.00 0.00 0.00 46.02 44.50 1bgq n GLY 83 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bgq s MET 84 N -2.37 0.82 0.75 1.61 1.00 -1.26 -4.73 119.30 115.12 1bgq s MET 84 Ca 0.00 -0.76 -0.06 0.00 0.00 0.00 0.00 55.69 54.87 1bgq s MET 84 Cb 0.00 -0.80 0.11 0.00 0.00 0.00 0.00 34.83 34.14 1bgq s MET 84 CO 0.00 0.19 1.05 0.95 0.00 0.00 0.00 175.02 177.21 1bgq s THR 85 N -0.95 2.21 0.20 2.05 -4.23 -1.26 -3.80 115.64 109.85 1bgq s THR 85 Ca -0.01 -0.35 -0.11 0.00 -1.18 0.00 0.00 61.69 60.04 1bgq s THR 85 Cb -0.08 -2.85 0.11 0.00 1.34 0.00 0.00 72.50 71.02 1bgq s THR 85 CO 0.01 0.00 1.80 0.50 -0.54 0.00 0.00 174.62 176.39 1bgq h LYS 86 N -0.74 0.59 -0.71 3.99 3.64 -1.96 -1.16 116.57 120.21 1bgq h LYS 86 Ca -0.42 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 58.91 1bgq h LYS 86 Cb 1.28 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 1bgq h LYS 86 CO 0.48 0.39 0.38 0.00 -2.27 0.00 0.00 179.45 178.43 1bgq h ALA 87 N 1.31 0.92 -0.27 5.00 0.00 -2.00 -2.70 119.26 121.52 1bgq h ALA 87 Ca 0.26 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1bgq h ALA 87 Cb 0.16 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1bgq h ALA 87 CO -0.17 0.45 -0.27 0.93 0.00 0.00 0.00 179.25 180.19 1bgq h GLU 88 N 0.99 0.53 -0.39 0.00 5.08 -1.79 -0.88 114.58 118.12 1bgq h GLU 88 Ca 0.25 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1bgq h GLU 88 Cb 0.07 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1bgq h GLU 88 CO -0.04 0.75 0.10 -0.07 -1.00 0.00 0.00 179.01 178.75 1bgq h LEU 89 N 0.46 0.59 -0.54 1.33 3.38 -1.03 0.42 115.31 119.93 1bgq h LEU 89 Ca 0.06 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1bgq h LEU 89 Cb 0.71 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1bgq h LEU 89 CO 0.05 0.67 0.17 0.40 0.09 0.00 0.00 178.44 179.83 1bgq h ILE 90 N 0.49 1.23 0.40 1.22 2.04 -1.36 -1.16 117.51 120.37 1bgq h ILE 90 Ca 0.12 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 1bgq h ILE 90 Cb 0.31 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1bgq h ILE 90 CO 0.00 0.29 -0.19 -1.13 0.00 0.00 0.00 178.15 177.12 1bgq h ASN 91 N 0.74 -0.46 -0.81 1.72 -0.73 -0.96 -1.55 115.58 113.53 1bgq h ASN 91 Ca 0.17 0.02 -0.04 0.00 1.87 0.00 0.00 56.30 58.32 1bgq h ASN 91 Cb 0.27 0.12 -0.04 0.00 0.27 0.00 0.00 38.32 38.94 1bgq h ASN 91 CO -0.01 -0.09 0.37 0.78 -0.37 0.00 0.00 177.43 178.11 1bgq h ASN 92 N -1.02 1.09 0.39 1.15 -0.26 -0.25 -2.94 115.58 113.74 1bgq h ASN 92 Ca -0.06 -0.15 0.00 0.00 -0.56 0.00 0.00 56.30 55.54 1bgq h ASN 92 Cb 0.41 -0.28 0.00 0.00 -1.06 0.00 0.00 38.32 37.39 1bgq h ASN 92 CO 0.09 0.94 -0.62 0.18 -1.06 0.00 0.00 177.43 176.96 1bgq n LEU 93 N -4.29 0.62 0.00 1.61 4.77 -0.44 -4.92 117.00 114.35 1bgq n LEU 93 Ca 0.08 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1bgq n LEU 93 Cb 0.16 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1bgq n LEU 93 CO 0.40 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1bgq n GLY 94 N 1.50 0.22 0.11 -0.72 0.00 -1.18 -5.00 105.19 100.12 1bgq n GLY 94 Ca 0.05 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.05 1bgq n GLY 94 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1bgq h THR 95 N 0.00 0.00 -3.34 2.61 1.35 -1.39 0.22 112.91 112.36 1bgq h THR 95 Ca 0.00 -0.60 -0.62 0.00 -0.55 0.00 0.00 66.41 64.64 1bgq h THR 95 Cb 0.00 1.45 -0.16 0.00 -1.73 0.00 0.00 68.15 67.71 1bgq h THR 95 CO 0.00 0.00 -0.56 -0.63 -0.25 0.00 0.00 175.52 174.08 1bgq s ILE 96 N -3.15 4.83 0.00 6.82 -1.09 -1.11 -4.64 121.20 122.86 1bgq s ILE 96 Ca 0.08 -0.01 -0.01 0.00 -2.23 0.00 0.00 60.65 58.48 1bgq s ILE 96 Cb 0.11 -3.19 -0.00 0.00 -1.58 0.00 0.00 42.46 37.80 1bgq s ILE 96 CO 0.66 0.44 0.26 0.00 -1.23 0.00 0.00 174.94 175.07 1bgq n ALA 97 N 3.68 -0.02 -0.80 9.38 0.00 -1.26 -4.94 120.51 126.56 1bgq n ALA 97 Ca -0.16 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1bgq n ALA 97 Cb 0.52 0.10 0.00 0.00 0.00 0.00 0.00 19.45 20.08 1bgq n ALA 97 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1bgq n LYS 98 N -2.49 0.00 -0.28 0.00 4.01 -1.26 -4.74 118.16 113.39 1bgq n LYS 98 Ca 0.00 0.29 -0.07 0.00 -0.51 0.00 0.00 58.31 58.02 1bgq n LYS 98 Cb 0.01 -0.50 -0.07 0.00 -0.51 0.00 0.00 35.03 33.96 1bgq n LYS 98 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1bgq n SER 99 N 0.00 -0.72 -0.02 4.39 3.41 -1.26 -1.45 113.62 117.98 1bgq n SER 99 Ca 0.00 1.26 0.15 0.00 -0.26 0.00 0.00 58.87 60.02 1bgq n SER 99 Cb 0.00 -0.18 0.88 0.00 -0.26 0.00 0.00 64.21 64.65 1bgq n SER 99 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bgq n GLY 100 N -1.17 -0.96 0.17 5.00 0.00 -1.25 -4.24 105.19 102.75 1bgq n GLY 100 Ca 0.01 -0.20 -0.07 0.00 0.00 0.00 0.00 46.02 45.76 1bgq n GLY 100 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1bgq h THR 101 N 0.10 0.63 0.12 2.61 2.02 -1.50 0.20 112.91 117.09 1bgq h THR 101 Ca 0.00 0.00 -0.29 0.00 0.77 0.00 0.00 66.41 66.89 1bgq h THR 101 Cb 0.02 0.63 0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1bgq h THR 101 CO 0.00 0.00 -1.22 0.50 0.37 0.00 0.00 175.52 175.17 1bgq h LYS 102 N -0.08 0.51 -0.89 6.66 1.63 -1.78 -3.08 116.57 119.54 1bgq h LYS 102 Ca 0.13 -0.71 -0.01 0.00 -0.85 0.00 0.00 60.65 59.21 1bgq h LYS 102 Cb 0.28 0.24 -0.04 0.00 -0.60 0.00 0.00 32.23 32.11 1bgq h LYS 102 CO -0.30 1.31 0.50 0.00 -3.45 0.00 0.00 179.45 177.50 1bgq h ALA 103 N 0.41 1.14 -0.44 5.00 0.00 -1.71 -0.53 119.26 123.13 1bgq h ALA 103 Ca -0.17 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 1bgq h ALA 103 Cb 1.90 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1bgq h ALA 103 CO 0.22 0.63 -0.13 0.35 0.00 0.00 0.00 179.25 180.32 1bgq h PHE 104 N 1.24 0.98 -0.63 0.00 3.57 -0.68 0.13 116.94 121.54 1bgq h PHE 104 Ca 0.31 -0.22 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 1bgq h PHE 104 Cb 0.01 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 1bgq h PHE 104 CO 0.01 0.98 0.19 0.52 -2.23 0.00 0.00 178.31 177.78 1bgq h MET 105 N 0.69 0.96 -0.40 1.11 2.86 -1.39 0.51 114.93 119.27 1bgq h MET 105 Ca 0.11 -0.19 -0.10 0.00 -2.06 0.00 0.00 59.70 57.46 1bgq h MET 105 Cb 0.68 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1bgq h MET 105 CO 0.05 0.83 -0.13 0.93 1.06 0.00 0.00 176.91 179.64 1bgq h GLU 106 N 0.93 0.80 -0.51 1.72 5.08 -0.89 -0.93 114.58 120.77 1bgq h GLU 106 Ca 0.21 -0.32 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1bgq h GLU 106 Cb 0.27 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1bgq h GLU 106 CO -0.01 0.94 0.18 0.00 -1.00 0.00 0.00 179.01 179.13 1bgq h ALA 107 N 0.83 0.67 0.03 3.43 0.00 -0.29 -1.50 119.26 122.44 1bgq h ALA 107 Ca 0.10 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1bgq h ALA 107 Cb 0.67 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1bgq h ALA 107 CO 0.05 0.31 -0.12 -0.07 0.00 0.00 0.00 179.25 179.42 1bgq h LEU 108 N 0.70 -0.33 -1.77 0.00 3.38 0.16 -1.16 115.31 116.28 1bgq h LEU 108 Ca 0.17 0.05 0.14 0.00 0.09 0.00 0.00 57.88 58.32 1bgq h LEU 108 Cb 0.24 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1bgq h LEU 108 CO -0.01 -0.17 0.43 -1.28 0.09 0.00 0.00 178.44 177.50 1bgq h SER 109 N -0.21 0.22 0.97 -0.43 0.87 -0.84 0.21 113.55 114.34 1bgq h SER 109 Ca 0.03 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1bgq h SER 109 Cb 0.25 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 1bgq h SER 109 CO -0.09 0.12 0.00 0.00 -0.53 0.00 0.00 176.83 176.33 1bgq n ALA 110 N -2.57 2.02 0.00 6.23 0.00 -0.56 -4.87 120.51 120.76 1bgq n ALA 110 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1bgq n ALA 110 Cb 0.53 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1bgq n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bgq n GLY 111 N 0.78 0.95 3.58 0.00 0.00 0.73 -5.09 105.19 106.13 1bgq n GLY 111 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 1bgq n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bgq n ALA 112 N 0.00 -0.79 -2.61 4.61 0.00 -0.55 -4.96 120.51 116.22 1bgq n ALA 112 Ca 0.00 -0.30 -0.40 0.00 0.00 0.00 0.00 53.44 52.74 1bgq n ALA 112 Cb 0.00 -2.06 -0.05 0.00 0.00 0.00 0.00 19.45 17.35 1bgq n ALA 112 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1bgq s ASP 113 N -1.81 7.04 0.51 0.00 -1.08 -1.26 -4.67 116.67 115.40 1bgq s ASP 113 Ca 0.69 1.25 0.35 0.00 -0.52 0.00 0.00 52.55 54.33 1bgq s ASP 113 Cb -0.31 -2.42 1.50 0.00 -1.46 0.00 0.00 42.92 40.23 1bgq s ASP 113 CO 0.55 -0.06 1.73 0.58 0.52 0.00 0.00 175.17 178.49 1bgq h VAL 114 N 4.53 0.30 0.00 1.11 2.07 -1.97 0.27 116.25 122.56 1bgq h VAL 114 Ca -0.42 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1bgq h VAL 114 Cb 1.20 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1bgq h VAL 114 CO 0.74 0.01 0.00 -1.54 0.02 0.00 0.00 177.57 176.80 1bgq n SER 115 N -4.28 0.11 0.08 0.57 3.41 -1.26 -1.17 113.62 111.07 1bgq n SER 115 Ca 0.31 0.54 0.13 0.00 -0.26 0.00 0.00 58.87 59.60 1bgq n SER 115 Cb 1.37 -0.56 0.46 0.00 -0.26 0.00 0.00 64.21 65.22 1bgq n SER 115 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1bgq n MET 116 N -1.64 0.18 -0.33 4.33 2.81 0.94 -4.03 117.12 119.37 1bgq n MET 116 Ca 0.01 0.17 0.19 0.00 -1.81 0.00 0.00 57.70 56.26 1bgq n MET 116 Cb 0.05 -1.72 0.37 0.00 -0.71 0.00 0.00 33.22 31.21 1bgq n MET 116 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 1bgq h ILE 117 N 0.00 0.03 0.00 2.02 2.10 -1.33 0.54 117.51 120.88 1bgq h ILE 117 Ca 0.00 -0.01 -0.02 0.00 1.08 0.00 0.00 64.86 65.91 1bgq h ILE 117 Cb 0.65 0.01 -0.00 0.00 -1.09 0.00 0.00 36.82 36.38 1bgq h ILE 117 CO 0.00 0.00 -0.10 1.23 -1.08 0.00 0.00 178.15 178.20 1bgq h GLY 118 N 0.02 0.00 2.00 8.18 0.00 -1.83 -1.15 103.07 110.28 1bgq h GLY 118 Ca 0.67 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.00 1bgq h GLY 118 CO -0.87 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 174.61 1bgq n GLN 119 N -3.80 0.18 -0.04 4.80 6.02 0.19 -2.32 117.38 122.41 1bgq n GLN 119 Ca -0.02 0.22 0.12 0.00 -0.01 0.00 0.00 57.00 57.31 1bgq n GLN 119 Cb 0.20 -1.74 0.24 0.00 1.02 0.00 0.00 30.24 29.96 1bgq n GLN 119 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1bgq n PHE 120 N -2.07 0.11 -1.06 1.08 3.01 -0.45 -4.96 117.46 113.14 1bgq n PHE 120 Ca 0.05 -0.06 -0.02 0.00 1.01 0.00 0.00 57.45 58.43 1bgq n PHE 120 Cb 0.36 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.82 1bgq n PHE 120 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1bgq n GLY 121 N 1.33 0.56 1.42 1.37 0.00 -0.98 -3.79 105.19 105.09 1bgq n GLY 121 Ca 0.16 -0.74 -0.01 0.00 0.00 0.00 0.00 46.02 45.43 1bgq n GLY 121 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1bgq n VAL 122 N -2.91 1.56 0.21 1.61 0.24 -1.18 -4.84 118.33 113.02 1bgq n VAL 122 Ca -0.02 -2.80 0.10 0.00 -2.04 0.00 0.00 64.34 59.59 1bgq n VAL 122 Cb 0.08 0.12 0.65 0.00 -1.47 0.00 0.00 33.84 33.22 1bgq n VAL 122 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1bgq h GLY 123 N 1.44 0.01 -0.09 7.63 0.00 -1.84 -2.59 103.07 107.63 1bgq h GLY 123 Ca -0.01 -0.00 0.21 0.00 0.00 0.00 0.00 47.33 47.53 1bgq h GLY 123 CO 0.20 0.00 0.45 -2.75 0.00 0.00 0.00 176.54 174.44 1bgq h PHE 124 N 0.01 0.75 0.00 5.60 3.57 -1.88 0.25 116.94 125.24 1bgq h PHE 124 Ca 0.05 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1bgq h PHE 124 Cb 0.20 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1bgq h PHE 124 CO -0.00 0.03 0.00 0.66 -2.23 0.00 0.00 178.31 176.77 1bgq n TYR 125 N -4.97 0.16 0.38 0.41 4.01 -0.98 -2.21 117.16 113.95 1bgq n TYR 125 Ca 0.22 0.07 0.12 0.00 -0.16 0.00 0.00 57.90 58.14 1bgq n TYR 125 Cb 0.62 -0.61 0.49 0.00 -0.31 0.00 0.00 39.34 39.54 1bgq n TYR 125 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1bgq n SER 126 N -1.65 0.64 0.30 7.72 3.41 0.86 -2.32 113.62 122.58 1bgq n SER 126 Ca 0.02 0.67 0.17 0.00 -0.26 0.00 0.00 58.87 59.47 1bgq n SER 126 Cb 0.13 -0.80 0.94 0.00 -0.26 0.00 0.00 64.21 64.22 1bgq n SER 126 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 1bgq h LEU 127 N 0.00 0.00 0.00 1.04 8.10 -1.60 -1.28 115.31 121.57 1bgq h LEU 127 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 1bgq h LEU 127 Cb 0.33 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.55 1bgq h LEU 127 CO 0.00 0.03 0.00 0.49 -4.11 0.00 0.00 178.44 174.85 1bgq n PHE 128 N -3.55 0.00 0.08 0.17 3.72 -0.98 -1.81 117.46 115.09 1bgq n PHE 128 Ca -0.03 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.29 1bgq n PHE 128 Cb 0.13 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.69 1bgq n PHE 128 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1bgq h LEU 129 N 0.00 0.30 -0.25 4.37 3.38 -1.46 -3.34 115.31 118.32 1bgq h LEU 129 Ca 0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1bgq h LEU 129 Cb 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1bgq h LEU 129 CO 0.00 0.98 -0.02 1.33 0.09 0.00 0.00 178.44 180.83 1bgq n VAL 130 N -3.74 0.00 -4.36 1.22 0.24 -0.98 -5.00 118.33 105.72 1bgq n VAL 130 Ca -0.04 -0.49 -0.19 0.00 -2.04 0.00 0.00 64.34 61.58 1bgq n VAL 130 Cb 0.75 1.00 -0.14 0.00 -1.47 0.00 0.00 33.84 33.99 1bgq n VAL 130 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bgq s ALA 131 N -0.80 0.98 -2.40 2.33 0.00 -0.75 -1.03 121.76 120.08 1bgq s ALA 131 Ca 0.00 -0.66 0.20 0.00 0.00 0.00 0.00 51.96 51.50 1bgq s ALA 131 Cb 0.00 -0.17 0.14 0.00 0.00 0.00 0.00 23.12 23.09 1bgq s ALA 131 CO 0.02 0.19 1.11 -0.40 0.00 0.00 0.00 175.76 176.68 1bgq n ASP 132 N 2.25 2.57 -3.73 0.00 5.68 -1.13 -4.23 116.55 117.95 1bgq n ASP 132 Ca -0.17 -1.78 -0.13 0.00 -0.50 0.00 0.00 54.79 52.21 1bgq n ASP 132 Cb 0.55 0.05 -0.09 0.00 -1.14 0.00 0.00 41.12 40.49 1bgq n ASP 132 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1bgq s ARG 133 N -1.70 0.57 -0.02 0.11 3.52 -1.25 -4.50 118.95 115.68 1bgq s ARG 133 Ca 0.22 0.29 -0.08 0.00 -0.13 0.00 0.00 55.73 56.03 1bgq s ARG 133 Cb 0.16 0.27 0.01 0.00 -1.56 0.00 0.00 34.95 33.83 1bgq s ARG 133 CO 0.27 -0.11 0.17 0.54 -0.81 0.00 0.00 175.30 175.36 1bgq s VAL 134 N -0.38 0.06 -0.09 7.11 0.11 -0.12 -1.54 120.40 125.55 1bgq s VAL 134 Ca -0.05 -0.49 0.02 0.00 -2.93 0.00 0.00 61.98 58.52 1bgq s VAL 134 Cb -0.03 -0.42 0.02 0.00 -1.53 0.00 0.00 36.38 34.41 1bgq s VAL 134 CO 0.02 -0.27 -0.13 -1.10 -3.33 0.00 0.00 175.10 170.29 1bgq s GLN 135 N -1.01 1.95 -0.39 1.54 -0.21 -0.47 -1.90 119.66 119.16 1bgq s GLN 135 Ca -0.11 -0.47 -0.07 0.00 0.02 0.00 0.00 55.36 54.74 1bgq s GLN 135 Cb -0.06 -1.68 0.07 0.00 1.00 0.00 0.00 33.01 32.34 1bgq s GLN 135 CO 0.02 -0.06 0.19 0.08 -2.12 0.00 0.00 175.29 173.40 1bgq s VAL 136 N 0.98 3.84 -0.27 1.09 1.01 0.13 -0.23 120.40 126.95 1bgq s VAL 136 Ca -0.08 -1.47 -0.12 0.00 0.00 0.00 0.00 61.98 60.31 1bgq s VAL 136 Cb -0.15 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.83 1bgq s VAL 136 CO -0.01 -0.44 0.25 -0.63 0.00 0.00 0.00 175.10 174.28 1bgq s ILE 137 N 1.35 5.27 0.08 2.22 1.01 0.15 -1.05 121.20 130.24 1bgq s ILE 137 Ca 0.02 0.31 0.04 0.00 0.00 0.00 0.00 60.65 61.02 1bgq s ILE 137 Cb -0.22 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 1bgq s ILE 137 CO 0.01 0.23 -0.11 -0.55 0.00 0.00 0.00 174.94 174.52 1bgq s SER 138 N 1.62 1.46 -0.22 3.58 0.15 -0.71 0.85 113.70 120.43 1bgq s SER 138 Ca 0.10 -0.71 -0.04 0.00 0.70 0.00 0.00 55.95 56.00 1bgq s SER 138 Cb -0.16 -0.01 0.10 0.00 -1.71 0.00 0.00 66.02 64.24 1bgq s SER 138 CO 0.10 -0.19 0.23 -0.75 1.20 0.00 0.00 173.24 173.83 1bgq s LYS 139 N -2.28 0.21 0.08 5.44 2.47 0.22 -1.97 119.74 123.91 1bgq s LYS 139 Ca 0.01 0.14 0.02 0.00 -1.56 0.00 0.00 55.97 54.58 1bgq s LYS 139 Cb -0.06 -1.14 -0.04 0.00 -1.46 0.00 0.00 37.83 35.13 1bgq s LYS 139 CO 0.01 -0.71 0.17 0.45 0.16 0.00 0.00 175.35 175.43 1bgq s SER 140 N 2.32 6.03 0.58 1.43 0.15 -1.25 -0.63 113.70 122.34 1bgq s SER 140 Ca 0.07 0.14 0.28 0.00 0.70 0.00 0.00 55.95 57.14 1bgq s SER 140 Cb -0.16 -1.76 1.63 0.00 -1.71 0.00 0.00 66.02 64.02 1bgq s SER 140 CO -0.15 0.15 2.09 0.78 1.20 0.00 0.00 173.24 177.30 1bgq h ASN 141 N 3.00 0.00 -0.14 5.45 2.35 -1.91 -1.97 115.58 122.36 1bgq h ASN 141 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 1bgq h ASN 141 Cb 1.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.54 1bgq h ASN 141 CO 0.71 0.00 0.00 0.47 -1.65 0.00 0.00 177.43 176.96 1bgq n ASP 142 N -3.85 1.10 -1.49 5.81 8.00 -1.26 -4.95 116.55 119.92 1bgq n ASP 142 Ca 0.02 -1.71 -0.03 0.00 0.71 0.00 0.00 54.79 53.79 1bgq n ASP 142 Cb 0.35 -0.09 0.01 0.00 -0.02 0.00 0.00 41.12 41.36 1bgq n ASP 142 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1bgq n ASP 143 N -0.02 -0.59 -4.44 -2.24 -0.08 -0.74 -5.02 116.55 103.42 1bgq n ASP 143 Ca 0.13 -1.44 -0.26 0.00 -1.51 0.00 0.00 54.79 51.72 1bgq n ASP 143 Cb 0.22 0.99 0.14 0.00 2.34 0.00 0.00 41.12 44.82 1bgq n ASP 143 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1bgq s GLU 144 N -2.05 1.19 -0.01 -0.67 0.41 -1.26 -4.49 118.70 111.83 1bgq s GLU 144 Ca 0.05 -0.99 -0.24 0.00 -0.41 0.00 0.00 54.97 53.37 1bgq s GLU 144 Cb -0.01 -2.17 -0.05 0.00 -1.78 0.00 0.00 34.13 30.12 1bgq s GLU 144 CO 0.03 -1.87 0.74 -1.14 -0.49 0.00 0.00 175.26 172.54 1bgq s GLN 145 N -5.42 4.46 0.08 1.61 0.74 -1.26 -4.52 119.66 115.34 1bgq s GLN 145 Ca 0.70 0.98 0.04 0.00 0.05 0.00 0.00 55.36 57.13 1bgq s GLN 145 Cb -0.04 -3.40 -0.03 0.00 1.10 0.00 0.00 33.01 30.64 1bgq s GLN 145 CO 0.48 0.19 -0.11 0.71 -0.55 0.00 0.00 175.29 176.01 1bgq s TYR 146 N 0.33 1.02 -0.19 1.67 1.51 -0.83 0.05 117.35 120.91 1bgq s TYR 146 Ca 0.38 -0.58 -0.02 0.00 -1.01 0.00 0.00 57.07 55.85 1bgq s TYR 146 Cb -0.19 -0.57 -0.01 0.00 -0.11 0.00 0.00 41.96 41.08 1bgq s TYR 146 CO 0.21 -0.00 -0.10 0.42 -1.11 0.00 0.00 175.55 174.97 1bgq s ILE 147 N -1.94 3.06 -0.20 2.71 1.01 0.40 -1.74 121.20 124.50 1bgq s ILE 147 Ca 0.00 -0.62 -0.06 0.00 0.00 0.00 0.00 60.65 59.97 1bgq s ILE 147 Cb -0.06 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.03 1bgq s ILE 147 CO 0.01 0.47 0.04 0.86 0.00 0.00 0.00 174.94 176.32 1bgq s TRP 148 N 1.10 3.14 0.03 3.97 -0.00 -0.21 -1.10 118.94 125.87 1bgq s TRP 148 Ca 0.01 -0.17 0.05 0.00 -0.00 0.00 0.00 56.10 55.98 1bgq s TRP 148 Cb -0.15 -2.10 -0.02 0.00 -0.00 0.00 0.00 33.47 31.21 1bgq s TRP 148 CO -0.02 -0.05 -0.14 -2.00 -0.00 0.00 0.00 176.95 174.74 1bgq s GLU 149 N 0.74 0.94 0.06 5.86 2.12 0.19 0.21 118.70 128.82 1bgq s GLU 149 Ca 0.02 -0.72 -0.21 0.00 0.36 0.00 0.00 54.97 54.42 1bgq s GLU 149 Cb -0.14 -0.94 0.05 0.00 0.26 0.00 0.00 34.13 33.36 1bgq s GLU 149 CO 0.02 0.24 0.49 0.45 -0.54 0.00 0.00 175.26 175.92 1bgq s SER 150 N -1.04 -0.39 -0.06 -1.70 0.15 -0.80 -1.49 113.70 108.37 1bgq s SER 150 Ca 0.02 0.09 0.22 0.00 0.70 0.00 0.00 55.95 56.97 1bgq s SER 150 Cb -0.08 0.48 0.42 0.00 -1.71 0.00 0.00 66.02 65.14 1bgq s SER 150 CO 0.01 -0.73 1.18 -0.46 1.20 0.00 0.00 173.24 174.44 1bgq n ASN 151 N 0.34 1.19 0.00 5.45 6.94 -1.26 -0.94 115.26 126.98 1bgq n ASN 151 Ca -0.18 -2.51 0.00 0.00 -0.02 0.00 0.00 54.58 51.87 1bgq n ASN 151 Cb 0.61 -0.36 0.00 0.00 -2.36 0.00 0.00 39.78 37.67 1bgq n ASN 151 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1bgq n ALA 152 N 0.06 0.00 -1.04 -2.53 0.00 -1.26 -4.82 120.51 110.92 1bgq n ALA 152 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.24 1bgq n ALA 152 Cb 1.02 -0.30 0.24 0.00 0.00 0.00 0.00 19.45 20.41 1bgq n ALA 152 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1bgq s GLY 153 N -2.00 1.57 0.00 0.00 0.00 -1.26 -4.69 107.32 100.94 1bgq s GLY 153 Ca 0.00 -0.86 0.23 0.00 0.00 0.00 0.00 44.72 44.09 1bgq s GLY 153 CO 0.00 -0.00 1.77 0.61 0.00 0.00 0.00 173.10 175.48 1bgq n GLY 154 N -0.79 -0.82 3.10 0.20 0.00 -1.26 -4.80 105.19 100.83 1bgq n GLY 154 Ca 0.12 -0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.92 1bgq n GLY 154 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bgq s SER 155 N -2.16 0.32 0.28 1.61 1.04 -1.26 0.13 113.70 113.67 1bgq s SER 155 Ca 0.32 -0.77 0.02 0.00 0.48 0.00 0.00 55.95 56.00 1bgq s SER 155 Cb 0.16 0.22 -0.06 0.00 0.10 0.00 0.00 66.02 66.44 1bgq s SER 155 CO 0.29 -0.57 0.08 0.72 0.98 0.00 0.00 173.24 174.74 1bgq s PHE 156 N -3.33 1.71 0.12 5.02 -0.71 -0.08 -4.67 117.98 116.04 1bgq s PHE 156 Ca 0.01 -1.08 0.05 0.00 -1.04 0.00 0.00 56.93 54.87 1bgq s PHE 156 Cb 0.03 -1.05 -0.04 0.00 -1.21 0.00 0.00 43.02 40.75 1bgq s PHE 156 CO -0.08 -0.19 -0.12 0.95 -1.34 0.00 0.00 175.22 174.44 1bgq s THR 157 N -3.56 1.22 -0.06 -4.49 -4.23 -0.56 -1.05 115.64 102.91 1bgq s THR 157 Ca 0.37 -1.75 0.01 0.00 -1.18 0.00 0.00 61.69 59.13 1bgq s THR 157 Cb 0.08 -1.54 0.02 0.00 1.34 0.00 0.00 72.50 72.41 1bgq s THR 157 CO 0.14 -0.50 -0.05 -0.69 -0.54 0.00 0.00 174.62 172.98 1bgq s VAL 158 N -2.39 0.63 -0.01 2.29 1.01 -0.59 -0.64 120.40 120.71 1bgq s VAL 158 Ca 0.09 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 61.96 1bgq s VAL 158 Cb -0.03 -0.66 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 1bgq s VAL 158 CO 0.02 0.26 -0.09 -0.89 0.00 0.00 0.00 175.10 174.40 1bgq s THR 159 N 1.13 0.69 0.30 3.92 2.01 -0.26 -2.28 115.64 121.14 1bgq s THR 159 Ca -0.08 -0.39 -0.29 0.00 0.31 0.00 0.00 61.69 61.25 1bgq s THR 159 Cb -0.14 -0.58 -0.11 0.00 0.01 0.00 0.00 72.50 71.68 1bgq s THR 159 CO -0.01 0.19 1.46 -0.22 -0.69 0.00 0.00 174.62 175.35 1bgq s LEU 160 N -0.23 4.37 -0.37 4.42 2.96 -1.26 -0.46 118.68 128.11 1bgq s LEU 160 Ca 0.03 2.82 -0.28 0.00 -0.22 0.00 0.00 54.13 56.49 1bgq s LEU 160 Cb -0.03 -3.64 0.02 0.00 0.50 0.00 0.00 46.19 43.03 1bgq s LEU 160 CO -0.00 -0.76 1.02 -0.62 -1.32 0.00 0.00 176.35 174.67 1bgq s ASP 161 N 0.13 6.77 -0.06 3.68 -1.08 0.11 -4.11 116.67 122.11 1bgq s ASP 161 Ca 0.57 0.74 0.09 0.00 -0.52 0.00 0.00 52.55 53.44 1bgq s ASP 161 Cb -0.44 -2.51 0.15 0.00 -1.46 0.00 0.00 42.92 38.67 1bgq s ASP 161 CO 0.50 -0.94 1.08 -0.62 0.52 0.00 0.00 175.17 175.71 1bgq n GLU 162 N 7.01 0.60 0.00 4.34 1.02 -1.26 -4.81 120.64 127.53 1bgq n GLU 162 Ca 0.10 -1.79 0.00 0.00 -0.02 0.00 0.00 57.16 55.45 1bgq n GLU 162 Cb 0.48 -0.94 0.00 0.00 -0.02 0.00 0.00 31.44 30.96 1bgq n GLU 162 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1bgq n VAL 163 N -0.63 0.00 -3.59 2.62 0.24 -1.26 -5.06 118.33 110.65 1bgq n VAL 163 Ca 0.08 -0.05 -0.20 0.00 -2.04 0.00 0.00 64.34 62.12 1bgq n VAL 163 Cb 0.69 0.41 -0.02 0.00 -1.47 0.00 0.00 33.84 33.45 1bgq n VAL 163 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1bgq s ASN 164 N -0.69 5.49 0.67 -1.34 0.01 -1.26 -5.08 114.94 112.74 1bgq s ASN 164 Ca 0.00 -0.44 -0.17 0.00 -0.71 0.00 0.00 52.86 51.54 1bgq s ASN 164 Cb 0.00 -0.96 0.00 0.00 0.41 0.00 0.00 41.25 40.71 1bgq s ASN 164 CO 0.00 -0.46 1.25 -1.83 -1.51 0.00 0.00 177.10 174.55 1bgq s GLU 165 N -4.10 2.45 0.07 -0.60 -1.05 -1.26 -4.93 118.70 109.28 1bgq s GLU 165 Ca 0.45 1.93 -0.30 0.00 -0.15 0.00 0.00 54.97 56.89 1bgq s GLU 165 Cb -0.07 -1.85 -0.05 0.00 -0.44 0.00 0.00 34.13 31.72 1bgq s GLU 165 CO 0.29 -1.64 1.05 1.03 0.95 0.00 0.00 175.26 176.94 1bgq s ARG 166 N -3.56 4.57 -0.16 -4.83 1.81 -1.26 -5.03 118.95 110.49 1bgq s ARG 166 Ca 0.79 1.56 -0.04 0.00 -1.72 0.00 0.00 55.73 56.32 1bgq s ARG 166 Cb -0.34 -3.38 -0.03 0.00 -0.45 0.00 0.00 34.95 30.76 1bgq s ARG 166 CO 0.41 -0.01 -0.02 0.96 -0.68 0.00 0.00 175.30 175.95 1bgq s ILE 167 N 0.54 3.97 0.21 1.52 -4.36 -1.26 -5.00 121.20 116.81 1bgq s ILE 167 Ca 0.52 -0.33 -0.10 0.00 -0.26 0.00 0.00 60.65 60.48 1bgq s ILE 167 Cb -0.25 -2.75 0.17 0.00 1.25 0.00 0.00 42.46 40.87 1bgq s ILE 167 CO 0.30 0.48 1.70 1.23 0.24 0.00 0.00 174.94 178.90 1bgq h GLY 168 N 6.83 0.78 -4.92 6.27 0.00 -1.95 -3.44 103.07 106.64 1bgq h GLY 168 Ca -0.32 -0.03 0.05 0.00 0.00 0.00 0.00 47.33 47.02 1bgq h GLY 168 CO 0.63 -0.12 0.43 -1.60 0.00 0.00 0.00 176.54 175.88 1bgq s ARG 169 N -6.11 0.62 0.00 4.80 3.52 -1.26 -4.70 118.95 115.82 1bgq s ARG 169 Ca -0.13 0.46 0.00 0.00 -0.13 0.00 0.00 55.73 55.93 1bgq s ARG 169 Cb 0.18 0.30 0.00 0.00 -1.56 0.00 0.00 34.95 33.87 1bgq s ARG 169 CO 0.74 -0.13 0.00 0.41 -0.81 0.00 0.00 175.30 175.51 1bgq n GLY 170 N 1.66 0.70 2.98 8.12 0.00 0.20 -4.36 105.19 114.49 1bgq n GLY 170 Ca -0.13 -2.15 -0.09 0.00 0.00 0.00 0.00 46.02 43.66 1bgq n GLY 170 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bgq s THR 171 N -1.05 0.10 -0.07 2.61 2.01 -0.95 -0.61 115.64 117.68 1bgq s THR 171 Ca 0.00 -0.83 0.04 0.00 0.31 0.00 0.00 61.69 61.21 1bgq s THR 171 Cb 0.00 -0.25 0.00 0.00 0.01 0.00 0.00 72.50 72.26 1bgq s THR 171 CO 0.00 -0.45 -0.19 -0.63 -0.69 0.00 0.00 174.62 172.65 1bgq s ILE 172 N -1.35 1.64 -0.40 1.82 1.01 0.25 -2.23 121.20 121.94 1bgq s ILE 172 Ca -0.15 -0.80 -0.08 0.00 0.00 0.00 0.00 60.65 59.63 1bgq s ILE 172 Cb -0.09 -1.43 0.08 0.00 0.01 0.00 0.00 42.46 41.03 1bgq s ILE 172 CO -0.01 0.47 0.22 -0.76 0.00 0.00 0.00 174.94 174.86 1bgq s LEU 173 N 0.29 5.00 -0.55 2.97 1.02 -0.15 -0.67 118.68 126.60 1bgq s LEU 173 Ca -0.12 -1.51 -0.19 0.00 0.02 0.00 0.00 54.13 52.32 1bgq s LEU 173 Cb -0.15 -1.94 0.08 0.00 0.02 0.00 0.00 46.19 44.20 1bgq s LEU 173 CO 0.05 -0.50 0.68 -0.60 0.02 0.00 0.00 176.35 176.00 1bgq s ARG 174 N 1.38 3.09 -0.25 1.70 3.52 0.68 -1.78 118.95 127.28 1bgq s ARG 174 Ca 0.03 -1.06 -0.17 0.00 -0.13 0.00 0.00 55.73 54.40 1bgq s ARG 174 Cb -0.22 -4.17 -0.03 0.00 -1.56 0.00 0.00 34.95 28.96 1bgq s ARG 174 CO 0.01 -1.39 0.46 -0.51 -0.81 0.00 0.00 175.30 173.07 1bgq s LEU 175 N 2.73 4.06 -0.78 -0.88 1.02 0.34 -1.37 118.68 123.81 1bgq s LEU 175 Ca 0.14 0.46 -0.18 0.00 0.02 0.00 0.00 54.13 54.57 1bgq s LEU 175 Cb -0.21 -2.58 0.14 0.00 0.02 0.00 0.00 46.19 43.56 1bgq s LEU 175 CO 0.10 -0.23 0.90 -0.36 0.02 0.00 0.00 176.35 176.78 1bgq s PHE 176 N 2.09 3.21 0.54 0.29 0.40 -0.59 -0.47 117.98 123.46 1bgq s PHE 176 Ca 0.19 -1.35 -0.21 0.00 -0.60 0.00 0.00 56.93 54.96 1bgq s PHE 176 Cb -0.16 -4.09 -0.06 0.00 0.51 0.00 0.00 43.02 39.23 1bgq s PHE 176 CO 0.09 -1.32 1.14 1.28 0.70 0.00 0.00 175.22 177.12 1bgq n LEU 177 N 5.93 4.28 -4.79 -0.37 4.77 -0.82 -2.85 117.00 123.16 1bgq n LEU 177 Ca 0.09 0.92 -0.32 0.00 -0.03 0.00 0.00 56.01 56.67 1bgq n LEU 177 Cb 0.46 -1.46 0.05 0.00 -2.33 0.00 0.00 43.42 40.14 1bgq n LEU 177 CO 0.50 -1.24 0.72 -0.54 -1.33 0.00 0.00 177.39 175.50 1bgq s LYS 178 N -2.67 2.84 0.61 3.23 1.02 -0.19 -4.77 119.74 119.81 1bgq s LYS 178 Ca 0.72 1.22 0.33 0.00 0.02 0.00 0.00 55.97 58.26 1bgq s LYS 178 Cb -0.44 -1.97 1.90 0.00 -0.52 0.00 0.00 37.83 36.80 1bgq s LYS 178 CO 0.50 -1.20 2.21 -0.44 -0.92 0.00 0.00 175.35 175.51 1bgq h ASP 179 N -0.23 0.00 -0.48 2.83 3.32 -1.94 -1.72 116.42 118.20 1bgq h ASP 179 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1bgq h ASP 179 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1bgq h ASP 179 CO 0.55 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.17 1bgq n ASP 180 N -3.60 3.51 -0.51 6.45 5.75 -1.26 -4.34 116.55 122.56 1bgq n ASP 180 Ca -0.02 -1.97 0.07 0.00 -0.01 0.00 0.00 54.79 52.86 1bgq n ASP 180 Cb 0.17 -0.32 0.18 0.00 -1.03 0.00 0.00 41.12 40.12 1bgq n ASP 180 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bgq n GLN 181 N 1.41 1.37 0.00 0.11 1.13 -0.65 -4.74 117.38 116.02 1bgq n GLN 181 Ca 0.20 -2.98 0.09 0.00 -1.94 0.00 0.00 57.00 52.36 1bgq n GLN 181 Cb 0.58 -1.46 0.55 0.00 0.11 0.00 0.00 30.24 30.01 1bgq n GLN 181 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1bgq n LEU 182 N -1.08 0.00 0.23 1.08 4.77 -1.24 -3.16 117.00 117.60 1bgq n LEU 182 Ca 0.17 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.25 1bgq n LEU 182 Cb 0.70 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 42.30 1bgq n LEU 182 CO -0.03 0.00 0.83 1.05 -1.33 0.00 0.00 177.39 177.91 1bgq h GLU 183 N 0.00 0.00 0.00 3.23 4.11 -1.93 -2.57 114.58 117.42 1bgq h GLU 183 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1bgq h GLU 183 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1bgq h GLU 183 CO 0.00 0.22 0.00 0.66 0.07 0.00 0.00 179.01 179.96 1bgq n TYR 184 N -3.48 0.00 0.33 2.06 4.01 -1.19 -1.78 117.16 117.11 1bgq n TYR 184 Ca -0.00 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.85 1bgq n TYR 184 Cb 0.39 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.47 1bgq n TYR 184 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1bgq n LEU 185 N -0.99 0.73 -4.73 7.72 4.77 -0.97 -4.74 117.00 118.81 1bgq n LEU 185 Ca 0.17 0.22 -0.40 0.00 -0.03 0.00 0.00 56.01 55.97 1bgq n LEU 185 Cb 0.08 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 1bgq n LEU 185 CO 0.13 -0.10 0.49 -1.61 -1.33 0.00 0.00 177.39 174.97 1bgq s GLU 186 N -3.28 4.49 0.29 3.23 2.02 -0.74 -4.81 118.70 119.91 1bgq s GLU 186 Ca 0.02 1.08 0.01 0.00 0.02 0.00 0.00 54.97 56.11 1bgq s GLU 186 Cb 0.12 -3.42 0.55 0.00 0.10 0.00 0.00 34.13 31.48 1bgq s GLU 186 CO 0.77 0.12 1.85 1.49 0.02 0.00 0.00 175.26 179.52 1bgq h GLU 187 N 6.35 0.97 0.70 1.61 4.81 -1.90 -1.41 114.58 125.72 1bgq h GLU 187 Ca -0.42 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 58.72 1bgq h GLU 187 Cb 1.21 -0.22 0.01 0.00 0.63 0.00 0.00 28.75 30.37 1bgq h GLU 187 CO 0.74 0.64 -0.34 0.87 -0.73 0.00 0.00 179.01 180.19 1bgq h LYS 188 N 1.00 -0.91 -0.34 1.92 1.57 -1.94 0.31 116.57 118.18 1bgq h LYS 188 Ca 0.48 0.06 0.07 0.00 -1.87 0.00 0.00 60.65 59.39 1bgq h LYS 188 Cb 0.44 0.21 -0.08 0.00 0.08 0.00 0.00 32.23 32.87 1bgq h LYS 188 CO -0.24 -0.58 -0.30 -0.09 -0.57 0.00 0.00 179.45 177.67 1bgq h ARG 189 N -1.18 -0.25 -0.07 3.15 9.65 -1.80 0.17 114.38 124.05 1bgq h ARG 189 Ca -0.10 0.02 0.04 0.00 -1.10 0.00 0.00 59.98 58.84 1bgq h ARG 189 Cb 0.75 0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 29.34 1bgq h ARG 189 CO 0.16 -0.17 -0.19 0.82 2.80 0.00 0.00 179.97 183.39 1bgq h ILE 190 N -0.26 0.52 -0.70 1.20 2.04 -1.27 -1.19 117.51 117.86 1bgq h ILE 190 Ca 0.16 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.15 1bgq h ILE 190 Cb 0.52 0.52 -0.09 0.00 -0.74 0.00 0.00 36.82 37.04 1bgq h ILE 190 CO -0.49 0.00 0.26 0.11 0.00 0.00 0.00 178.15 178.03 1bgq h LYS 191 N -0.27 0.40 -0.20 2.37 1.57 -0.07 -1.58 116.57 118.78 1bgq h LYS 191 Ca 0.08 -0.02 -0.20 0.00 -1.87 0.00 0.00 60.65 58.64 1bgq h LYS 191 Cb 0.39 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1bgq h LYS 191 CO -0.23 0.27 -0.65 1.05 -0.57 0.00 0.00 179.45 179.31 1bgq h GLU 192 N 0.41 0.75 -0.65 3.15 4.11 -0.54 -2.40 114.58 119.42 1bgq h GLU 192 Ca 0.37 -0.54 -0.04 0.00 0.07 0.00 0.00 59.36 59.23 1bgq h GLU 192 Cb 0.54 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 1bgq h GLU 192 CO -0.38 1.16 0.25 0.28 0.07 0.00 0.00 179.01 180.39 1bgq h VAL 193 N 0.55 1.24 -0.25 -1.06 2.07 -0.86 -2.34 116.25 115.60 1bgq h VAL 193 Ca -0.02 -0.76 -0.07 0.00 0.82 0.00 0.00 66.70 66.67 1bgq h VAL 193 Cb 1.26 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 1bgq h VAL 193 CO 0.13 0.30 -0.15 0.40 0.02 0.00 0.00 177.57 178.27 1bgq h ILE 194 N 0.92 1.23 -0.37 4.57 2.04 -1.29 -3.09 117.51 121.51 1bgq h ILE 194 Ca 0.22 -1.03 -0.06 0.00 1.00 0.00 0.00 64.86 64.99 1bgq h ILE 194 Cb 0.22 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1bgq h ILE 194 CO -0.02 0.33 -0.00 0.50 0.00 0.00 0.00 178.15 178.96 1bgq h LYS 195 N 0.39 0.66 -0.06 2.37 3.64 -0.91 -2.68 116.57 119.99 1bgq h LYS 195 Ca 0.07 -0.21 -0.17 0.00 -1.27 0.00 0.00 60.65 59.07 1bgq h LYS 195 Cb 0.51 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1bgq h LYS 195 CO 0.03 0.76 -0.64 0.07 -2.27 0.00 0.00 179.45 177.41 1bgq h ARG 196 N 0.48 0.54 -0.12 1.90 0.11 -1.42 -3.37 114.38 112.51 1bgq h ARG 196 Ca 0.11 -0.50 0.00 0.00 0.10 0.00 0.00 59.98 59.69 1bgq h ARG 196 Cb 0.47 0.12 0.00 0.00 1.11 0.00 0.00 29.97 31.67 1bgq h ARG 196 CO 0.02 1.13 0.00 0.72 0.10 0.00 0.00 179.97 181.94 1bgq n HIS 197 N -4.15 0.12 -3.24 4.08 8.25 -1.17 -4.65 115.22 114.47 1bgq n HIS 197 Ca -0.09 -0.07 -0.25 0.00 -0.26 0.00 0.00 57.72 57.05 1bgq n HIS 197 Cb 0.68 -0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.72 1bgq n HIS 197 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1bgq n SER 198 N 1.25 1.05 -0.02 0.41 7.64 -1.01 -4.92 113.62 118.02 1bgq n SER 198 Ca 0.14 -2.88 -0.09 0.00 1.01 0.00 0.00 58.87 57.05 1bgq n SER 198 Cb 0.55 -0.65 -0.14 0.00 -1.01 0.00 0.00 64.21 62.96 1bgq n SER 198 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1bgq n GLU 199 N 1.24 0.64 -3.23 1.43 2.13 -1.26 -4.56 120.64 117.03 1bgq n GLU 199 Ca 0.23 0.28 -0.35 0.00 0.66 0.00 0.00 57.16 57.99 1bgq n GLU 199 Cb 0.50 -1.78 -0.04 0.00 0.27 0.00 0.00 31.44 30.40 1bgq n GLU 199 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1bgq n PHE 200 N -3.05 2.99 -4.42 4.31 3.72 -1.26 -5.00 117.46 114.75 1bgq n PHE 200 Ca -0.18 -3.41 -0.34 0.00 -0.05 0.00 0.00 57.45 53.47 1bgq n PHE 200 Cb 1.06 -0.89 -0.13 0.00 -0.94 0.00 0.00 39.48 38.57 1bgq n PHE 200 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1bgq s VAL 201 N -2.63 3.44 0.01 -4.37 1.01 -1.26 -5.02 120.40 111.58 1bgq s VAL 201 Ca 0.36 -0.51 0.32 0.00 0.00 0.00 0.00 61.98 62.15 1bgq s VAL 201 Cb 0.10 -2.50 0.38 0.00 0.00 0.00 0.00 36.38 34.36 1bgq s VAL 201 CO 0.04 0.49 1.94 0.00 0.00 0.00 0.00 175.10 177.57 1bgq h ALA 202 N 7.05 1.00 -2.99 5.51 0.00 -1.98 -3.45 119.26 124.41 1bgq h ALA 202 Ca -0.31 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 53.98 1bgq h ALA 202 Cb 1.19 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.86 1bgq h ALA 202 CO 0.59 0.00 -0.67 0.71 0.00 0.00 0.00 179.25 179.88 1bgq s TYR 203 N -3.60 2.83 0.37 0.00 2.02 -1.26 -5.09 117.35 112.62 1bgq s TYR 203 Ca 0.02 -0.13 -0.27 0.00 -0.37 0.00 0.00 57.07 56.31 1bgq s TYR 203 Cb 0.09 -1.39 -0.10 0.00 -0.40 0.00 0.00 41.96 40.16 1bgq s TYR 203 CO 0.54 0.51 1.32 -1.25 -1.57 0.00 0.00 175.55 175.09 1bgq s PRO 204 N -2.81 4.15 -0.33 -1.71 0.04 -1.26 -4.84 135.00 128.23 1bgq s PRO 204 Ca 0.27 2.22 -0.04 0.00 0.04 0.00 0.00 61.00 63.49 1bgq s PRO 204 Cb -0.10 -2.91 0.06 0.00 0.04 0.00 0.00 34.50 31.59 1bgq s PRO 204 CO 0.18 -0.36 0.07 0.42 0.04 0.00 0.00 177.00 177.35 1bgq s ILE 205 N -1.20 3.30 -0.14 0.56 1.01 -1.26 -1.66 121.20 121.82 1bgq s ILE 205 Ca 0.53 -1.41 -0.12 0.00 0.00 0.00 0.00 60.65 59.65 1bgq s ILE 205 Cb -0.39 -2.95 -0.05 0.00 0.01 0.00 0.00 42.46 39.08 1bgq s ILE 205 CO 0.52 -0.23 0.24 -1.10 0.00 0.00 0.00 174.94 174.37 1bgq s GLN 206 N 1.28 4.01 -0.23 2.79 -0.21 0.58 -4.98 119.66 122.90 1bgq s GLN 206 Ca -0.02 0.02 -0.07 0.00 0.02 0.00 0.00 55.36 55.31 1bgq s GLN 206 Cb -0.20 -3.34 -0.03 0.00 1.00 0.00 0.00 33.01 30.44 1bgq s GLN 206 CO -0.00 0.44 0.05 -1.17 -2.12 0.00 0.00 175.29 172.48 1bgq s LEU 207 N -0.10 3.41 -0.36 2.90 2.96 -1.26 -0.08 118.68 126.14 1bgq s LEU 207 Ca 0.15 -0.18 -0.18 0.00 -0.22 0.00 0.00 54.13 53.70 1bgq s LEU 207 Cb -0.13 -1.90 0.00 0.00 0.50 0.00 0.00 46.19 44.67 1bgq s LEU 207 CO 0.04 0.01 0.50 -0.69 -1.32 0.00 0.00 176.35 174.90 1bgq s VAL 208 N 1.31 5.02 -0.10 1.68 1.01 0.02 -4.97 120.40 124.38 1bgq s VAL 208 Ca 0.05 0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.29 1bgq s VAL 208 Cb -0.15 -3.98 -0.00 0.00 0.00 0.00 0.00 36.38 32.25 1bgq s VAL 208 CO 0.03 -0.26 -0.23 0.54 0.00 0.00 0.00 175.10 175.18 1bgq s VAL 209 N 2.37 2.19 -0.40 2.92 0.11 -1.26 -4.20 120.40 122.13 1bgq s VAL 209 Ca 0.18 -0.98 -0.17 0.00 -2.93 0.00 0.00 61.98 58.07 1bgq s VAL 209 Cb -0.16 -1.84 0.01 0.00 -1.53 0.00 0.00 36.38 32.87 1bgq s VAL 209 CO 0.14 0.56 0.46 -0.89 -3.33 0.00 0.00 175.10 172.04 1bgq s THR 210 N 0.24 5.06 -0.14 5.04 2.01 -1.26 -5.06 115.64 121.53 1bgq s THR 210 Ca -0.15 -0.13 0.00 0.00 0.31 0.00 0.00 61.69 61.72 1bgq s THR 210 Cb -0.17 -4.01 -0.01 0.00 0.01 0.00 0.00 72.50 68.32 1bgq s THR 210 CO 0.08 -0.36 -0.15 -1.59 -0.69 0.00 0.00 174.62 171.90 1bgq s LYS 211 N 2.24 3.26 -0.12 4.92 0.00 -1.26 -5.09 119.74 123.70 1bgq s LYS 211 Ca 0.14 -0.74 -0.29 0.00 0.00 0.00 0.00 55.97 55.08 1bgq s LYS 211 Cb -0.16 -2.61 -0.03 0.00 0.00 0.00 0.00 37.83 35.02 1bgq s LYS 211 CO 0.14 0.08 1.41 -2.00 0.00 0.00 0.00 175.35 174.99 1bgq s GLU 212 N 0.65 4.21 -0.09 1.78 2.12 -1.26 -4.92 118.70 121.20 1bgq s GLU 212 Ca -0.08 1.87 -0.36 0.00 0.36 0.00 0.00 54.97 56.76 1bgq s GLU 212 Cb -0.16 -3.84 -0.13 0.00 0.26 0.00 0.00 34.13 30.26 1bgq s GLU 212 CO 0.02 -0.75 1.77 0.28 -0.54 0.00 0.00 175.26 176.04 1bgq n VAL 213 N 5.39 0.40 0.00 3.70 0.31 -1.26 -5.36 118.33 121.52 1bgq n VAL 213 Ca 0.15 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 1bgq n VAL 213 Cb 0.44 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.77 1bgq n VAL 213 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89