#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wvr n VAL 2 N 0.00 1.24 -0.10 2.41 0.31 -1.26 -3.80 118.33 117.12 1wvr n VAL 2 Ca 0.00 -0.71 -0.12 0.00 -0.01 0.00 0.00 64.34 63.50 1wvr n VAL 2 Cb 0.00 -0.66 -0.04 0.00 -0.91 0.00 0.00 33.84 32.23 1wvr n VAL 2 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1wvr h ASP 3 N 0.00 0.63 0.08 4.52 3.32 -1.98 -0.34 116.42 122.66 1wvr h ASP 3 Ca -0.49 -0.39 0.01 0.00 0.02 0.00 0.00 57.03 56.18 1wvr h ASP 3 Cb 2.05 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 41.40 1wvr h ASP 3 CO 0.01 0.88 -0.15 0.15 -1.72 0.00 0.00 179.24 178.41 1wvr h PHE 4 N 0.37 -0.39 -0.58 4.55 3.57 -1.90 -2.50 116.94 120.06 1wvr h PHE 4 Ca 0.07 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 1wvr h PHE 4 Cb 0.63 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.51 1wvr h PHE 4 CO 0.06 -0.23 0.30 -0.44 -2.23 0.00 0.00 178.31 175.77 1wvr h ASP 5 N -0.29 0.72 0.89 0.41 3.45 -1.63 -1.59 116.42 118.37 1wvr h ASP 5 Ca 0.02 -0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.42 1wvr h ASP 5 Cb 0.31 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 38.90 1wvr h ASP 5 CO -0.09 0.60 0.00 -1.54 -1.57 0.00 0.00 179.24 176.64 1wvr n SER 6 N -4.38 0.54 -0.73 6.45 3.41 -0.14 -2.40 113.62 116.37 1wvr n SER 6 Ca 0.05 0.60 0.08 0.00 -0.26 0.00 0.00 58.87 59.35 1wvr n SER 6 Cb 0.11 -0.73 0.23 0.00 -0.26 0.00 0.00 64.21 63.56 1wvr n SER 6 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1wvr n GLU 7 N -2.07 2.69 -1.96 4.33 4.07 -0.63 -4.97 120.64 122.10 1wvr n GLU 7 Ca 0.04 -2.70 -0.42 0.00 -0.06 0.00 0.00 57.16 54.02 1wvr n GLU 7 Cb 0.28 -1.72 -0.03 0.00 -0.06 0.00 0.00 31.44 29.91 1wvr n GLU 7 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1wvr s SER 8 N -1.95 6.61 0.37 4.31 0.15 -1.00 -4.87 113.70 117.31 1wvr s SER 8 Ca 0.38 2.65 0.27 0.00 0.70 0.00 0.00 55.95 59.95 1wvr s SER 8 Cb 0.30 -2.61 1.29 0.00 -1.71 0.00 0.00 66.02 63.29 1wvr s SER 8 CO 0.09 -0.77 1.81 -0.65 1.20 0.00 0.00 173.24 174.91 1wvr h PRO 9 N 5.93 0.00 0.00 5.44 0.11 -1.91 -1.86 132.00 139.71 1wvr h PRO 9 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1wvr h PRO 9 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1wvr h PRO 9 CO 0.85 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.18 1wvr n ARG 10 N -2.45 0.05 -2.79 1.05 1.74 -1.26 -4.44 116.66 108.56 1wvr n ARG 10 Ca -0.00 0.02 -0.42 0.00 -0.77 0.00 0.00 57.85 56.68 1wvr n ARG 10 Cb 0.14 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 1wvr n ARG 10 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1wvr s LYS 11 N -2.95 4.32 0.28 5.56 1.02 -0.70 -4.94 119.74 122.33 1wvr s LYS 11 Ca 0.15 1.18 0.00 0.00 0.02 0.00 0.00 55.97 57.32 1wvr s LYS 11 Cb 0.18 -3.58 0.65 0.00 -0.52 0.00 0.00 37.83 34.57 1wvr s LYS 11 CO 0.50 -0.39 1.64 -1.35 -0.92 0.00 0.00 175.35 174.82 1wvr h PRO 12 N 7.31 0.16 0.00 -1.68 0.11 -1.89 0.30 132.00 136.31 1wvr h PRO 12 Ca -0.27 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.76 1wvr h PRO 12 Cb 1.12 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1wvr h PRO 12 CO 0.87 0.11 -0.29 0.93 -0.21 0.00 0.00 178.00 179.40 1wvr h GLU 13 N 0.17 0.00 -0.10 1.05 4.39 -1.94 -2.29 114.58 115.85 1wvr h GLU 13 Ca 0.53 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 60.03 1wvr h GLU 13 Cb 1.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 1wvr h GLU 13 CO -0.68 0.29 -0.76 0.82 -1.16 0.00 0.00 179.01 177.52 1wvr h ILE 14 N 0.00 1.35 -0.14 3.13 1.08 -0.72 -2.06 117.51 120.15 1wvr h ILE 14 Ca -0.00 -2.11 -0.01 0.00 -0.39 0.00 0.00 64.86 62.35 1wvr h ILE 14 Cb 0.76 2.09 -0.01 0.00 -3.07 0.00 0.00 36.82 36.60 1wvr h ILE 14 CO 0.04 0.64 0.06 1.56 -0.69 0.00 0.00 178.15 179.76 1wvr h GLN 15 N 0.35 0.21 -0.13 2.37 4.20 -0.95 0.29 115.11 121.45 1wvr h GLN 15 Ca -0.04 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1wvr h GLN 15 Cb 1.35 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.09 1wvr h GLN 15 CO 0.14 0.29 0.09 -0.91 -0.67 0.00 0.00 178.83 177.77 1wvr h ASN 16 N 0.08 0.15 -0.03 1.46 -0.26 -1.39 0.69 115.58 116.28 1wvr h ASN 16 Ca 0.05 -0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.77 1wvr h ASN 16 Cb 0.16 -0.04 -0.00 0.00 -1.06 0.00 0.00 38.32 37.38 1wvr h ASN 16 CO -0.00 0.11 -0.04 -0.08 -1.06 0.00 0.00 177.43 176.35 1wvr h GLU 17 N 0.17 0.08 -0.54 0.81 4.81 -0.73 0.71 114.58 119.89 1wvr h GLU 17 Ca 0.05 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.26 1wvr h GLU 17 Cb -0.01 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 1wvr h GLU 17 CO -0.01 0.58 0.33 0.82 -0.73 0.00 0.00 179.01 180.00 1wvr h ILE 18 N -0.42 1.07 -0.31 2.32 2.04 -0.25 -1.03 117.51 120.94 1wvr h ILE 18 Ca 0.00 -0.23 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 1wvr h ILE 18 Cb 0.57 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 1wvr h ILE 18 CO 0.01 0.12 -0.29 0.40 0.00 0.00 0.00 178.15 178.39 1wvr h ILE 19 N 0.66 1.30 -0.02 -0.67 1.08 -0.90 -2.59 117.51 116.37 1wvr h ILE 19 Ca 0.22 -1.45 -0.10 0.00 -0.39 0.00 0.00 64.86 63.13 1wvr h ILE 19 Cb 0.01 1.53 -0.01 0.00 -3.07 0.00 0.00 36.82 35.28 1wvr h ILE 19 CO -0.09 0.47 -0.47 0.44 -0.69 0.00 0.00 178.15 177.81 1wvr h ASP 20 N 0.50 0.05 0.23 1.72 3.45 -0.72 -1.46 116.42 120.19 1wvr h ASP 20 Ca 0.05 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.48 1wvr h ASP 20 Cb 0.86 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.62 1wvr h ASP 20 CO 0.07 0.52 -0.11 0.25 -1.57 0.00 0.00 179.24 178.40 1wvr h LEU 21 N 0.04 -0.27 -0.71 1.55 6.46 -1.16 0.77 115.31 122.00 1wvr h LEU 21 Ca -0.00 -0.22 0.10 0.00 -0.12 0.00 0.00 57.88 57.64 1wvr h LEU 21 Cb 0.85 0.07 -0.08 0.00 -0.73 0.00 0.00 40.66 40.77 1wvr h LEU 21 CO 0.06 0.11 0.34 0.45 -0.62 0.00 0.00 178.44 178.78 1wvr h HIS 22 N -0.68 0.60 0.00 1.25 3.86 -1.38 -0.52 115.15 118.28 1wvr h HIS 22 Ca -0.03 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.12 1wvr h HIS 22 Cb 0.47 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 1wvr h HIS 22 CO 0.03 0.19 -0.44 -0.91 0.86 0.00 0.00 177.93 177.66 1wvr h ASN 23 N 0.56 0.00 -0.46 2.45 2.35 -1.17 0.25 115.58 119.56 1wvr h ASN 23 Ca 0.36 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.98 1wvr h ASN 23 Cb 0.42 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1wvr h ASN 23 CO -0.30 0.44 -0.20 -1.28 -1.65 0.00 0.00 177.43 174.44 1wvr h SER 24 N 0.00 0.98 -0.16 5.81 0.87 0.42 -2.26 113.55 119.20 1wvr h SER 24 Ca -0.00 -0.40 -0.17 0.00 -1.23 0.00 0.00 61.79 59.99 1wvr h SER 24 Cb 0.79 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.48 1wvr h SER 24 CO 0.06 1.15 -0.52 -0.07 -0.53 0.00 0.00 176.83 176.92 1wvr h LEU 25 N 0.79 0.81 -1.24 2.23 3.38 -0.68 -3.17 115.31 117.44 1wvr h LEU 25 Ca 0.11 -0.42 -0.08 0.00 0.09 0.00 0.00 57.88 57.57 1wvr h LEU 25 Cb 0.78 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1wvr h LEU 25 CO 0.06 1.18 -0.37 0.03 0.09 0.00 0.00 178.44 179.44 1wvr h ARG 26 N 0.57 0.00 -0.02 1.13 3.08 -0.40 -3.01 114.38 115.74 1wvr h ARG 26 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1wvr h ARG 26 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.14 1wvr h ARG 26 CO 0.11 0.37 -0.04 2.89 -1.07 0.00 0.00 179.97 182.23 1wvr n ARG 27 N -3.97 1.64 -0.06 0.04 1.85 -0.86 -3.98 116.66 111.32 1wvr n ARG 27 Ca -0.02 -1.03 0.05 0.00 -1.00 0.00 0.00 57.85 55.85 1wvr n ARG 27 Cb 0.42 -1.48 0.07 0.00 -1.05 0.00 0.00 32.46 30.42 1wvr n ARG 27 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1wvr n SER 28 N 0.22 1.98 -4.40 2.89 3.41 -1.14 -4.97 113.62 111.61 1wvr n SER 28 Ca 0.17 -2.48 -0.30 0.00 -0.26 0.00 0.00 58.87 56.00 1wvr n SER 28 Cb 0.39 -0.22 0.21 0.00 -0.26 0.00 0.00 64.21 64.33 1wvr n SER 28 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1wvr n VAL 29 N -0.91 0.00 -3.66 -3.33 0.24 -1.18 -5.01 118.33 104.48 1wvr n VAL 29 Ca 0.08 -0.35 -0.07 0.00 -2.04 0.00 0.00 64.34 61.95 1wvr n VAL 29 Cb 0.47 -0.82 -0.08 0.00 -1.47 0.00 0.00 33.84 31.93 1wvr n VAL 29 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1wvr s ASN 30 N -2.18 -0.58 1.06 -1.34 2.47 -1.26 -3.92 114.94 109.19 1wvr s ASN 30 Ca 0.63 1.15 -0.12 0.00 0.42 0.00 0.00 52.86 54.94 1wvr s ASN 30 Cb -0.20 1.39 0.20 0.00 -1.45 0.00 0.00 41.25 41.19 1wvr s ASN 30 CO 0.65 -0.22 0.92 -0.81 -3.72 0.00 0.00 177.10 173.92 1wvr n PRO 31 N 4.97 -1.52 -1.61 0.43 -0.04 -1.26 -4.86 135.00 131.12 1wvr n PRO 31 Ca -0.14 -0.40 -0.34 0.00 -0.04 0.00 0.00 63.50 62.58 1wvr n PRO 31 Cb 0.52 -2.17 0.07 0.00 -0.04 0.00 0.00 33.50 31.88 1wvr n PRO 31 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1wvr s THR 32 N -2.47 2.79 -0.06 0.52 -4.23 -1.25 -4.90 115.64 106.03 1wvr s THR 32 Ca 0.66 0.38 0.01 0.00 -1.18 0.00 0.00 61.69 61.55 1wvr s THR 32 Cb -0.23 -2.91 -0.03 0.00 1.34 0.00 0.00 72.50 70.66 1wvr s THR 32 CO 0.63 -0.22 -0.05 0.00 -0.54 0.00 0.00 174.62 174.44 1wvr s ALA 33 N -2.16 3.06 -1.03 3.99 0.00 -1.21 -1.02 121.76 123.39 1wvr s ALA 33 Ca 0.71 -0.89 0.19 0.00 0.00 0.00 0.00 51.96 51.96 1wvr s ALA 33 Cb -0.25 -1.27 -0.17 0.00 0.00 0.00 0.00 23.12 21.43 1wvr s ALA 33 CO 0.43 0.59 0.82 -1.13 0.00 0.00 0.00 175.76 176.46 1wvr n SER 34 N 2.08 1.04 -1.41 0.00 3.41 0.12 -3.37 113.62 115.48 1wvr n SER 34 Ca -0.18 -1.02 0.03 0.00 -0.26 0.00 0.00 58.87 57.45 1wvr n SER 34 Cb 0.53 0.91 0.07 0.00 -0.26 0.00 0.00 64.21 65.46 1wvr n SER 34 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1wvr n ASN 35 N -1.21 1.36 -4.62 4.04 6.94 -1.26 -0.89 115.26 119.63 1wvr n ASN 35 Ca 0.04 -2.54 -0.43 0.00 -0.02 0.00 0.00 54.58 51.63 1wvr n ASN 35 Cb 0.31 -0.37 -0.02 0.00 -2.36 0.00 0.00 39.78 37.33 1wvr n ASN 35 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 1wvr s MET 36 N -1.26 3.85 0.41 -3.83 1.75 -1.26 -4.71 119.30 114.24 1wvr s MET 36 Ca 0.35 0.97 -0.23 0.00 -1.25 0.00 0.00 55.69 55.52 1wvr s MET 36 Cb 0.38 -3.87 -0.09 0.00 2.84 0.00 0.00 34.83 34.08 1wvr s MET 36 CO -0.13 -1.21 1.02 -0.51 -0.65 0.00 0.00 175.02 173.55 1wvr s LEU 37 N 4.38 4.10 0.22 4.11 1.43 -0.54 -0.56 118.68 131.81 1wvr s LEU 37 Ca 0.52 1.96 -0.30 0.00 -1.03 0.00 0.00 54.13 55.28 1wvr s LEU 37 Cb -0.12 -4.26 -0.09 0.00 0.03 0.00 0.00 46.19 41.75 1wvr s LEU 37 CO 0.25 -0.47 1.17 -0.75 0.23 0.00 0.00 176.35 176.78 1wvr s LYS 38 N -2.63 4.53 0.27 1.70 2.20 0.81 -4.72 119.74 121.89 1wvr s LYS 38 Ca 0.59 1.87 -0.09 0.00 -0.36 0.00 0.00 55.97 57.99 1wvr s LYS 38 Cb -0.19 -3.22 -0.07 0.00 -1.51 0.00 0.00 37.83 32.85 1wvr s LYS 38 CO 0.24 -0.01 0.58 1.41 -0.36 0.00 0.00 175.35 177.22 1wvr s MET 39 N -0.68 3.76 0.00 4.03 -2.45 -1.26 -4.70 119.30 118.00 1wvr s MET 39 Ca 0.50 0.23 -0.10 0.00 -1.25 0.00 0.00 55.69 55.08 1wvr s MET 39 Cb -0.33 -2.61 0.01 0.00 1.25 0.00 0.00 34.83 33.15 1wvr s MET 39 CO 0.39 0.24 0.19 -1.83 1.05 0.00 0.00 175.02 175.06 1wvr s GLU 40 N -3.17 0.56 0.60 4.11 -1.05 -0.56 -4.95 118.70 114.23 1wvr s GLU 40 Ca 0.47 -0.35 -0.20 0.00 -0.15 0.00 0.00 54.97 54.74 1wvr s GLU 40 Cb -0.11 0.24 -0.03 0.00 -0.44 0.00 0.00 34.13 33.78 1wvr s GLU 40 CO 0.25 -0.14 1.27 1.87 0.95 0.00 0.00 175.26 179.46 1wvr n TRP 41 N 1.34 1.92 -3.47 4.83 -0.00 -1.26 -2.20 117.44 118.60 1wvr n TRP 41 Ca -0.22 0.43 -0.29 0.00 -0.00 0.00 0.00 57.50 57.42 1wvr n TRP 41 Cb 0.56 -2.29 -0.12 0.00 -0.00 0.00 0.00 31.31 29.46 1wvr n TRP 41 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 177.69 177.22 1wvr s TYR 42 N -1.36 0.80 0.23 5.87 5.04 0.39 -4.74 117.35 123.58 1wvr s TYR 42 Ca 0.77 -1.70 -0.10 0.00 -2.44 0.00 0.00 57.07 53.60 1wvr s TYR 42 Cb -0.40 -0.96 0.34 0.00 0.35 0.00 0.00 41.96 41.29 1wvr s TYR 42 CO 0.45 -0.83 1.40 -2.30 -1.34 0.00 0.00 175.55 172.93 1wvr n PRO 43 N 3.95 -0.13 -0.22 4.97 -0.02 -1.26 0.73 135.00 143.02 1wvr n PRO 43 Ca 0.13 1.39 0.13 0.00 -2.02 0.00 0.00 63.50 63.13 1wvr n PRO 43 Cb 0.37 -2.08 0.42 0.00 -0.02 0.00 0.00 33.50 32.20 1wvr n PRO 43 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1wvr h GLU 44 N 0.00 0.58 0.00 -0.52 4.57 -1.96 0.50 114.58 117.74 1wvr h GLU 44 Ca 0.39 -0.03 -0.11 0.00 -1.18 0.00 0.00 59.36 58.42 1wvr h GLU 44 Cb 0.61 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 1wvr h GLU 44 CO -0.91 0.38 -0.54 0.00 -1.18 0.00 0.00 179.01 176.76 1wvr h ALA 45 N 1.62 1.10 -0.16 2.92 0.00 -0.02 -1.54 119.26 123.17 1wvr h ALA 45 Ca 0.41 -0.49 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1wvr h ALA 45 Cb 0.72 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1wvr h ALA 45 CO -0.16 0.67 -0.32 0.00 0.00 0.00 0.00 179.25 179.44 1wvr h ALA 46 N 1.46 0.26 -0.36 0.00 0.00 0.39 -0.35 119.26 120.66 1wvr h ALA 46 Ca -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1wvr h ALA 46 Cb 0.96 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1wvr h ALA 46 CO 0.07 0.30 0.23 0.00 0.00 0.00 0.00 179.25 179.85 1wvr h ALA 47 N 0.57 0.45 -0.04 0.00 0.00 -0.66 0.26 119.26 119.83 1wvr h ALA 47 Ca 0.01 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1wvr h ALA 47 Cb 0.92 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1wvr h ALA 47 CO 0.07 -0.07 -0.45 -0.97 0.00 0.00 0.00 179.25 177.83 1wvr h ASN 48 N 0.47 0.10 -0.14 0.00 -0.73 -1.29 0.77 115.58 114.76 1wvr h ASN 48 Ca 0.13 -0.04 -0.17 0.00 1.87 0.00 0.00 56.30 58.08 1wvr h ASN 48 Cb -0.03 -0.03 -0.00 0.00 0.27 0.00 0.00 38.32 38.53 1wvr h ASN 48 CO -0.03 0.54 -0.53 0.00 -0.37 0.00 0.00 177.43 177.05 1wvr h ALA 49 N 1.46 0.60 -0.00 1.57 0.00 -0.54 -3.04 119.26 119.30 1wvr h ALA 49 Ca 0.00 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 1wvr h ALA 49 Cb 0.83 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1wvr h ALA 49 CO 0.06 0.68 -0.00 0.93 0.00 0.00 0.00 179.25 180.93 1wvr h GLU 50 N 0.56 0.01 -1.14 0.00 5.08 -0.10 0.62 114.58 119.61 1wvr h GLU 50 Ca 0.02 -0.00 0.32 0.00 -1.00 0.00 0.00 59.36 58.69 1wvr h GLU 50 Cb 1.10 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.27 1wvr h GLU 50 CO 0.11 0.36 0.78 0.00 -1.00 0.00 0.00 179.01 179.26 1wvr h ARG 51 N -0.35 0.18 0.00 2.33 3.08 -0.86 -1.40 114.38 117.37 1wvr h ARG 51 Ca 0.00 -0.01 -0.13 0.00 0.07 0.00 0.00 59.98 59.91 1wvr h ARG 51 Cb 0.36 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1wvr h ARG 51 CO 0.00 0.12 -0.73 2.35 -1.07 0.00 0.00 179.97 180.64 1wvr h TRP 52 N 0.18 0.01 -0.07 3.04 2.91 -1.37 -3.36 115.95 117.30 1wvr h TRP 52 Ca 0.61 -0.01 0.03 0.00 1.13 0.00 0.00 58.89 60.65 1wvr h TRP 52 Cb 1.97 -0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 30.58 1wvr h TRP 52 CO -0.00 1.28 -0.17 0.00 -1.03 0.00 0.00 178.44 178.53 1wvr h ALA 53 N -0.27 -0.15 0.00 2.65 0.00 -0.17 -1.17 119.26 120.15 1wvr h ALA 53 Ca -0.20 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1wvr h ALA 53 Cb 1.19 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1wvr h ALA 53 CO -0.11 -0.64 0.02 0.66 0.00 0.00 0.00 179.25 179.17 1wvr n TYR 54 N -5.30 0.00 0.55 0.00 4.01 -0.59 0.07 117.16 115.88 1wvr n TYR 54 Ca -0.04 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.83 1wvr n TYR 54 Cb 0.22 -0.46 0.38 0.00 -0.31 0.00 0.00 39.34 39.16 1wvr n TYR 54 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 1wvr h ARG 55 N 0.00 0.00 -6.27 -0.72 2.43 -1.35 -3.48 114.38 104.99 1wvr h ARG 55 Ca 0.00 0.00 -0.46 0.00 -0.81 0.00 0.00 59.98 58.71 1wvr h ARG 55 Cb 0.03 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1wvr h ARG 55 CO 0.00 0.00 -0.85 0.00 -1.51 0.00 0.00 179.97 177.61 1wvr s ILE 57 N -3.74 2.82 -0.72 0.00 1.01 -1.26 -4.94 121.20 114.37 1wvr s ILE 57 Ca 0.07 -2.47 -0.26 0.00 0.00 0.00 0.00 60.65 57.99 1wvr s ILE 57 Cb -0.04 -2.98 -0.24 0.00 0.01 0.00 0.00 42.46 39.22 1wvr s ILE 57 CO 0.84 -0.69 1.88 -0.62 0.00 0.00 0.00 174.94 176.36 1wvr n GLU 58 N 4.11 0.62 -3.60 2.79 4.71 -1.26 -4.75 120.64 123.25 1wvr n GLU 58 Ca 0.03 -1.67 -0.04 0.00 -0.01 0.00 0.00 57.16 55.46 1wvr n GLU 58 Cb 0.40 -3.28 -0.02 0.00 -1.01 0.00 0.00 31.44 27.53 1wvr n GLU 58 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 1wvr s SER 59 N 7.03 -0.20 0.48 1.62 1.04 -1.26 -5.15 113.70 117.26 1wvr s SER 59 Ca 0.71 -0.11 -0.24 0.00 0.48 0.00 0.00 55.95 56.79 1wvr s SER 59 Cb 0.06 0.30 -0.07 0.00 0.10 0.00 0.00 66.02 66.40 1wvr s SER 59 CO 0.22 -0.51 1.36 -1.00 0.98 0.00 0.00 173.24 174.29 1wvr s HIS 60 N -2.83 2.47 1.11 5.02 3.76 -1.26 -5.00 115.29 118.55 1wvr s HIS 60 Ca 0.10 1.35 -0.19 0.00 -0.15 0.00 0.00 55.06 56.16 1wvr s HIS 60 Cb 0.00 -3.80 0.26 0.00 1.11 0.00 0.00 32.58 30.15 1wvr s HIS 60 CO -0.04 -2.71 1.25 -1.54 -0.85 0.00 0.00 174.74 170.85 1wvr s SER 61 N -0.77 1.80 0.11 1.40 1.04 -1.26 -4.99 113.70 111.03 1wvr s SER 61 Ca 0.65 0.29 -0.29 0.00 0.48 0.00 0.00 55.95 57.08 1wvr s SER 61 Cb -0.41 -0.31 -0.06 0.00 0.10 0.00 0.00 66.02 65.35 1wvr s SER 61 CO 0.50 -3.55 0.91 -0.94 0.98 0.00 0.00 173.24 171.15 1wvr s SER 62 N -4.56 7.45 0.41 7.02 1.04 -1.26 -4.91 113.70 118.90 1wvr s SER 62 Ca 0.75 1.74 0.25 0.00 0.48 0.00 0.00 55.95 59.16 1wvr s SER 62 Cb -0.04 -2.56 1.29 0.00 0.10 0.00 0.00 66.02 64.81 1wvr s SER 62 CO 0.55 -0.02 1.66 0.03 0.98 0.00 0.00 173.24 176.44 1wvr h ARG 63 N 5.40 0.19 -0.93 4.02 -0.00 -1.95 0.60 114.38 121.72 1wvr h ARG 63 Ca -0.43 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.98 59.02 1wvr h ARG 63 Cb 1.21 -0.04 -0.04 0.00 0.00 0.00 0.00 29.97 31.09 1wvr h ARG 63 CO 0.71 0.12 0.54 -0.44 0.00 0.00 0.00 179.97 180.90 1wvr h ASP 64 N 0.19 1.13 0.88 7.04 3.32 -1.98 -2.19 116.42 124.81 1wvr h ASP 64 Ca 0.75 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.72 1wvr h ASP 64 Cb 2.16 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 41.42 1wvr h ASP 64 CO -0.43 0.88 0.00 -1.54 -1.72 0.00 0.00 179.24 176.44 1wvr n SER 65 N -4.34 0.50 -2.03 6.45 3.41 0.21 -3.10 113.62 114.73 1wvr n SER 65 Ca 0.10 0.60 -0.12 0.00 -0.26 0.00 0.00 58.87 59.19 1wvr n SER 65 Cb 0.08 -0.71 0.26 0.00 -0.26 0.00 0.00 64.21 63.57 1wvr n SER 65 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1wvr n ARG 66 N -2.03 3.16 -3.14 4.33 1.74 -0.82 -4.83 116.66 115.07 1wvr n ARG 66 Ca 0.04 -3.07 -0.45 0.00 -0.77 0.00 0.00 57.85 53.60 1wvr n ARG 66 Cb 0.27 -2.18 -0.04 0.00 -1.02 0.00 0.00 32.46 29.48 1wvr n ARG 66 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1wvr s VAL 67 N -3.11 4.89 -0.17 1.55 1.01 -1.18 -0.92 120.40 122.47 1wvr s VAL 67 Ca 0.55 -1.10 -0.06 0.00 0.00 0.00 0.00 61.98 61.37 1wvr s VAL 67 Cb 0.45 -4.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 1wvr s VAL 67 CO 0.12 -1.09 0.02 -0.63 0.00 0.00 0.00 175.10 173.51 1wvr s ILE 68 N 2.49 4.40 -1.91 2.22 1.01 0.24 -4.36 121.20 125.28 1wvr s ILE 68 Ca 0.10 -0.18 0.00 0.00 0.00 0.00 0.00 60.65 60.58 1wvr s ILE 68 Cb -0.25 -2.96 0.00 0.00 0.01 0.00 0.00 42.46 39.27 1wvr s ILE 68 CO 0.05 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1wvr n GLY 69 N 3.51 0.58 2.18 6.18 0.00 -1.26 -0.57 105.19 115.82 1wvr n GLY 69 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1wvr n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wvr n GLY 70 N -0.72 0.83 3.49 -0.02 0.00 -1.26 -5.03 105.19 102.48 1wvr n GLY 70 Ca -0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 1wvr n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wvr s ILE 71 N -3.21 3.50 -0.05 -0.61 1.01 0.27 -5.06 121.20 117.04 1wvr s ILE 71 Ca 0.00 -0.53 -0.30 0.00 0.00 0.00 0.00 60.65 59.82 1wvr s ILE 71 Cb 0.00 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 1wvr s ILE 71 CO 0.00 0.55 1.27 -0.54 0.00 0.00 0.00 174.94 176.23 1wvr s LYS 72 N -0.23 4.32 0.15 2.79 1.02 -1.26 -0.59 119.74 125.94 1wvr s LYS 72 Ca 0.02 1.77 0.07 0.00 0.02 0.00 0.00 55.97 57.86 1wvr s LYS 72 Cb -0.13 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 33.56 1wvr s LYS 72 CO 0.03 -0.51 -0.04 0.00 -0.92 0.00 0.00 175.35 173.91 1wvr n GLY 74 N 0.17 -0.87 3.60 0.00 0.00 0.28 -4.66 105.19 103.70 1wvr n GLY 74 Ca -0.11 -1.77 -0.15 0.00 0.00 0.00 0.00 46.02 43.99 1wvr n GLY 74 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wvr s GLU 75 N -4.69 0.87 -0.06 1.61 2.12 -1.26 -1.72 118.70 115.57 1wvr s GLU 75 Ca 0.47 0.71 0.02 0.00 0.36 0.00 0.00 54.97 56.53 1wvr s GLU 75 Cb -0.02 0.42 0.02 0.00 0.26 0.00 0.00 34.13 34.81 1wvr s GLU 75 CO 0.33 -0.17 -0.09 -0.80 -0.54 0.00 0.00 175.26 173.99 1wvr s ASN 76 N -0.17 1.50 0.18 -1.70 0.02 0.45 -4.97 114.94 110.25 1wvr s ASN 76 Ca -0.03 -0.23 0.11 0.00 -1.02 0.00 0.00 52.86 51.69 1wvr s ASN 76 Cb -0.03 -0.68 -0.04 0.00 0.02 0.00 0.00 41.25 40.51 1wvr s ASN 76 CO 0.03 -0.02 -0.22 0.27 0.02 0.00 0.00 177.10 177.18 1wvr s ILE 77 N 0.87 2.47 -0.00 0.60 -4.36 -1.26 -1.04 121.20 118.48 1wvr s ILE 77 Ca -0.11 -1.94 -0.08 0.00 -0.26 0.00 0.00 60.65 58.26 1wvr s ILE 77 Cb -0.15 -2.18 0.00 0.00 1.25 0.00 0.00 42.46 41.39 1wvr s ILE 77 CO 0.01 -0.09 0.16 -0.47 0.24 0.00 0.00 174.94 174.79 1wvr s TYR 78 N -1.59 0.00 -0.02 1.37 5.04 0.50 -4.98 117.35 117.67 1wvr s TYR 78 Ca 0.20 -0.05 -0.05 0.00 -2.44 0.00 0.00 57.07 54.73 1wvr s TYR 78 Cb -0.08 -0.03 0.00 0.00 0.35 0.00 0.00 41.96 42.21 1wvr s TYR 78 CO 0.10 -0.28 0.12 0.00 -1.34 0.00 0.00 175.55 174.15 1wvr s MET 79 N -1.26 0.30 0.24 4.97 0.23 -1.26 0.19 119.30 122.71 1wvr s MET 79 Ca -0.13 -0.14 -0.10 0.00 -1.03 0.00 0.00 55.69 54.29 1wvr s MET 79 Cb -0.07 0.13 -0.01 0.00 -1.53 0.00 0.00 34.83 33.35 1wvr s MET 79 CO 0.02 -0.06 0.40 0.00 -2.03 0.00 0.00 175.02 173.35 1wvr s ALA 80 N -0.68 0.08 -1.07 3.16 0.00 -0.39 -5.03 121.76 117.83 1wvr s ALA 80 Ca -0.08 -1.07 0.24 0.00 0.00 0.00 0.00 51.96 51.05 1wvr s ALA 80 Cb -0.05 1.14 0.25 0.00 0.00 0.00 0.00 23.12 24.47 1wvr s ALA 80 CO 0.01 -0.80 1.24 0.25 0.00 0.00 0.00 175.76 176.46 1wvr n THR 81 N -0.36 0.00 -4.08 0.00 -2.24 -1.26 -2.54 114.28 103.79 1wvr n THR 81 Ca -0.01 -0.02 -0.10 0.00 -2.27 0.00 0.00 64.05 61.65 1wvr n THR 81 Cb 0.63 0.55 -0.11 0.00 -2.10 0.00 0.00 70.33 69.30 1wvr n THR 81 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1wvr s TYR 82 N -2.96 0.63 0.02 4.78 -0.85 -1.26 -4.75 117.35 112.97 1wvr s TYR 82 Ca 0.11 -0.73 -0.32 0.00 -0.52 0.00 0.00 57.07 55.61 1wvr s TYR 82 Cb 0.17 -0.39 -0.11 0.00 0.38 0.00 0.00 41.96 42.01 1wvr s TYR 82 CO 0.74 -0.18 1.89 -2.30 -1.52 0.00 0.00 175.55 174.19 1wvr n PRO 83 N 0.81 2.57 -3.65 -3.49 -0.02 -1.26 -4.87 135.00 125.08 1wvr n PRO 83 Ca -0.18 0.94 -0.21 0.00 -2.02 0.00 0.00 63.50 62.03 1wvr n PRO 83 Cb 0.58 -2.83 -0.01 0.00 -0.02 0.00 0.00 33.50 31.21 1wvr n PRO 83 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wvr s ALA 84 N 3.73 4.02 0.08 3.55 0.00 -1.26 -4.88 121.76 127.00 1wvr s ALA 84 Ca 0.88 -1.28 -0.08 0.00 0.00 0.00 0.00 51.96 51.48 1wvr s ALA 84 Cb -0.55 -1.77 -0.05 0.00 0.00 0.00 0.00 23.12 20.74 1wvr s ALA 84 CO 0.44 0.07 0.36 0.15 0.00 0.00 0.00 175.76 176.78 1wvr s LYS 85 N -4.13 3.69 0.33 0.00 3.01 -1.26 -4.92 119.74 116.46 1wvr s LYS 85 Ca 0.40 0.06 0.05 0.00 -1.01 0.00 0.00 55.97 55.47 1wvr s LYS 85 Cb -0.09 -2.98 0.58 0.00 -1.01 0.00 0.00 37.83 34.32 1wvr s LYS 85 CO 0.31 0.56 1.83 -1.49 0.51 0.00 0.00 175.35 177.08 1wvr h TRP 86 N 3.59 0.48 -0.59 3.18 4.06 -1.99 0.12 115.95 124.80 1wvr h TRP 86 Ca -0.49 -0.07 -0.06 0.00 2.06 0.00 0.00 58.89 60.34 1wvr h TRP 86 Cb 1.19 -0.13 -0.03 0.00 -1.00 0.00 0.00 29.16 29.19 1wvr h TRP 86 CO 0.66 0.55 0.15 0.00 -3.56 0.00 0.00 178.44 176.23 1wvr h THR 87 N 0.42 1.24 -0.14 1.49 1.03 -1.95 0.50 112.91 115.49 1wvr h THR 87 Ca 0.08 -0.86 -0.23 0.00 -0.01 0.00 0.00 66.41 65.40 1wvr h THR 87 Cb 0.45 0.62 0.01 0.00 -1.07 0.00 0.00 68.15 68.16 1wvr h THR 87 CO 0.02 0.32 -0.80 0.44 -0.01 0.00 0.00 175.52 175.50 1wvr h ASP 88 N 0.88 0.95 -0.25 0.00 3.32 -1.83 -1.85 116.42 117.64 1wvr h ASP 88 Ca 0.19 -0.64 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1wvr h ASP 88 Cb 0.31 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1wvr h ASP 88 CO -0.00 1.43 0.16 0.40 -1.72 0.00 0.00 179.24 179.51 1wvr h ILE 89 N 0.53 1.08 -0.19 0.35 2.04 -0.68 -1.45 117.51 119.19 1wvr h ILE 89 Ca -0.06 -0.15 -0.11 0.00 1.00 0.00 0.00 64.86 65.54 1wvr h ILE 89 Cb 1.43 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 1wvr h ILE 89 CO 0.16 0.07 -0.34 0.40 0.00 0.00 0.00 178.15 178.44 1wvr h ILE 90 N 0.33 1.29 0.00 -0.67 2.04 -0.92 -2.59 117.51 116.99 1wvr h ILE 90 Ca 0.09 -1.41 -0.16 0.00 1.00 0.00 0.00 64.86 64.38 1wvr h ILE 90 Cb -0.02 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1wvr h ILE 90 CO -0.02 0.44 -0.75 0.45 0.00 0.00 0.00 178.15 178.27 1wvr h HIS 91 N 0.33 0.00 -0.65 1.37 3.86 -1.15 0.08 115.15 118.98 1wvr h HIS 91 Ca 0.04 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.19 1wvr h HIS 91 Cb 0.77 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.21 1wvr h HIS 91 CO 0.02 0.75 0.18 0.00 0.86 0.00 0.00 177.93 179.74 1wvr h ALA 92 N 1.25 0.86 -0.21 2.45 0.00 -1.09 0.45 119.26 122.96 1wvr h ALA 92 Ca -0.01 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 1wvr h ALA 92 Cb 1.36 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1wvr h ALA 92 CO 0.10 0.55 -0.09 -1.49 0.00 0.00 0.00 179.25 178.32 1wvr h TRP 93 N 0.95 0.50 -0.54 0.00 6.55 -1.31 -3.23 115.95 118.87 1wvr h TRP 93 Ca 0.21 -0.12 -0.01 0.00 0.95 0.00 0.00 58.89 59.92 1wvr h TRP 93 Cb 0.33 -0.12 -0.03 0.00 -0.86 0.00 0.00 29.16 28.48 1wvr h TRP 93 CO 0.02 0.71 0.31 1.25 -1.05 0.00 0.00 178.44 179.69 1wvr h HIS 94 N 0.15 0.72 -0.28 0.49 2.76 -0.62 -2.93 115.15 115.44 1wvr h HIS 94 Ca 0.05 -0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.29 1wvr h HIS 94 Cb 0.57 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 1wvr h HIS 94 CO 0.06 0.51 0.63 0.78 -1.30 0.00 0.00 177.93 178.62 1wvr h GLY 95 N 0.72 0.00 1.75 5.26 0.00 -0.12 -0.75 103.07 109.93 1wvr h GLY 95 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1wvr h GLY 95 CO -0.03 0.00 0.08 1.18 0.00 0.00 0.00 176.54 177.77 1wvr n GLU 96 N -3.10 0.07 0.20 4.80 1.02 -1.11 -1.03 120.64 121.49 1wvr n GLU 96 Ca 0.05 0.54 0.15 0.00 -0.02 0.00 0.00 57.16 57.88 1wvr n GLU 96 Cb 0.75 -1.83 0.65 0.00 -0.02 0.00 0.00 31.44 31.00 1wvr n GLU 96 CO 0.00 0.00 0.00 0.10 1.18 0.00 0.00 177.13 178.41 1wvr h TYR 97 N 0.00 0.00 0.00 -0.32 -0.00 -1.39 -2.46 116.97 112.81 1wvr h TYR 97 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.73 1wvr h TYR 97 Cb 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.89 1wvr h TYR 97 CO 0.00 0.00 -0.02 0.87 -0.00 0.00 0.00 178.16 179.01 1wvr h LYS 98 N 0.00 0.00 -0.39 0.10 1.57 -1.34 -1.20 116.57 115.31 1wvr h LYS 98 Ca 0.00 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.50 1wvr h LYS 98 Cb 0.30 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 32.40 1wvr h LYS 98 CO 0.00 0.02 -0.62 -0.25 -0.57 0.00 0.00 179.45 178.03 1wvr n ASP 99 N -3.27 3.37 -4.04 0.86 8.00 -0.92 -5.01 116.55 115.54 1wvr n ASP 99 Ca -0.02 -3.83 -0.20 0.00 0.71 0.00 0.00 54.79 51.45 1wvr n ASP 99 Cb 0.13 -0.45 -0.15 0.00 -0.02 0.00 0.00 41.12 40.64 1wvr n ASP 99 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1wvr s PHE 100 N -3.42 0.97 -0.13 1.24 5.36 -0.46 -1.04 117.98 120.50 1wvr s PHE 100 Ca 0.45 -0.20 -0.01 0.00 -0.96 0.00 0.00 56.93 56.22 1wvr s PHE 100 Cb 0.39 -0.64 0.03 0.00 -0.34 0.00 0.00 43.02 42.47 1wvr s PHE 100 CO -0.01 -0.03 -0.06 0.21 -1.46 0.00 0.00 175.22 173.86 1wvr s LYS 101 N -0.16 1.37 0.05 10.12 2.20 0.11 -4.96 119.74 128.48 1wvr s LYS 101 Ca 0.03 -0.30 -0.35 0.00 -0.36 0.00 0.00 55.97 54.99 1wvr s LYS 101 Cb -0.05 -1.66 -0.14 0.00 -1.51 0.00 0.00 37.83 34.46 1wvr s LYS 101 CO -0.00 -0.33 1.59 0.98 -0.36 0.00 0.00 175.35 177.23 1wvr n TYR 102 N 4.95 2.08 0.00 4.03 9.36 -1.26 0.07 117.16 136.39 1wvr n TYR 102 Ca -0.12 0.33 0.00 0.00 3.32 0.00 0.00 57.90 61.43 1wvr n TYR 102 Cb 0.49 -2.51 0.00 0.00 -0.63 0.00 0.00 39.34 36.69 1wvr n TYR 102 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1wvr n GLY 103 N 3.46 3.03 0.13 2.98 0.00 -0.46 -4.74 105.19 109.59 1wvr n GLY 103 Ca 0.19 -0.81 -0.20 0.00 0.00 0.00 0.00 46.02 45.21 1wvr n GLY 103 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1wvr n VAL 104 N 0.00 1.59 0.00 1.61 3.14 -0.77 -4.81 118.33 119.09 1wvr n VAL 104 Ca 0.00 -0.59 0.00 0.00 -2.96 0.00 0.00 64.34 60.79 1wvr n VAL 104 Cb 0.00 -1.55 0.00 0.00 -1.06 0.00 0.00 33.84 31.23 1wvr n VAL 104 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1wvr n GLY 105 N 2.13 0.60 3.71 7.55 0.00 0.11 -4.80 105.19 114.49 1wvr n GLY 105 Ca -0.41 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 1wvr n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wvr s ALA 106 N -2.00 3.41 -0.14 4.61 0.00 -1.26 0.10 121.76 126.48 1wvr s ALA 106 Ca 0.00 0.83 -0.04 0.00 0.00 0.00 0.00 51.96 52.75 1wvr s ALA 106 Cb 0.00 -3.46 0.05 0.00 0.00 0.00 0.00 23.12 19.71 1wvr s ALA 106 CO 0.00 -0.49 0.08 0.08 0.00 0.00 0.00 175.76 175.43 1wvr s VAL 107 N 1.24 -0.03 0.56 0.00 1.01 -0.20 -2.09 120.40 120.89 1wvr s VAL 107 Ca 0.59 -0.07 -0.21 0.00 0.00 0.00 0.00 61.98 62.28 1wvr s VAL 107 Cb -0.29 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 1wvr s VAL 107 CO 0.28 -0.17 1.32 -2.16 0.00 0.00 0.00 175.10 174.38 1wvr s PRO 108 N 2.12 3.07 0.00 2.72 0.04 -1.26 -4.62 135.00 137.06 1wvr s PRO 108 Ca 0.02 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.21 1wvr s PRO 108 Cb -0.15 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.22 1wvr s PRO 108 CO -0.08 -1.22 0.61 -1.13 0.04 0.00 0.00 177.00 175.22 1wvr n SER 109 N -1.19 0.00 -0.37 6.66 3.41 -0.89 -0.29 113.62 120.95 1wvr n SER 109 Ca 0.11 0.18 0.09 0.00 -0.26 0.00 0.00 58.87 58.99 1wvr n SER 109 Cb 0.46 -0.18 -0.01 0.00 -0.26 0.00 0.00 64.21 64.22 1wvr n SER 109 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1wvr n ASP 110 N -1.11 1.67 -4.77 4.04 3.85 -1.26 -4.91 116.55 114.06 1wvr n ASP 110 Ca 0.00 -1.34 -0.35 0.00 -0.71 0.00 0.00 54.79 52.40 1wvr n ASP 110 Cb 0.10 0.50 0.01 0.00 -1.35 0.00 0.00 41.12 40.38 1wvr n ASP 110 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1wvr s ALA 111 N -2.07 2.66 -0.06 2.12 0.00 0.60 -5.00 121.76 120.01 1wvr s ALA 111 Ca 0.14 0.77 -0.24 0.00 0.00 0.00 0.00 51.96 52.63 1wvr s ALA 111 Cb 0.14 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 1wvr s ALA 111 CO 0.46 -0.84 0.74 0.54 0.00 0.00 0.00 175.76 176.66 1wvr s VAL 112 N -1.88 5.02 0.00 0.00 0.11 -1.26 -4.88 120.40 117.51 1wvr s VAL 112 Ca 0.72 1.54 0.00 0.00 -2.93 0.00 0.00 61.98 61.30 1wvr s VAL 112 Cb -0.23 -4.08 0.00 0.00 -1.53 0.00 0.00 36.38 30.54 1wvr s VAL 112 CO 0.29 0.23 0.00 -0.38 -3.33 0.00 0.00 175.10 171.91 1wvr n ILE 113 N 3.83 0.00 0.33 7.04 2.08 -1.26 -4.83 119.36 126.54 1wvr n ILE 113 Ca -0.00 0.00 0.20 0.00 0.56 0.00 0.00 62.75 63.51 1wvr n ILE 113 Cb 0.51 1.27 1.13 0.00 -0.75 0.00 0.00 39.64 41.80 1wvr n ILE 113 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 1wvr h GLY 114 N 0.00 0.00 1.75 7.39 0.00 -1.95 -1.20 103.07 109.06 1wvr h GLY 114 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 1wvr h GLY 114 CO 0.00 0.00 -0.84 0.45 0.00 0.00 0.00 176.54 176.15 1wvr h HIS 115 N 0.00 0.00 0.00 5.60 3.86 -1.90 -2.84 115.15 119.87 1wvr h HIS 115 Ca 0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1wvr h HIS 115 Cb 0.01 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.48 1wvr h HIS 115 CO 0.00 0.64 -0.01 -0.92 0.86 0.00 0.00 177.93 178.50 1wvr h TYR 116 N 0.00 0.00 -0.16 2.45 3.20 -1.22 -3.21 116.97 118.03 1wvr h TYR 116 Ca -0.05 0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.85 1wvr h TYR 116 Cb 1.53 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.80 1wvr h TYR 116 CO 0.00 0.82 0.11 1.79 -1.64 0.00 0.00 178.16 179.25 1wvr h THR 117 N -1.00 0.97 -0.35 1.81 1.35 -1.43 -0.87 112.91 113.38 1wvr h THR 117 Ca -0.00 -0.03 -0.12 0.00 -0.55 0.00 0.00 66.41 65.71 1wvr h THR 117 Cb 0.82 0.87 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 1wvr h THR 117 CO -0.00 0.02 -0.27 -0.61 -0.25 0.00 0.00 175.52 174.41 1wvr h GLN 118 N 0.09 0.73 -0.27 4.72 5.75 -1.60 -0.46 115.11 124.06 1wvr h GLN 118 Ca 0.07 -0.31 -0.05 0.00 -0.15 0.00 0.00 58.65 58.21 1wvr h GLN 118 Cb 0.18 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.69 1wvr h GLN 118 CO -0.01 0.91 -0.05 0.82 -2.65 0.00 0.00 178.83 177.85 1wvr h ILE 119 N 0.63 1.19 -0.32 2.39 2.04 -1.16 -2.98 117.51 119.30 1wvr h ILE 119 Ca 0.08 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.09 1wvr h ILE 119 Cb 0.77 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 1wvr h ILE 119 CO 0.06 0.26 0.01 1.33 0.00 0.00 0.00 178.15 179.82 1wvr n VAL 120 N -4.27 2.40 -2.18 1.67 0.24 -1.00 -4.80 118.33 110.38 1wvr n VAL 120 Ca 0.01 -2.03 -0.43 0.00 -2.04 0.00 0.00 64.34 59.85 1wvr n VAL 120 Cb 0.26 -0.28 -0.02 0.00 -1.47 0.00 0.00 33.84 32.32 1wvr n VAL 120 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 1wvr s TRP 121 N -2.93 2.25 0.44 6.34 -0.11 -0.20 -4.51 118.94 120.22 1wvr s TRP 121 Ca 0.44 0.60 0.27 0.00 1.22 0.00 0.00 56.10 58.63 1wvr s TRP 121 Cb 0.36 -3.92 1.33 0.00 -1.50 0.00 0.00 33.47 29.74 1wvr s TRP 121 CO 0.07 -2.72 1.70 0.10 -4.62 0.00 0.00 176.95 171.49 1wvr h TYR 122 N 10.16 0.47 0.00 5.86 -0.00 -1.49 -1.28 116.97 130.70 1wvr h TYR 122 Ca -0.32 0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.43 1wvr h TYR 122 Cb 1.14 -0.13 0.00 0.00 0.00 0.00 0.00 36.73 37.74 1wvr h TYR 122 CO 0.89 -0.06 -0.65 1.17 -0.00 0.00 0.00 178.16 179.51 1wvr n LYS 123 N -4.56 0.07 -2.68 0.10 3.00 -1.26 -1.47 118.16 111.36 1wvr n LYS 123 Ca 0.31 0.01 -0.42 0.00 -0.00 0.00 0.00 58.31 58.21 1wvr n LYS 123 Cb 1.22 -1.53 -0.03 0.00 0.00 0.00 0.00 35.03 34.69 1wvr n LYS 123 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1wvr s SER 124 N -3.26 6.43 0.00 3.14 0.01 -0.48 -3.81 113.70 115.73 1wvr s SER 124 Ca 0.09 -1.35 0.19 0.00 1.31 0.00 0.00 55.95 56.19 1wvr s SER 124 Cb 0.16 -2.51 0.23 0.00 0.21 0.00 0.00 66.02 64.12 1wvr s SER 124 CO 0.74 -1.46 1.18 0.00 0.41 0.00 0.00 173.24 174.11 1wvr n TYR 125 N 8.29 0.17 -4.43 2.43 0.18 -1.12 -4.76 117.16 117.92 1wvr n TYR 125 Ca 0.21 -0.11 -0.23 0.00 1.88 0.00 0.00 57.90 59.65 1wvr n TYR 125 Cb 0.50 -0.00 -0.16 0.00 -0.38 0.00 0.00 39.34 39.29 1wvr n TYR 125 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1wvr s ARG 126 N -1.46 1.39 0.02 -3.48 0.52 -0.51 -1.50 118.95 113.93 1wvr s ARG 126 Ca 0.26 -0.30 0.03 0.00 -0.52 0.00 0.00 55.73 55.20 1wvr s ARG 126 Cb 0.17 -1.20 -0.02 0.00 0.52 0.00 0.00 34.95 34.42 1wvr s ARG 126 CO 0.24 -0.01 -0.09 0.00 0.02 0.00 0.00 175.30 175.46 1wvr s ALA 127 N 0.76 0.77 -0.12 2.13 0.00 -0.93 0.05 121.76 124.41 1wvr s ALA 127 Ca -0.13 -0.62 -0.05 0.00 0.00 0.00 0.00 51.96 51.16 1wvr s ALA 127 Cb -0.15 -0.10 0.06 0.00 0.00 0.00 0.00 23.12 22.93 1wvr s ALA 127 CO 0.02 0.12 0.25 0.20 0.00 0.00 0.00 175.76 176.34 1wvr s GLY 128 N -0.94 -0.10 0.30 0.00 0.00 -0.68 -0.46 107.32 105.44 1wvr s GLY 128 Ca -0.02 0.91 0.09 0.00 0.00 0.00 0.00 44.72 45.70 1wvr s GLY 128 CO 0.00 1.72 0.08 0.00 0.00 0.00 0.00 173.10 174.90 1wvr s ALA 130 N -2.37 -0.21 -0.03 0.00 0.00 0.11 -4.71 121.76 114.55 1wvr s ALA 130 Ca 0.34 -0.22 0.05 0.00 0.00 0.00 0.00 51.96 52.14 1wvr s ALA 130 Cb -0.04 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 1wvr s ALA 130 CO 0.21 -0.19 -0.19 0.00 0.00 0.00 0.00 175.76 175.60 1wvr s ALA 131 N -1.31 1.63 -0.01 0.00 0.00 -1.26 -1.35 121.76 119.46 1wvr s ALA 131 Ca -0.14 -0.79 0.02 0.00 0.00 0.00 0.00 51.96 51.05 1wvr s ALA 131 Cb -0.08 -0.48 -0.00 0.00 0.00 0.00 0.00 23.12 22.56 1wvr s ALA 131 CO 0.01 0.34 -0.05 0.00 0.00 0.00 0.00 175.76 176.06 1wvr s ALA 132 N -0.19 0.44 -0.28 0.00 0.00 0.19 -4.90 121.76 117.02 1wvr s ALA 132 Ca 0.01 -0.19 -0.14 0.00 0.00 0.00 0.00 51.96 51.63 1wvr s ALA 132 Cb -0.10 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 1wvr s ALA 132 CO 0.01 0.09 0.33 -0.47 0.00 0.00 0.00 175.76 175.73 1wvr s TYR 133 N -0.01 3.24 -0.55 0.00 6.14 -1.26 -0.41 117.35 124.50 1wvr s TYR 133 Ca 0.01 0.31 0.03 0.00 0.64 0.00 0.00 57.07 58.05 1wvr s TYR 133 Cb -0.03 -2.54 0.14 0.00 0.42 0.00 0.00 41.96 39.94 1wvr s TYR 133 CO -0.00 -0.23 0.31 0.00 0.64 0.00 0.00 175.55 176.27 1wvr h PRO 135 N 6.52 0.19 -0.44 0.00 0.11 -1.88 -2.88 132.00 133.61 1wvr h PRO 135 Ca -0.05 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.00 1wvr h PRO 135 Cb 0.89 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.93 1wvr h PRO 135 CO 0.70 0.13 0.04 0.43 -0.21 0.00 0.00 178.00 179.08 1wvr n SER 136 N -4.47 4.49 -4.57 -2.05 7.64 -1.26 -5.00 113.62 108.40 1wvr n SER 136 Ca 0.05 -3.09 -0.24 0.00 1.01 0.00 0.00 58.87 56.60 1wvr n SER 136 Cb 0.31 -0.63 -0.09 0.00 -1.01 0.00 0.00 64.21 62.79 1wvr n SER 136 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1wvr s SER 137 N -1.51 4.00 0.29 6.43 0.01 -1.09 -5.03 113.70 116.81 1wvr s SER 137 Ca 0.48 -0.95 0.02 0.00 1.31 0.00 0.00 55.95 56.81 1wvr s SER 137 Cb 0.39 -0.50 0.58 0.00 0.21 0.00 0.00 66.02 66.70 1wvr s SER 137 CO 0.11 -0.08 1.85 0.50 0.41 0.00 0.00 173.24 176.02 1wvr h LYS 138 N 2.02 0.94 -5.40 12.44 3.64 -1.95 -3.37 116.57 124.90 1wvr h LYS 138 Ca -0.42 -0.06 -0.68 0.00 -1.27 0.00 0.00 60.65 58.23 1wvr h LYS 138 Cb 1.25 -0.21 -0.31 0.00 -0.41 0.00 0.00 32.23 32.55 1wvr h LYS 138 CO 0.63 0.62 -0.85 0.71 -2.27 0.00 0.00 179.45 178.30 1wvr s TYR 139 N -5.92 2.61 -2.41 1.91 1.51 -1.26 -4.94 117.35 108.84 1wvr s TYR 139 Ca -0.12 -0.93 0.24 0.00 -1.01 0.00 0.00 57.07 55.26 1wvr s TYR 139 Cb 0.22 -1.73 0.81 0.00 -0.11 0.00 0.00 41.96 41.15 1wvr s TYR 139 CO 0.81 -0.35 1.59 -1.13 -1.11 0.00 0.00 175.55 175.36 1wvr n SER 140 N 3.46 1.80 -3.66 2.29 3.41 -1.18 -4.54 113.62 115.20 1wvr n SER 140 Ca -0.19 -1.67 -0.28 0.00 -0.26 0.00 0.00 58.87 56.48 1wvr n SER 140 Cb 0.53 -0.07 -0.16 0.00 -0.26 0.00 0.00 64.21 64.25 1wvr n SER 140 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1wvr s TYR 141 N -1.86 0.76 -0.09 7.33 2.02 -1.05 0.25 117.35 124.71 1wvr s TYR 141 Ca 0.35 -0.86 0.01 0.00 -0.37 0.00 0.00 57.07 56.20 1wvr s TYR 141 Cb 0.19 -1.02 -0.02 0.00 -0.40 0.00 0.00 41.96 40.71 1wvr s TYR 141 CO 0.29 -0.67 -0.10 0.12 -1.57 0.00 0.00 175.55 173.62 1wvr s PHE 142 N 1.95 2.84 -0.00 2.71 5.36 0.45 -1.26 117.98 130.03 1wvr s PHE 142 Ca 0.04 -0.23 0.05 0.00 -0.96 0.00 0.00 56.93 55.82 1wvr s PHE 142 Cb -0.17 -1.75 -0.01 0.00 -0.34 0.00 0.00 43.02 40.75 1wvr s PHE 142 CO -0.17 0.11 -0.15 0.71 -1.46 0.00 0.00 175.22 174.26 1wvr s TYR 143 N -0.37 1.36 -0.07 10.12 1.51 0.13 0.54 117.35 130.57 1wvr s TYR 143 Ca 0.04 -0.28 -0.03 0.00 -1.01 0.00 0.00 57.07 55.80 1wvr s TYR 143 Cb -0.12 -0.86 0.04 0.00 -0.11 0.00 0.00 41.96 40.91 1wvr s TYR 143 CO 0.02 -0.01 0.15 0.08 -1.11 0.00 0.00 175.55 174.69 1wvr s VAL 144 N -0.45 -0.06 -0.05 0.71 1.01 -0.46 -0.37 120.40 120.72 1wvr s VAL 144 Ca 0.05 0.19 0.04 0.00 0.00 0.00 0.00 61.98 62.27 1wvr s VAL 144 Cb -0.06 -0.25 -0.00 0.00 0.00 0.00 0.00 36.38 36.06 1wvr s VAL 144 CO -0.00 0.08 -0.18 0.00 0.00 0.00 0.00 175.10 174.99 1wvr s GLN 146 N 0.05 2.23 -0.09 0.00 -0.21 -0.58 -0.41 119.66 120.66 1wvr s GLN 146 Ca -0.05 -0.86 0.03 0.00 0.02 0.00 0.00 55.36 54.50 1wvr s GLN 146 Cb -0.12 -2.19 -0.01 0.00 1.00 0.00 0.00 33.01 31.69 1wvr s GLN 146 CO 0.03 0.58 -0.18 0.71 -2.12 0.00 0.00 175.29 174.30 1wvr s TYR 147 N -0.71 2.64 -0.07 0.91 2.02 -0.70 -1.68 117.35 119.76 1wvr s TYR 147 Ca 0.11 -0.63 0.02 0.00 -0.37 0.00 0.00 57.07 56.21 1wvr s TYR 147 Cb -0.10 -1.71 0.02 0.00 -0.40 0.00 0.00 41.96 39.77 1wvr s TYR 147 CO 0.01 -0.16 -0.11 0.00 -1.57 0.00 0.00 175.55 173.72 1wvr s PRO 149 N 0.78 3.17 0.95 0.00 0.04 -1.25 -1.42 135.00 137.26 1wvr s PRO 149 Ca -0.13 0.62 -0.14 0.00 0.04 0.00 0.00 61.00 61.40 1wvr s PRO 149 Cb -0.15 -2.04 -0.00 0.00 0.04 0.00 0.00 34.50 32.34 1wvr s PRO 149 CO 0.02 -0.85 0.20 0.00 0.04 0.00 0.00 177.00 176.41 1wvr n ALA 150 N -2.91 -3.05 -3.21 8.56 0.00 0.52 -3.99 120.51 116.42 1wvr n ALA 150 Ca 0.07 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.90 1wvr n ALA 150 Cb 0.56 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 18.32 1wvr n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wvr n GLY 151 N 1.85 6.10 3.89 0.00 0.00 -1.26 -4.72 105.19 111.06 1wvr n GLY 151 Ca 0.05 -2.09 -0.25 0.00 0.00 0.00 0.00 46.02 43.74 1wvr n GLY 151 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1wvr n ASN 152 N -0.41 -0.69 -4.78 1.61 5.03 -1.26 -4.91 115.26 109.86 1wvr n ASN 152 Ca 0.00 -0.97 -0.35 0.00 0.87 0.00 0.00 54.58 54.13 1wvr n ASN 152 Cb 0.00 -3.26 -0.01 0.00 -1.02 0.00 0.00 39.78 35.49 1wvr n ASN 152 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1wvr s ILE 153 N -3.88 3.24 -0.68 2.41 -1.09 -1.26 -4.85 121.20 115.08 1wvr s ILE 153 Ca 0.02 0.80 -0.33 0.00 -2.23 0.00 0.00 60.65 58.91 1wvr s ILE 153 Cb -0.01 -3.34 -0.18 0.00 -1.58 0.00 0.00 42.46 37.35 1wvr s ILE 153 CO 0.87 -0.14 2.17 -0.38 -1.23 0.00 0.00 174.94 176.24 1wvr n ILE 154 N -1.10 0.00 -2.85 2.92 2.08 -1.26 -0.77 119.36 118.38 1wvr n ILE 154 Ca 0.10 0.00 -0.18 0.00 0.56 0.00 0.00 62.75 63.23 1wvr n ILE 154 Cb 0.51 -0.45 0.03 0.00 -0.75 0.00 0.00 39.64 38.98 1wvr n ILE 154 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1wvr n GLY 155 N 6.24 -0.31 0.00 7.39 0.00 -1.26 -4.86 105.19 112.39 1wvr n GLY 155 Ca 0.54 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.52 1wvr n GLY 155 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wvr n LYS 156 N -3.40 1.09 0.24 1.61 4.76 0.05 -4.82 118.16 117.69 1wvr n LYS 156 Ca -0.10 -0.12 0.10 0.00 -2.87 0.00 0.00 58.31 55.33 1wvr n LYS 156 Cb 0.60 -0.49 0.56 0.00 -1.84 0.00 0.00 35.03 33.86 1wvr n LYS 156 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 1wvr h THR 157 N 0.32 0.00 0.00 -0.18 1.35 -1.89 0.12 112.91 112.63 1wvr h THR 157 Ca 0.00 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 65.81 1wvr h THR 157 Cb 0.16 0.45 -0.01 0.00 -1.73 0.00 0.00 68.15 67.03 1wvr h THR 157 CO 0.00 0.00 -0.25 0.00 -0.25 0.00 0.00 175.52 175.02 1wvr h ALA 158 N 1.25 0.84 -2.61 6.62 0.00 -1.87 -3.38 119.26 120.10 1wvr h ALA 158 Ca 0.00 -0.23 -0.60 0.00 0.00 0.00 0.00 54.91 54.08 1wvr h ALA 158 Cb 0.64 -0.04 -0.40 0.00 0.00 0.00 0.00 17.79 17.99 1wvr h ALA 158 CO 0.00 0.31 -0.77 0.25 0.00 0.00 0.00 179.25 179.04 1wvr n THR 159 N -3.16 0.46 0.27 0.00 -2.24 0.41 -1.36 114.28 108.66 1wvr n THR 159 Ca 0.03 -4.30 0.15 0.00 -2.27 0.00 0.00 64.05 57.65 1wvr n THR 159 Cb 0.63 -1.96 0.72 0.00 -2.10 0.00 0.00 70.33 67.62 1wvr n THR 159 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1wvr h PRO 160 N 5.20 0.00 -3.39 -0.78 0.13 -1.75 -3.44 132.00 127.96 1wvr h PRO 160 Ca 0.19 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.29 1wvr h PRO 160 Cb 0.81 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.84 1wvr h PRO 160 CO 0.58 0.00 -0.02 1.52 -0.23 0.00 0.00 178.00 179.85 1wvr s TYR 161 N -3.64 -0.04 -0.24 1.56 -0.85 -1.26 -1.26 117.35 111.62 1wvr s TYR 161 Ca -0.01 -0.31 -0.25 0.00 -0.52 0.00 0.00 57.07 55.99 1wvr s TYR 161 Cb 0.09 0.33 -0.01 0.00 0.38 0.00 0.00 41.96 42.75 1wvr s TYR 161 CO 0.34 -0.89 0.83 0.21 -1.52 0.00 0.00 175.55 174.51 1wvr s LYS 162 N -3.89 4.19 0.19 -3.49 2.20 -1.26 -5.01 119.74 112.67 1wvr s LYS 162 Ca 0.10 0.95 -0.30 0.00 -0.36 0.00 0.00 55.97 56.36 1wvr s LYS 162 Cb -0.00 -3.64 -0.09 0.00 -1.51 0.00 0.00 37.83 32.59 1wvr s LYS 162 CO -0.02 -0.51 1.32 0.45 -0.36 0.00 0.00 175.35 176.22 1wvr s SER 163 N 1.33 6.88 0.00 1.43 0.15 -1.26 -0.71 113.70 121.53 1wvr s SER 163 Ca 0.35 2.40 0.00 0.00 0.70 0.00 0.00 55.95 59.40 1wvr s SER 163 Cb -0.15 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 1wvr s SER 163 CO 0.07 -0.54 0.00 0.61 1.20 0.00 0.00 173.24 174.58 1wvr n GLY 164 N 2.45 -1.69 3.75 9.45 0.00 -0.19 -4.69 105.19 114.26 1wvr n GLY 164 Ca 0.07 -1.22 -0.41 0.00 0.00 0.00 0.00 46.02 44.45 1wvr n GLY 164 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1wvr s PRO 165 N -1.89 4.18 -0.02 1.61 0.02 -1.26 -3.36 135.00 134.27 1wvr s PRO 165 Ca 0.00 2.47 -0.37 0.00 0.02 0.00 0.00 61.00 63.12 1wvr s PRO 165 Cb 0.00 -3.06 -0.15 0.00 0.02 0.00 0.00 34.50 31.30 1wvr s PRO 165 CO 0.00 -0.56 1.58 -2.30 -0.33 0.00 0.00 177.00 175.39 1wvr n PRO 166 N 2.42 1.51 -1.09 5.54 -0.02 -1.22 0.12 135.00 142.26 1wvr n PRO 166 Ca 0.08 0.55 -0.03 0.00 -2.02 0.00 0.00 63.50 62.08 1wvr n PRO 166 Cb 0.38 -2.26 -0.01 0.00 -0.02 0.00 0.00 33.50 31.59 1wvr n PRO 166 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wvr h GLY 168 N 0.00 0.53 -0.84 0.00 0.00 -0.12 0.29 103.07 102.93 1wvr h GLY 168 Ca -0.06 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1wvr h GLY 168 CO 0.09 0.06 0.00 1.22 0.00 0.00 0.00 176.54 177.91 1wvr n ASP 169 N -4.46 1.79 -2.92 0.19 10.43 -0.07 -4.43 116.55 117.09 1wvr n ASP 169 Ca 0.12 -1.66 -0.13 0.00 2.57 0.00 0.00 54.79 55.69 1wvr n ASP 169 Cb 0.49 -0.07 0.04 0.00 1.84 0.00 0.00 41.12 43.42 1wvr n ASP 169 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1wvr h PRO 171 N 2.95 0.41 -0.54 0.00 0.11 -1.70 -1.99 132.00 131.24 1wvr h PRO 171 Ca -0.02 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1wvr h PRO 171 Cb 1.06 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1wvr h PRO 171 CO 0.29 0.27 0.00 0.43 -0.21 0.00 0.00 178.00 178.78 1wvr n SER 172 N -4.47 3.27 -2.90 -2.05 7.64 -1.26 -4.36 113.62 109.49 1wvr n SER 172 Ca 0.07 -1.98 -0.12 0.00 1.01 0.00 0.00 58.87 57.85 1wvr n SER 172 Cb 0.26 -0.36 0.03 0.00 -1.01 0.00 0.00 64.21 63.14 1wvr n SER 172 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1wvr n ASP 173 N 1.31 -0.29 -4.38 6.43 9.92 -0.76 -5.09 116.55 123.69 1wvr n ASP 173 Ca 0.20 -3.07 -0.32 0.00 -0.53 0.00 0.00 54.79 51.07 1wvr n ASP 173 Cb 0.54 0.32 -0.15 0.00 -0.64 0.00 0.00 41.12 41.19 1wvr n ASP 173 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wvr s ASP 175 N -0.23 3.50 -1.13 0.00 3.68 0.42 -4.90 116.67 118.00 1wvr s ASP 175 Ca -0.00 -2.28 -0.13 0.00 2.13 0.00 0.00 52.55 52.27 1wvr s ASP 175 Cb -0.13 -0.78 -0.03 0.00 -1.45 0.00 0.00 42.92 40.53 1wvr s ASP 175 CO 0.03 -0.31 0.82 0.59 0.13 0.00 0.00 175.17 176.43 1wvr n ASN 176 N 3.97 -5.13 0.00 -0.34 4.13 -1.26 -2.56 115.26 114.08 1wvr n ASN 176 Ca 0.07 -0.89 0.00 0.00 1.68 0.00 0.00 54.58 55.45 1wvr n ASN 176 Cb 0.37 -4.09 0.00 0.00 -1.54 0.00 0.00 39.78 34.52 1wvr n ASN 176 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1wvr n GLY 177 N -1.52 0.91 3.22 7.41 0.00 -1.26 -4.88 105.19 109.06 1wvr n GLY 177 Ca -0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.62 1wvr n GLY 177 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wvr s LEU 178 N 0.00 2.02 0.30 0.99 1.43 -1.06 -4.20 118.68 118.16 1wvr s LEU 178 Ca 0.00 -0.40 -0.27 0.00 -1.03 0.00 0.00 54.13 52.43 1wvr s LEU 178 Cb 0.00 -1.12 -0.10 0.00 0.03 0.00 0.00 46.19 45.00 1wvr s LEU 178 CO 0.00 0.23 0.94 0.00 0.23 0.00 0.00 176.35 177.76 1wvr n THR 180 N 0.78 1.87 -3.15 0.00 -2.24 -0.64 -0.14 114.28 110.76 1wvr n THR 180 Ca 0.01 -1.94 -0.27 0.00 -2.27 0.00 0.00 64.05 59.59 1wvr n THR 180 Cb 0.49 -0.12 -0.06 0.00 -2.10 0.00 0.00 70.33 68.54 1wvr n THR 180 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1wvr n ASN 181 N -0.93 4.10 -4.78 3.42 6.94 -1.26 -5.04 115.26 117.71 1wvr n ASN 181 Ca 0.16 -3.57 -0.35 0.00 -0.02 0.00 0.00 54.58 50.80 1wvr n ASN 181 Cb 0.67 -0.61 -0.00 0.00 -2.36 0.00 0.00 39.78 37.47 1wvr n ASN 181 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1wvr s PRO 182 N -3.03 3.43 -0.25 -0.53 0.04 -1.26 -0.49 135.00 132.92 1wvr s PRO 182 Ca 0.45 1.54 -0.21 0.00 0.04 0.00 0.00 61.00 62.82 1wvr s PRO 182 Cb 0.23 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.72 1wvr s PRO 182 CO -0.08 -0.77 0.64 0.00 0.04 0.00 0.00 177.00 176.82 1wvr n THR 184 N 5.16 0.89 -3.85 0.00 -2.24 -1.26 -4.94 114.28 108.04 1wvr n THR 184 Ca -0.00 -0.93 -0.22 0.00 -2.27 0.00 0.00 64.05 60.62 1wvr n THR 184 Cb 0.49 0.57 -0.05 0.00 -2.10 0.00 0.00 70.33 69.24 1wvr n THR 184 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1wvr s ARG 185 N -1.11 2.49 -0.15 -0.78 1.81 -1.26 -5.12 118.95 114.84 1wvr s ARG 185 Ca 0.47 -1.53 -0.05 0.00 -1.72 0.00 0.00 55.73 52.90 1wvr s ARG 185 Cb 0.25 -2.29 0.07 0.00 -0.45 0.00 0.00 34.95 32.53 1wvr s ARG 185 CO 0.33 -0.03 0.31 -2.00 -0.68 0.00 0.00 175.30 173.22 1wvr s GLU 186 N -3.99 0.20 0.68 3.54 2.12 -1.26 -4.72 118.70 115.27 1wvr s GLU 186 Ca 0.43 0.83 -0.17 0.00 0.36 0.00 0.00 54.97 56.41 1wvr s GLU 186 Cb -0.03 0.07 -0.00 0.00 0.26 0.00 0.00 34.13 34.43 1wvr s GLU 186 CO 0.25 -0.27 1.12 0.09 -0.54 0.00 0.00 175.26 175.91 1wvr n ASN 187 N 5.31 1.23 -0.04 -1.70 5.03 -1.26 -4.69 115.26 119.14 1wvr n ASN 187 Ca -0.08 0.75 -0.15 0.00 0.87 0.00 0.00 54.58 55.97 1wvr n ASN 187 Cb 0.50 -1.47 -0.14 0.00 -1.02 0.00 0.00 39.78 37.65 1wvr n ASN 187 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1wvr n GLU 188 N -1.85 0.69 -4.17 3.52 -0.58 -0.73 -4.94 120.64 112.58 1wvr n GLU 188 Ca 0.14 0.22 -0.32 0.00 -0.42 0.00 0.00 57.16 56.79 1wvr n GLU 188 Cb 0.49 -1.69 -0.08 0.00 -0.57 0.00 0.00 31.44 29.59 1wvr n GLU 188 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1wvr s PHE 189 N -2.56 3.15 -0.28 -0.32 0.08 -1.26 -5.01 117.98 111.78 1wvr s PHE 189 Ca -0.17 0.10 0.28 0.00 0.12 0.00 0.00 56.93 57.26 1wvr s PHE 189 Cb 0.07 -1.67 1.09 0.00 -0.57 0.00 0.00 43.02 41.95 1wvr s PHE 189 CO 0.77 0.50 1.82 1.79 -0.10 0.00 0.00 175.22 180.00 1wvr h THR 190 N 3.21 0.00 -0.29 0.64 1.35 -1.98 -2.98 112.91 112.85 1wvr h THR 190 Ca -0.48 -0.39 -0.16 0.00 -0.55 0.00 0.00 66.41 64.83 1wvr h THR 190 Cb 1.17 1.25 -0.10 0.00 -1.73 0.00 0.00 68.15 68.74 1wvr h THR 190 CO 0.60 0.00 -0.24 -0.46 -0.25 0.00 0.00 175.52 175.18 1wvr n ASN 191 N -2.60 2.48 -0.20 5.36 6.94 -1.26 -4.72 115.26 121.28 1wvr n ASN 191 Ca 0.02 -3.83 0.09 0.00 -0.02 0.00 0.00 54.58 50.84 1wvr n ASN 191 Cb 0.29 -0.59 0.39 0.00 -2.36 0.00 0.00 39.78 37.50 1wvr n ASN 191 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wvr h ASP 193 N 0.67 -0.80 -0.88 0.00 5.19 -1.87 0.80 116.42 119.52 1wvr h ASP 193 Ca 0.35 0.05 0.06 0.00 -0.62 0.00 0.00 57.03 56.87 1wvr h ASP 193 Cb 0.47 0.24 -0.06 0.00 0.18 0.00 0.00 39.33 40.15 1wvr h ASP 193 CO -0.13 -0.50 0.55 -1.28 -3.12 0.00 0.00 179.24 174.77 1wvr h SER 194 N -0.79 0.88 -0.22 6.45 0.87 -1.83 0.35 113.55 119.26 1wvr h SER 194 Ca -0.06 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.53 1wvr h SER 194 Cb 0.65 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 1wvr h SER 194 CO 0.06 0.56 0.08 -0.07 -0.53 0.00 0.00 176.83 176.93 1wvr h LEU 195 N 1.01 0.10 -0.79 2.23 3.38 -0.91 -2.41 115.31 117.92 1wvr h LEU 195 Ca 0.38 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.29 1wvr h LEU 195 Cb 0.16 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1wvr h LEU 195 CO -0.17 0.09 0.02 0.58 0.09 0.00 0.00 178.44 179.05 1wvr h VAL 196 N 0.19 1.25 -0.05 1.22 2.07 -0.05 -2.20 116.25 118.68 1wvr h VAL 196 Ca 0.09 -1.06 0.02 0.00 0.82 0.00 0.00 66.70 66.57 1wvr h VAL 196 Cb 0.05 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1wvr h VAL 196 CO -0.09 0.38 0.17 -0.61 0.02 0.00 0.00 177.57 177.45 1wvr h GLN 197 N 0.87 0.00 0.00 1.57 5.75 0.15 -3.22 115.11 120.23 1wvr h GLN 197 Ca 0.17 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.67 1wvr h GLN 197 Cb 0.48 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.03 1wvr h GLN 197 CO 0.02 0.00 0.00 1.63 -2.65 0.00 0.00 178.83 177.83 1wvr n LYS 198 N -3.22 0.00 0.00 1.69 4.76 -0.84 -4.95 118.16 115.60 1wvr n LYS 198 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 1wvr n LYS 198 Cb 0.25 -0.36 0.00 0.00 -1.84 0.00 0.00 35.03 33.08 1wvr n LYS 198 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1wvr n SER 199 N -0.76 0.00 -3.62 4.39 7.64 -1.15 -5.09 113.62 115.03 1wvr n SER 199 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.85 1wvr n SER 199 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1wvr n SER 199 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1wvr s SER 200 N -1.76 -0.08 0.00 6.43 1.04 -1.24 -4.98 113.70 113.11 1wvr s SER 200 Ca 0.00 0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.43 1wvr s SER 200 Cb 0.00 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.20 1wvr s SER 200 CO 0.00 -0.13 0.59 0.00 0.98 0.00 0.00 173.24 174.68 1wvr n GLN 202 N 0.21 0.67 -3.79 0.00 6.02 -1.26 -4.85 117.38 114.37 1wvr n GLN 202 Ca 0.00 0.16 -0.35 0.00 -0.01 0.00 0.00 57.00 56.80 1wvr n GLN 202 Cb 0.29 -1.66 -0.09 0.00 1.02 0.00 0.00 30.24 29.80 1wvr n GLN 202 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1wvr s ASP 203 N -5.93 5.96 0.00 1.08 -1.08 -1.19 -4.96 116.67 110.55 1wvr s ASP 203 Ca -0.10 0.13 0.00 0.00 -0.52 0.00 0.00 52.55 52.06 1wvr s ASP 203 Cb 0.07 -2.05 0.00 0.00 -1.46 0.00 0.00 42.92 39.48 1wvr s ASP 203 CO 0.81 0.13 0.51 0.59 0.52 0.00 0.00 175.17 177.73 1wvr n ASN 204 N 3.84 0.00 0.09 -0.34 3.02 -1.26 -3.01 115.26 117.59 1wvr n ASN 204 Ca -0.16 0.10 -0.10 0.00 -0.03 0.00 0.00 54.58 54.39 1wvr n ASN 204 Cb 0.52 -0.10 -0.06 0.00 -0.61 0.00 0.00 39.78 39.53 1wvr n ASN 204 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1wvr h TYR 205 N 0.00 -0.86 0.00 3.10 -1.99 -1.93 -3.25 116.97 112.04 1wvr h TYR 205 Ca 0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1wvr h TYR 205 Cb 0.57 0.36 0.00 0.00 2.00 0.00 0.00 36.73 39.66 1wvr h TYR 205 CO 0.00 -0.35 -0.78 -1.33 -0.00 0.00 0.00 178.16 175.70 1wvr n MET 206 N -4.16 0.25 0.06 4.88 2.81 -1.16 -3.82 117.12 115.97 1wvr n MET 206 Ca -0.05 0.04 0.12 0.00 -1.81 0.00 0.00 57.70 56.00 1wvr n MET 206 Cb 0.24 -1.62 0.59 0.00 -0.71 0.00 0.00 33.22 31.72 1wvr n MET 206 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1wvr h LYS 207 N 0.00 0.17 0.01 0.03 1.57 -1.67 1.43 116.57 118.11 1wvr h LYS 207 Ca 0.00 -0.01 -0.32 0.00 -1.87 0.00 0.00 60.65 58.45 1wvr h LYS 207 Cb 0.71 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.93 1wvr h LYS 207 CO 0.00 0.11 -1.89 -1.13 -0.57 0.00 0.00 179.45 175.97 1wvr n SER 208 N -4.47 0.87 0.08 0.86 3.41 -1.24 -3.57 113.62 109.56 1wvr n SER 208 Ca 0.05 0.30 0.08 0.00 -0.26 0.00 0.00 58.87 59.04 1wvr n SER 208 Cb 0.31 0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.28 1wvr n SER 208 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1wvr n LYS 209 N -3.04 0.61 -2.92 4.33 4.76 -0.95 -4.45 118.16 116.50 1wvr n LYS 209 Ca -0.22 0.14 -0.20 0.00 -2.87 0.00 0.00 58.31 55.16 1wvr n LYS 209 Cb 1.07 -1.82 -0.02 0.00 -1.84 0.00 0.00 35.03 32.43 1wvr n LYS 209 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1wvr h PRO 211 N 2.94 0.12 -0.11 0.00 0.11 -1.67 -1.35 132.00 132.04 1wvr h PRO 211 Ca 0.09 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.22 1wvr h PRO 211 Cb 0.89 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.95 1wvr h PRO 211 CO 0.63 0.08 -0.03 0.00 -0.21 0.00 0.00 178.00 178.47 1wvr h ALA 212 N 1.18 0.07 0.00 -0.75 0.00 -1.84 0.61 119.26 118.53 1wvr h ALA 212 Ca 0.11 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1wvr h ALA 212 Cb 0.12 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1wvr h ALA 212 CO -0.16 -0.49 -0.06 0.77 0.00 0.00 0.00 179.25 179.32 1wvr h SER 213 N -0.01 0.00 0.34 0.00 0.02 -1.91 0.05 113.55 112.03 1wvr h SER 213 Ca 0.05 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.68 1wvr h SER 213 Cb 0.09 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.58 1wvr h SER 213 CO -0.11 0.06 -1.87 0.00 -1.14 0.00 0.00 176.83 173.76 1wvr n PHE 215 N -3.15 0.00 -0.77 0.00 0.99 0.20 -4.73 117.46 110.00 1wvr n PHE 215 Ca -0.23 0.00 0.08 0.00 -0.00 0.00 0.00 57.45 57.30 1wvr n PHE 215 Cb 1.06 0.00 0.35 0.00 -1.00 0.00 0.00 39.48 39.89 1wvr n PHE 215 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1wvr h GLN 217 N 3.63 0.21 -0.55 0.00 7.50 -1.83 -0.87 115.11 123.21 1wvr h GLN 217 Ca 0.00 -0.01 -0.35 0.00 0.50 0.00 0.00 58.65 58.79 1wvr h GLN 217 Cb 1.63 -0.05 -0.22 0.00 0.05 0.00 0.00 27.48 28.89 1wvr h GLN 217 CO 0.32 0.14 -0.12 0.27 -1.50 0.00 0.00 178.83 177.94 1wvr n ASN 218 N -4.45 3.83 -4.22 1.46 6.94 -1.26 -4.99 115.26 112.57 1wvr n ASN 218 Ca 0.09 -3.79 -0.13 0.00 -0.02 0.00 0.00 54.58 50.73 1wvr n ASN 218 Cb 0.43 -0.62 -0.10 0.00 -2.36 0.00 0.00 39.78 37.14 1wvr n ASN 218 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1wvr s LYS 219 N -3.43 0.97 -0.23 -3.83 3.01 -0.33 -4.97 119.74 110.92 1wvr s LYS 219 Ca 0.49 -1.40 -0.24 0.00 -1.01 0.00 0.00 55.97 53.82 1wvr s LYS 219 Cb 0.42 -0.47 -0.01 0.00 -1.01 0.00 0.00 37.83 36.76 1wvr s LYS 219 CO 0.01 0.04 0.78 0.42 0.51 0.00 0.00 175.35 177.11 1wvr s ILE 220 N -3.40 4.88 -1.36 2.17 -1.09 0.36 -4.80 121.20 117.96 1wvr s ILE 220 Ca 0.14 1.47 0.11 0.00 -2.23 0.00 0.00 60.65 60.14 1wvr s ILE 220 Cb 0.03 -4.07 0.09 0.00 -1.58 0.00 0.00 42.46 36.92 1wvr s ILE 220 CO -0.01 -0.03 0.84 -0.38 -1.23 0.00 0.00 174.94 174.13