#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r5d s GLU 2 N 0.00 0.73 0.52 1.97 2.12 -1.26 -5.14 118.70 117.64 1r5d s GLU 2 Ca 0.00 -0.16 -0.21 0.00 0.36 0.00 0.00 54.97 54.96 1r5d s GLU 2 Cb 0.00 -0.72 -0.06 0.00 0.26 0.00 0.00 34.13 33.61 1r5d s GLU 2 CO 0.00 0.01 1.18 -1.54 -0.54 0.00 0.00 175.26 174.38 1r5d s SER 3 N 0.47 5.74 0.41 -1.70 1.04 -1.26 -4.89 113.70 113.51 1r5d s SER 3 Ca -0.06 2.33 0.07 0.00 0.48 0.00 0.00 55.95 58.78 1r5d s SER 3 Cb -0.10 -2.60 0.86 0.00 0.10 0.00 0.00 66.02 64.28 1r5d s SER 3 CO 0.00 -1.21 2.05 0.00 0.98 0.00 0.00 173.24 175.05 1r5d h ALA 4 N 1.50 1.73 -0.12 5.32 0.00 -2.00 -0.57 119.26 125.10 1r5d h ALA 4 Ca -0.50 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1r5d h ALA 4 Cb 1.27 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1r5d h ALA 4 CO 0.58 0.24 0.05 0.00 0.00 0.00 0.00 179.25 180.11 1r5d h ALA 5 N 1.73 0.16 -0.58 0.00 0.00 -2.00 -1.68 119.26 116.89 1r5d h ALA 5 Ca 0.17 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1r5d h ALA 5 Cb -0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1r5d h ALA 5 CO -0.04 -0.25 0.13 0.00 0.00 0.00 0.00 179.25 179.10 1r5d h ALA 6 N 0.88 1.15 -0.90 0.00 0.00 -1.80 -2.50 119.26 116.09 1r5d h ALA 6 Ca 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1r5d h ALA 6 Cb 0.18 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1r5d h ALA 6 CO -0.00 0.57 0.52 -0.22 0.00 0.00 0.00 179.25 180.12 1r5d h LYS 7 N 0.86 1.24 -0.15 0.00 3.64 -0.91 -0.85 116.57 120.39 1r5d h LYS 7 Ca 0.19 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1r5d h LYS 7 Cb 0.32 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1r5d h LYS 7 CO -0.00 0.89 0.08 0.35 -2.27 0.00 0.00 179.45 178.49 1r5d h PHE 8 N 1.25 0.22 -0.25 1.91 3.04 -0.87 -0.44 116.94 121.80 1r5d h PHE 8 Ca 0.32 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.27 1r5d h PHE 8 Cb -0.01 -0.07 -0.02 0.00 2.56 0.00 0.00 35.95 38.41 1r5d h PHE 8 CO 0.01 0.25 0.13 0.93 -2.02 0.00 0.00 178.31 177.61 1r5d h GLU 9 N 0.13 0.27 -0.94 1.11 5.08 -1.14 0.40 114.58 119.49 1r5d h GLU 9 Ca 0.05 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1r5d h GLU 9 Cb 0.11 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 1r5d h GLU 9 CO -0.01 0.18 0.57 -0.09 -1.00 0.00 0.00 179.01 178.66 1r5d h ARG 10 N 0.28 1.27 0.01 2.33 2.43 -1.03 -1.06 114.38 118.61 1r5d h ARG 10 Ca 0.10 -0.12 -0.26 0.00 -0.81 0.00 0.00 59.98 58.89 1r5d h ARG 10 Cb 0.01 -0.27 -0.04 0.00 -0.42 0.00 0.00 29.97 29.26 1r5d h ARG 10 CO -0.06 0.89 -1.45 1.96 -1.51 0.00 0.00 179.97 179.80 1r5d h GLN 11 N 1.29 0.02 0.00 0.20 4.20 -0.82 -3.42 115.11 116.58 1r5d h GLN 11 Ca 0.34 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.01 1r5d h GLN 11 Cb -0.06 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.74 1r5d h GLN 11 CO -0.06 0.73 0.00 0.72 -0.67 0.00 0.00 178.83 179.54 1r5d n HIS 12 N -3.19 0.00 -4.31 2.96 8.25 0.14 -5.05 115.22 114.02 1r5d n HIS 12 Ca -0.11 -0.06 -0.34 0.00 -0.26 0.00 0.00 57.72 56.95 1r5d n HIS 12 Cb 1.01 -0.01 -0.12 0.00 1.12 0.00 0.00 29.99 32.00 1r5d n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1r5d s MET 13 N -0.12 3.72 -0.43 -0.41 -1.94 -0.40 -4.99 119.30 114.72 1r5d s MET 13 Ca 0.00 -0.49 0.07 0.00 -1.71 0.00 0.00 55.69 53.56 1r5d s MET 13 Cb 0.00 -2.98 0.25 0.00 2.01 0.00 0.00 34.83 34.11 1r5d s MET 13 CO 0.00 0.23 0.67 -3.47 -0.01 0.00 0.00 175.02 172.44 1r5d n ASP 14 N 3.58 -1.05 -4.90 3.03 2.03 -1.26 -4.82 116.55 113.16 1r5d n ASP 14 Ca -0.17 -2.94 -0.29 0.00 0.52 0.00 0.00 54.79 51.91 1r5d n ASP 14 Cb 0.52 0.36 0.02 0.00 -0.72 0.00 0.00 41.12 41.30 1r5d n ASP 14 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1r5d s SER 15 N -1.40 5.88 -1.71 1.67 0.01 -1.26 -4.25 113.70 112.64 1r5d s SER 15 Ca 0.34 1.03 0.00 0.00 1.31 0.00 0.00 55.95 58.63 1r5d s SER 15 Cb 0.20 -2.07 0.00 0.00 0.21 0.00 0.00 66.02 64.35 1r5d s SER 15 CO -0.16 -0.96 0.00 0.61 0.41 0.00 0.00 173.24 173.14 1r5d n GLY 16 N -2.64 0.77 3.46 3.44 0.00 -1.26 -4.96 105.19 104.00 1r5d n GLY 16 Ca 0.04 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.82 1r5d n GLY 16 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1r5d s ASN 17 N -2.53 -0.73 -0.14 1.61 3.84 -1.26 -5.15 114.94 110.58 1r5d s ASN 17 Ca 0.00 1.22 -0.03 0.00 0.21 0.00 0.00 52.86 54.26 1r5d s ASN 17 Cb 0.00 1.18 -0.03 0.00 -0.55 0.00 0.00 41.25 41.85 1r5d s ASN 17 CO 0.00 -0.22 -0.03 -0.94 -2.79 0.00 0.00 177.10 173.12 1r5d s SER 18 N 1.68 4.87 0.34 -4.21 1.04 -1.26 -5.01 113.70 111.14 1r5d s SER 18 Ca -0.09 -0.08 0.05 0.00 0.48 0.00 0.00 55.95 56.32 1r5d s SER 18 Cb -0.07 -1.68 0.70 0.00 0.10 0.00 0.00 66.02 65.07 1r5d s SER 18 CO -0.16 0.22 1.89 -0.65 0.98 0.00 0.00 173.24 175.52 1r5d h PRO 19 N 6.35 0.80 -1.85 4.02 0.11 -2.01 -2.44 132.00 136.97 1r5d h PRO 19 Ca -0.36 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.59 1r5d h PRO 19 Cb 1.19 -0.18 -0.05 0.00 0.11 0.00 0.00 31.00 32.07 1r5d h PRO 19 CO 0.61 0.53 0.13 -1.13 -0.21 0.00 0.00 178.00 177.92 1r5d n SER 20 N -4.53 5.71 -3.97 -2.05 3.41 -1.26 -4.80 113.62 106.13 1r5d n SER 20 Ca 0.15 -2.63 -0.31 0.00 -0.26 0.00 0.00 58.87 55.83 1r5d n SER 20 Cb 0.34 -1.12 -0.15 0.00 -0.26 0.00 0.00 64.21 63.02 1r5d n SER 20 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1r5d s SER 21 N 1.41 4.16 0.55 4.04 0.15 -0.92 -4.98 113.70 118.10 1r5d s SER 21 Ca 0.12 -1.42 0.31 0.00 0.70 0.00 0.00 55.95 55.67 1r5d s SER 21 Cb 0.09 -1.32 1.60 0.00 -1.71 0.00 0.00 66.02 64.68 1r5d s SER 21 CO -0.00 -0.26 2.11 0.28 1.20 0.00 0.00 173.24 176.57 1r5d h SER 22 N 7.86 0.00 0.74 5.45 0.02 -1.89 -2.27 113.55 123.47 1r5d h SER 22 Ca -0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1r5d h SER 22 Cb 1.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.59 1r5d h SER 22 CO 0.44 0.08 0.00 0.28 -1.14 0.00 0.00 176.83 176.49 1r5d h SER 23 N 0.00 0.00 0.83 3.07 0.02 -1.94 -3.24 113.55 112.29 1r5d h SER 23 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1r5d h SER 23 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1r5d h SER 23 CO 0.01 0.00 -0.18 -3.20 -1.14 0.00 0.00 176.83 172.32 1r5d n ASN 24 N -2.32 0.18 -0.29 3.07 5.15 -0.85 -4.38 115.26 115.82 1r5d n ASN 24 Ca 0.02 0.23 -0.10 0.00 -0.60 0.00 0.00 54.58 54.14 1r5d n ASN 24 Cb 0.23 -0.23 -0.08 0.00 -0.53 0.00 0.00 39.78 39.17 1r5d n ASN 24 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1r5d h TYR 25 N 0.00 -1.53 -0.62 1.20 3.20 -1.77 -2.38 116.97 115.07 1r5d h TYR 25 Ca 0.00 0.10 0.09 0.00 3.14 0.00 0.00 58.73 62.06 1r5d h TYR 25 Cb 0.50 0.76 -0.07 0.00 1.54 0.00 0.00 36.73 39.46 1r5d h TYR 25 CO 0.00 -0.33 0.25 0.00 -1.64 0.00 0.00 178.16 176.44 1r5d h ASN 27 N 0.44 0.86 0.03 0.00 2.35 -1.75 0.46 115.58 117.97 1r5d h ASN 27 Ca 0.31 -0.02 -0.24 0.00 -0.55 0.00 0.00 56.30 55.81 1r5d h ASN 27 Cb 0.36 -0.21 0.01 0.00 0.05 0.00 0.00 38.32 38.54 1r5d h ASN 27 CO -0.29 0.61 -0.90 -0.07 -1.65 0.00 0.00 177.43 175.14 1r5d h LEU 28 N 1.01 0.82 -0.08 1.61 3.38 -0.94 -3.05 115.31 118.07 1r5d h LEU 28 Ca 0.29 -0.60 -0.13 0.00 0.09 0.00 0.00 57.88 57.53 1r5d h LEU 28 Cb -0.09 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 40.42 1r5d h LEU 28 CO -0.07 1.39 -0.46 0.24 0.09 0.00 0.00 178.44 179.62 1r5d h MET 29 N 0.41 0.45 -0.70 1.13 2.86 -0.48 0.13 114.93 118.73 1r5d h MET 29 Ca -0.08 -0.38 0.05 0.00 -2.06 0.00 0.00 59.70 57.22 1r5d h MET 29 Cb 1.53 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 33.23 1r5d h MET 29 CO 0.17 1.02 0.46 0.52 1.06 0.00 0.00 176.91 180.14 1r5d h MET 30 N 0.01 0.76 -0.01 1.72 2.86 -0.20 0.14 114.93 120.20 1r5d h MET 30 Ca -0.04 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.53 1r5d h MET 30 Cb 1.12 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.61 1r5d h MET 30 CO 0.10 0.50 -0.12 0.00 1.06 0.00 0.00 176.91 178.45 1r5d n ARG 33 N -4.67 1.19 -3.56 0.00 5.12 0.44 -4.92 116.66 110.25 1r5d n ARG 33 Ca 0.12 -0.28 -0.23 0.00 -1.93 0.00 0.00 57.85 55.53 1r5d n ARG 33 Cb 0.19 -1.08 0.08 0.00 -1.16 0.00 0.00 32.46 30.50 1r5d n ARG 33 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1r5d n LYS 34 N -0.26 -7.73 -0.86 5.56 4.76 -0.76 -4.91 118.16 113.97 1r5d n LYS 34 Ca 0.03 0.81 -0.04 0.00 -2.87 0.00 0.00 58.31 56.24 1r5d n LYS 34 Cb 0.07 -5.80 0.19 0.00 -1.84 0.00 0.00 35.03 27.65 1r5d n LYS 34 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1r5d n MET 35 N -4.85 1.90 -0.36 1.97 2.81 -0.19 -4.37 117.12 114.03 1r5d n MET 35 Ca -0.01 -3.29 0.02 0.00 -1.81 0.00 0.00 57.70 52.61 1r5d n MET 35 Cb 0.57 -1.81 0.03 0.00 -0.71 0.00 0.00 33.22 31.29 1r5d n MET 35 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1r5d n THR 36 N -1.10 0.41 -3.63 2.03 -2.24 -1.25 -2.30 114.28 106.21 1r5d n THR 36 Ca 0.31 -0.49 -0.37 0.00 -2.27 0.00 0.00 64.05 61.24 1r5d n THR 36 Cb 0.95 0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 69.46 1r5d n THR 36 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1r5d s GLN 37 N -0.61 4.02 0.00 -0.78 -0.21 -1.26 -4.32 119.66 116.50 1r5d s GLN 37 Ca 0.07 -0.28 0.00 0.00 0.02 0.00 0.00 55.36 55.16 1r5d s GLN 37 Cb 0.06 -3.59 0.00 0.00 1.00 0.00 0.00 33.01 30.48 1r5d s GLN 37 CO 0.01 -0.04 0.00 0.41 -2.12 0.00 0.00 175.29 173.55 1r5d n GLY 38 N 4.59 2.20 3.55 3.09 0.00 -1.26 -4.88 105.19 112.47 1r5d n GLY 38 Ca -0.14 -0.48 -0.07 0.00 0.00 0.00 0.00 46.02 45.32 1r5d n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1r5d s LYS 39 N 0.00 0.60 -0.13 1.61 0.00 -1.26 -5.08 119.74 115.48 1r5d s LYS 39 Ca 0.00 -0.19 -0.29 0.00 0.00 0.00 0.00 55.97 55.49 1r5d s LYS 39 Cb 0.00 0.28 -0.01 0.00 0.00 0.00 0.00 37.83 38.10 1r5d s LYS 39 CO 0.00 -0.26 1.03 0.00 0.00 0.00 0.00 175.35 176.13 1r5d s LYS 41 N 2.33 4.26 0.16 0.00 2.20 -0.97 -4.91 119.74 122.81 1r5d s LYS 41 Ca 0.48 2.16 -0.16 0.00 -0.36 0.00 0.00 55.97 58.09 1r5d s LYS 41 Cb -0.18 -3.44 0.03 0.00 -1.51 0.00 0.00 37.83 32.73 1r5d s LYS 41 CO 0.15 -0.59 1.81 -1.00 -0.36 0.00 0.00 175.35 175.37 1r5d h PRO 42 N 7.58 0.54 -4.19 4.03 0.13 -1.94 -3.43 132.00 134.72 1r5d h PRO 42 Ca -0.41 -0.03 -0.24 0.00 -0.87 0.00 0.00 66.00 64.45 1r5d h PRO 42 Cb 1.20 -0.12 -0.23 0.00 0.13 0.00 0.00 31.00 31.97 1r5d h PRO 42 CO 0.90 0.36 -0.72 0.08 -0.23 0.00 0.00 178.00 178.39 1r5d s VAL 43 N -6.16 0.29 -0.28 1.56 1.01 -1.26 -1.32 120.40 114.25 1r5d s VAL 43 Ca -0.13 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 60.88 1r5d s VAL 43 Cb 0.11 -0.35 0.09 0.00 0.00 0.00 0.00 36.38 36.23 1r5d s VAL 43 CO 0.73 -0.29 0.85 0.21 0.00 0.00 0.00 175.10 176.60 1r5d s ASN 44 N -1.07 -0.64 -0.04 3.32 2.47 -0.74 -5.03 114.94 113.20 1r5d s ASN 44 Ca -0.09 1.21 0.05 0.00 0.42 0.00 0.00 52.86 54.45 1r5d s ASN 44 Cb -0.07 1.23 -0.02 0.00 -1.45 0.00 0.00 41.25 40.93 1r5d s ASN 44 CO -0.00 -0.21 -0.18 -0.89 -3.72 0.00 0.00 177.10 172.10 1r5d s THR 45 N 0.42 2.77 -0.06 -5.21 2.01 -1.26 -1.27 115.64 113.03 1r5d s THR 45 Ca 0.00 -0.85 0.03 0.00 0.31 0.00 0.00 61.69 61.19 1r5d s THR 45 Cb -0.05 -2.06 -0.02 0.00 0.01 0.00 0.00 72.50 70.38 1r5d s THR 45 CO -0.03 0.58 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.96 1r5d s PHE 46 N -0.70 2.68 -0.15 4.92 0.08 -0.36 -4.96 117.98 119.49 1r5d s PHE 46 Ca 0.11 -0.29 -0.05 0.00 0.12 0.00 0.00 56.93 56.82 1r5d s PHE 46 Cb -0.10 -1.66 -0.04 0.00 -0.57 0.00 0.00 43.02 40.65 1r5d s PHE 46 CO 0.00 0.08 0.04 0.08 -0.10 0.00 0.00 175.22 175.32 1r5d s VAL 47 N -0.51 4.58 -2.05 -0.44 1.01 -1.26 -0.32 120.40 121.42 1r5d s VAL 47 Ca 0.07 -0.12 0.21 0.00 0.00 0.00 0.00 61.98 62.14 1r5d s VAL 47 Cb -0.12 -3.02 0.03 0.00 0.00 0.00 0.00 36.38 33.27 1r5d s VAL 47 CO 0.01 0.51 1.05 1.41 0.00 0.00 0.00 175.10 178.09 1r5d n HIS 48 N 3.07 0.00 -1.48 5.22 -0.00 -0.10 -4.98 115.22 116.95 1r5d n HIS 48 Ca -0.17 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.25 1r5d n HIS 48 Cb 0.53 0.00 0.18 0.00 -0.00 0.00 0.00 29.99 30.70 1r5d n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1r5d s GLU 49 N -2.21 0.27 0.72 -0.41 0.41 -1.26 -5.00 118.70 111.23 1r5d s GLU 49 Ca 0.19 0.02 -0.13 0.00 -0.41 0.00 0.00 54.97 54.63 1r5d s GLU 49 Cb 0.17 -1.76 0.03 0.00 -1.78 0.00 0.00 34.13 30.79 1r5d s GLU 49 CO 0.47 -2.73 1.12 -1.54 -0.49 0.00 0.00 175.26 172.09 1r5d s SER 50 N -4.18 4.61 0.33 -0.19 1.04 -1.26 -4.90 113.70 109.16 1r5d s SER 50 Ca 0.69 2.03 0.05 0.00 0.48 0.00 0.00 55.95 59.20 1r5d s SER 50 Cb -0.11 -2.55 0.59 0.00 0.10 0.00 0.00 66.02 64.05 1r5d s SER 50 CO 0.54 -1.97 1.83 0.25 0.98 0.00 0.00 173.24 174.88 1r5d h LEU 51 N -0.49 0.39 -0.31 2.42 5.85 -1.98 -2.14 115.31 119.05 1r5d h LEU 51 Ca -0.46 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.14 1r5d h LEU 51 Cb 1.25 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 1r5d h LEU 51 CO 0.52 0.56 0.10 0.00 -0.34 0.00 0.00 178.44 179.28 1r5d h ALA 52 N 1.48 0.41 -0.44 1.25 0.00 -1.99 -0.56 119.26 119.41 1r5d h ALA 52 Ca 0.07 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1r5d h ALA 52 Cb 0.48 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1r5d h ALA 52 CO 0.03 0.05 0.12 -0.44 0.00 0.00 0.00 179.25 179.01 1r5d h ASP 53 N 0.35 0.59 0.33 0.00 5.19 -1.85 -2.03 116.42 119.00 1r5d h ASP 53 Ca 0.10 -0.09 -0.25 0.00 -0.62 0.00 0.00 57.03 56.17 1r5d h ASP 53 Cb 0.25 -0.15 0.01 0.00 0.18 0.00 0.00 39.33 39.61 1r5d h ASP 53 CO -0.00 0.58 -1.08 0.58 -3.12 0.00 0.00 179.24 176.21 1r5d h VAL 54 N 0.63 1.39 0.00 -1.35 2.07 -1.17 -3.19 116.25 114.62 1r5d h VAL 54 Ca 0.15 -2.56 -0.06 0.00 0.82 0.00 0.00 66.70 65.05 1r5d h VAL 54 Cb 0.22 2.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1r5d h VAL 54 CO -0.01 0.77 -0.29 0.11 0.02 0.00 0.00 177.57 178.17 1r5d h LYS 55 N 0.22 0.00 0.00 1.57 1.57 -0.92 -2.14 116.57 116.87 1r5d h LYS 55 Ca -0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1r5d h LYS 55 Cb 1.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.05 1r5d h LYS 55 CO 0.19 0.29 0.00 0.00 -0.57 0.00 0.00 179.45 179.36 1r5d h ALA 56 N 1.71 1.00 0.00 3.86 0.00 -1.36 -2.51 119.26 121.96 1r5d h ALA 56 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1r5d h ALA 56 Cb 0.60 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1r5d h ALA 56 CO 0.04 0.00 -0.14 0.28 0.00 0.00 0.00 179.25 179.43 1r5d h VAL 57 N 0.00 0.80 0.00 0.00 2.07 -1.46 -1.84 116.25 115.81 1r5d h VAL 57 Ca 0.00 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1r5d h VAL 57 Cb 0.34 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1r5d h VAL 57 CO 0.00 0.13 0.00 0.00 0.02 0.00 0.00 177.57 177.72 1r5d n SER 59 N -1.52 2.63 0.00 0.00 3.41 -0.69 -5.01 113.62 112.44 1r5d n SER 59 Ca 0.02 -1.89 0.00 0.00 -0.26 0.00 0.00 58.87 56.74 1r5d n SER 59 Cb 0.10 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1r5d n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r5d n GLN 60 N 0.42 2.47 -2.38 4.33 6.02 -0.57 -5.00 117.38 122.67 1r5d n GLN 60 Ca 0.09 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.65 1r5d n GLN 60 Cb 0.37 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.61 1r5d n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1r5d s LYS 61 N 3.90 3.98 0.02 -1.09 2.20 -1.17 -4.87 119.74 122.71 1r5d s LYS 61 Ca 0.00 1.41 -0.30 0.00 -0.36 0.00 0.00 55.97 56.71 1r5d s LYS 61 Cb 0.00 -3.87 -0.06 0.00 -1.51 0.00 0.00 37.83 32.39 1r5d s LYS 61 CO 0.00 -1.04 1.34 0.21 -0.36 0.00 0.00 175.35 175.50 1r5d s LYS 62 N 4.07 4.32 0.25 4.03 2.36 -1.26 0.12 119.74 133.63 1r5d s LYS 62 Ca 0.58 1.92 -0.00 0.00 -2.55 0.00 0.00 55.97 55.92 1r5d s LYS 62 Cb -0.19 -3.48 -0.03 0.00 -1.05 0.00 0.00 37.83 33.08 1r5d s LYS 62 CO 0.22 -0.49 0.23 0.14 1.55 0.00 0.00 175.35 177.00 1r5d s VAL 63 N 1.94 0.00 -0.04 4.02 -7.23 0.15 -4.89 120.40 114.34 1r5d s VAL 63 Ca 0.62 -1.91 -0.17 0.00 -1.81 0.00 0.00 61.98 58.71 1r5d s VAL 63 Cb -0.31 -2.48 -0.05 0.00 0.56 0.00 0.00 36.38 34.10 1r5d s VAL 63 CO 0.27 0.00 0.46 -0.89 -0.31 0.00 0.00 175.10 174.63 1r5d s THR 64 N -3.90 5.06 0.95 5.32 2.01 -1.26 -3.44 115.64 120.37 1r5d s THR 64 Ca 0.37 0.94 -0.11 0.00 0.31 0.00 0.00 61.69 63.20 1r5d s THR 64 Cb 0.05 -3.78 0.16 0.00 0.01 0.00 0.00 72.50 68.93 1r5d s THR 64 CO 0.16 0.46 1.10 0.00 -0.69 0.00 0.00 174.62 175.65 1r5d h LYS 66 N -1.87 0.00 -0.65 0.00 1.57 -1.91 -2.48 116.57 111.24 1r5d h LYS 66 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1r5d h LYS 66 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 1r5d h LYS 66 CO 0.48 0.10 0.00 0.27 -0.57 0.00 0.00 179.45 179.72 1r5d n ASN 67 N -3.37 4.25 0.00 0.86 0.23 -1.26 -4.92 115.26 111.05 1r5d n ASN 67 Ca -0.01 -2.52 0.00 0.00 -0.53 0.00 0.00 54.58 51.52 1r5d n ASN 67 Cb 0.28 -0.57 0.00 0.00 -2.08 0.00 0.00 39.78 37.40 1r5d n ASN 67 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1r5d n GLY 68 N 0.75 2.83 3.66 4.83 0.00 -0.93 -5.03 105.19 111.29 1r5d n GLY 68 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 1r5d n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1r5d s GLN 69 N -0.14 0.79 -0.14 1.61 -0.21 -1.26 -4.75 119.66 115.56 1r5d s GLN 69 Ca 0.00 1.08 0.17 0.00 0.02 0.00 0.00 55.36 56.63 1r5d s GLN 69 Cb 0.00 -1.74 0.40 0.00 1.00 0.00 0.00 33.01 32.67 1r5d s GLN 69 CO 0.00 -2.63 1.29 0.25 -2.12 0.00 0.00 175.29 172.07 1r5d n THR 70 N -4.19 2.02 -1.07 -0.19 -2.24 -1.26 -1.55 114.28 105.80 1r5d n THR 70 Ca 0.08 -1.97 -0.13 0.00 -2.27 0.00 0.00 64.05 59.76 1r5d n THR 70 Cb 0.54 -0.19 0.25 0.00 -2.10 0.00 0.00 70.33 68.84 1r5d n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1r5d n ASN 71 N -0.85 4.41 -4.86 3.42 6.94 -1.26 -4.87 115.26 118.19 1r5d n ASN 71 Ca 0.18 -3.35 -0.36 0.00 -0.02 0.00 0.00 54.58 51.03 1r5d n ASN 71 Cb 0.74 -0.78 -0.06 0.00 -2.36 0.00 0.00 39.78 37.32 1r5d n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1r5d s TYR 73 N -1.20 1.34 -0.13 0.00 1.51 -0.09 0.29 117.35 119.07 1r5d s TYR 73 Ca 0.26 -0.27 -0.02 0.00 -1.01 0.00 0.00 57.07 56.03 1r5d s TYR 73 Cb -0.14 -0.85 -0.03 0.00 -0.11 0.00 0.00 41.96 40.82 1r5d s TYR 73 CO 0.14 -0.01 -0.05 -1.14 -1.11 0.00 0.00 175.55 173.38 1r5d s GLN 74 N -0.45 3.43 0.50 -0.62 0.74 0.33 -1.54 119.66 122.05 1r5d s GLN 74 Ca 0.05 -0.53 -0.22 0.00 0.05 0.00 0.00 55.36 54.71 1r5d s GLN 74 Cb -0.06 -2.83 -0.06 0.00 1.10 0.00 0.00 33.01 31.16 1r5d s GLN 74 CO -0.00 0.35 1.27 -1.54 -0.55 0.00 0.00 175.29 174.83 1r5d s SER 75 N 0.05 5.70 0.12 6.67 1.04 -0.16 -3.04 113.70 124.08 1r5d s SER 75 Ca -0.00 2.57 -0.02 0.00 0.48 0.00 0.00 55.95 58.97 1r5d s SER 75 Cb -0.13 -2.62 -0.12 0.00 0.10 0.00 0.00 66.02 63.24 1r5d s SER 75 CO 0.03 -1.26 1.28 0.07 0.98 0.00 0.00 173.24 174.34 1r5d h LYS 76 N 1.77 0.30 -6.20 4.02 5.09 -1.96 -3.43 116.57 116.15 1r5d h LYS 76 Ca -0.50 -0.37 -0.50 0.00 0.09 0.00 0.00 60.65 59.37 1r5d h LYS 76 Cb 1.27 0.12 -0.05 0.00 0.10 0.00 0.00 32.23 33.67 1r5d h LYS 76 CO 0.59 1.09 -0.52 -1.12 -2.09 0.00 0.00 179.45 177.39 1r5d s SER 77 N -7.04 5.50 0.53 7.07 0.01 -1.26 -5.05 113.70 113.45 1r5d s SER 77 Ca -0.04 -0.27 -0.18 0.00 1.31 0.00 0.00 55.95 56.77 1r5d s SER 77 Cb 0.09 -1.37 -0.06 0.00 0.21 0.00 0.00 66.02 64.88 1r5d s SER 77 CO 0.86 -0.05 1.04 0.42 0.41 0.00 0.00 173.24 175.92 1r5d s THR 78 N -2.15 3.87 0.23 1.44 -4.23 -1.26 -4.47 115.64 109.07 1r5d s THR 78 Ca 0.33 1.02 0.08 0.00 -1.18 0.00 0.00 61.69 61.95 1r5d s THR 78 Cb -0.08 -3.45 -0.05 0.00 1.34 0.00 0.00 72.50 70.27 1r5d s THR 78 CO 0.25 -0.39 -0.14 -0.04 -0.54 0.00 0.00 174.62 173.77 1r5d s MET 79 N -3.64 1.42 -0.36 3.99 -1.94 -0.18 -4.88 119.30 113.71 1r5d s MET 79 Ca 0.65 -1.65 -0.24 0.00 -1.71 0.00 0.00 55.69 52.74 1r5d s MET 79 Cb -0.16 -1.22 0.01 0.00 2.01 0.00 0.00 34.83 35.47 1r5d s MET 79 CO 0.28 0.18 0.82 1.03 -0.01 0.00 0.00 175.02 177.32 1r5d s ARG 80 N -3.64 3.78 0.18 2.03 0.52 -1.26 -2.59 118.95 117.97 1r5d s ARG 80 Ca 0.25 0.39 0.02 0.00 -0.52 0.00 0.00 55.73 55.87 1r5d s ARG 80 Cb -0.01 -3.81 -0.05 0.00 0.52 0.00 0.00 34.95 31.61 1r5d s ARG 80 CO 0.09 -0.87 -0.01 0.96 0.02 0.00 0.00 175.30 175.49 1r5d s ILE 81 N 3.19 0.77 -0.12 1.52 -4.36 -1.08 -0.93 121.20 120.20 1r5d s ILE 81 Ca 0.33 -1.99 0.03 0.00 -0.26 0.00 0.00 60.65 58.76 1r5d s ILE 81 Cb -0.13 -2.14 0.00 0.00 1.25 0.00 0.00 42.46 41.45 1r5d s ILE 81 CO 0.17 -0.47 -0.22 -0.89 0.24 0.00 0.00 174.94 173.77 1r5d s THR 82 N -3.59 2.11 -0.25 8.37 2.01 0.57 -1.70 115.64 123.16 1r5d s THR 82 Ca 0.24 -0.98 -0.15 0.00 0.31 0.00 0.00 61.69 61.11 1r5d s THR 82 Cb 0.06 -1.83 -0.04 0.00 0.01 0.00 0.00 72.50 70.70 1r5d s THR 82 CO 0.05 0.55 0.39 -0.62 -0.69 0.00 0.00 174.62 174.29 1r5d s ASP 83 N 0.60 6.31 -0.20 3.53 2.15 0.48 -1.23 116.67 128.31 1r5d s ASP 83 Ca -0.12 0.36 -0.02 0.00 0.43 0.00 0.00 52.55 53.20 1r5d s ASP 83 Cb -0.17 -2.22 -0.00 0.00 -0.30 0.00 0.00 42.92 40.23 1r5d s ASP 83 CO 0.03 -0.16 -0.09 0.00 -0.17 0.00 0.00 175.17 174.78 1r5d s ARG 85 N 1.28 0.96 -0.01 0.00 0.52 -1.08 -1.80 118.95 118.82 1r5d s ARG 85 Ca 0.03 -0.15 -0.35 0.00 -0.52 0.00 0.00 55.73 54.75 1r5d s ARG 85 Cb -0.14 -0.94 -0.13 0.00 0.52 0.00 0.00 34.95 34.26 1r5d s ARG 85 CO -0.04 -0.08 1.74 0.39 0.02 0.00 0.00 175.30 177.33 1r5d n GLU 86 N 4.07 2.05 -1.29 3.54 1.02 -0.43 -0.83 120.64 128.77 1r5d n GLU 86 Ca -0.24 0.75 -0.30 0.00 -0.02 0.00 0.00 57.16 57.35 1r5d n GLU 86 Cb 0.51 -2.54 0.13 0.00 -0.02 0.00 0.00 31.44 29.51 1r5d n GLU 86 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1r5d s THR 87 N 2.80 2.75 0.36 2.62 -4.23 -1.02 -4.88 115.64 114.04 1r5d s THR 87 Ca 0.88 0.24 0.31 0.00 -1.18 0.00 0.00 61.69 61.95 1r5d s THR 87 Cb -0.73 -2.79 0.33 0.00 1.34 0.00 0.00 72.50 70.66 1r5d s THR 87 CO 0.48 -0.32 2.08 1.23 -0.54 0.00 0.00 174.62 177.54 1r5d h GLY 88 N -1.44 0.00 1.95 3.99 0.00 -1.93 -2.01 103.07 103.63 1r5d h GLY 88 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1r5d h GLY 88 CO 0.56 0.00 -0.04 1.76 0.00 0.00 0.00 176.54 178.82 1r5d h SER 89 N 0.00 0.00 -2.60 0.19 0.02 -1.96 -3.47 113.55 105.74 1r5d h SER 89 Ca -0.00 -0.01 -0.59 0.00 -0.84 0.00 0.00 61.79 60.35 1r5d h SER 89 Cb 0.36 0.00 0.08 0.00 0.14 0.00 0.00 62.40 62.98 1r5d h SER 89 CO 0.01 0.01 0.60 -0.24 -1.14 0.00 0.00 176.83 176.07 1r5d n SER 90 N -2.39 2.69 -3.31 3.07 2.88 -0.76 -4.88 113.62 110.91 1r5d n SER 90 Ca 0.05 1.14 -0.07 0.00 -1.33 0.00 0.00 58.87 58.66 1r5d n SER 90 Cb 0.45 -1.41 -0.06 0.00 -0.75 0.00 0.00 64.21 62.43 1r5d n SER 90 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1r5d s LYS 91 N -0.31 0.39 0.35 -1.46 2.36 -0.68 -4.91 119.74 115.47 1r5d s LYS 91 Ca 0.69 0.52 -0.26 0.00 -2.55 0.00 0.00 55.97 54.37 1r5d s LYS 91 Cb -0.67 -0.29 -0.12 0.00 -1.05 0.00 0.00 37.83 35.70 1r5d s LYS 91 CO 0.49 -0.72 1.02 0.98 1.55 0.00 0.00 175.35 178.66 1r5d n TYR 92 N 5.37 1.26 1.08 4.03 9.36 -1.26 0.90 117.16 137.90 1r5d n TYR 92 Ca -0.02 0.63 0.03 0.00 3.32 0.00 0.00 57.90 61.85 1r5d n TYR 92 Cb 0.50 -2.25 0.10 0.00 -0.63 0.00 0.00 39.34 37.06 1r5d n TYR 92 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1r5d n PRO 93 N 0.48 1.66 -3.01 2.98 -0.04 -1.26 -4.94 135.00 130.88 1r5d n PRO 93 Ca 0.09 -0.78 -0.44 0.00 -0.04 0.00 0.00 63.50 62.33 1r5d n PRO 93 Cb 0.35 -1.33 0.01 0.00 -0.04 0.00 0.00 33.50 32.49 1r5d n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1r5d n ASN 94 N 0.12 5.96 -4.69 3.54 5.03 0.26 -5.01 115.26 120.47 1r5d n ASN 94 Ca 0.07 -3.25 -0.42 0.00 0.87 0.00 0.00 54.58 51.85 1r5d n ASN 94 Cb 0.28 -1.34 -0.03 0.00 -1.02 0.00 0.00 39.78 37.67 1r5d n ASN 94 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1r5d s ALA 96 N 2.03 2.83 0.03 0.00 0.00 -1.26 -4.94 121.76 120.45 1r5d s ALA 96 Ca 0.59 -1.18 -0.02 0.00 0.00 0.00 0.00 51.96 51.35 1r5d s ALA 96 Cb -0.28 -0.88 -0.02 0.00 0.00 0.00 0.00 23.12 21.94 1r5d s ALA 96 CO 0.25 0.61 0.01 0.71 0.00 0.00 0.00 175.76 177.34 1r5d s TYR 97 N -1.06 0.30 -0.10 0.00 2.02 -1.26 -2.44 117.35 114.81 1r5d s TYR 97 Ca 0.18 -0.63 -0.03 0.00 -0.37 0.00 0.00 57.07 56.22 1r5d s TYR 97 Cb -0.11 -0.22 -0.03 0.00 -0.40 0.00 0.00 41.96 41.20 1r5d s TYR 97 CO 0.09 -0.28 0.02 0.21 -1.57 0.00 0.00 175.55 174.02 1r5d s LYS 98 N -2.32 3.19 -0.23 -0.62 2.20 -0.01 -4.76 119.74 117.19 1r5d s LYS 98 Ca -0.08 -0.37 -0.09 0.00 -0.36 0.00 0.00 55.97 55.07 1r5d s LYS 98 Cb -0.03 -2.90 -0.04 0.00 -1.51 0.00 0.00 37.83 33.34 1r5d s LYS 98 CO -0.04 0.64 0.12 0.99 -0.36 0.00 0.00 175.35 176.71 1r5d s THR 99 N -0.70 5.00 -0.19 3.43 2.01 -1.26 -2.64 115.64 121.28 1r5d s THR 99 Ca 0.11 0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.16 1r5d s THR 99 Cb -0.12 -3.32 0.05 0.00 0.01 0.00 0.00 72.50 69.13 1r5d s THR 99 CO 0.02 0.36 -0.02 -0.89 -0.69 0.00 0.00 174.62 173.40 1r5d s THR 100 N 1.11 0.98 0.02 -0.82 2.01 -0.66 -4.99 115.64 113.30 1r5d s THR 100 Ca 0.06 -0.76 -0.27 0.00 0.31 0.00 0.00 61.69 61.03 1r5d s THR 100 Cb -0.14 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 71.01 1r5d s THR 100 CO 0.04 -0.07 0.86 -1.10 -0.69 0.00 0.00 174.62 173.66 1r5d s GLN 101 N 1.66 4.55 0.33 4.92 -0.21 -1.26 -0.39 119.66 129.26 1r5d s GLN 101 Ca -0.02 1.22 0.07 0.00 0.02 0.00 0.00 55.36 56.65 1r5d s GLN 101 Cb -0.17 -3.42 -0.03 0.00 1.00 0.00 0.00 33.01 30.39 1r5d s GLN 101 CO -0.07 0.11 0.26 0.14 -2.12 0.00 0.00 175.29 173.61 1r5d s VAL 102 N 0.49 0.05 -0.36 1.09 -7.23 -0.69 -4.97 120.40 108.78 1r5d s VAL 102 Ca 0.44 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.64 1r5d s VAL 102 Cb -0.21 -2.48 0.15 0.00 0.56 0.00 0.00 36.38 34.40 1r5d s VAL 102 CO 0.25 0.00 0.34 -1.61 -0.31 0.00 0.00 175.10 173.77 1r5d s GLU 103 N -3.49 0.59 0.21 4.82 2.02 -1.26 -2.63 118.70 118.96 1r5d s GLU 103 Ca 0.39 -0.89 0.01 0.00 0.02 0.00 0.00 54.97 54.50 1r5d s GLU 103 Cb 0.02 -0.83 -0.05 0.00 0.10 0.00 0.00 34.13 33.38 1r5d s GLU 103 CO 0.26 -1.18 0.06 0.15 0.02 0.00 0.00 175.26 174.57 1r5d s LYS 104 N 1.45 1.22 0.43 1.61 1.02 -1.07 -4.75 119.74 119.65 1r5d s LYS 104 Ca 0.16 -1.63 -0.23 0.00 0.02 0.00 0.00 55.97 54.30 1r5d s LYS 104 Cb -0.17 -0.14 -0.09 0.00 -0.52 0.00 0.00 37.83 36.92 1r5d s LYS 104 CO -0.05 -0.24 1.06 -1.01 -0.92 0.00 0.00 175.35 174.18 1r5d s HIS 105 N -3.81 3.15 0.12 3.18 3.76 -0.99 -1.01 115.29 119.69 1r5d s HIS 105 Ca 0.31 1.61 0.07 0.00 -0.15 0.00 0.00 55.06 56.91 1r5d s HIS 105 Cb 0.07 -3.13 -0.04 0.00 1.11 0.00 0.00 32.58 30.59 1r5d s HIS 105 CO 0.09 -0.77 -0.10 0.96 -0.85 0.00 0.00 174.74 174.07 1r5d s ILE 106 N -1.75 3.32 -0.17 0.60 -4.36 -1.26 -0.62 121.20 116.96 1r5d s ILE 106 Ca 0.61 -1.34 0.01 0.00 -0.26 0.00 0.00 60.65 59.67 1r5d s ILE 106 Cb -0.21 -2.57 0.02 0.00 1.25 0.00 0.00 42.46 40.96 1r5d s ILE 106 CO 0.26 0.08 -0.16 -0.63 0.24 0.00 0.00 174.94 174.72 1r5d s ILE 107 N -1.28 1.83 0.25 8.37 1.01 0.32 -0.99 121.20 130.70 1r5d s ILE 107 Ca 0.22 -0.86 0.11 0.00 0.00 0.00 0.00 60.65 60.12 1r5d s ILE 107 Cb -0.11 -1.71 -0.05 0.00 0.01 0.00 0.00 42.46 40.60 1r5d s ILE 107 CO 0.14 0.45 -0.20 0.68 0.00 0.00 0.00 174.94 176.01 1r5d s VAL 108 N 1.37 2.29 -0.14 2.92 -7.23 -0.59 -0.16 120.40 118.86 1r5d s VAL 108 Ca 0.04 -2.28 -0.09 0.00 -1.81 0.00 0.00 61.98 57.84 1r5d s VAL 108 Cb -0.14 -2.20 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 1r5d s VAL 108 CO -0.11 -0.38 0.16 0.00 -0.31 0.00 0.00 175.10 174.46 1r5d s ALA 109 N -2.41 3.80 -0.04 1.32 0.00 0.87 -0.92 121.76 124.38 1r5d s ALA 109 Ca 0.26 -0.63 0.02 0.00 0.00 0.00 0.00 51.96 51.62 1r5d s ALA 109 Cb -0.05 -2.08 -0.03 0.00 0.00 0.00 0.00 23.12 20.97 1r5d s ALA 109 CO 0.12 0.44 -0.08 0.00 0.00 0.00 0.00 175.76 176.24 1r5d s GLY 111 N -1.03 0.45 0.00 0.00 0.00 -0.66 -4.90 107.32 101.18 1r5d s GLY 111 Ca 0.14 -0.78 0.00 0.00 0.00 0.00 0.00 44.72 44.08 1r5d s GLY 111 CO 0.04 -0.46 0.00 0.61 0.00 0.00 0.00 173.10 173.28 1r5d n GLY 112 N -0.46 -0.90 2.66 0.20 0.00 -1.26 -1.78 105.19 103.65 1r5d n GLY 112 Ca -0.03 -1.68 -0.27 0.00 0.00 0.00 0.00 46.02 44.04 1r5d n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r5d s LYS 113 N -1.31 0.31 0.75 1.61 -0.14 -1.26 -2.89 119.74 116.81 1r5d s LYS 113 Ca 0.00 -0.27 -0.12 0.00 -1.36 0.00 0.00 55.97 54.21 1r5d s LYS 113 Cb 0.00 -1.89 0.05 0.00 -1.68 0.00 0.00 37.83 34.31 1r5d s LYS 113 CO 0.00 -0.70 1.12 -1.25 -0.76 0.00 0.00 175.35 173.76 1r5d s PRO 114 N 2.02 2.23 -0.36 -1.68 0.04 -1.26 -5.09 135.00 130.90 1r5d s PRO 114 Ca 0.02 1.35 -0.29 0.00 0.04 0.00 0.00 61.00 62.12 1r5d s PRO 114 Cb -0.16 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 1r5d s PRO 114 CO -0.11 -1.69 1.61 0.45 0.04 0.00 0.00 177.00 177.30 1r5d s SER 115 N -2.90 6.13 0.27 6.66 0.15 -1.14 -4.90 113.70 117.97 1r5d s SER 115 Ca 0.65 1.11 0.10 0.00 0.70 0.00 0.00 55.95 58.51 1r5d s SER 115 Cb -0.20 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.52 1r5d s SER 115 CO 0.51 -1.55 -0.15 0.68 1.20 0.00 0.00 173.24 173.93 1r5d s VAL 116 N 6.10 2.13 0.15 4.45 -7.23 -0.73 -4.84 120.40 120.43 1r5d s VAL 116 Ca 0.71 -2.28 -0.31 0.00 -1.81 0.00 0.00 61.98 58.28 1r5d s VAL 116 Cb -0.19 -2.32 -0.10 0.00 0.56 0.00 0.00 36.38 34.33 1r5d s VAL 116 CO 0.33 -0.40 1.70 -2.84 -0.31 0.00 0.00 175.10 173.57 1r5d s PRO 117 N -3.59 4.17 0.00 4.82 0.02 -1.26 -1.65 135.00 137.50 1r5d s PRO 117 Ca 0.28 2.48 0.00 0.00 0.02 0.00 0.00 61.00 63.79 1r5d s PRO 117 Cb -0.01 -3.34 0.00 0.00 0.02 0.00 0.00 34.50 31.16 1r5d s PRO 117 CO 0.13 -0.73 0.41 1.33 -0.33 0.00 0.00 177.00 177.80 1r5d n VAL 118 N 4.34 0.12 -3.64 3.83 0.24 0.98 -4.91 118.33 119.29 1r5d n VAL 118 Ca 0.16 -0.37 -0.04 0.00 -2.04 0.00 0.00 64.34 62.05 1r5d n VAL 118 Cb 0.38 1.24 -0.07 0.00 -1.47 0.00 0.00 33.84 33.93 1r5d n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1r5d s HIS 119 N -0.12 -0.66 -0.20 6.34 5.65 -1.19 -4.96 115.29 120.15 1r5d s HIS 119 Ca 0.00 1.34 -0.24 0.00 0.25 0.00 0.00 55.06 56.41 1r5d s HIS 119 Cb 0.00 0.40 -0.01 0.00 -1.18 0.00 0.00 32.58 31.79 1r5d s HIS 119 CO 0.00 -0.33 0.78 0.12 -0.65 0.00 0.00 174.74 174.66 1r5d s PHE 120 N 1.27 3.37 -0.21 3.88 2.19 -1.26 -0.09 117.98 127.12 1r5d s PHE 120 Ca -0.08 1.12 -0.19 0.00 0.33 0.00 0.00 56.93 58.11 1r5d s PHE 120 Cb -0.04 -2.97 -0.16 0.00 -1.31 0.00 0.00 43.02 38.53 1r5d s PHE 120 CO -0.15 -0.28 0.08 -3.47 1.83 0.00 0.00 175.22 173.23 1r5d n ASP 121 N 5.47 1.87 0.00 6.13 2.03 0.77 -4.92 116.55 127.90 1r5d n ASP 121 Ca 0.03 0.43 0.00 0.00 0.52 0.00 0.00 54.79 55.77 1r5d n ASP 121 Cb 0.49 -0.93 0.00 0.00 -0.72 0.00 0.00 41.12 39.95 1r5d n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1r5d n ALA 122 N -3.58 0.00 -2.51 -1.67 0.00 -0.84 -4.91 120.51 107.01 1r5d n ALA 122 Ca -0.33 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 52.84 1r5d n ALA 122 Cb 0.67 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.02 1r5d n ALA 122 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1r5d s SER 123 N 0.00 3.90 0.00 0.00 1.04 -1.26 0.12 113.70 117.50 1r5d s SER 123 Ca 0.00 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.74 1r5d s SER 123 Cb 0.00 -0.52 0.00 0.00 0.10 0.00 0.00 66.02 65.60 1r5d s SER 123 CO 0.00 0.12 0.00 0.55 0.98 0.00 0.00 173.24 174.89