#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pvm s PHE 2 N 0.00 0.16 -0.30 2.03 0.08 -1.26 -5.01 117.98 113.68 1pvm s PHE 2 Ca 0.00 -0.34 -0.15 0.00 0.12 0.00 0.00 56.93 56.56 1pvm s PHE 2 Cb 0.00 -0.12 0.18 0.00 -0.57 0.00 0.00 43.02 42.50 1pvm s PHE 2 CO 0.00 -0.22 1.08 1.41 -0.10 0.00 0.00 175.22 177.38 1pvm s MET 3 N -1.38 0.19 0.17 0.44 -2.45 -1.26 -5.04 119.30 109.97 1pvm s MET 3 Ca -0.15 0.41 -0.27 0.00 -1.25 0.00 0.00 55.69 54.42 1pvm s MET 3 Cb -0.09 0.24 -0.08 0.00 1.25 0.00 0.00 34.83 36.15 1pvm s MET 3 CO 0.00 -0.14 0.84 -0.98 1.05 0.00 0.00 175.02 175.80 1pvm s ARG 4 N 2.63 4.66 0.39 4.11 1.70 -1.26 -0.32 118.95 130.87 1pvm s ARG 4 Ca -0.01 1.28 0.16 0.00 -0.47 0.00 0.00 55.73 56.69 1pvm s ARG 4 Cb -0.07 -3.29 1.03 0.00 -0.57 0.00 0.00 34.95 32.04 1pvm s ARG 4 CO -0.14 0.48 1.81 -0.39 -1.08 0.00 0.00 175.30 175.99 1pvm h VAL 5 N 3.44 0.63 -1.07 4.99 -1.51 -1.19 -2.00 116.25 119.54 1pvm h VAL 5 Ca -0.46 -0.16 0.29 0.00 -1.23 0.00 0.00 66.70 65.14 1pvm h VAL 5 Cb 1.20 0.12 -0.10 0.00 -2.13 0.00 0.00 31.29 30.39 1pvm h VAL 5 CO 0.68 0.09 0.69 -0.08 -1.23 0.00 0.00 177.57 177.71 1pvm h GLU 6 N 0.47 0.34 -0.16 5.19 4.81 -1.74 0.17 114.58 123.67 1pvm h GLU 6 Ca 0.53 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.64 1pvm h GLU 6 Cb 1.23 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 1pvm h GLU 6 CO -0.25 0.22 -0.34 0.87 -0.73 0.00 0.00 179.01 178.79 1pvm h LYS 7 N 0.35 0.32 0.00 1.92 1.57 -1.67 -3.30 116.57 115.76 1pvm h LYS 7 Ca 0.62 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 59.27 1pvm h LYS 7 Cb 1.65 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.94 1pvm h LYS 7 CO -0.31 0.62 -0.88 0.44 -0.57 0.00 0.00 179.45 178.75 1pvm n ILE 8 N -4.08 0.00 -0.65 1.86 -5.35 0.33 -5.02 119.36 106.44 1pvm n ILE 8 Ca -0.01 -0.19 -0.28 0.00 -0.27 0.00 0.00 62.75 62.00 1pvm n ILE 8 Cb 0.44 0.85 0.24 0.00 -1.74 0.00 0.00 39.64 39.42 1pvm n ILE 8 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1pvm s MET 9 N -2.51 -0.67 -0.36 6.28 0.23 0.33 -4.95 119.30 117.64 1pvm s MET 9 Ca 0.04 0.80 -0.06 0.00 -1.03 0.00 0.00 55.69 55.44 1pvm s MET 9 Cb 0.11 -1.59 0.05 0.00 -1.53 0.00 0.00 34.83 31.88 1pvm s MET 9 CO 0.61 -3.55 0.14 1.21 -2.03 0.00 0.00 175.02 171.40 1pvm s ASN 10 N -2.68 5.35 0.00 -1.18 3.04 -0.50 -4.93 114.94 114.05 1pvm s ASN 10 Ca 0.68 -1.30 0.30 0.00 0.04 0.00 0.00 52.86 52.57 1pvm s ASN 10 Cb -0.24 -1.88 1.40 0.00 -1.54 0.00 0.00 41.25 38.99 1pvm s ASN 10 CO 0.63 -0.39 1.95 -1.20 -3.04 0.00 0.00 177.10 175.06 1pvm n SER 11 N 4.80 0.60 -0.98 -4.21 7.64 -1.26 -1.63 113.62 118.58 1pvm n SER 11 Ca -0.11 -0.97 0.05 0.00 1.01 0.00 0.00 58.87 58.85 1pvm n SER 11 Cb 0.44 -0.03 0.20 0.00 -1.01 0.00 0.00 64.21 63.81 1pvm n SER 11 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1pvm n ASN 12 N -0.65 2.81 -4.34 6.43 4.05 -1.26 -4.83 115.26 117.47 1pvm n ASN 12 Ca 0.19 -2.22 -0.32 0.00 0.45 0.00 0.00 54.58 52.67 1pvm n ASN 12 Cb 0.24 -0.42 0.16 0.00 1.23 0.00 0.00 39.78 41.00 1pvm n ASN 12 CO 0.00 0.00 0.00 2.22 -3.05 0.00 0.00 177.26 176.43 1pvm n PHE 13 N 0.55 -1.39 -4.88 1.20 1.16 -1.24 -5.03 117.46 107.84 1pvm n PHE 13 Ca 0.14 0.15 -0.33 0.00 -1.87 0.00 0.00 57.45 55.55 1pvm n PHE 13 Cb 0.53 -1.65 -0.14 0.00 -1.61 0.00 0.00 39.48 36.62 1pvm n PHE 13 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 1pvm s LYS 14 N -3.58 2.77 -0.05 3.97 1.02 -1.26 -5.07 119.74 117.54 1pvm s LYS 14 Ca 0.57 -0.70 0.04 0.00 0.02 0.00 0.00 55.97 55.89 1pvm s LYS 14 Cb -0.16 -2.44 -0.02 0.00 -0.52 0.00 0.00 37.83 34.68 1pvm s LYS 14 CO 0.66 0.49 -0.15 0.99 -0.92 0.00 0.00 175.35 176.42 1pvm s THR 15 N -0.37 3.02 0.11 2.17 2.01 -1.26 -2.04 115.64 119.29 1pvm s THR 15 Ca 0.04 -0.73 0.06 0.00 0.31 0.00 0.00 61.69 61.36 1pvm s THR 15 Cb -0.12 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 1pvm s THR 15 CO 0.02 0.59 -0.14 0.68 -0.69 0.00 0.00 174.62 175.08 1pvm s VAL 16 N -0.67 1.27 0.35 3.82 -7.23 -0.58 -4.98 120.40 112.39 1pvm s VAL 16 Ca 0.10 -1.64 -0.27 0.00 -1.81 0.00 0.00 61.98 58.36 1pvm s VAL 16 Cb -0.11 -1.45 -0.09 0.00 0.56 0.00 0.00 36.38 35.29 1pvm s VAL 16 CO 0.01 -0.39 1.14 0.21 -0.31 0.00 0.00 175.10 175.76 1pvm s ASN 17 N -2.33 6.84 0.00 4.85 3.84 -1.26 -1.36 114.94 125.52 1pvm s ASN 17 Ca 0.07 2.30 0.04 0.00 0.21 0.00 0.00 52.86 55.48 1pvm s ASN 17 Cb -0.06 -2.62 0.18 0.00 -0.55 0.00 0.00 41.25 38.21 1pvm s ASN 17 CO 0.03 -0.45 1.09 -2.67 -2.79 0.00 0.00 177.10 172.31 1pvm n TRP 18 N 0.50 0.00 0.45 0.43 4.27 -0.08 -1.18 117.44 121.83 1pvm n TRP 18 Ca 0.02 0.00 0.11 0.00 -3.89 0.00 0.00 57.50 53.74 1pvm n TRP 18 Cb 0.46 -0.45 0.17 0.00 -1.36 0.00 0.00 31.31 30.13 1pvm n TRP 18 CO 0.00 0.00 0.00 0.09 -2.29 0.00 0.00 177.69 175.49 1pvm n ASN 19 N -1.45 3.22 -4.76 -0.67 5.03 -1.26 -1.96 115.26 113.41 1pvm n ASN 19 Ca 0.01 -1.95 -0.41 0.00 0.87 0.00 0.00 54.58 53.10 1pvm n ASN 19 Cb 0.04 -0.17 -0.02 0.00 -1.02 0.00 0.00 39.78 38.62 1pvm n ASN 19 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1pvm s THR 20 N -1.54 2.49 0.69 3.41 2.01 -0.33 -4.69 115.64 117.68 1pvm s THR 20 Ca 0.33 0.45 -0.11 0.00 0.31 0.00 0.00 61.69 62.67 1pvm s THR 20 Cb 0.21 -3.29 0.01 0.00 0.01 0.00 0.00 72.50 69.43 1pvm s THR 20 CO 0.29 0.09 1.06 0.42 -0.69 0.00 0.00 174.62 175.79 1pvm s THR 21 N -0.61 3.97 0.29 -0.82 -4.23 -1.26 -0.52 115.64 112.46 1pvm s THR 21 Ca 0.55 0.67 -0.01 0.00 -1.18 0.00 0.00 61.69 61.72 1pvm s THR 21 Cb -0.43 -3.37 0.28 0.00 1.34 0.00 0.00 72.50 70.32 1pvm s THR 21 CO 0.51 -0.81 1.91 0.58 -0.54 0.00 0.00 174.62 176.27 1pvm h VAL 22 N -0.63 1.10 0.22 2.29 2.07 -0.58 -0.51 116.25 120.21 1pvm h VAL 22 Ca -0.44 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 66.70 1pvm h VAL 22 Cb 1.21 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1pvm h VAL 22 CO 0.56 0.20 -0.20 0.15 0.02 0.00 0.00 177.57 178.31 1pvm h PHE 23 N 1.11 -0.53 -0.52 1.57 3.57 -1.49 0.02 116.94 120.67 1pvm h PHE 23 Ca 0.40 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.82 1pvm h PHE 23 Cb 0.14 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 1pvm h PHE 23 CO -0.00 -0.30 0.01 -0.44 -2.23 0.00 0.00 178.31 175.35 1pvm h ASP 24 N -0.45 0.85 -0.52 0.41 3.32 -1.75 -1.80 116.42 116.49 1pvm h ASP 24 Ca -0.01 -0.21 -0.06 0.00 0.02 0.00 0.00 57.03 56.77 1pvm h ASP 24 Cb 0.41 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1pvm h ASP 24 CO -0.04 0.90 0.08 0.00 -1.72 0.00 0.00 179.24 178.47 1pvm h ALA 25 N 1.19 0.69 -0.11 3.45 0.00 -0.87 -2.47 119.26 121.14 1pvm h ALA 25 Ca 0.16 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1pvm h ALA 25 Cb 0.47 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1pvm h ALA 25 CO 0.02 0.43 -0.42 0.28 0.00 0.00 0.00 179.25 179.56 1pvm h VAL 26 N 0.74 1.31 -0.75 0.00 2.07 -0.84 -1.63 116.25 117.16 1pvm h VAL 26 Ca 0.16 -1.54 -0.04 0.00 0.82 0.00 0.00 66.70 66.09 1pvm h VAL 26 Cb 0.41 1.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1pvm h VAL 26 CO 0.01 0.46 0.29 0.11 0.02 0.00 0.00 177.57 178.46 1pvm h LYS 27 N 0.20 1.11 -0.43 1.57 1.57 -1.12 0.12 116.57 119.60 1pvm h LYS 27 Ca 0.02 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.56 1pvm h LYS 27 Cb 0.83 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 1pvm h LYS 27 CO 0.07 0.90 0.12 0.82 -0.57 0.00 0.00 179.45 180.79 1pvm h ILE 28 N 1.09 1.23 -0.19 1.86 2.04 -0.97 -0.51 117.51 122.05 1pvm h ILE 28 Ca 0.25 -0.76 -0.00 0.00 1.00 0.00 0.00 64.86 65.34 1pvm h ILE 28 Cb 0.21 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1pvm h ILE 28 CO -0.02 0.27 0.11 0.24 0.00 0.00 0.00 178.15 178.75 1pvm h MET 29 N 0.55 0.26 -0.68 2.37 2.86 -0.79 -1.81 114.93 117.69 1pvm h MET 29 Ca 0.14 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1pvm h MET 29 Cb 0.29 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 1pvm h MET 29 CO -0.00 0.23 0.15 -0.91 1.06 0.00 0.00 176.91 177.44 1pvm h ASN 30 N 0.21 1.03 0.64 1.22 2.35 -0.65 0.19 115.58 120.57 1pvm h ASN 30 Ca 0.07 -0.22 -0.13 0.00 -0.55 0.00 0.00 56.30 55.47 1pvm h ASN 30 Cb 0.05 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.13 1pvm h ASN 30 CO -0.01 0.99 -0.61 1.05 -1.65 0.00 0.00 177.43 177.20 1pvm h GLU 31 N 1.03 0.00 0.00 0.81 4.11 -0.98 -3.21 114.58 116.35 1pvm h GLU 31 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.64 1pvm h GLU 31 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1pvm h GLU 31 CO 0.00 0.61 -0.94 0.09 0.07 0.00 0.00 179.01 178.84 1pvm n ASN 32 N -3.78 0.86 -3.39 3.06 4.13 -0.69 -4.97 115.26 110.48 1pvm n ASN 32 Ca -0.01 -0.80 -0.23 0.00 1.68 0.00 0.00 54.58 55.22 1pvm n ASN 32 Cb 0.62 0.89 0.07 0.00 -1.54 0.00 0.00 39.78 39.81 1pvm n ASN 32 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 1pvm n HIS 33 N -1.54 -2.61 -3.90 3.10 8.25 0.63 -4.98 115.22 114.17 1pvm n HIS 33 Ca 0.04 0.88 -0.29 0.00 -0.26 0.00 0.00 57.72 58.08 1pvm n HIS 33 Cb 0.34 -4.84 -0.16 0.00 1.12 0.00 0.00 29.99 26.45 1pvm n HIS 33 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1pvm s LEU 34 N -7.04 2.10 -0.69 2.41 1.43 -0.96 -5.03 118.68 110.90 1pvm s LEU 34 Ca 0.51 -0.99 -0.02 0.00 -1.03 0.00 0.00 54.13 52.60 1pvm s LEU 34 Cb -0.22 -1.02 0.40 0.00 0.03 0.00 0.00 46.19 45.37 1pvm s LEU 34 CO 0.63 -0.23 2.06 -1.22 0.23 0.00 0.00 176.35 177.81 1pvm n TYR 35 N 4.78 3.01 -3.64 0.29 4.01 -1.26 -4.38 117.16 119.97 1pvm n TYR 35 Ca -0.12 -2.75 -0.02 0.00 -0.16 0.00 0.00 57.90 54.85 1pvm n TYR 35 Cb 0.45 -1.35 -0.05 0.00 -0.31 0.00 0.00 39.34 38.08 1pvm n TYR 35 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1pvm s GLY 36 N -1.44 -0.70 -0.03 2.72 0.00 -1.26 -3.87 107.32 102.75 1pvm s GLY 36 Ca 0.59 2.39 0.05 0.00 0.00 0.00 0.00 44.72 47.75 1pvm s GLY 36 CO -0.12 2.96 -0.17 1.08 0.00 0.00 0.00 173.10 176.84 1pvm s LEU 37 N 2.66 1.96 0.05 0.66 1.43 -0.64 -4.78 118.68 120.03 1pvm s LEU 37 Ca -0.07 -0.33 -0.26 0.00 -1.03 0.00 0.00 54.13 52.44 1pvm s LEU 37 Cb -0.11 -0.93 -0.05 0.00 0.03 0.00 0.00 46.19 45.13 1pvm s LEU 37 CO -0.19 0.18 0.79 -0.69 0.23 0.00 0.00 176.35 176.67 1pvm s VAL 38 N -0.16 4.72 -0.12 -1.59 1.01 -0.86 -0.71 120.40 122.68 1pvm s VAL 38 Ca 0.01 1.69 -0.02 0.00 0.00 0.00 0.00 61.98 63.66 1pvm s VAL 38 Cb -0.09 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 1pvm s VAL 38 CO 0.01 0.35 -0.05 -0.69 0.00 0.00 0.00 175.10 174.72 1pvm s VAL 39 N 0.02 3.86 0.15 2.92 1.01 0.58 -1.52 120.40 127.41 1pvm s VAL 39 Ca 0.40 -0.39 0.11 0.00 0.00 0.00 0.00 61.98 62.09 1pvm s VAL 39 Cb -0.21 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 1pvm s VAL 39 CO 0.24 0.54 -0.25 -0.54 0.00 0.00 0.00 175.10 175.09 1pvm s LYS 40 N -0.09 1.38 0.00 2.72 1.02 -0.46 -0.18 119.74 124.13 1pvm s LYS 40 Ca 0.02 -1.38 0.00 0.00 0.02 0.00 0.00 55.97 54.63 1pvm s LYS 40 Cb -0.13 -1.76 0.00 0.00 -0.52 0.00 0.00 37.83 35.42 1pvm s LYS 40 CO 0.03 0.40 0.00 -0.40 -0.92 0.00 0.00 175.35 174.46 1pvm n ASP 41 N 0.70 0.00 0.00 2.83 5.68 0.17 -0.90 116.55 125.03 1pvm n ASP 41 Ca -0.16 -0.78 0.14 0.00 -0.50 0.00 0.00 54.79 53.48 1pvm n ASP 41 Cb 0.54 0.00 0.70 0.00 -1.14 0.00 0.00 41.12 41.23 1pvm n ASP 41 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1pvm n ASP 42 N -2.35 0.00 -0.65 -1.12 8.00 -1.26 -3.28 116.55 115.89 1pvm n ASP 42 Ca 0.00 -0.12 0.07 0.00 0.71 0.00 0.00 54.79 55.45 1pvm n ASP 42 Cb 0.00 -0.28 0.19 0.00 -0.02 0.00 0.00 41.12 41.01 1pvm n ASP 42 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1pvm n ASN 43 N -1.28 3.25 0.00 -2.24 4.13 -1.26 -4.97 115.26 112.89 1pvm n ASN 43 Ca 0.13 -2.59 0.00 0.00 1.68 0.00 0.00 54.58 53.80 1pvm n ASN 43 Cb 0.22 -0.38 0.00 0.00 -1.54 0.00 0.00 39.78 38.08 1pvm n ASN 43 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1pvm n GLY 44 N -0.25 0.52 3.78 7.41 0.00 -1.21 -5.04 105.19 110.40 1pvm n GLY 44 Ca 0.16 -0.37 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 1pvm n GLY 44 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pvm s ASN 45 N -2.34 6.94 -0.48 1.61 0.01 -1.26 -4.86 114.94 114.56 1pvm s ASN 45 Ca 0.00 1.11 -0.29 0.00 -0.71 0.00 0.00 52.86 52.97 1pvm s ASN 45 Cb 0.00 -2.34 0.03 0.00 0.41 0.00 0.00 41.25 39.35 1pvm s ASN 45 CO 0.00 0.16 1.15 -1.81 -1.51 0.00 0.00 177.10 175.10 1pvm s ASP 46 N -0.44 6.61 -0.00 -1.22 1.01 -1.26 -0.66 116.67 120.71 1pvm s ASP 46 Ca 0.29 0.46 0.15 0.00 0.71 0.00 0.00 52.55 54.17 1pvm s ASP 46 Cb -0.18 -2.55 -0.18 0.00 1.01 0.00 0.00 42.92 41.02 1pvm s ASP 46 CO 0.16 -1.28 0.61 1.33 0.21 0.00 0.00 175.17 176.20 1pvm n VAL 47 N 6.86 0.00 -4.02 -1.27 0.24 0.75 -4.85 118.33 116.05 1pvm n VAL 47 Ca 0.12 -0.17 0.03 0.00 -2.04 0.00 0.00 64.34 62.28 1pvm n VAL 47 Cb 0.49 0.86 0.01 0.00 -1.47 0.00 0.00 33.84 33.74 1pvm n VAL 47 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1pvm n GLY 48 N 1.40 0.19 2.82 7.63 0.00 -1.10 -3.80 105.19 112.33 1pvm n GLY 48 Ca 0.02 -1.04 -0.23 0.00 0.00 0.00 0.00 46.02 44.77 1pvm n GLY 48 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pvm s LEU 49 N 0.00 0.83 -0.23 0.99 0.20 -0.79 -0.30 118.68 119.37 1pvm s LEU 49 Ca 0.31 -0.13 -0.19 0.00 0.69 0.00 0.00 54.13 54.81 1pvm s LEU 49 Cb -0.01 -0.51 -0.03 0.00 -0.43 0.00 0.00 46.19 45.21 1pvm s LEU 49 CO -0.01 -0.15 0.53 -0.22 -0.29 0.00 0.00 176.35 176.21 1pvm s LEU 50 N 1.73 4.10 0.33 -0.68 2.96 0.11 -0.64 118.68 126.58 1pvm s LEU 50 Ca 0.02 0.62 0.06 0.00 -0.22 0.00 0.00 54.13 54.61 1pvm s LEU 50 Cb -0.13 -2.71 -0.07 0.00 0.50 0.00 0.00 46.19 43.78 1pvm s LEU 50 CO -0.05 -0.25 -0.01 -0.94 -1.32 0.00 0.00 176.35 173.79 1pvm s SER 51 N 1.35 2.95 0.14 3.68 1.04 -1.26 -1.61 113.70 119.99 1pvm s SER 51 Ca 0.23 -1.30 -0.18 0.00 0.48 0.00 0.00 55.95 55.19 1pvm s SER 51 Cb -0.16 -0.21 -0.02 0.00 0.10 0.00 0.00 66.02 65.74 1pvm s SER 51 CO 0.09 -0.45 1.79 -0.33 0.98 0.00 0.00 173.24 175.33 1pvm h GLU 52 N 2.09 0.38 -0.74 4.02 5.08 -1.98 -2.66 114.58 120.77 1pvm h GLU 52 Ca -0.41 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 57.91 1pvm h GLU 52 Cb 1.24 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.37 1pvm h GLU 52 CO 0.71 0.25 0.41 -0.09 -1.00 0.00 0.00 179.01 179.30 1pvm h ARG 53 N 0.39 1.02 -0.29 2.33 9.65 -1.97 -1.81 114.38 123.71 1pvm h ARG 53 Ca 0.12 -0.11 -0.02 0.00 -1.10 0.00 0.00 59.98 58.87 1pvm h ARG 53 Cb -0.03 -0.21 -0.02 0.00 -1.39 0.00 0.00 29.97 28.33 1pvm h ARG 53 CO -0.04 0.75 0.10 0.66 2.80 0.00 0.00 179.97 184.23 1pvm h SER 54 N 1.03 0.36 -0.16 -3.80 4.64 -1.80 0.17 113.55 113.99 1pvm h SER 54 Ca 0.26 -0.03 -0.16 0.00 -0.47 0.00 0.00 61.79 61.39 1pvm h SER 54 Cb 0.02 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 62.02 1pvm h SER 54 CO -0.04 0.35 -0.53 0.40 -0.87 0.00 0.00 176.83 176.14 1pvm h ILE 55 N 0.41 1.33 -0.60 0.95 2.04 -1.11 0.74 117.51 121.27 1pvm h ILE 55 Ca 0.10 -1.79 -0.09 0.00 1.00 0.00 0.00 64.86 64.08 1pvm h ILE 55 Cb 0.12 2.00 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 1pvm h ILE 55 CO -0.01 0.55 0.00 0.40 0.00 0.00 0.00 178.15 179.10 1pvm h ILE 56 N 0.31 1.26 0.09 -0.67 1.08 -0.84 -0.72 117.51 118.03 1pvm h ILE 56 Ca -0.02 -1.14 -0.32 0.00 -0.39 0.00 0.00 64.86 62.99 1pvm h ILE 56 Cb 1.16 0.79 -0.02 0.00 -3.07 0.00 0.00 36.82 35.68 1pvm h ILE 56 CO 0.11 0.41 -1.70 0.11 -0.69 0.00 0.00 178.15 176.40 1pvm h LYS 57 N 0.96 0.18 -0.01 2.37 1.79 -1.02 -3.38 116.57 117.47 1pvm h LYS 57 Ca 0.17 -0.31 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1pvm h LYS 57 Cb 0.55 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.31 1pvm h LYS 57 CO 0.03 0.97 -0.12 0.54 -1.08 0.00 0.00 179.45 179.80 1pvm n ARG 58 N -3.35 1.74 -0.04 3.15 1.74 0.25 -4.59 116.66 115.56 1pvm n ARG 58 Ca -0.20 -0.62 -0.09 0.00 -0.77 0.00 0.00 57.85 56.16 1pvm n ARG 58 Cb 1.04 -1.03 -0.03 0.00 -1.02 0.00 0.00 32.46 31.42 1pvm n ARG 58 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1pvm n PHE 59 N -0.13 0.00 -0.21 -1.55 7.35 -0.37 -4.69 117.46 117.84 1pvm n PHE 59 Ca 0.03 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.74 1pvm n PHE 59 Cb 0.16 -0.36 0.13 0.00 0.35 0.00 0.00 39.48 39.76 1pvm n PHE 59 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1pvm h ILE 60 N -0.47 0.58 0.00 -2.13 1.08 -1.46 -0.82 117.51 114.28 1pvm h ILE 60 Ca -0.17 -0.08 0.00 0.00 -0.39 0.00 0.00 64.86 64.22 1pvm h ILE 60 Cb 0.90 0.32 0.00 0.00 -3.07 0.00 0.00 36.82 34.97 1pvm h ILE 60 CO -0.11 0.04 0.00 -2.65 -0.69 0.00 0.00 178.15 174.75 1pvm n PRO 61 N -5.17 0.00 0.18 2.37 -0.02 -1.26 -1.39 135.00 129.71 1pvm n PRO 61 Ca 0.10 0.46 0.13 0.00 -2.02 0.00 0.00 63.50 62.17 1pvm n PRO 61 Cb 0.36 -1.50 0.27 0.00 -0.02 0.00 0.00 33.50 32.62 1pvm n PRO 61 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pvm h ARG 62 N 0.00 0.00 -6.21 -0.52 3.08 -1.39 -0.09 114.38 109.25 1pvm h ARG 62 Ca 0.00 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.61 1pvm h ARG 62 Cb 0.04 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.13 1pvm h ARG 62 CO 0.00 0.00 -0.89 -1.71 -1.07 0.00 0.00 179.97 176.30 1pvm n ASN 63 N -2.81 -2.87 -4.25 7.04 5.15 -0.49 -4.65 115.26 112.39 1pvm n ASN 63 Ca 0.04 -0.94 -0.17 0.00 -0.60 0.00 0.00 54.58 52.92 1pvm n ASN 63 Cb 0.48 -3.59 -0.11 0.00 -0.53 0.00 0.00 39.78 36.04 1pvm n ASN 63 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1pvm s LYS 64 N -6.04 1.04 0.48 1.20 -0.14 -1.26 -5.13 119.74 109.89 1pvm s LYS 64 Ca 0.21 -1.31 -0.23 0.00 -1.36 0.00 0.00 55.97 53.29 1pvm s LYS 64 Cb -0.07 -0.82 -0.07 0.00 -1.68 0.00 0.00 37.83 35.20 1pvm s LYS 64 CO 0.85 0.14 1.23 0.15 -0.76 0.00 0.00 175.35 176.95 1pvm s LYS 65 N -3.02 3.58 0.55 1.68 1.02 -1.26 -4.90 119.74 117.39 1pvm s LYS 65 Ca 0.12 1.92 0.25 0.00 0.02 0.00 0.00 55.97 58.27 1pvm s LYS 65 Cb -0.03 -2.37 1.49 0.00 -0.52 0.00 0.00 37.83 36.40 1pvm s LYS 65 CO 0.02 -0.74 2.08 -1.35 -0.92 0.00 0.00 175.35 174.45 1pvm h PRO 66 N 1.89 0.00 -0.11 -1.68 0.11 -1.96 -0.84 132.00 129.41 1pvm h PRO 66 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1pvm h PRO 66 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1pvm h PRO 66 CO 0.59 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.98 1pvm n ASP 67 N -4.15 1.08 -0.55 -2.05 5.68 -1.26 -1.32 116.55 113.98 1pvm n ASP 67 Ca 0.03 -1.61 0.06 0.00 -0.50 0.00 0.00 54.79 52.76 1pvm n ASP 67 Cb 0.35 -0.07 0.10 0.00 -1.14 0.00 0.00 41.12 40.36 1pvm n ASP 67 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1pvm n GLU 68 N -0.06 1.71 -4.17 0.11 1.02 -0.32 -4.94 120.64 113.99 1pvm n GLU 68 Ca 0.15 -1.61 -0.26 0.00 -0.02 0.00 0.00 57.16 55.42 1pvm n GLU 68 Cb 0.24 -1.24 -0.17 0.00 -0.02 0.00 0.00 31.44 30.25 1pvm n GLU 68 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1pvm s VAL 69 N -0.97 1.04 0.29 2.62 1.01 -1.24 -4.97 120.40 118.18 1pvm s VAL 69 Ca 0.18 -0.35 -0.28 0.00 0.00 0.00 0.00 61.98 61.53 1pvm s VAL 69 Cb 0.11 -1.02 -0.09 0.00 0.00 0.00 0.00 36.38 35.38 1pvm s VAL 69 CO 0.15 0.36 1.05 -2.16 0.00 0.00 0.00 175.10 174.49 1pvm s PRO 70 N 1.28 4.61 0.46 2.72 0.04 -1.26 -1.17 135.00 141.67 1pvm s PRO 70 Ca -0.03 1.66 0.31 0.00 0.04 0.00 0.00 61.00 62.98 1pvm s PRO 70 Cb -0.14 -3.08 1.61 0.00 0.04 0.00 0.00 34.50 32.92 1pvm s PRO 70 CO -0.03 0.23 1.95 -0.84 0.04 0.00 0.00 177.00 178.35 1pvm h ILE 71 N 2.94 0.00 0.00 0.56 3.07 -0.88 -2.39 117.51 120.80 1pvm h ILE 71 Ca -0.47 -0.09 -0.00 0.00 1.55 0.00 0.00 64.86 65.85 1pvm h ILE 71 Cb 1.21 0.84 -0.00 0.00 -0.27 0.00 0.00 36.82 38.60 1pvm h ILE 71 CO 0.66 0.00 -0.01 0.08 -1.05 0.00 0.00 178.15 177.83 1pvm h ARG 72 N 0.00 0.00 -0.01 0.16 0.11 -1.66 0.16 114.38 113.13 1pvm h ARG 72 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1pvm h ARG 72 Cb 0.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.19 1pvm h ARG 72 CO 0.00 0.01 -0.10 1.28 0.10 0.00 0.00 179.97 181.26 1pvm n LEU 73 N -4.13 1.35 -0.03 0.08 4.77 -0.90 -4.35 117.00 113.79 1pvm n LEU 73 Ca -0.03 -0.42 -0.05 0.00 -0.03 0.00 0.00 56.01 55.48 1pvm n LEU 73 Cb 0.09 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 1pvm n LEU 73 CO 0.30 0.23 -0.71 0.52 -1.33 0.00 0.00 177.39 176.41 1pvm n VAL 74 N -0.12 0.36 -1.14 4.08 0.31 -0.04 -4.93 118.33 116.85 1pvm n VAL 74 Ca 0.16 -0.12 -0.35 0.00 -0.01 0.00 0.00 64.34 64.02 1pvm n VAL 74 Cb 0.36 -0.98 0.09 0.00 -0.91 0.00 0.00 33.84 32.40 1pvm n VAL 74 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1pvm n MET 75 N -2.87 0.16 -2.15 5.55 0.00 0.36 -4.73 117.12 113.44 1pvm n MET 75 Ca -0.12 0.10 -0.42 0.00 0.00 0.00 0.00 57.70 57.27 1pvm n MET 75 Cb 0.61 -1.93 -0.03 0.00 0.00 0.00 0.00 33.22 31.87 1pvm n MET 75 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 1pvm s ARG 76 N -3.16 4.28 -0.15 3.17 1.81 0.19 -4.83 118.95 120.26 1pvm s ARG 76 Ca 0.65 2.07 -0.11 0.00 -1.72 0.00 0.00 55.73 56.62 1pvm s ARG 76 Cb -0.31 -3.44 0.05 0.00 -0.45 0.00 0.00 34.95 30.80 1pvm s ARG 76 CO 0.59 -0.54 0.39 0.21 -0.68 0.00 0.00 175.30 175.27 1pvm s LYS 77 N 1.89 0.41 0.81 3.54 2.20 -1.26 -1.89 119.74 125.44 1pvm s LYS 77 Ca 0.66 0.66 -0.14 0.00 -0.36 0.00 0.00 55.97 56.79 1pvm s LYS 77 Cb -0.35 0.08 0.06 0.00 -1.51 0.00 0.00 37.83 36.11 1pvm s LYS 77 CO 0.29 -0.11 1.02 -2.30 -0.36 0.00 0.00 175.35 173.88 1pvm n PRO 78 N 3.65 0.15 -1.70 4.03 -0.02 -1.26 -4.08 135.00 135.77 1pvm n PRO 78 Ca -0.19 0.12 -0.42 0.00 -2.02 0.00 0.00 63.50 60.99 1pvm n PRO 78 Cb 0.56 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.72 1pvm n PRO 78 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1pvm s ILE 79 N -2.12 2.51 0.14 4.25 2.07 -1.25 -4.90 121.20 121.91 1pvm s ILE 79 Ca 0.70 0.01 -0.31 0.00 -1.41 0.00 0.00 60.65 59.64 1pvm s ILE 79 Cb -0.29 -3.01 -0.09 0.00 0.13 0.00 0.00 42.46 39.20 1pvm s ILE 79 CO 0.54 -0.00 1.53 -2.84 -1.91 0.00 0.00 174.94 172.25 1pvm s PRO 80 N 2.82 4.24 0.18 3.50 0.02 -1.26 -4.96 135.00 139.54 1pvm s PRO 80 Ca 0.82 2.28 -0.21 0.00 0.02 0.00 0.00 61.00 63.91 1pvm s PRO 80 Cb -0.46 -3.21 0.05 0.00 0.02 0.00 0.00 34.50 30.90 1pvm s PRO 80 CO 0.37 -0.57 0.59 -1.59 -0.33 0.00 0.00 177.00 175.46 1pvm s LYS 81 N 1.25 1.34 0.05 5.54 -2.85 -1.26 -0.72 119.74 123.09 1pvm s LYS 81 Ca 0.69 -0.62 -0.01 0.00 -1.00 0.00 0.00 55.97 55.03 1pvm s LYS 81 Cb -0.42 0.57 -0.04 0.00 -2.06 0.00 0.00 37.83 35.89 1pvm s LYS 81 CO 0.31 -0.59 -0.03 0.14 0.10 0.00 0.00 175.35 175.28 1pvm s VAL 82 N -3.80 0.23 0.44 1.79 -7.23 -0.63 -4.93 120.40 106.27 1pvm s VAL 82 Ca 0.04 -1.59 -0.21 0.00 -1.81 0.00 0.00 61.98 58.40 1pvm s VAL 82 Cb -0.01 -1.22 -0.11 0.00 0.56 0.00 0.00 36.38 35.60 1pvm s VAL 82 CO -0.09 -0.86 0.97 -0.54 -0.31 0.00 0.00 175.10 174.26 1pvm s LYS 83 N -3.30 4.17 0.67 4.82 1.02 -1.26 -0.94 119.74 124.92 1pvm s LYS 83 Ca 0.02 1.17 0.43 0.00 0.02 0.00 0.00 55.97 57.61 1pvm s LYS 83 Cb 0.03 -2.19 2.37 0.00 -0.52 0.00 0.00 37.83 37.52 1pvm s LYS 83 CO -0.07 -0.09 2.34 0.66 -0.92 0.00 0.00 175.35 177.27 1pvm h SER 84 N 1.90 0.00 -0.08 2.83 4.64 -1.25 -1.40 113.55 120.19 1pvm h SER 84 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1pvm h SER 84 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1pvm h SER 84 CO 0.61 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.67 1pvm n ASP 85 N -3.09 1.75 -4.77 4.97 3.85 -1.26 -2.34 116.55 115.66 1pvm n ASP 85 Ca -0.03 -1.63 -0.40 0.00 -0.71 0.00 0.00 54.79 52.03 1pvm n ASP 85 Cb 0.09 -0.05 -0.00 0.00 -1.35 0.00 0.00 41.12 39.82 1pvm n ASP 85 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1pvm s TYR 86 N -1.91 2.75 0.43 2.11 1.51 -0.53 -4.80 117.35 116.91 1pvm s TYR 86 Ca 0.35 1.38 -0.21 0.00 -1.01 0.00 0.00 57.07 57.58 1pvm s TYR 86 Cb 0.20 -3.72 -0.11 0.00 -0.11 0.00 0.00 41.96 38.22 1pvm s TYR 86 CO 0.31 -2.25 0.95 0.34 -1.11 0.00 0.00 175.55 173.79 1pvm s ASP 87 N -0.68 6.93 0.51 2.29 2.15 -1.26 -0.98 116.67 125.63 1pvm s ASP 87 Ca 0.57 1.69 0.26 0.00 0.43 0.00 0.00 52.55 55.51 1pvm s ASP 87 Cb -0.39 -2.54 1.36 0.00 -0.30 0.00 0.00 42.92 41.05 1pvm s ASP 87 CO 0.50 -0.37 1.92 -0.37 -0.17 0.00 0.00 175.17 176.69 1pvm h VAL 88 N 1.91 0.65 -0.05 1.11 -1.51 -1.00 0.35 116.25 117.71 1pvm h VAL 88 Ca -0.49 -0.03 -0.10 0.00 -1.23 0.00 0.00 66.70 64.85 1pvm h VAL 88 Cb 1.18 0.55 -0.01 0.00 -2.13 0.00 0.00 31.29 30.88 1pvm h VAL 88 CO 0.61 0.02 -0.44 0.11 -1.23 0.00 0.00 177.57 176.64 1pvm h LYS 89 N 0.09 0.12 -0.19 5.19 1.57 -1.91 -1.06 116.57 120.37 1pvm h LYS 89 Ca 0.37 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 58.90 1pvm h LYS 89 Cb 1.33 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1pvm h LYS 89 CO -0.04 0.54 -0.64 -0.44 -0.57 0.00 0.00 179.45 178.30 1pvm h ASP 90 N 0.10 0.81 -0.48 0.86 3.45 -0.69 -2.30 116.42 118.17 1pvm h ASP 90 Ca 0.01 -0.47 -0.06 0.00 0.43 0.00 0.00 57.03 56.93 1pvm h ASP 90 Cb 0.82 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 39.34 1pvm h ASP 90 CO 0.06 1.24 0.05 0.58 -1.57 0.00 0.00 179.24 179.61 1pvm h VAL 91 N 0.52 1.25 -0.61 -1.35 2.07 -1.09 -1.40 116.25 115.64 1pvm h VAL 91 Ca -0.01 -0.97 0.04 0.00 0.82 0.00 0.00 66.70 66.58 1pvm h VAL 91 Cb 1.24 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 1pvm h VAL 91 CO 0.13 0.34 0.35 0.00 0.02 0.00 0.00 177.57 178.41 1pvm h ALA 92 N 0.95 0.80 -0.74 1.67 0.00 -1.12 0.12 119.26 120.93 1pvm h ALA 92 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1pvm h ALA 92 Cb 0.43 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1pvm h ALA 92 CO 0.01 0.05 0.30 0.00 0.00 0.00 0.00 179.25 179.62 1pvm h ALA 93 N 1.29 1.12 -0.12 0.00 0.00 -1.17 -0.60 119.26 119.78 1pvm h ALA 93 Ca 0.26 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1pvm h ALA 93 Cb 0.09 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1pvm h ALA 93 CO -0.14 0.63 -0.00 -0.92 0.00 0.00 0.00 179.25 178.82 1pvm h TYR 94 N 1.08 0.24 0.04 0.00 3.20 -0.41 -0.58 116.97 120.53 1pvm h TYR 94 Ca 0.25 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.08 1pvm h TYR 94 Cb 0.20 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.41 1pvm h TYR 94 CO 0.02 0.46 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.91 1pvm h LEU 95 N -0.05 -0.04 -0.73 2.82 3.38 -0.60 -2.36 115.31 117.73 1pvm h LEU 95 Ca 0.03 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1pvm h LEU 95 Cb 0.36 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 1pvm h LEU 95 CO 0.01 -0.01 0.47 -1.28 0.09 0.00 0.00 178.44 177.72 1pvm h SER 96 N -0.07 0.80 -0.06 -0.43 0.87 -1.11 0.47 113.55 114.02 1pvm h SER 96 Ca -0.00 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.53 1pvm h SER 96 Cb 0.06 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 1pvm h SER 96 CO 0.01 0.57 0.01 -0.08 -0.53 0.00 0.00 176.83 176.81 1pvm h GLU 97 N 0.95 0.16 -0.24 2.24 4.81 -0.95 -2.80 114.58 118.74 1pvm h GLU 97 Ca 0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1pvm h GLU 97 Cb -0.05 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.29 1pvm h GLU 97 CO -0.08 0.17 0.00 0.09 -0.73 0.00 0.00 179.01 178.45 1pvm n ASN 98 N -4.45 3.10 -1.88 1.04 3.02 -0.73 -4.97 115.26 110.39 1pvm n ASN 98 Ca -0.01 -1.92 -0.16 0.00 -0.03 0.00 0.00 54.58 52.45 1pvm n ASN 98 Cb 0.13 -0.15 -0.01 0.00 -0.61 0.00 0.00 39.78 39.15 1pvm n ASN 98 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pvm n GLY 99 N 1.27 -0.30 3.89 7.41 0.00 -0.02 -3.08 105.19 114.36 1pvm n GLY 99 Ca 0.16 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 1pvm n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pvm s LEU 100 N -4.70 4.06 0.00 0.99 1.43 -0.18 -4.30 118.68 115.99 1pvm s LEU 100 Ca 0.01 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.04 1pvm s LEU 100 Cb -0.00 -2.61 0.00 0.00 0.03 0.00 0.00 46.19 43.61 1pvm s LEU 100 CO 0.01 -0.03 0.69 -1.84 0.23 0.00 0.00 176.35 175.41 1pvm n GLU 101 N -1.11 0.49 -3.54 1.70 -0.00 -1.26 -4.46 120.64 112.46 1pvm n GLU 101 Ca -0.08 -0.87 -0.09 0.00 -0.00 0.00 0.00 57.16 56.12 1pvm n GLU 101 Cb 0.57 -1.00 -0.03 0.00 -0.00 0.00 0.00 31.44 30.98 1pvm n GLU 101 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.13 176.15 1pvm s ARG 102 N -0.37 0.68 0.23 3.44 1.70 -1.26 -0.65 118.95 122.72 1pvm s ARG 102 Ca 0.00 -0.09 -0.20 0.00 -0.47 0.00 0.00 55.73 54.97 1pvm s ARG 102 Cb 0.00 0.32 0.03 0.00 -0.57 0.00 0.00 34.95 34.73 1pvm s ARG 102 CO 0.00 -0.27 0.63 0.00 -1.08 0.00 0.00 175.30 174.59 1pvm s ALA 104 N -3.88 3.16 -0.10 0.00 0.00 0.11 -1.35 121.76 119.70 1pvm s ALA 104 Ca 0.09 -0.30 0.03 0.00 0.00 0.00 0.00 51.96 51.78 1pvm s ALA 104 Cb -0.03 -2.90 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1pvm s ALA 104 CO 0.00 -0.71 -0.21 0.08 0.00 0.00 0.00 175.76 174.92 1pvm s VAL 105 N -3.09 1.87 0.20 0.00 1.01 0.33 -1.60 120.40 119.13 1pvm s VAL 105 Ca 0.54 -0.91 0.10 0.00 0.00 0.00 0.00 61.98 61.71 1pvm s VAL 105 Cb -0.11 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 1pvm s VAL 105 CO 0.50 0.52 -0.12 0.68 0.00 0.00 0.00 175.10 176.68 1pvm s VAL 106 N 0.47 2.98 0.43 2.92 -7.23 -0.12 -0.55 120.40 119.30 1pvm s VAL 106 Ca -0.17 -1.82 0.01 0.00 -1.81 0.00 0.00 61.98 58.19 1pvm s VAL 106 Cb -0.17 -2.49 0.08 0.00 0.56 0.00 0.00 36.38 34.36 1pvm s VAL 106 CO 0.07 -0.16 0.58 -0.90 -0.31 0.00 0.00 175.10 174.38 1pvm n ASP 107 N -0.05 0.90 -0.06 4.85 5.68 -0.90 -0.70 116.55 126.26 1pvm n ASP 107 Ca -0.10 -1.73 -0.07 0.00 -0.50 0.00 0.00 54.79 52.38 1pvm n ASP 107 Cb 0.56 -0.37 -0.01 0.00 -1.14 0.00 0.00 41.12 40.16 1pvm n ASP 107 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1pvm h ASP 108 N -0.29 -0.33 -0.34 -1.12 3.32 -2.01 -1.07 116.42 114.58 1pvm h ASP 108 Ca -0.19 0.09 0.10 0.00 0.02 0.00 0.00 57.03 57.05 1pvm h ASP 108 Cb 0.74 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 1pvm h ASP 108 CO 0.22 -0.12 0.33 -0.65 -1.72 0.00 0.00 179.24 177.29 1pvm h PRO 109 N -0.04 0.00 0.00 3.56 0.11 -2.06 -3.45 132.00 130.12 1pvm h PRO 109 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1pvm h PRO 109 Cb 0.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.36 1pvm h PRO 109 CO -0.30 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 177.90 1pvm n GLY 110 N -1.49 0.81 3.87 -0.55 0.00 -0.40 -5.10 105.19 102.33 1pvm n GLY 110 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1pvm n GLY 110 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1pvm s ARG 111 N -0.73 3.81 -0.13 1.61 1.70 -1.26 -4.76 118.95 119.19 1pvm s ARG 111 Ca 0.00 0.37 -0.29 0.00 -0.47 0.00 0.00 55.73 55.33 1pvm s ARG 111 Cb 0.00 -2.53 -0.02 0.00 -0.57 0.00 0.00 34.95 31.82 1pvm s ARG 111 CO 0.00 0.17 1.33 0.08 -1.08 0.00 0.00 175.30 175.80 1pvm s VAL 112 N -2.04 4.14 -0.88 4.99 1.01 -1.26 -2.13 120.40 124.23 1pvm s VAL 112 Ca 0.49 1.39 0.11 0.00 0.00 0.00 0.00 61.98 63.98 1pvm s VAL 112 Cb -0.11 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 1pvm s VAL 112 CO 0.24 -0.11 0.61 1.33 0.00 0.00 0.00 175.10 177.18 1pvm n VAL 113 N 5.30 0.00 -3.90 2.92 0.24 0.29 -4.98 118.33 118.19 1pvm n VAL 113 Ca 0.14 -0.33 0.04 0.00 -2.04 0.00 0.00 64.34 62.15 1pvm n VAL 113 Cb 0.45 1.09 0.01 0.00 -1.47 0.00 0.00 33.84 33.91 1pvm n VAL 113 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1pvm s GLY 114 N -1.70 -0.28 -0.02 7.63 0.00 -1.16 -4.33 107.32 107.47 1pvm s GLY 114 Ca 0.08 0.35 0.04 0.00 0.00 0.00 0.00 44.72 45.18 1pvm s GLY 114 CO 0.35 4.90 -0.13 -0.42 0.00 0.00 0.00 173.10 177.80 1pvm s ILE 115 N -2.03 1.08 -0.09 0.90 1.01 -0.65 -0.51 121.20 120.92 1pvm s ILE 115 Ca 0.27 -0.56 0.04 0.00 0.00 0.00 0.00 60.65 60.40 1pvm s ILE 115 Cb 0.02 -0.92 0.00 0.00 0.01 0.00 0.00 42.46 41.57 1pvm s ILE 115 CO -0.03 0.31 -0.22 0.54 0.00 0.00 0.00 174.94 175.54 1pvm s VAL 116 N -0.13 1.85 0.38 2.92 0.11 -0.45 -1.40 120.40 123.67 1pvm s VAL 116 Ca 0.02 -0.91 0.08 0.00 -2.93 0.00 0.00 61.98 58.24 1pvm s VAL 116 Cb -0.07 -1.61 -0.06 0.00 -1.53 0.00 0.00 36.38 33.11 1pvm s VAL 116 CO 0.00 0.51 0.09 0.42 -3.33 0.00 0.00 175.10 172.80 1pvm s THR 117 N 0.32 2.40 0.35 5.04 -4.23 -1.26 -1.57 115.64 116.69 1pvm s THR 117 Ca -0.15 -1.85 0.05 0.00 -1.18 0.00 0.00 61.69 58.56 1pvm s THR 117 Cb -0.17 -2.93 0.29 0.00 1.34 0.00 0.00 72.50 71.04 1pvm s THR 117 CO 0.07 -0.08 1.96 0.25 -0.54 0.00 0.00 174.62 176.27 1pvm h LEU 118 N 1.63 0.71 -0.80 4.79 5.85 -1.28 -1.24 115.31 124.97 1pvm h LEU 118 Ca -0.43 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.27 1pvm h LEU 118 Cb 1.25 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 1pvm h LEU 118 CO 0.70 0.47 0.42 0.74 -0.34 0.00 0.00 178.44 180.44 1pvm h THR 119 N 0.82 1.24 -0.62 1.05 2.02 -1.95 0.40 112.91 115.86 1pvm h THR 119 Ca 0.32 -0.61 -0.04 0.00 0.77 0.00 0.00 66.41 66.85 1pvm h THR 119 Cb 0.21 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 66.78 1pvm h THR 119 CO -0.10 0.27 0.25 0.44 0.37 0.00 0.00 175.52 176.75 1pvm h ASP 120 N 1.11 0.86 1.06 4.18 3.45 -1.63 -2.94 116.42 122.51 1pvm h ASP 120 Ca 0.28 -0.17 -0.11 0.00 0.43 0.00 0.00 57.03 57.46 1pvm h ASP 120 Cb 0.05 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.58 1pvm h ASP 120 CO -0.04 0.80 -0.54 -0.07 -1.57 0.00 0.00 179.24 177.81 1pvm h LEU 121 N 0.87 0.00 -1.92 1.55 3.38 -0.84 -3.31 115.31 115.03 1pvm h LEU 121 Ca 0.21 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.25 1pvm h LEU 121 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1pvm h LEU 121 CO -0.02 0.54 0.43 0.77 0.09 0.00 0.00 178.44 180.25 1pvm h SER 122 N 0.00 0.00 1.12 -0.43 4.64 -0.02 0.82 113.55 119.68 1pvm h SER 122 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1pvm h SER 122 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1pvm h SER 122 CO 0.07 0.00 -0.31 0.54 -0.87 0.00 0.00 176.83 176.26 1pvm n ARG 123 N -3.37 0.25 0.00 4.77 1.74 -1.25 -4.16 116.66 114.65 1pvm n ARG 123 Ca 0.04 0.13 0.00 0.00 -0.77 0.00 0.00 57.85 57.25 1pvm n ARG 123 Cb 0.56 -1.72 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 1pvm n ARG 123 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1pvm n TYR 124 N -2.11 0.00 -3.96 -1.55 4.02 0.19 -5.06 117.16 108.69 1pvm n TYR 124 Ca 0.05 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.70 1pvm n TYR 124 Cb 0.42 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.72 1pvm n TYR 124 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1pvm s LEU 125 N -0.42 4.32 0.68 7.72 1.43 -0.67 -4.99 118.68 126.75 1pvm s LEU 125 Ca 0.00 0.12 -0.12 0.00 -1.03 0.00 0.00 54.13 53.09 1pvm s LEU 125 Cb 0.00 -2.88 0.00 0.00 0.03 0.00 0.00 46.19 43.35 1pvm s LEU 125 CO 0.00 -0.01 1.07 -0.94 0.23 0.00 0.00 176.35 176.70 1pvm s SER 126 N -3.61 5.31 0.33 2.29 1.04 -1.26 -4.87 113.70 112.93 1pvm s SER 126 Ca 0.34 1.74 0.01 0.00 0.48 0.00 0.00 55.95 58.52 1pvm s SER 126 Cb -0.10 -2.51 0.56 0.00 0.10 0.00 0.00 66.02 64.06 1pvm s SER 126 CO 0.29 -1.49 1.99 -0.09 0.98 0.00 0.00 173.24 174.92 1pvm h ARG 127 N -0.42 0.93 -0.78 4.02 2.43 -1.98 -2.03 114.38 116.55 1pvm h ARG 127 Ca -0.45 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 58.63 1pvm h ARG 127 Cb 1.22 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.53 1pvm h ARG 127 CO 0.56 0.62 0.35 0.00 -1.51 0.00 0.00 179.97 179.99 1pvm h ALA 128 N 1.55 1.01 -0.43 2.80 0.00 -1.99 -1.01 119.26 121.19 1pvm h ALA 128 Ca 0.26 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 1pvm h ALA 128 Cb -0.10 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 1pvm h ALA 128 CO -0.05 0.60 -0.25 1.03 0.00 0.00 0.00 179.25 180.58 1pvm h SER 129 N 1.12 0.92 -0.19 0.00 0.87 -1.76 -1.01 113.55 113.49 1pvm h SER 129 Ca 0.27 -0.35 -0.02 0.00 -1.23 0.00 0.00 61.79 60.45 1pvm h SER 129 Cb 0.16 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 1pvm h SER 129 CO -0.03 1.11 0.05 0.40 -0.53 0.00 0.00 176.83 177.83 1pvm h ILE 130 N 0.76 1.20 -0.99 2.23 2.04 -1.11 -1.38 117.51 120.27 1pvm h ILE 130 Ca 0.10 -0.66 0.01 0.00 1.00 0.00 0.00 64.86 65.31 1pvm h ILE 130 Cb 0.80 1.27 -0.05 0.00 -0.74 0.00 0.00 36.82 38.10 1pvm h ILE 130 CO 0.07 0.20 0.65 0.74 0.00 0.00 0.00 178.15 179.82 1pvm h THR 131 N 0.13 1.25 -0.26 -0.27 2.02 -1.11 -1.33 112.91 113.34 1pvm h THR 131 Ca 0.06 -0.46 0.02 0.00 0.77 0.00 0.00 66.41 66.80 1pvm h THR 131 Cb 0.27 -0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.46 1pvm h THR 131 CO 0.00 0.24 0.13 -0.78 0.37 0.00 0.00 175.52 175.48 1pvm h ASP 132 N 1.33 0.20 -0.73 4.18 3.58 -0.83 0.69 116.42 124.83 1pvm h ASP 132 Ca 0.37 0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.81 1pvm h ASP 132 Cb -0.14 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 40.85 1pvm h ASP 132 CO -0.08 0.15 0.38 0.40 -2.88 0.00 0.00 179.24 177.20 1pvm h ILE 133 N 0.27 1.23 -0.40 2.25 2.04 -0.77 -0.58 117.51 121.56 1pvm h ILE 133 Ca 0.11 -0.61 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 1pvm h ILE 133 Cb 0.03 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.38 1pvm h ILE 133 CO -0.07 0.26 0.15 -0.07 0.00 0.00 0.00 178.15 178.43 1pvm h LEU 134 N 1.02 0.55 -0.28 1.44 3.38 -0.81 -1.28 115.31 119.33 1pvm h LEU 134 Ca 0.25 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1pvm h LEU 134 Cb 0.07 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1pvm h LEU 134 CO -0.04 0.58 0.10 -0.07 0.09 0.00 0.00 178.44 179.10 1pvm h LEU 135 N 0.50 0.39 -1.29 1.67 3.38 -0.61 -2.81 115.31 116.53 1pvm h LEU 135 Ca 0.13 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1pvm h LEU 135 Cb 0.20 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1pvm h LEU 135 CO -0.01 0.47 0.01 0.28 0.09 0.00 0.00 178.44 179.27 1pvm h SER 136 N 0.29 0.45 0.30 -0.43 0.02 -1.03 -0.80 113.55 112.35 1pvm h SER 136 Ca 0.09 -0.08 -0.08 0.00 -0.84 0.00 0.00 61.79 60.89 1pvm h SER 136 Cb 0.21 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1pvm h SER 136 CO -0.01 0.51 -0.34 -0.74 -1.14 0.00 0.00 176.83 175.12 1pvm h HIS 137 N 0.47 0.06 0.20 3.45 -0.00 -1.05 0.14 115.15 118.42 1pvm h HIS 137 Ca 0.10 -0.01 -0.30 0.00 -0.00 0.00 0.00 60.37 60.16 1pvm h HIS 137 Cb 0.30 -0.02 0.03 0.00 -0.00 0.00 0.00 27.41 27.72 1pvm h HIS 137 CO 0.01 0.39 -1.35 -0.09 -0.00 0.00 0.00 177.93 176.88 1pvm h ARG 138 N 0.05 0.43 0.00 5.26 2.43 -1.16 -3.39 114.38 117.99 1pvm h ARG 138 Ca 0.00 -0.74 -0.22 0.00 -0.81 0.00 0.00 59.98 58.22 1pvm h ARG 138 Cb 0.62 0.27 -0.04 0.00 -0.42 0.00 0.00 29.97 30.41 1pvm h ARG 138 CO 0.05 1.35 -1.29 1.79 -1.51 0.00 0.00 179.97 180.36 1pvm h THR 139 N -0.03 1.03 -2.91 0.20 1.35 -1.06 -3.47 112.91 108.02 1pvm h THR 139 Ca -0.25 -2.71 -0.61 0.00 -0.55 0.00 0.00 66.41 62.29 1pvm h THR 139 Cb 1.99 2.46 -0.13 0.00 -1.73 0.00 0.00 68.15 70.75 1pvm h THR 139 CO 0.21 0.59 -0.70 -0.54 -0.25 0.00 0.00 175.52 174.83 1pvm s LYS 140 N -2.74 2.18 0.01 4.72 1.02 0.47 -5.07 119.74 120.33 1pvm s LYS 140 Ca -0.02 -1.23 0.06 0.00 0.02 0.00 0.00 55.97 54.81 1pvm s LYS 140 Cb 0.09 -2.22 -0.02 0.00 -0.52 0.00 0.00 37.83 35.16 1pvm s LYS 140 CO 0.81 0.44 -0.19 0.34 -0.92 0.00 0.00 175.35 175.83 1pvm s ASP 141 N -2.92 2.23 0.28 2.83 2.15 -1.26 -4.61 116.67 115.37 1pvm s ASP 141 Ca 0.26 -0.41 -0.30 0.00 0.43 0.00 0.00 52.55 52.54 1pvm s ASP 141 Cb -0.09 -0.22 -0.13 0.00 -0.30 0.00 0.00 42.92 42.18 1pvm s ASP 141 CO 0.16 0.19 1.30 0.00 -0.17 0.00 0.00 175.17 176.65 1pvm n TYR 142 N 2.31 2.02 -3.12 -5.34 9.36 -1.18 -4.84 117.16 116.37 1pvm n TYR 142 Ca -0.16 0.53 -0.42 0.00 3.32 0.00 0.00 57.90 61.17 1pvm n TYR 142 Cb 0.54 -2.40 -0.07 0.00 -0.63 0.00 0.00 39.34 36.78 1pvm n TYR 142 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 1pvm s GLN 143 N -1.06 3.70 -0.94 2.98 -1.52 -1.26 -5.00 119.66 116.56 1pvm s GLN 143 Ca 0.63 0.07 -0.23 0.00 -1.95 0.00 0.00 55.36 53.88 1pvm s GLN 143 Cb -0.64 -3.80 0.06 0.00 -0.22 0.00 0.00 33.01 28.41 1pvm s GLN 143 CO 0.55 -0.71 1.34 -1.01 -0.25 0.00 0.00 175.29 175.22 1pvm s HIS 144 N 2.67 2.61 0.32 0.91 3.76 -1.26 -4.79 115.29 119.52 1pvm s HIS 144 Ca 0.24 -0.81 -0.29 0.00 -0.15 0.00 0.00 55.06 54.05 1pvm s HIS 144 Cb -0.15 -4.59 -0.11 0.00 1.11 0.00 0.00 32.58 28.85 1pvm s HIS 144 CO 0.14 -1.86 1.41 -0.51 -0.85 0.00 0.00 174.74 173.07 1pvm s LEU 145 N 4.62 4.38 0.20 0.89 1.43 -1.26 -0.63 118.68 128.32 1pvm s LEU 145 Ca 0.41 2.81 -0.31 0.00 -1.03 0.00 0.00 54.13 56.01 1pvm s LEU 145 Cb -0.03 -3.65 -0.10 0.00 0.03 0.00 0.00 46.19 42.44 1pvm s LEU 145 CO -0.05 -0.70 1.48 0.00 0.23 0.00 0.00 176.35 177.31 1pvm h PRO 147 N 5.89 0.00 0.08 0.00 0.13 -1.92 -0.09 132.00 136.09 1pvm h PRO 147 Ca -0.44 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.52 1pvm h PRO 147 Cb 1.21 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.36 1pvm h PRO 147 CO 0.84 0.27 -0.70 -0.22 -0.23 0.00 0.00 178.00 177.95 1pvm h LYS 148 N 0.00 0.34 0.00 0.86 3.64 -1.98 -3.38 116.57 116.05 1pvm h LYS 148 Ca -0.00 -0.47 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1pvm h LYS 148 Cb 0.87 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1pvm h LYS 148 CO 0.04 1.17 -1.12 0.00 -2.27 0.00 0.00 179.45 177.27 1pvm n GLY 150 N 1.60 0.84 0.02 0.00 0.00 -0.05 -4.69 105.19 102.92 1pvm n GLY 150 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1pvm n GLY 150 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1pvm n VAL 151 N -2.00 0.24 -1.54 1.61 0.24 -1.26 -4.74 118.33 110.89 1pvm n VAL 151 Ca 0.00 -0.15 -0.30 0.00 -2.04 0.00 0.00 64.34 61.86 1pvm n VAL 151 Cb 0.00 -0.88 0.09 0.00 -1.47 0.00 0.00 33.84 31.58 1pvm n VAL 151 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1pvm s GLY 152 N -3.53 1.62 -0.02 7.63 0.00 -1.26 -4.86 107.32 106.90 1pvm s GLY 152 Ca -0.02 -0.21 0.08 0.00 0.00 0.00 0.00 44.72 44.57 1pvm s GLY 152 CO 0.14 0.23 -0.25 -1.34 0.00 0.00 0.00 173.10 171.87 1pvm s VAL 153 N -3.15 2.12 -0.12 1.40 -7.23 -1.26 -0.67 120.40 111.48 1pvm s VAL 153 Ca 0.61 -1.08 -0.30 0.00 -1.81 0.00 0.00 61.98 59.40 1pvm s VAL 153 Cb -0.15 -1.73 -0.02 0.00 0.56 0.00 0.00 36.38 35.04 1pvm s VAL 153 CO 0.54 0.58 1.22 -0.76 -0.31 0.00 0.00 175.10 176.37 1pvm s LEU 154 N -0.61 4.22 0.03 1.32 1.43 0.20 -0.99 118.68 124.28 1pvm s LEU 154 Ca 0.10 1.72 0.07 0.00 -1.03 0.00 0.00 54.13 54.99 1pvm s LEU 154 Cb -0.10 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.54 1pvm s LEU 154 CO -0.01 -0.67 -0.17 -1.61 0.23 0.00 0.00 176.35 174.12 1pvm s GLU 155 N 2.89 2.14 0.42 1.70 0.41 0.53 -4.70 118.70 122.09 1pvm s GLU 155 Ca 0.54 -0.94 -0.25 0.00 -0.41 0.00 0.00 54.97 53.91 1pvm s GLU 155 Cb -0.22 -2.23 -0.08 0.00 -1.78 0.00 0.00 34.13 29.81 1pvm s GLU 155 CO 0.17 0.55 1.24 -2.14 -0.49 0.00 0.00 175.26 174.59 1pvm s PRO 156 N -1.41 3.90 -0.20 0.39 0.02 -1.26 0.15 135.00 136.59 1pvm s PRO 156 Ca 0.15 2.00 -0.00 0.00 0.02 0.00 0.00 61.00 63.17 1pvm s PRO 156 Cb -0.11 -2.64 0.02 0.00 0.02 0.00 0.00 34.50 31.79 1pvm s PRO 156 CO 0.05 -0.50 -0.15 0.08 -0.33 0.00 0.00 177.00 176.16 1pvm s VAL 157 N -1.36 2.44 0.16 3.83 1.01 0.20 -4.84 120.40 121.83 1pvm s VAL 157 Ca 0.59 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.72 1pvm s VAL 157 Cb -0.34 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 1pvm s VAL 157 CO 0.43 0.45 0.27 -0.31 0.00 0.00 0.00 175.10 175.95 1pvm s TYR 158 N 1.33 3.44 0.44 5.22 1.51 -1.26 -0.91 117.35 127.12 1pvm s TYR 158 Ca 0.04 0.09 0.07 0.00 -1.01 0.00 0.00 57.07 56.26 1pvm s TYR 158 Cb -0.14 -1.64 0.07 0.00 -0.11 0.00 0.00 41.96 40.14 1pvm s TYR 158 CO -0.10 0.51 0.59 0.27 -1.11 0.00 0.00 175.55 175.71 1pvm n ASN 159 N -0.58 1.70 0.33 2.29 2.04 -0.58 -4.91 115.26 115.54 1pvm n ASN 159 Ca -0.07 -2.21 0.20 0.00 -0.44 0.00 0.00 54.58 52.05 1pvm n ASN 159 Cb 0.54 -0.30 1.07 0.00 -2.53 0.00 0.00 39.78 38.56 1pvm n ASN 159 CO 0.00 0.00 0.00 1.05 -0.44 0.00 0.00 177.26 177.87 1pvm h GLU 160 N 0.00 0.00 -0.00 -3.83 4.11 -2.00 0.13 114.58 112.99 1pvm h GLU 160 Ca -0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.22 1pvm h GLU 160 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1pvm h GLU 160 CO 0.31 0.00 -0.43 1.63 0.07 0.00 0.00 179.01 180.59 1pvm n LYS 161 N -3.12 0.30 -0.64 1.06 5.02 -1.26 -4.91 118.16 114.62 1pvm n LYS 161 Ca -0.02 -0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.08 1pvm n LYS 161 Cb 0.18 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.69 1pvm n LYS 161 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pvm n GLY 162 N 1.44 0.63 3.78 0.72 0.00 0.03 -5.05 105.19 106.75 1pvm n GLY 162 Ca 0.08 -0.52 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 1pvm n GLY 162 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pvm s GLU 163 N -1.04 4.32 -0.08 1.61 2.02 -1.26 -4.81 118.70 119.46 1pvm s GLU 163 Ca 0.00 0.84 -0.30 0.00 0.02 0.00 0.00 54.97 55.53 1pvm s GLU 163 Cb 0.00 -3.28 -0.03 0.00 0.10 0.00 0.00 34.13 30.92 1pvm s GLU 163 CO 0.00 0.52 1.19 0.42 0.02 0.00 0.00 175.26 177.40 1pvm s ILE 164 N -0.75 4.33 -0.22 -1.63 1.01 -0.05 -1.52 121.20 122.37 1pvm s ILE 164 Ca 0.32 1.64 -0.12 0.00 0.00 0.00 0.00 60.65 62.48 1pvm s ILE 164 Cb -0.20 -4.05 -0.18 0.00 0.01 0.00 0.00 42.46 38.04 1pvm s ILE 164 CO 0.20 -0.03 -0.01 0.29 0.00 0.00 0.00 174.94 175.40 1pvm n LYS 165 N 5.43 0.63 -3.92 2.79 4.76 -0.09 -4.57 118.16 123.19 1pvm n LYS 165 Ca 0.11 0.35 -0.09 0.00 -2.87 0.00 0.00 58.31 55.81 1pvm n LYS 165 Cb 0.46 -1.62 -0.05 0.00 -1.84 0.00 0.00 35.03 31.98 1pvm n LYS 165 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1pvm s VAL 166 N -2.47 0.01 -0.21 -0.18 -7.23 -1.24 -5.03 120.40 104.05 1pvm s VAL 166 Ca -0.32 -1.21 -0.03 0.00 -1.81 0.00 0.00 61.98 58.61 1pvm s VAL 166 Cb 0.09 -2.01 -0.01 0.00 0.56 0.00 0.00 36.38 35.02 1pvm s VAL 166 CO 0.60 -0.05 -0.06 -0.36 -0.31 0.00 0.00 175.10 174.91 1pvm s PHE 167 N -3.97 2.93 -0.05 2.82 0.40 0.18 -0.63 117.98 119.66 1pvm s PHE 167 Ca 0.18 -0.99 0.04 0.00 -0.60 0.00 0.00 56.93 55.55 1pvm s PHE 167 Cb -0.01 -2.07 -0.02 0.00 0.51 0.00 0.00 43.02 41.43 1pvm s PHE 167 CO 0.05 -0.55 -0.15 0.50 0.70 0.00 0.00 175.22 175.78 1pvm s ARG 168 N 1.38 2.54 0.36 0.44 3.52 0.12 -1.33 118.95 125.98 1pvm s ARG 168 Ca 0.05 -0.70 -0.28 0.00 -0.13 0.00 0.00 55.73 54.66 1pvm s ARG 168 Cb -0.14 -2.38 -0.11 0.00 -1.56 0.00 0.00 34.95 30.76 1pvm s ARG 168 CO -0.04 0.60 1.46 0.00 -0.81 0.00 0.00 175.30 176.51 1pvm h SER 170 N 3.18 0.00 -2.26 0.00 4.64 -1.39 -3.45 113.55 114.27 1pvm h SER 170 Ca -0.50 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.27 1pvm h SER 170 Cb 1.24 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.34 1pvm h SER 170 CO 0.65 0.43 1.30 -3.20 -0.87 0.00 0.00 176.83 175.15 1pvm n ASN 171 N -3.43 3.94 0.13 4.97 2.85 -1.26 -4.86 115.26 117.60 1pvm n ASN 171 Ca 0.00 0.72 0.03 0.00 -0.11 0.00 0.00 54.58 55.23 1pvm n ASN 171 Cb 0.59 -1.54 0.43 0.00 1.24 0.00 0.00 39.78 40.50 1pvm n ASN 171 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1pvm h PRO 172 N 11.77 0.23 0.00 1.20 0.11 -2.03 -1.03 132.00 142.26 1pvm h PRO 172 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1pvm h PRO 172 Cb 1.24 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1pvm h PRO 172 CO 0.95 0.32 0.00 0.00 -0.21 0.00 0.00 178.00 179.05 1pvm n ALA 173 N -2.49 2.49 -2.40 -0.75 0.00 -1.26 -4.81 120.51 111.29 1pvm n ALA 173 Ca -0.01 -0.16 -0.29 0.00 0.00 0.00 0.00 53.44 52.99 1pvm n ALA 173 Cb 0.22 -1.45 -0.14 0.00 0.00 0.00 0.00 19.45 18.08 1pvm n ALA 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pvm n ASP 175 N 1.35 3.25 -4.76 0.00 5.75 -1.26 -4.80 116.55 116.08 1pvm n ASP 175 Ca -0.18 -2.58 -0.40 0.00 -0.01 0.00 0.00 54.79 51.62 1pvm n ASP 175 Cb 0.53 -0.38 -0.04 0.00 -1.03 0.00 0.00 41.12 40.20 1pvm n ASP 175 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 1pvm s TYR 176 N -2.04 3.50 0.04 2.11 5.04 -1.26 -4.96 117.35 119.78 1pvm s TYR 176 Ca 0.31 1.67 -0.28 0.00 -2.44 0.00 0.00 57.07 56.33 1pvm s TYR 176 Cb 0.23 -3.30 0.07 0.00 0.35 0.00 0.00 41.96 39.31 1pvm s TYR 176 CO 0.10 -0.67 0.65 -1.83 -1.34 0.00 0.00 175.55 172.45 1pvm s GLU 177 N -1.59 1.15 0.00 4.97 -1.05 -1.26 -1.19 118.70 119.73 1pvm s GLU 177 Ca 0.46 -0.04 0.00 0.00 -0.15 0.00 0.00 54.97 55.25 1pvm s GLU 177 Cb -0.32 0.54 0.00 0.00 -0.44 0.00 0.00 34.13 33.91 1pvm s GLU 177 CO 0.41 -0.42 0.00 -0.85 0.95 0.00 0.00 175.26 175.34