#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2apq s GLU 2 N 0.00 0.84 0.70 1.97 2.12 -1.26 -5.16 118.70 117.90 2apq s GLU 2 Ca 0.00 1.00 -0.13 0.00 0.36 0.00 0.00 54.97 56.20 2apq s GLU 2 Cb 0.00 0.41 0.02 0.00 0.26 0.00 0.00 34.13 34.81 2apq s GLU 2 CO 0.00 -0.10 1.09 0.95 -0.54 0.00 0.00 175.26 176.66 2apq s THR 3 N 0.39 3.50 0.21 -1.70 -4.23 -1.26 -4.86 115.64 107.69 2apq s THR 3 Ca -0.00 0.58 -0.08 0.00 -1.18 0.00 0.00 61.69 61.01 2apq s THR 3 Cb -0.05 -3.13 0.15 0.00 1.34 0.00 0.00 72.50 70.81 2apq s THR 3 CO 0.01 -0.55 1.77 0.00 -0.54 0.00 0.00 174.62 175.31 2apq h ALA 4 N -0.47 1.01 -0.75 3.99 0.00 -1.96 0.06 119.26 121.14 2apq h ALA 4 Ca -0.45 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.28 2apq h ALA 4 Cb 1.23 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 2apq h ALA 4 CO 0.54 0.65 0.49 0.00 0.00 0.00 0.00 179.25 180.93 2apq h ALA 5 N 1.16 0.96 -0.45 0.00 0.00 -1.88 -0.19 119.26 118.86 2apq h ALA 5 Ca 0.26 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 2apq h ALA 5 Cb 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2apq h ALA 5 CO -0.02 0.32 -0.25 0.00 0.00 0.00 0.00 179.25 179.30 2apq h ALA 6 N 1.29 0.70 -0.59 0.00 0.00 -1.82 -2.46 119.26 116.38 2apq h ALA 6 Ca 0.29 -0.40 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2apq h ALA 6 Cb -0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2apq h ALA 6 CO -0.08 0.67 0.02 -0.22 0.00 0.00 0.00 179.25 179.65 2apq h LYS 7 N 0.82 1.00 -0.64 0.00 3.64 -0.70 -1.50 116.57 119.19 2apq h LYS 7 Ca 0.10 -0.29 0.03 0.00 -1.27 0.00 0.00 60.65 59.21 2apq h LYS 7 Cb 0.83 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.50 2apq h LYS 7 CO 0.07 0.97 0.40 0.35 -2.27 0.00 0.00 179.45 178.97 2apq h PHE 8 N 0.93 0.75 -0.30 1.91 3.04 -0.88 -0.26 116.94 122.12 2apq h PHE 8 Ca 0.17 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.13 2apq h PHE 8 Cb 0.50 -0.24 -0.01 0.00 2.56 0.00 0.00 35.95 38.76 2apq h PHE 8 CO 0.03 0.43 0.15 0.93 -2.02 0.00 0.00 178.31 177.83 2apq h GLU 9 N 0.78 0.44 -0.49 1.11 5.08 -1.04 0.15 114.58 120.61 2apq h GLU 9 Ca 0.26 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2apq h GLU 9 Cb 0.02 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 2apq h GLU 9 CO -0.10 0.41 0.27 -0.09 -1.00 0.00 0.00 179.01 178.49 2apq h ARG 10 N 0.36 0.69 0.00 2.33 2.43 -1.01 -1.78 114.38 117.40 2apq h ARG 10 Ca 0.10 -0.08 -0.18 0.00 -0.81 0.00 0.00 59.98 59.02 2apq h ARG 10 Cb 0.11 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 2apq h ARG 10 CO -0.01 0.54 -0.84 1.96 -1.51 0.00 0.00 179.97 180.10 2apq h GLN 11 N 0.65 0.00 0.00 0.20 4.20 -0.93 -3.42 115.11 115.82 2apq h GLN 11 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 2apq h GLN 11 Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 2apq h GLN 11 CO -0.03 0.84 -0.19 0.72 -0.67 0.00 0.00 178.83 179.51 2apq n HIS 12 N -3.39 0.00 -3.55 2.96 8.25 0.03 -4.64 115.22 114.89 2apq n HIS 12 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.10 2apq n HIS 12 Cb 0.85 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.88 2apq n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2apq s MET 13 N -1.00 4.20 -0.46 -0.41 -1.94 -0.67 -0.05 119.30 118.96 2apq s MET 13 Ca 0.00 0.02 0.05 0.00 -1.71 0.00 0.00 55.69 54.04 2apq s MET 13 Cb 0.00 -3.47 0.18 0.00 2.01 0.00 0.00 34.83 33.55 2apq s MET 13 CO 0.00 0.15 0.40 -3.47 -0.01 0.00 0.00 175.02 172.09 2apq n ASP 14 N 3.91 0.25 0.00 3.03 2.03 -0.19 -4.82 116.55 120.76 2apq n ASP 14 Ca -0.12 -2.57 0.14 0.00 0.52 0.00 0.00 54.79 52.76 2apq n ASP 14 Cb 0.52 -0.60 0.82 0.00 -0.72 0.00 0.00 41.12 41.14 2apq n ASP 14 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2apq n SER 15 N 2.45 0.00 0.13 1.67 7.64 -1.25 -3.81 113.62 120.45 2apq n SER 15 Ca 0.27 -0.77 0.07 0.00 1.01 0.00 0.00 58.87 59.46 2apq n SER 15 Cb 0.47 -0.04 0.03 0.00 -1.01 0.00 0.00 64.21 63.65 2apq n SER 15 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2apq h SER 16 N 0.00 0.00 -4.38 6.43 0.02 -1.93 -3.47 113.55 110.23 2apq h SER 16 Ca 0.00 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.54 2apq h SER 16 Cb 0.04 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 62.37 2apq h SER 16 CO 0.00 0.23 -0.77 0.42 -1.14 0.00 0.00 176.83 175.56 2apq s THR 17 N -3.15 1.14 -0.55 -2.27 -4.23 -1.25 -5.04 115.64 100.30 2apq s THR 17 Ca 0.02 -1.42 0.24 0.00 -1.18 0.00 0.00 61.69 59.35 2apq s THR 17 Cb 0.08 -1.19 0.30 0.00 1.34 0.00 0.00 72.50 73.03 2apq s THR 17 CO 0.76 -0.29 1.65 0.77 -0.54 0.00 0.00 174.62 176.96 2apq h SER 18 N 4.07 0.00 -4.96 3.99 4.64 -1.89 -3.44 113.55 115.96 2apq h SER 18 Ca -0.40 -0.01 0.21 0.00 -0.47 0.00 0.00 61.79 61.12 2apq h SER 18 Cb 1.19 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.15 2apq h SER 18 CO 0.43 0.00 0.64 0.00 -0.87 0.00 0.00 176.83 177.04 2apq s ALA 19 N -3.17 -1.93 0.19 5.18 0.00 -1.26 -4.84 121.76 115.92 2apq s ALA 19 Ca 0.08 0.87 -0.31 0.00 0.00 0.00 0.00 51.96 52.59 2apq s ALA 19 Cb 0.08 0.33 -0.11 0.00 0.00 0.00 0.00 23.12 23.42 2apq s ALA 19 CO 0.65 -0.83 1.60 0.00 0.00 0.00 0.00 175.76 177.17 2apq s ALA 20 N -2.84 3.80 -0.37 0.00 0.00 -1.26 -4.92 121.76 116.18 2apq s ALA 20 Ca 0.10 1.44 0.23 0.00 0.00 0.00 0.00 51.96 53.73 2apq s ALA 20 Cb 0.00 -3.64 0.09 0.00 0.00 0.00 0.00 23.12 19.57 2apq s ALA 20 CO -0.04 -0.83 1.11 0.66 0.00 0.00 0.00 175.76 176.66 2apq h SER 21 N 6.46 0.00 -5.15 0.00 4.64 -2.00 -3.49 113.55 114.02 2apq h SER 21 Ca -0.43 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 60.78 2apq h SER 21 Cb 1.21 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.21 2apq h SER 21 CO 0.90 0.04 -0.02 -0.94 -0.87 0.00 0.00 176.83 175.95 2apq s SER 22 N -4.96 -0.17 0.00 4.97 1.04 -1.26 -5.02 113.70 108.29 2apq s SER 22 Ca 0.02 -0.72 0.14 0.00 0.48 0.00 0.00 55.95 55.87 2apq s SER 22 Cb 0.11 0.60 0.71 0.00 0.10 0.00 0.00 66.02 67.54 2apq s SER 22 CO 0.77 -1.14 1.41 -1.54 0.98 0.00 0.00 173.24 173.72 2apq n SER 23 N -0.37 0.00 -0.49 7.02 3.41 -1.26 -2.22 113.62 119.71 2apq n SER 23 Ca -0.05 0.17 0.13 0.00 -0.26 0.00 0.00 58.87 58.86 2apq n SER 23 Cb 0.62 -0.33 0.35 0.00 -0.26 0.00 0.00 64.21 64.59 2apq n SER 23 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2apq n ASN 24 N -1.33 1.66 -0.13 4.04 5.15 -1.26 -4.43 115.26 118.96 2apq n ASN 24 Ca 0.06 -1.40 -0.05 0.00 -0.60 0.00 0.00 54.58 52.60 2apq n ASN 24 Cb 0.13 0.10 0.02 0.00 -0.53 0.00 0.00 39.78 39.49 2apq n ASN 24 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2apq h TYR 25 N 2.39 -0.33 -0.53 1.20 5.03 -1.85 -1.72 116.97 121.16 2apq h TYR 25 Ca 0.00 0.04 -0.05 0.00 2.58 0.00 0.00 58.73 61.30 2apq h TYR 25 Cb 0.61 0.21 -0.02 0.00 1.55 0.00 0.00 36.73 39.08 2apq h TYR 25 CO 0.00 -0.22 0.14 0.00 -1.32 0.00 0.00 178.16 176.76 2apq h ASN 27 N 0.75 0.67 -0.03 0.00 2.35 -1.67 0.56 115.58 118.21 2apq h ASN 27 Ca 0.17 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.94 2apq h ASN 27 Cb 0.31 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 2apq h ASN 27 CO -0.00 0.42 -0.04 1.56 -1.65 0.00 0.00 177.43 177.72 2apq h GLN 28 N 0.80 0.08 -0.20 0.81 4.20 -0.94 -3.11 115.11 116.74 2apq h GLN 28 Ca 0.35 -0.05 -0.17 0.00 0.06 0.00 0.00 58.65 58.85 2apq h GLN 28 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2apq h GLN 28 CO -0.20 0.58 -0.52 0.52 -0.67 0.00 0.00 178.83 178.54 2apq h MET 29 N -0.42 0.71 -0.75 1.46 2.86 -0.64 -0.44 114.93 117.71 2apq h MET 29 Ca 0.00 -0.50 0.05 0.00 -2.06 0.00 0.00 59.70 57.19 2apq h MET 29 Cb 0.57 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.26 2apq h MET 29 CO 0.01 1.12 0.50 0.52 1.06 0.00 0.00 176.91 180.11 2apq h MET 30 N 0.43 0.84 0.10 1.72 2.86 -1.03 -0.91 114.93 118.94 2apq h MET 30 Ca -0.01 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2apq h MET 30 Cb 1.14 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.61 2apq h MET 30 CO 0.11 0.56 -0.05 -0.22 1.06 0.00 0.00 176.91 178.37 2apq h LYS 31 N 0.87 -0.13 0.00 1.72 3.64 -1.43 0.54 116.57 121.79 2apq h LYS 31 Ca 0.31 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.67 2apq h LYS 31 Cb 0.14 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2apq h LYS 31 CO -0.10 0.34 -0.14 0.66 -2.27 0.00 0.00 179.45 177.95 2apq h SER 32 N -0.66 0.00 -0.37 4.20 4.64 -0.89 -1.69 113.55 118.78 2apq h SER 32 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2apq h SER 32 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2apq h SER 32 CO 0.02 0.14 0.00 0.54 -0.87 0.00 0.00 176.83 176.66 2apq n ARG 33 N -3.39 2.36 -2.10 4.77 5.12 -0.36 -4.91 116.66 118.15 2apq n ARG 33 Ca -0.01 -1.54 -0.13 0.00 -1.93 0.00 0.00 57.85 54.24 2apq n ARG 33 Cb 0.33 -1.53 -0.02 0.00 -1.16 0.00 0.00 32.46 30.08 2apq n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2apq n ASN 34 N 0.56 -4.20 -1.05 0.55 5.03 -0.63 -4.84 115.26 110.68 2apq n ASN 34 Ca 0.14 0.05 0.11 0.00 0.87 0.00 0.00 54.58 55.74 2apq n ASN 34 Cb 0.49 -3.29 0.27 0.00 -1.02 0.00 0.00 39.78 36.23 2apq n ASN 34 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2apq n LEU 35 N -1.82 3.08 -0.24 3.41 4.77 0.18 -3.91 117.00 122.46 2apq n LEU 35 Ca -0.15 -1.43 0.06 0.00 -0.03 0.00 0.00 56.01 54.45 2apq n LEU 35 Cb 0.59 -0.31 0.08 0.00 -2.33 0.00 0.00 43.42 41.45 2apq n LEU 35 CO 0.19 0.72 0.44 0.35 -1.33 0.00 0.00 177.39 177.75 2apq n THR 36 N 1.20 1.12 0.29 -5.08 -2.24 -1.21 -1.92 114.28 106.45 2apq n THR 36 Ca 0.19 -1.34 -0.12 0.00 -2.27 0.00 0.00 64.05 60.51 2apq n THR 36 Cb 0.52 0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.76 2apq n THR 36 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2apq h LYS 37 N 0.00 -0.73 0.00 -0.78 6.56 -1.91 -3.37 116.57 116.34 2apq h LYS 37 Ca 0.00 0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.64 2apq h LYS 37 Cb 1.15 0.17 0.00 0.00 -0.57 0.00 0.00 32.23 32.98 2apq h LYS 37 CO 0.00 -0.49 -1.20 -0.25 -2.06 0.00 0.00 179.45 175.45 2apq n ASP 38 N -4.51 1.19 -3.67 0.86 8.00 -1.26 -5.02 116.55 112.15 2apq n ASP 38 Ca -0.09 -0.39 -0.10 0.00 0.71 0.00 0.00 54.79 54.92 2apq n ASP 38 Cb 0.30 1.36 -0.03 0.00 -0.02 0.00 0.00 41.12 42.73 2apq n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2apq s ARG 39 N -2.70 1.46 -0.36 -1.24 3.03 -1.26 -5.07 118.95 112.80 2apq s ARG 39 Ca -0.00 -0.77 -0.27 0.00 2.03 0.00 0.00 55.73 56.72 2apq s ARG 39 Cb 0.10 0.57 0.02 0.00 -1.03 0.00 0.00 34.95 34.60 2apq s ARG 39 CO 0.60 -0.64 0.97 0.00 -1.13 0.00 0.00 175.30 175.09 2apq s LYS 41 N 3.56 4.15 0.16 0.00 2.20 -0.81 -4.90 119.74 124.10 2apq s LYS 41 Ca 0.40 2.56 -0.12 0.00 -0.36 0.00 0.00 55.97 58.45 2apq s LYS 41 Cb -0.12 -3.89 0.03 0.00 -1.51 0.00 0.00 37.83 32.35 2apq s LYS 41 CO 0.19 -0.89 1.62 -1.35 -0.36 0.00 0.00 175.35 174.56 2apq h PRO 42 N 9.58 0.92 -3.73 4.03 0.11 -1.95 -3.43 132.00 137.53 2apq h PRO 42 Ca -0.47 -0.28 -0.28 0.00 0.11 0.00 0.00 66.00 65.08 2apq h PRO 42 Cb 1.22 -0.09 -0.31 0.00 0.11 0.00 0.00 31.00 31.93 2apq h PRO 42 CO 0.94 0.92 -0.73 0.08 -0.21 0.00 0.00 178.00 179.00 2apq s VAL 43 N -5.07 0.06 -0.18 3.15 1.01 -1.26 -0.49 120.40 117.63 2apq s VAL 43 Ca -0.12 0.06 -0.26 0.00 0.00 0.00 0.00 61.98 61.66 2apq s VAL 43 Cb 0.12 -0.12 0.07 0.00 0.00 0.00 0.00 36.38 36.45 2apq s VAL 43 CO 0.83 0.07 0.67 0.21 0.00 0.00 0.00 175.10 176.88 2apq s ASN 44 N 0.51 -0.68 -0.08 3.32 2.47 -0.40 -5.02 114.94 115.06 2apq s ASN 44 Ca -0.05 1.12 0.04 0.00 0.42 0.00 0.00 52.86 54.39 2apq s ASN 44 Cb -0.07 1.08 -0.01 0.00 -1.45 0.00 0.00 41.25 40.80 2apq s ASN 44 CO -0.01 -0.37 -0.21 -0.89 -3.72 0.00 0.00 177.10 171.90 2apq s THR 45 N -0.20 2.40 -0.10 -5.21 2.01 -1.26 0.08 115.64 113.35 2apq s THR 45 Ca -0.04 -0.92 -0.04 0.00 0.31 0.00 0.00 61.69 61.00 2apq s THR 45 Cb -0.03 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.52 2apq s THR 45 CO 0.04 0.56 0.04 -0.36 -0.69 0.00 0.00 174.62 174.21 2apq s PHE 46 N 0.02 3.28 -0.22 4.92 0.08 -0.13 -4.33 117.98 121.61 2apq s PHE 46 Ca -0.08 0.27 -0.04 0.00 0.12 0.00 0.00 56.93 57.20 2apq s PHE 46 Cb -0.15 -1.85 -0.01 0.00 -0.57 0.00 0.00 43.02 40.44 2apq s PHE 46 CO 0.05 0.52 -0.03 0.08 -0.10 0.00 0.00 175.22 175.74 2apq s VAL 47 N -0.82 3.54 -1.28 -0.44 1.01 0.93 -0.75 120.40 122.58 2apq s VAL 47 Ca 0.13 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.60 2apq s VAL 47 Cb -0.12 -2.61 0.16 0.00 0.00 0.00 0.00 36.38 33.81 2apq s VAL 47 CO 0.03 0.42 2.07 1.41 0.00 0.00 0.00 175.10 179.02 2apq n HIS 48 N 4.69 2.74 -4.14 5.22 8.25 0.69 -1.02 115.22 131.66 2apq n HIS 48 Ca -0.18 -2.78 -0.11 0.00 -0.26 0.00 0.00 57.72 54.38 2apq n HIS 48 Cb 0.51 -1.85 -0.08 0.00 1.12 0.00 0.00 29.99 29.68 2apq n HIS 48 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2apq s GLU 49 N -0.49 1.33 0.68 -0.41 0.41 -1.26 -4.43 118.70 114.52 2apq s GLU 49 Ca 0.45 -1.52 -0.16 0.00 -0.41 0.00 0.00 54.97 53.32 2apq s GLU 49 Cb 0.13 0.34 0.01 0.00 -1.78 0.00 0.00 34.13 32.83 2apq s GLU 49 CO -0.03 -0.48 1.21 -1.54 -0.49 0.00 0.00 175.26 173.92 2apq s SER 50 N -3.12 4.59 0.24 -0.19 1.04 -1.26 -3.96 113.70 111.03 2apq s SER 50 Ca 0.34 2.35 -0.05 0.00 0.48 0.00 0.00 55.95 59.07 2apq s SER 50 Cb 0.04 -2.59 0.40 0.00 0.10 0.00 0.00 66.02 63.97 2apq s SER 50 CO 0.12 -2.00 1.77 0.25 0.98 0.00 0.00 173.24 174.36 2apq h LEU 51 N 0.13 0.45 -0.55 2.42 5.85 -1.96 -2.19 115.31 119.45 2apq h LEU 51 Ca -0.49 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.36 2apq h LEU 51 Cb 1.30 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.28 2apq h LEU 51 CO 0.52 0.23 0.27 0.00 -0.34 0.00 0.00 178.44 179.13 2apq h ALA 52 N 1.48 0.72 -0.81 1.25 0.00 -1.99 -0.42 119.26 119.48 2apq h ALA 52 Ca 0.38 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 2apq h ALA 52 Cb 0.47 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2apq h ALA 52 CO -0.31 -0.08 0.46 -0.44 0.00 0.00 0.00 179.25 178.89 2apq h ASP 53 N 0.52 1.00 -0.13 0.00 5.19 -1.77 -1.55 116.42 119.68 2apq h ASP 53 Ca 0.25 -0.08 -0.11 0.00 -0.62 0.00 0.00 57.03 56.47 2apq h ASP 53 Cb 0.18 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 39.44 2apq h ASP 53 CO -0.19 0.79 -0.34 0.58 -3.12 0.00 0.00 179.24 176.97 2apq h VAL 54 N 1.12 1.37 -0.31 -1.35 2.07 -1.02 -3.03 116.25 115.10 2apq h VAL 54 Ca 0.29 -1.63 0.05 0.00 0.82 0.00 0.00 66.70 66.23 2apq h VAL 54 Cb 0.00 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 2apq h VAL 54 CO -0.05 0.49 0.22 1.56 0.02 0.00 0.00 177.57 179.80 2apq h GLN 55 N 0.05 0.19 0.00 1.57 4.20 -0.97 -1.92 115.11 118.23 2apq h GLN 55 Ca -0.01 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 2apq h GLN 55 Cb 0.95 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.69 2apq h GLN 55 CO 0.07 0.13 -0.08 0.00 -0.67 0.00 0.00 178.83 178.28 2apq h ALA 56 N 1.83 1.07 -0.22 3.87 0.00 -1.16 -2.51 119.26 122.15 2apq h ALA 56 Ca 0.14 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2apq h ALA 56 Cb 0.31 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2apq h ALA 56 CO -0.02 0.09 0.17 0.28 0.00 0.00 0.00 179.25 179.77 2apq h VAL 57 N 0.00 0.83 0.00 0.00 2.07 -1.34 -1.52 116.25 116.29 2apq h VAL 57 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2apq h VAL 57 Cb 0.44 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 2apq h VAL 57 CO 0.01 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.60 2apq n SER 59 N -1.86 3.09 0.00 0.00 3.41 -0.57 -4.99 113.62 112.71 2apq n SER 59 Ca 0.00 -3.10 0.00 0.00 -0.26 0.00 0.00 58.87 55.51 2apq n SER 59 Cb 0.07 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 2apq n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2apq n GLN 60 N -0.97 0.47 -2.79 4.33 6.02 -0.16 -5.02 117.38 119.26 2apq n GLN 60 Ca 0.19 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.76 2apq n GLN 60 Cb 0.78 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 32.01 2apq n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2apq s LYS 61 N 4.16 3.93 -0.01 -1.09 2.47 -1.02 -4.90 119.74 123.29 2apq s LYS 61 Ca 0.00 0.72 -0.30 0.00 -1.56 0.00 0.00 55.97 54.83 2apq s LYS 61 Cb 0.00 -3.77 -0.05 0.00 -1.46 0.00 0.00 37.83 32.56 2apq s LYS 61 CO 0.00 -0.88 1.26 1.21 0.16 0.00 0.00 175.35 177.10 2apq s ASN 62 N 1.76 7.00 0.14 1.43 3.04 -1.26 -0.23 114.94 126.81 2apq s ASN 62 Ca 0.39 1.96 0.00 0.00 0.04 0.00 0.00 52.86 55.26 2apq s ASN 62 Cb -0.12 -2.56 -0.04 0.00 -1.54 0.00 0.00 41.25 36.98 2apq s ASN 62 CO 0.16 -0.59 0.02 0.68 -3.04 0.00 0.00 177.10 174.33 2apq s VAL 63 N 1.94 0.39 0.41 -5.21 -7.23 0.24 -4.92 120.40 106.02 2apq s VAL 63 Ca 0.59 -1.94 -0.25 0.00 -1.81 0.00 0.00 61.98 58.58 2apq s VAL 63 Cb -0.28 -2.03 -0.08 0.00 0.56 0.00 0.00 36.38 34.54 2apq s VAL 63 CO 0.25 -0.52 1.17 0.00 -0.31 0.00 0.00 175.10 175.69 2apq s ALA 64 N -3.85 3.13 0.68 1.32 0.00 -1.26 -3.09 121.76 118.70 2apq s ALA 64 Ca 0.22 0.96 -0.11 0.00 0.00 0.00 0.00 51.96 53.04 2apq s ALA 64 Cb 0.07 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.80 2apq s ALA 64 CO 0.02 -0.54 1.07 0.00 0.00 0.00 0.00 175.76 176.30 2apq h LYS 66 N -0.57 0.82 -0.02 0.00 1.63 -1.93 -0.85 116.57 115.66 2apq h LYS 66 Ca -0.45 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 2apq h LYS 66 Cb 1.23 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 32.67 2apq h LYS 66 CO 0.62 0.55 0.00 0.27 -3.45 0.00 0.00 179.45 177.44 2apq n ASN 67 N -4.71 0.16 0.00 4.20 0.23 -1.26 -4.89 115.26 108.98 2apq n ASN 67 Ca 0.21 -1.54 0.00 0.00 -0.53 0.00 0.00 54.58 52.73 2apq n ASN 67 Cb 0.48 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.17 2apq n ASN 67 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2apq n GLY 68 N 0.78 1.37 3.72 4.83 0.00 -0.32 -5.05 105.19 110.51 2apq n GLY 68 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 2apq n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2apq s GLN 69 N -0.49 1.84 -0.02 1.61 -0.21 -1.26 -4.74 119.66 116.39 2apq s GLN 69 Ca 0.00 1.49 0.14 0.00 0.02 0.00 0.00 55.36 57.01 2apq s GLN 69 Cb 0.00 -1.82 0.42 0.00 1.00 0.00 0.00 33.01 32.60 2apq s GLN 69 CO 0.00 -2.01 1.35 0.25 -2.12 0.00 0.00 175.29 172.76 2apq n THR 70 N -3.44 1.16 -1.14 -0.19 -2.24 -1.26 -0.30 114.28 106.86 2apq n THR 70 Ca 0.11 -1.09 -0.13 0.00 -2.27 0.00 0.00 64.05 60.67 2apq n THR 70 Cb 0.52 0.41 0.25 0.00 -2.10 0.00 0.00 70.33 69.41 2apq n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2apq n ASN 71 N 0.69 4.27 -4.91 3.42 6.94 -1.26 -4.73 115.26 119.68 2apq n ASN 71 Ca 0.16 -3.41 -0.30 0.00 -0.02 0.00 0.00 54.58 51.01 2apq n ASN 71 Cb 0.53 -0.78 -0.04 0.00 -2.36 0.00 0.00 39.78 37.13 2apq n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2apq s TYR 73 N -1.74 0.49 -0.16 0.00 1.51 0.42 -0.59 117.35 117.28 2apq s TYR 73 Ca 0.40 -0.09 -0.06 0.00 -1.01 0.00 0.00 57.07 56.30 2apq s TYR 73 Cb -0.12 -0.41 -0.04 0.00 -0.11 0.00 0.00 41.96 41.28 2apq s TYR 73 CO 0.27 -0.08 0.05 -1.14 -1.11 0.00 0.00 175.55 173.54 2apq s GLN 74 N 0.42 3.78 0.28 -0.62 0.74 0.68 -1.24 119.66 123.70 2apq s GLN 74 Ca -0.05 -0.34 -0.30 0.00 0.05 0.00 0.00 55.36 54.72 2apq s GLN 74 Cb -0.08 -3.14 -0.11 0.00 1.10 0.00 0.00 33.01 30.79 2apq s GLN 74 CO -0.00 0.38 1.51 -1.54 -0.55 0.00 0.00 175.29 175.08 2apq s SER 75 N 0.06 6.52 0.35 6.67 1.04 -0.15 -2.43 113.70 125.75 2apq s SER 75 Ca 0.05 2.81 0.02 0.00 0.48 0.00 0.00 55.95 59.31 2apq s SER 75 Cb -0.12 -2.63 0.62 0.00 0.10 0.00 0.00 66.02 63.99 2apq s SER 75 CO 0.01 -0.80 2.00 1.88 0.98 0.00 0.00 173.24 177.31 2apq h TYR 76 N 4.78 0.79 -2.32 5.02 0.05 -1.95 -3.43 116.97 119.91 2apq h TYR 76 Ca -0.47 0.01 -0.51 0.00 0.05 0.00 0.00 58.73 57.82 2apq h TYR 76 Cb 1.22 -0.26 -0.04 0.00 1.01 0.00 0.00 36.73 38.66 2apq h TYR 76 CO 0.59 0.51 -0.50 -1.12 -1.05 0.00 0.00 178.16 176.60 2apq s SER 77 N -6.49 5.87 0.56 3.88 0.01 -1.26 -5.07 113.70 111.20 2apq s SER 77 Ca -0.10 -0.08 -0.18 0.00 1.31 0.00 0.00 55.95 56.90 2apq s SER 77 Cb 0.17 -1.62 -0.05 0.00 0.21 0.00 0.00 66.02 64.74 2apq s SER 77 CO 0.77 -0.02 1.10 0.42 0.41 0.00 0.00 173.24 175.92 2apq s THR 78 N -1.98 3.36 0.09 1.44 -4.23 -1.26 -4.39 115.64 108.68 2apq s THR 78 Ca 0.33 0.79 0.04 0.00 -1.18 0.00 0.00 61.69 61.67 2apq s THR 78 Cb -0.09 -3.30 -0.03 0.00 1.34 0.00 0.00 72.50 70.42 2apq s THR 78 CO 0.26 -0.24 -0.11 -0.04 -0.54 0.00 0.00 174.62 173.95 2apq s MET 79 N -3.49 0.86 -0.15 3.99 -1.94 0.75 -4.86 119.30 114.45 2apq s MET 79 Ca 0.70 -1.12 -0.29 0.00 -1.71 0.00 0.00 55.69 53.27 2apq s MET 79 Cb -0.21 -0.64 -0.02 0.00 2.01 0.00 0.00 34.83 35.97 2apq s MET 79 CO 0.29 0.11 1.27 0.45 -0.01 0.00 0.00 175.02 177.13 2apq s SER 80 N -2.28 6.94 0.10 3.03 0.15 -1.26 -1.39 113.70 118.99 2apq s SER 80 Ca 0.04 1.72 0.04 0.00 0.70 0.00 0.00 55.95 58.45 2apq s SER 80 Cb -0.05 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.69 2apq s SER 80 CO 0.01 -0.75 -0.10 0.27 1.20 0.00 0.00 173.24 173.87 2apq s ILE 81 N 3.39 0.94 -0.16 6.45 -4.36 -0.03 -0.22 121.20 127.20 2apq s ILE 81 Ca 0.55 -1.64 0.01 0.00 -0.26 0.00 0.00 60.65 59.31 2apq s ILE 81 Cb -0.22 -1.36 0.02 0.00 1.25 0.00 0.00 42.46 42.15 2apq s ILE 81 CO 0.16 -0.56 -0.17 -0.89 0.24 0.00 0.00 174.94 173.72 2apq s THR 82 N -2.44 1.78 -0.06 8.37 2.01 0.07 -1.34 115.64 124.03 2apq s THR 82 Ca 0.05 -0.77 -0.20 0.00 0.31 0.00 0.00 61.69 61.09 2apq s THR 82 Cb -0.03 -1.63 -0.05 0.00 0.01 0.00 0.00 72.50 70.81 2apq s THR 82 CO -0.00 0.49 0.56 -1.81 -0.69 0.00 0.00 174.62 173.17 2apq s ASP 83 N 1.34 6.86 -0.11 3.53 1.01 0.55 -0.95 116.67 128.90 2apq s ASP 83 Ca 0.03 1.02 0.02 0.00 0.71 0.00 0.00 52.55 54.34 2apq s ASP 83 Cb -0.13 -2.34 -0.01 0.00 1.01 0.00 0.00 42.92 41.45 2apq s ASP 83 CO -0.10 0.04 -0.19 0.00 0.21 0.00 0.00 175.17 175.12 2apq s ARG 85 N 0.29 -0.04 0.24 0.00 3.52 -0.86 -1.28 118.95 120.82 2apq s ARG 85 Ca -0.14 0.25 -0.31 0.00 -0.13 0.00 0.00 55.73 55.40 2apq s ARG 85 Cb -0.17 -0.30 -0.13 0.00 -1.56 0.00 0.00 34.95 32.79 2apq s ARG 85 CO 0.07 -0.21 1.45 -1.91 -0.81 0.00 0.00 175.30 173.89 2apq n GLU 86 N 4.44 2.15 -1.32 5.12 2.13 0.36 -0.61 120.64 132.91 2apq n GLU 86 Ca -0.22 0.77 -0.31 0.00 0.66 0.00 0.00 57.16 58.06 2apq n GLU 86 Cb 0.50 -2.45 0.10 0.00 0.27 0.00 0.00 31.44 29.86 2apq n GLU 86 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2apq s THR 87 N 0.01 3.23 0.47 6.31 -4.23 -0.08 -4.82 115.64 116.52 2apq s THR 87 Ca 0.68 0.40 0.13 0.00 -1.18 0.00 0.00 61.69 61.72 2apq s THR 87 Cb -0.63 -2.95 0.24 0.00 1.34 0.00 0.00 72.50 70.51 2apq s THR 87 CO 0.49 -0.52 2.08 1.23 -0.54 0.00 0.00 174.62 177.36 2apq h GLY 88 N -1.18 0.17 0.36 3.99 0.00 -1.93 -2.98 103.07 101.50 2apq h GLY 88 Ca -0.45 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 46.80 2apq h GLY 88 CO 0.54 0.07 -0.90 -1.14 0.00 0.00 0.00 176.54 175.10 2apq n SER 89 N -4.46 0.77 -4.63 0.19 3.41 -1.26 -4.95 113.62 102.68 2apq n SER 89 Ca -0.01 -0.65 -0.48 0.00 -0.26 0.00 0.00 58.87 57.47 2apq n SER 89 Cb 0.12 0.80 -0.05 0.00 -0.26 0.00 0.00 64.21 64.83 2apq n SER 89 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2apq n SER 90 N -1.59 2.30 -3.71 4.04 2.88 -1.13 -4.99 113.62 111.42 2apq n SER 90 Ca 0.04 1.11 -0.20 0.00 -1.33 0.00 0.00 58.87 58.49 2apq n SER 90 Cb 0.35 -1.32 -0.18 0.00 -0.75 0.00 0.00 64.21 62.32 2apq n SER 90 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2apq s LYS 91 N 0.37 0.08 0.30 -1.46 2.20 -1.18 -4.93 119.74 115.13 2apq s LYS 91 Ca 0.78 0.29 -0.30 0.00 -0.36 0.00 0.00 55.97 56.38 2apq s LYS 91 Cb -0.79 -0.57 -0.11 0.00 -1.51 0.00 0.00 37.83 34.85 2apq s LYS 91 CO 0.45 -0.30 1.58 -0.47 -0.36 0.00 0.00 175.35 176.26 2apq s TYR 92 N 1.95 2.73 -1.42 4.03 5.04 -1.26 -0.06 117.35 128.36 2apq s TYR 92 Ca 0.03 0.82 0.29 0.00 -2.44 0.00 0.00 57.07 55.76 2apq s TYR 92 Cb -0.12 -4.07 1.24 0.00 0.35 0.00 0.00 41.96 39.36 2apq s TYR 92 CO -0.03 -3.54 1.88 -0.35 -1.34 0.00 0.00 175.55 172.17 2apq n PRO 93 N 1.98 0.44 -3.19 4.97 -0.04 -1.26 -5.00 135.00 132.90 2apq n PRO 93 Ca 0.07 -0.11 -0.45 0.00 -0.04 0.00 0.00 63.50 62.98 2apq n PRO 93 Cb 0.38 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.34 2apq n PRO 93 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2apq s ASN 94 N -2.64 7.23 0.16 3.54 -0.87 0.91 -5.02 114.94 118.27 2apq s ASN 94 Ca 0.25 -3.38 -0.30 0.00 -1.57 0.00 0.00 52.86 47.86 2apq s ASN 94 Cb 0.20 -2.28 -0.07 0.00 -0.02 0.00 0.00 41.25 39.07 2apq s ASN 94 CO 0.50 -0.46 0.97 0.00 -2.57 0.00 0.00 177.10 175.54 2apq s ALA 96 N -0.42 0.68 0.03 0.00 0.00 -1.26 -4.97 121.76 115.83 2apq s ALA 96 Ca 0.45 -0.31 0.04 0.00 0.00 0.00 0.00 51.96 52.14 2apq s ALA 96 Cb -0.25 -0.20 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 2apq s ALA 96 CO 0.31 0.15 -0.12 0.71 0.00 0.00 0.00 175.76 176.81 2apq s TYR 97 N -0.05 1.01 -0.00 0.00 2.02 -1.26 -0.90 117.35 118.15 2apq s TYR 97 Ca 0.01 -0.34 -0.21 0.00 -0.37 0.00 0.00 57.07 56.16 2apq s TYR 97 Cb -0.05 -0.60 -0.05 0.00 -0.40 0.00 0.00 41.96 40.86 2apq s TYR 97 CO -0.00 0.00 0.60 0.21 -1.57 0.00 0.00 175.55 174.80 2apq s LYS 98 N -1.07 4.32 -0.19 -0.62 2.36 0.22 -4.64 119.74 120.12 2apq s LYS 98 Ca -0.01 0.75 -0.07 0.00 -2.55 0.00 0.00 55.97 54.10 2apq s LYS 98 Cb -0.07 -3.34 -0.03 0.00 -1.05 0.00 0.00 37.83 33.33 2apq s LYS 98 CO 0.01 0.37 0.04 0.99 1.55 0.00 0.00 175.35 178.31 2apq s THR 99 N -0.19 4.46 -0.11 3.43 2.01 -1.26 -2.03 115.64 121.94 2apq s THR 99 Ca 0.31 -0.14 0.01 0.00 0.31 0.00 0.00 61.69 62.18 2apq s THR 99 Cb -0.18 -3.02 0.02 0.00 0.01 0.00 0.00 72.50 69.33 2apq s THR 99 CO 0.17 0.43 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.53 2apq s THR 100 N 0.71 1.30 -0.16 -0.82 2.01 -0.45 -4.96 115.64 113.27 2apq s THR 100 Ca 0.02 -0.50 -0.08 0.00 0.31 0.00 0.00 61.69 61.44 2apq s THR 100 Cb -0.14 -1.23 -0.04 0.00 0.01 0.00 0.00 72.50 71.10 2apq s THR 100 CO 0.02 0.41 0.10 -1.58 -0.69 0.00 0.00 174.62 172.88 2apq s GLN 101 N 1.25 3.78 0.27 4.92 2.00 -1.26 -0.33 119.66 130.29 2apq s GLN 101 Ca -0.02 -0.24 -0.19 0.00 -2.00 0.00 0.00 55.36 52.91 2apq s GLN 101 Cb -0.14 -3.23 0.01 0.00 0.80 0.00 0.00 33.01 30.45 2apq s GLN 101 CO -0.05 0.48 0.67 0.00 -0.50 0.00 0.00 175.29 175.90 2apq s ALA 102 N -0.20 -1.00 -0.31 1.58 0.00 -0.45 -5.02 121.76 116.37 2apq s ALA 102 Ca 0.09 -0.44 -0.04 0.00 0.00 0.00 0.00 51.96 51.57 2apq s ALA 102 Cb -0.12 0.90 0.04 0.00 0.00 0.00 0.00 23.12 23.94 2apq s ALA 102 CO 0.01 -1.00 0.04 -0.80 0.00 0.00 0.00 175.76 174.01 2apq s ASN 103 N -2.94 5.00 0.06 0.00 0.02 -1.26 -0.86 114.94 114.95 2apq s ASN 103 Ca 0.14 -1.08 -0.03 0.00 -1.02 0.00 0.00 52.86 50.87 2apq s ASN 103 Cb -0.05 -1.79 -0.03 0.00 0.02 0.00 0.00 41.25 39.40 2apq s ASN 103 CO 0.08 -0.25 0.02 -0.54 0.02 0.00 0.00 177.10 176.42 2apq s LYS 104 N 1.36 0.65 0.44 -0.60 1.02 -0.48 -4.80 119.74 117.32 2apq s LYS 104 Ca -0.02 -1.14 -0.22 0.00 0.02 0.00 0.00 55.97 54.61 2apq s LYS 104 Cb -0.19 0.23 -0.08 0.00 -0.52 0.00 0.00 37.83 37.27 2apq s LYS 104 CO 0.00 -0.14 1.06 -1.01 -0.92 0.00 0.00 175.35 174.35 2apq s HIS 105 N -3.81 3.09 0.17 3.18 3.76 -0.19 -0.18 115.29 121.32 2apq s HIS 105 Ca 0.06 1.60 0.07 0.00 -0.15 0.00 0.00 55.06 56.64 2apq s HIS 105 Cb 0.07 -3.14 -0.04 0.00 1.11 0.00 0.00 32.58 30.57 2apq s HIS 105 CO -0.10 -0.85 0.03 0.96 -0.85 0.00 0.00 174.74 173.93 2apq s ILE 106 N -1.77 3.89 -0.11 0.60 -4.36 -1.26 -0.31 121.20 117.88 2apq s ILE 106 Ca 0.63 -1.34 0.00 0.00 -0.26 0.00 0.00 60.65 59.68 2apq s ILE 106 Cb -0.21 -2.96 0.02 0.00 1.25 0.00 0.00 42.46 40.56 2apq s ILE 106 CO 0.26 -0.11 -0.10 -0.63 0.24 0.00 0.00 174.94 174.60 2apq s ILE 107 N -1.73 1.15 0.10 8.37 1.01 0.34 -0.98 121.20 129.46 2apq s ILE 107 Ca 0.28 -0.39 0.09 0.00 0.00 0.00 0.00 60.65 60.63 2apq s ILE 107 Cb -0.09 -1.13 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 2apq s ILE 107 CO 0.20 0.38 -0.22 0.68 0.00 0.00 0.00 174.94 175.98 2apq s VAL 108 N 1.49 1.82 0.06 2.92 -7.23 -0.37 -0.59 120.40 118.50 2apq s VAL 108 Ca 0.02 -1.52 -0.22 0.00 -1.81 0.00 0.00 61.98 58.44 2apq s VAL 108 Cb -0.13 -1.63 -0.06 0.00 0.56 0.00 0.00 36.38 35.11 2apq s VAL 108 CO -0.07 0.02 0.65 0.00 -0.31 0.00 0.00 175.10 175.40 2apq s ALA 109 N -1.07 3.49 0.00 1.32 0.00 -0.40 -0.44 121.76 124.66 2apq s ALA 109 Ca 0.08 0.14 0.07 0.00 0.00 0.00 0.00 51.96 52.25 2apq s ALA 109 Cb -0.10 -2.80 -0.02 0.00 0.00 0.00 0.00 23.12 20.21 2apq s ALA 109 CO 0.04 0.24 -0.21 0.00 0.00 0.00 0.00 175.76 175.83 2apq s GLU 111 N -0.70 0.84 -0.53 0.00 -1.05 -0.69 -4.89 118.70 111.69 2apq s GLU 111 Ca 0.08 -0.71 -0.31 0.00 -0.15 0.00 0.00 54.97 53.88 2apq s GLU 111 Cb -0.08 0.35 -0.12 0.00 -0.44 0.00 0.00 34.13 33.84 2apq s GLU 111 CO -0.00 -0.27 2.37 0.41 0.95 0.00 0.00 175.26 178.72 2apq n GLY 112 N 0.27 0.20 3.56 -3.83 0.00 -1.26 -1.98 105.19 102.16 2apq n GLY 112 Ca -0.17 0.89 -0.38 0.00 0.00 0.00 0.00 46.02 46.36 2apq n GLY 112 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2apq n TYR 127 N 11.87 1.58 -4.25 1.61 9.36 -1.26 -5.67 117.16 130.40 2apq n TYR 127 Ca 0.45 0.05 -0.14 0.00 3.32 0.00 0.00 57.90 61.58 2apq n TYR 127 Cb 0.29 -2.66 -0.10 0.00 -0.63 0.00 0.00 39.34 36.23 2apq n TYR 127 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 2apq s VAL 128 N 11.16 0.97 0.27 2.97 -7.23 -0.84 -4.85 120.40 122.86 2apq s VAL 128 Ca 0.99 -2.02 -0.30 0.00 -1.81 0.00 0.00 61.98 58.85 2apq s VAL 128 Cb -0.22 -1.95 -0.10 0.00 0.56 0.00 0.00 36.38 34.67 2apq s VAL 128 CO 0.29 -0.65 1.40 -2.84 -0.31 0.00 0.00 175.10 172.99 2apq s PRO 129 N -3.81 4.29 0.00 4.82 0.02 -1.26 -1.70 135.00 137.35 2apq s PRO 129 Ca 0.19 2.28 0.00 0.00 0.02 0.00 0.00 61.00 63.49 2apq s PRO 129 Cb 0.04 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.47 2apq s PRO 129 CO 0.02 -0.36 0.17 1.33 -0.33 0.00 0.00 177.00 177.83 2apq n VAL 130 N 1.86 0.00 -3.64 3.83 0.24 0.12 -4.41 118.33 116.33 2apq n VAL 130 Ca 0.05 -0.33 -0.16 0.00 -2.04 0.00 0.00 64.34 61.86 2apq n VAL 130 Cb 0.41 1.17 -0.07 0.00 -1.47 0.00 0.00 33.84 33.87 2apq n VAL 130 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2apq s ALA 131 N -0.32 -1.29 -0.38 2.33 0.00 -1.13 -4.72 121.76 116.25 2apq s ALA 131 Ca 0.00 0.83 -0.15 0.00 0.00 0.00 0.00 51.96 52.64 2apq s ALA 131 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.16 2apq s ALA 131 CO 0.00 -0.32 0.32 0.12 0.00 0.00 0.00 175.76 175.88 2apq s PHE 134 N -1.27 3.22 -0.09 0.00 2.19 -1.26 -1.28 117.98 119.49 2apq s PHE 134 Ca -0.12 -0.35 -0.19 0.00 0.33 0.00 0.00 56.93 56.59 2apq s PHE 134 Cb -0.03 -2.62 -0.28 0.00 -1.31 0.00 0.00 43.02 38.78 2apq s PHE 134 CO 0.07 -0.51 0.68 0.22 1.83 0.00 0.00 175.22 177.51 2apq h ASP 135 N 8.58 0.37 -4.70 6.13 3.58 -1.19 -3.48 116.42 125.70 2apq h ASP 135 Ca -0.29 -0.88 0.30 0.00 0.42 0.00 0.00 57.03 56.59 2apq h ASP 135 Cb 1.13 -0.12 -0.17 0.00 1.72 0.00 0.00 39.33 41.89 2apq h ASP 135 CO 0.71 1.48 0.88 0.00 -2.88 0.00 0.00 179.24 179.43 2apq s ALA 136 N -2.44 -2.19 0.15 -0.78 0.00 -1.05 -4.97 121.76 110.49 2apq s ALA 136 Ca -0.18 1.42 0.07 0.00 0.00 0.00 0.00 51.96 53.27 2apq s ALA 136 Cb 0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 2apq s ALA 136 CO 0.78 -0.73 -0.05 -1.54 0.00 0.00 0.00 175.76 174.22 2apq s SER 137 N -2.40 4.58 0.00 0.00 1.04 -1.26 -0.51 113.70 115.15 2apq s SER 137 Ca 0.12 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.13 2apq s SER 137 Cb 0.01 -0.92 0.00 0.00 0.10 0.00 0.00 66.02 65.22 2apq s SER 137 CO -0.04 0.12 0.30 0.52 0.98 0.00 0.00 173.24 175.12