#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pvm s PRO -4 N 0.00 4.20 0.00 1.45 0.02 -1.26 -4.92 135.00 134.49 1pvm s PRO -4 Ca 0.00 2.43 0.00 0.00 0.02 0.00 0.00 61.00 63.45 1pvm s PRO -4 Cb 0.00 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.45 1pvm s PRO -4 CO 0.00 -0.51 0.00 0.54 -0.33 0.00 0.00 177.00 176.70 1pvm n ARG -3 N 2.17 1.70 -0.59 5.54 1.74 -1.26 -5.16 116.66 120.80 1pvm n ARG -3 Ca 0.07 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.21 1pvm n ARG -3 Cb 0.39 -0.14 -0.03 0.00 -1.02 0.00 0.00 32.46 31.66 1pvm n ARG -3 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pvm n GLY -2 N 0.23 -3.01 3.75 -0.13 0.00 -1.26 -4.87 105.19 99.91 1pvm n GLY -2 Ca 0.00 -1.25 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 1pvm n GLY -2 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pvm s GLY -1 N -5.05 2.72 -0.03 -0.02 0.00 -1.26 -5.00 107.32 98.68 1pvm s GLY -1 Ca 0.00 1.17 -0.13 0.00 0.00 0.00 0.00 44.72 45.76 1pvm s GLY -1 CO 0.00 1.97 0.28 0.30 0.00 0.00 0.00 173.10 175.65 1pvm s HIS 0 N -0.54 -0.18 0.21 1.90 4.02 -1.26 -5.05 115.29 114.39 1pvm s HIS 0 Ca 0.53 0.31 -0.01 0.00 1.02 0.00 0.00 55.06 56.91 1pvm s HIS 0 Cb -0.38 0.08 0.17 0.00 -1.02 0.00 0.00 32.58 31.43 1pvm s HIS 0 CO 0.45 -0.33 1.53 1.98 1.02 0.00 0.00 174.74 179.39 1pvm h MET 1 N 4.25 0.47 -6.32 1.40 1.85 -1.96 -3.42 114.93 111.21 1pvm h MET 1 Ca -0.29 -0.29 -0.60 0.00 -0.61 0.00 0.00 59.70 57.91 1pvm h MET 1 Cb 1.18 0.03 -0.12 0.00 0.43 0.00 0.00 31.60 33.12 1pvm h MET 1 CO 0.38 0.89 -0.70 -0.06 -0.40 0.00 0.00 176.91 177.03 1pvm s PHE 2 N -3.97 2.60 0.00 1.39 0.40 -1.26 -4.87 117.98 112.27 1pvm s PHE 2 Ca -0.06 -0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.02 1pvm s PHE 2 Cb 0.12 -1.20 0.00 0.00 0.51 0.00 0.00 43.02 42.44 1pvm s PHE 2 CO 0.83 0.58 0.00 -0.12 0.70 0.00 0.00 175.22 177.21 1pvm n MET 3 N -0.41 0.00 -2.50 0.44 1.56 -1.26 -5.00 117.12 109.94 1pvm n MET 3 Ca -0.08 0.00 -0.41 0.00 -0.27 0.00 0.00 57.70 56.94 1pvm n MET 3 Cb 0.57 0.00 -0.04 0.00 2.15 0.00 0.00 33.22 35.90 1pvm n MET 3 CO 0.00 0.00 0.00 -0.98 -0.73 0.00 0.00 175.97 174.26 1pvm s ARG 4 N 0.00 4.61 0.28 2.12 1.70 -1.26 -1.59 118.95 124.80 1pvm s ARG 4 Ca 0.00 1.75 0.01 0.00 -0.47 0.00 0.00 55.73 57.02 1pvm s ARG 4 Cb 0.00 -3.25 0.64 0.00 -0.57 0.00 0.00 34.95 31.78 1pvm s ARG 4 CO 0.00 0.12 1.70 0.28 -1.08 0.00 0.00 175.30 176.32 1pvm h VAL 5 N 3.50 0.51 -1.15 4.99 2.07 -0.91 -1.69 116.25 123.56 1pvm h VAL 5 Ca -0.45 -0.14 0.34 0.00 0.82 0.00 0.00 66.70 67.27 1pvm h VAL 5 Cb 1.21 0.08 -0.11 0.00 -1.52 0.00 0.00 31.29 30.95 1pvm h VAL 5 CO 0.71 0.07 0.74 -0.08 0.02 0.00 0.00 177.57 179.03 1pvm h GLU 6 N 0.40 0.25 0.00 1.57 4.81 -1.76 0.48 114.58 120.32 1pvm h GLU 6 Ca 0.51 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.73 1pvm h GLU 6 Cb 0.93 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.25 1pvm h GLU 6 CO -0.50 0.16 0.00 0.87 -0.73 0.00 0.00 179.01 178.81 1pvm h LYS 7 N 0.25 0.00 -0.00 1.92 1.57 -1.62 -3.33 116.57 115.37 1pvm h LYS 7 Ca 0.69 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.47 1pvm h LYS 7 Cb 1.97 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.28 1pvm h LYS 7 CO -0.35 0.00 -0.04 0.44 -0.57 0.00 0.00 179.45 178.93 1pvm n ILE 8 N -2.74 0.00 -1.15 1.86 -5.35 0.04 -4.94 119.36 107.07 1pvm n ILE 8 Ca 0.04 -0.48 -0.30 0.00 -0.27 0.00 0.00 62.75 61.74 1pvm n ILE 8 Cb 0.42 1.01 0.15 0.00 -1.74 0.00 0.00 39.64 39.48 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 -0.71 1.09 -0.47 6.28 0.23 -0.46 -4.90 119.30 120.36 1pvm s MET 9 Ca 0.01 0.83 -0.17 0.00 -1.03 0.00 0.00 55.69 55.33 1pvm s MET 9 Cb 0.01 -1.79 0.05 0.00 -1.53 0.00 0.00 34.83 31.57 1pvm s MET 9 CO 0.04 -2.36 0.50 1.21 -2.03 0.00 0.00 175.02 172.38 1pvm s ASN 10 N -3.35 6.19 0.01 -1.18 3.04 0.30 -4.90 114.94 115.05 1pvm s ASN 10 Ca 0.64 -0.96 0.29 0.00 0.04 0.00 0.00 52.86 52.87 1pvm s ASN 10 Cb -0.19 -2.24 1.19 0.00 -1.54 0.00 0.00 41.25 38.48 1pvm s ASN 10 CO 0.57 -0.72 1.90 -1.20 -3.04 0.00 0.00 177.10 174.61 1pvm n SER 11 N 5.71 0.05 -2.21 -4.21 7.64 -1.26 -2.11 113.62 117.22 1pvm n SER 11 Ca -0.08 0.47 -0.27 0.00 1.01 0.00 0.00 58.87 59.99 1pvm n SER 11 Cb 0.45 -0.47 0.12 0.00 -1.01 0.00 0.00 64.21 63.30 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 -1.52 5.65 -4.74 6.43 4.05 -1.26 -4.85 115.26 119.02 1pvm n ASN 12 Ca 0.07 -3.59 -0.32 0.00 0.45 0.00 0.00 54.58 51.19 1pvm n ASN 12 Cb 0.34 -0.90 0.10 0.00 1.23 0.00 0.00 39.78 40.55 1pvm n ASN 12 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 177.26 174.93 1pvm s PHE 13 N -3.31 2.32 0.05 1.20 -0.12 -1.24 -5.04 117.98 111.84 1pvm s PHE 13 Ca 0.57 1.61 0.04 0.00 -0.05 0.00 0.00 56.93 59.10 1pvm s PHE 13 Cb 0.46 -3.19 -0.04 0.00 -0.63 0.00 0.00 43.02 39.62 1pvm s PHE 13 CO 0.05 -2.09 -0.01 0.15 -0.05 0.00 0.00 175.22 173.26 1pvm s LYS 14 N -4.55 2.60 0.02 1.99 1.02 -1.26 -5.04 119.74 114.51 1pvm s LYS 14 Ca 0.65 -0.76 0.08 0.00 0.02 0.00 0.00 55.97 55.96 1pvm s LYS 14 Cb -0.21 -2.56 -0.02 0.00 -0.52 0.00 0.00 37.83 34.52 1pvm s LYS 14 CO 0.52 0.57 -0.25 0.99 -0.92 0.00 0.00 175.35 176.26 1pvm s THR 15 N -1.19 1.97 0.08 2.17 2.01 -1.26 -1.47 115.64 117.95 1pvm s THR 15 Ca 0.22 -1.20 0.04 0.00 0.31 0.00 0.00 61.69 61.06 1pvm s THR 15 Cb -0.12 -1.67 -0.03 0.00 0.01 0.00 0.00 72.50 70.70 1pvm s THR 15 CO 0.14 0.43 -0.11 0.68 -0.69 0.00 0.00 174.62 175.07 1pvm s VAL 16 N -0.69 0.95 0.43 3.82 -7.23 0.14 -4.95 120.40 112.87 1pvm s VAL 16 Ca 0.10 -1.42 -0.23 0.00 -1.81 0.00 0.00 61.98 58.61 1pvm s VAL 16 Cb -0.10 -1.13 -0.08 0.00 0.56 0.00 0.00 36.38 35.63 1pvm s VAL 16 CO 0.01 -0.40 1.12 0.21 -0.31 0.00 0.00 175.10 175.73 1pvm s ASN 17 N -2.04 6.41 0.03 4.85 3.84 -1.26 -1.30 114.94 125.46 1pvm s ASN 17 Ca 0.00 2.21 0.09 0.00 0.21 0.00 0.00 52.86 55.38 1pvm s ASN 17 Cb -0.07 -2.60 0.41 0.00 -0.55 0.00 0.00 41.25 38.44 1pvm s ASN 17 CO 0.01 -0.75 1.30 -2.67 -2.79 0.00 0.00 177.10 172.20 1pvm n TRP 18 N -0.30 0.08 0.62 0.43 4.27 0.24 -1.65 117.44 121.13 1pvm n TRP 18 Ca 0.06 0.03 0.11 0.00 -3.89 0.00 0.00 57.50 53.82 1pvm n TRP 18 Cb 0.48 -0.55 0.14 0.00 -1.36 0.00 0.00 31.31 30.02 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 -1.57 3.07 -4.78 -0.67 5.03 -1.26 -1.87 115.26 113.21 1pvm n ASN 19 Ca 0.02 -1.94 -0.41 0.00 0.87 0.00 0.00 54.58 53.12 1pvm n ASN 19 Cb 0.10 -0.11 -0.00 0.00 -1.02 0.00 0.00 39.78 38.75 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 -1.64 2.18 0.72 3.41 2.01 -0.66 -4.67 115.64 117.00 1pvm s THR 20 Ca 0.30 0.18 -0.11 0.00 0.31 0.00 0.00 61.69 62.37 1pvm s THR 20 Cb 0.20 -3.11 0.02 0.00 0.01 0.00 0.00 72.50 69.62 1pvm s THR 20 CO 0.28 0.04 1.08 0.42 -0.69 0.00 0.00 174.62 175.75 1pvm s THR 21 N -1.13 3.68 0.27 -0.82 -4.23 -1.26 -0.59 115.64 111.56 1pvm s THR 21 Ca 0.52 0.55 -0.04 0.00 -1.18 0.00 0.00 61.69 61.54 1pvm s THR 21 Cb -0.45 -3.38 0.20 0.00 1.34 0.00 0.00 72.50 70.21 1pvm s THR 21 CO 0.61 -0.71 1.88 0.58 -0.54 0.00 0.00 174.62 176.43 1pvm h VAL 22 N -0.77 1.23 -0.07 2.29 2.07 -0.69 -0.90 116.25 119.41 1pvm h VAL 22 Ca -0.45 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 66.45 1pvm h VAL 22 Cb 1.24 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1pvm h VAL 22 CO 0.60 0.27 0.01 0.15 0.02 0.00 0.00 177.57 178.62 1pvm h PHE 23 N 1.07 0.02 -0.13 1.57 3.57 -1.59 -0.85 116.94 120.59 1pvm h PHE 23 Ca 0.26 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.65 1pvm h PHE 23 Cb 0.08 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 1pvm h PHE 23 CO 0.01 0.01 -0.44 -0.44 -2.23 0.00 0.00 178.31 175.22 1pvm h ASP 24 N 0.04 0.32 -0.27 0.41 3.32 -1.77 -2.64 116.42 115.83 1pvm h ASP 24 Ca 0.03 -0.14 -0.10 0.00 0.02 0.00 0.00 57.03 56.84 1pvm h ASP 24 Cb 0.03 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1pvm h ASP 24 CO -0.04 0.72 -0.22 0.00 -1.72 0.00 0.00 179.24 177.97 1pvm h ALA 25 N 1.30 0.40 -0.01 3.45 0.00 -0.97 -2.96 119.26 120.46 1pvm h ALA 25 Ca 0.02 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 1pvm h ALA 25 Cb 0.87 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1pvm h ALA 25 CO 0.07 0.36 -0.24 0.28 0.00 0.00 0.00 179.25 179.72 1pvm h VAL 26 N 0.37 1.18 -0.86 0.00 2.07 -1.12 -1.80 116.25 116.08 1pvm h VAL 26 Ca 0.05 -0.83 0.01 0.00 0.82 0.00 0.00 66.70 66.75 1pvm h VAL 26 Cb 0.78 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 1pvm h VAL 26 CO 0.06 0.24 0.57 0.11 0.02 0.00 0.00 177.57 178.56 1pvm h LYS 27 N 0.01 1.12 -0.54 1.57 1.57 -1.31 0.12 116.57 119.11 1pvm h LYS 27 Ca 0.00 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 1pvm h LYS 27 Cb 0.43 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 1pvm h LYS 27 CO 0.03 0.74 0.06 0.82 -0.57 0.00 0.00 179.45 180.53 1pvm h ILE 28 N 1.15 1.26 -0.14 1.86 2.04 -1.27 -1.24 117.51 121.18 1pvm h ILE 28 Ca 0.32 -1.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 1pvm h ILE 28 Cb -0.11 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1pvm h ILE 28 CO -0.08 0.36 0.06 0.24 0.00 0.00 0.00 178.15 178.73 1pvm h MET 29 N 0.79 0.20 -0.61 2.37 2.86 -0.71 -2.24 114.93 117.60 1pvm h MET 29 Ca 0.16 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.70 1pvm h MET 29 Cb 0.44 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 1pvm h MET 29 CO 0.02 0.29 0.13 -0.91 1.06 0.00 0.00 176.91 177.49 1pvm h ASN 30 N 0.07 0.94 -0.35 1.22 2.35 -0.74 0.12 115.58 119.18 1pvm h ASN 30 Ca 0.05 -0.24 -0.02 0.00 -0.55 0.00 0.00 56.30 55.53 1pvm h ASN 30 Cb 0.16 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 1pvm h ASN 30 CO -0.00 0.94 0.16 -0.08 -1.65 0.00 0.00 177.43 176.79 1pvm h GLU 31 N 0.89 0.51 -0.01 0.81 4.81 -1.19 -3.13 114.58 117.27 1pvm h GLU 31 Ca 0.19 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1pvm h GLU 31 Cb 0.38 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1pvm h GLU 31 CO 0.01 0.48 -0.13 0.09 -0.73 0.00 0.00 179.01 178.73 1pvm n ASN 32 N -4.71 1.61 -3.75 1.04 4.13 -0.85 -4.94 115.26 107.79 1pvm n ASN 32 Ca -0.01 -1.37 -0.24 0.00 1.68 0.00 0.00 54.58 54.64 1pvm n ASN 32 Cb 0.12 0.09 0.04 0.00 -1.54 0.00 0.00 39.78 38.49 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 0.05 -2.10 -3.96 3.10 8.25 0.31 -4.96 115.22 115.90 1pvm n HIS 33 Ca 0.15 0.88 -0.30 0.00 -0.26 0.00 0.00 57.72 58.19 1pvm n HIS 33 Cb 0.40 -4.33 -0.16 0.00 1.12 0.00 0.00 29.99 27.01 1pvm n HIS 33 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1pvm s LEU 34 N -6.89 2.00 -0.40 2.41 2.96 -0.62 -5.03 118.68 113.11 1pvm s LEU 34 Ca 0.24 -0.78 0.05 0.00 -0.22 0.00 0.00 54.13 53.43 1pvm s LEU 34 Cb -0.12 -1.12 0.55 0.00 0.50 0.00 0.00 46.19 46.00 1pvm s LEU 34 CO 0.81 -0.15 1.67 -1.22 -1.32 0.00 0.00 176.35 176.14 1pvm n TYR 35 N 4.76 2.19 -3.64 5.38 4.01 -1.26 -4.20 117.16 124.40 1pvm n TYR 35 Ca -0.14 -1.96 -0.04 0.00 -0.16 0.00 0.00 57.90 55.60 1pvm n TYR 35 Cb 0.47 -0.77 -0.07 0.00 -0.31 0.00 0.00 39.34 38.67 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 -2.13 -0.56 0.00 2.72 0.00 -1.26 -3.68 107.32 102.41 1pvm s GLY 36 Ca 0.52 1.93 0.07 0.00 0.00 0.00 0.00 44.72 47.24 1pvm s GLY 36 CO 0.03 2.77 -0.21 1.08 0.00 0.00 0.00 173.10 176.77 1pvm s LEU 37 N 2.76 2.08 0.13 0.66 1.43 -0.56 -4.72 118.68 120.46 1pvm s LEU 37 Ca -0.03 -0.43 -0.25 0.00 -1.03 0.00 0.00 54.13 52.39 1pvm s LEU 37 Cb -0.12 -1.06 -0.07 0.00 0.03 0.00 0.00 46.19 44.96 1pvm s LEU 37 CO -0.16 0.23 0.77 -0.69 0.23 0.00 0.00 176.35 176.73 1pvm s VAL 38 N -0.59 4.48 -0.12 -1.59 1.01 -0.54 -1.05 120.40 122.00 1pvm s VAL 38 Ca 0.08 1.68 -0.00 0.00 0.00 0.00 0.00 61.98 63.74 1pvm s VAL 38 Cb -0.08 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.15 1pvm s VAL 38 CO 0.00 0.48 -0.11 -0.69 0.00 0.00 0.00 175.10 174.78 1pvm s VAL 39 N -0.83 3.25 0.13 2.92 1.01 -0.05 -0.68 120.40 126.15 1pvm s VAL 39 Ca 0.36 -0.60 0.10 0.00 0.00 0.00 0.00 61.98 61.84 1pvm s VAL 39 Cb -0.22 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 1pvm s VAL 39 CO 0.25 0.54 -0.22 -0.54 0.00 0.00 0.00 175.10 175.13 1pvm s LYS 40 N 0.08 1.61 0.00 2.72 1.02 -0.42 -0.67 119.74 124.08 1pvm s LYS 40 Ca -0.04 -1.29 0.00 0.00 0.02 0.00 0.00 55.97 54.66 1pvm s LYS 40 Cb -0.14 -2.00 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 1pvm s LYS 40 CO 0.04 0.46 0.00 -0.40 -0.92 0.00 0.00 175.35 174.53 1pvm n ASP 41 N 0.76 0.00 0.00 2.83 5.68 -0.39 -0.59 116.55 124.85 1pvm n ASP 41 Ca -0.16 -0.49 0.15 0.00 -0.50 0.00 0.00 54.79 53.79 1pvm n ASP 41 Cb 0.53 0.00 0.83 0.00 -1.14 0.00 0.00 41.12 41.35 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 -1.46 0.00 -0.42 -1.12 8.00 -1.26 -3.14 116.55 117.15 1pvm n ASP 42 Ca 0.00 -0.56 0.04 0.00 0.71 0.00 0.00 54.79 54.98 1pvm n ASP 42 Cb 0.00 -0.14 0.10 0.00 -0.02 0.00 0.00 41.12 41.06 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 -1.14 2.59 0.00 -2.24 5.03 -1.26 -4.98 115.26 113.26 1pvm n ASN 43 Ca 0.19 -1.98 0.00 0.00 0.87 0.00 0.00 54.58 53.65 1pvm n ASN 43 Cb 0.17 -0.15 0.00 0.00 -1.02 0.00 0.00 39.78 38.78 1pvm n ASN 43 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1pvm n GLY 44 N 0.18 0.60 3.77 7.41 0.00 -1.19 -5.05 105.19 110.92 1pvm n GLY 44 Ca 0.08 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.10 7.26 -0.53 1.61 0.01 -1.26 -4.84 114.94 115.08 1pvm s ASN 45 Ca 0.00 1.50 -0.29 0.00 -0.71 0.00 0.00 52.86 53.36 1pvm s ASN 45 Cb 0.00 -2.46 0.03 0.00 0.41 0.00 0.00 41.25 39.23 1pvm s ASN 45 CO 0.00 0.13 1.17 -1.81 -1.51 0.00 0.00 177.10 175.08 1pvm s ASP 46 N -0.64 6.53 -0.00 -1.22 1.01 -1.26 -1.26 116.67 119.83 1pvm s ASP 46 Ca 0.36 0.27 0.16 0.00 0.71 0.00 0.00 52.55 54.05 1pvm s ASP 46 Cb -0.21 -2.55 -0.18 0.00 1.01 0.00 0.00 42.92 40.98 1pvm s ASP 46 CO 0.24 -1.38 0.63 1.33 0.21 0.00 0.00 175.17 176.19 1pvm n VAL 47 N 6.76 0.00 -3.96 -1.27 0.24 0.16 -4.64 118.33 115.62 1pvm n VAL 47 Ca 0.10 -0.16 0.02 0.00 -2.04 0.00 0.00 64.34 62.26 1pvm n VAL 47 Cb 0.49 0.87 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 0.34 2.80 7.63 0.00 -1.13 -3.36 105.19 112.86 1pvm n GLY 48 Ca 0.02 -1.01 -0.20 0.00 0.00 0.00 0.00 46.02 44.83 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 0.87 -0.23 0.99 0.20 -0.40 -0.87 118.68 119.24 1pvm s LEU 49 Ca 0.23 -0.05 -0.13 0.00 0.69 0.00 0.00 54.13 54.88 1pvm s LEU 49 Cb -0.01 -0.31 -0.04 0.00 -0.43 0.00 0.00 46.19 45.39 1pvm s LEU 49 CO -0.00 -0.14 0.27 -0.22 -0.29 0.00 0.00 176.35 175.97 1pvm s LEU 50 N 1.45 4.11 0.34 -0.68 2.96 -0.21 -0.17 118.68 126.49 1pvm s LEU 50 Ca -0.03 0.27 0.04 0.00 -0.22 0.00 0.00 54.13 54.18 1pvm s LEU 50 Cb -0.13 -2.29 -0.06 0.00 0.50 0.00 0.00 46.19 44.21 1pvm s LEU 50 CO -0.03 -0.02 0.07 -0.94 -1.32 0.00 0.00 176.35 174.10 1pvm s SER 51 N 1.17 2.46 0.11 3.68 1.04 -1.26 -1.50 113.70 119.40 1pvm s SER 51 Ca 0.13 -1.42 -0.20 0.00 0.48 0.00 0.00 55.95 54.93 1pvm s SER 51 Cb -0.14 -0.00 -0.09 0.00 0.10 0.00 0.00 66.02 65.89 1pvm s SER 51 CO 0.07 -0.65 1.75 -0.33 0.98 0.00 0.00 173.24 175.06 1pvm h GLU 52 N 2.06 0.21 -0.69 4.02 5.08 -1.99 -2.63 114.58 120.64 1pvm h GLU 52 Ca -0.40 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 57.93 1pvm h GLU 52 Cb 1.25 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1pvm h GLU 52 CO 0.68 0.16 0.40 -0.09 -1.00 0.00 0.00 179.01 179.16 1pvm h ARG 53 N 0.20 0.95 -0.59 2.33 9.65 -1.97 -1.71 114.38 123.23 1pvm h ARG 53 Ca 0.06 -0.09 -0.01 0.00 -1.10 0.00 0.00 59.98 58.84 1pvm h ARG 53 Cb -0.00 -0.20 -0.03 0.00 -1.39 0.00 0.00 29.97 28.35 1pvm h ARG 53 CO -0.01 0.68 0.33 0.66 2.80 0.00 0.00 179.97 184.43 1pvm h SER 54 N 0.96 0.72 -0.31 -3.80 4.64 -1.80 0.15 113.55 114.11 1pvm h SER 54 Ca 0.25 -0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.40 1pvm h SER 54 Cb -0.00 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 1pvm h SER 54 CO -0.04 0.58 -0.29 0.40 -0.87 0.00 0.00 176.83 176.61 1pvm h ILE 55 N 0.82 1.30 -0.50 0.95 2.04 -1.03 0.11 117.51 121.20 1pvm h ILE 55 Ca 0.21 -1.45 -0.11 0.00 1.00 0.00 0.00 64.86 64.51 1pvm h ILE 55 Cb 0.01 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1pvm h ILE 55 CO -0.04 0.47 -0.12 0.40 0.00 0.00 0.00 178.15 178.86 1pvm h ILE 56 N 0.50 1.27 0.12 -0.67 1.08 -0.73 -0.81 117.51 118.28 1pvm h ILE 56 Ca 0.05 -1.27 -0.30 0.00 -0.39 0.00 0.00 64.86 62.96 1pvm h ILE 56 Cb 0.86 1.06 -0.00 0.00 -3.07 0.00 0.00 36.82 35.66 1pvm h ILE 56 CO 0.07 0.44 -1.46 0.11 -0.69 0.00 0.00 178.15 176.62 1pvm h LYS 57 N 0.82 0.26 0.00 2.37 1.79 -0.73 -3.38 116.57 117.70 1pvm h LYS 57 Ca 0.13 -0.45 0.00 0.00 -2.18 0.00 0.00 60.65 58.15 1pvm h LYS 57 Cb 0.69 0.17 0.00 0.00 -1.58 0.00 0.00 32.23 31.50 1pvm h LYS 57 CO 0.05 1.14 -1.00 0.54 -1.08 0.00 0.00 179.45 179.11 1pvm n ARG 58 N -3.48 1.75 -0.10 3.15 1.74 0.39 -4.61 116.66 115.50 1pvm n ARG 58 Ca -0.14 -0.05 -0.15 0.00 -0.77 0.00 0.00 57.85 56.74 1pvm n ARG 58 Cb 1.04 -1.06 -0.05 0.00 -1.02 0.00 0.00 32.46 31.36 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 -1.56 0.20 -0.25 -1.55 7.35 -0.41 -4.49 117.46 116.74 1pvm n PHE 59 Ca -0.00 0.09 0.05 0.00 -0.76 0.00 0.00 57.45 56.82 1pvm n PHE 59 Cb 0.17 -0.70 0.18 0.00 0.35 0.00 0.00 39.48 39.47 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 -1.00 0.58 0.00 -2.13 1.08 -1.45 -1.07 117.51 113.52 1pvm h ILE 60 Ca -0.20 -0.12 0.00 0.00 -0.39 0.00 0.00 64.86 64.15 1pvm h ILE 60 Cb 1.11 0.21 0.00 0.00 -3.07 0.00 0.00 36.82 35.07 1pvm h ILE 60 CO -0.12 0.06 0.00 -0.65 -0.69 0.00 0.00 178.15 176.75 1pvm h PRO 61 N 0.34 0.00 0.00 2.37 0.11 -1.82 -0.72 132.00 132.28 1pvm h PRO 61 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 1pvm h PRO 61 Cb 0.66 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.77 1pvm h PRO 61 CO -0.46 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.33 1pvm h ARG 62 N 0.00 0.00 -6.03 1.05 3.08 -1.40 0.11 114.38 111.19 1pvm h ARG 62 Ca 0.00 0.00 -0.39 0.00 0.07 0.00 0.00 59.98 59.66 1pvm h ARG 62 Cb 0.03 0.00 0.10 0.00 0.08 0.00 0.00 29.97 30.18 1pvm h ARG 62 CO 0.00 0.00 -0.90 -1.71 -1.07 0.00 0.00 179.97 176.29 1pvm n ASN 63 N -2.74 -4.64 -4.24 7.04 5.15 -0.28 -4.71 115.26 110.83 1pvm n ASN 63 Ca 0.04 -0.91 -0.14 0.00 -0.60 0.00 0.00 54.58 52.97 1pvm n ASN 63 Cb 0.44 -3.91 -0.10 0.00 -0.53 0.00 0.00 39.78 35.68 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 -5.64 1.05 0.45 1.20 -0.14 -1.26 -5.13 119.74 110.27 1pvm s LYS 64 Ca 0.36 -1.46 -0.24 0.00 -1.36 0.00 0.00 55.97 53.28 1pvm s LYS 64 Cb -0.11 -0.50 -0.07 0.00 -1.68 0.00 0.00 37.83 35.47 1pvm s LYS 64 CO 0.83 0.02 1.22 0.15 -0.76 0.00 0.00 175.35 176.80 1pvm s LYS 65 N -3.80 3.75 0.53 1.68 1.02 -1.26 -4.91 119.74 116.76 1pvm s LYS 65 Ca 0.18 1.92 0.24 0.00 0.02 0.00 0.00 55.97 58.32 1pvm s LYS 65 Cb 0.04 -2.49 1.37 0.00 -0.52 0.00 0.00 37.83 36.23 1pvm s LYS 65 CO 0.01 -0.60 2.02 -1.35 -0.92 0.00 0.00 175.35 174.51 1pvm h PRO 66 N 2.17 0.01 -0.03 -1.68 0.11 -1.96 -0.88 132.00 129.73 1pvm h PRO 66 Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1pvm h PRO 66 Cb 1.25 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1pvm h PRO 66 CO 0.61 0.01 0.00 -0.40 -0.21 0.00 0.00 178.00 178.00 1pvm n ASP 67 N -4.40 0.55 -0.60 -2.05 5.68 -1.26 -1.62 116.55 112.85 1pvm n ASP 67 Ca 0.08 -1.31 0.07 0.00 -0.50 0.00 0.00 54.79 53.13 1pvm n ASP 67 Cb 0.53 -0.01 0.09 0.00 -1.14 0.00 0.00 41.12 40.58 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 -0.51 1.32 -3.97 0.11 1.02 -0.34 -4.93 120.64 113.34 1pvm n GLU 68 Ca 0.19 -1.50 -0.29 0.00 -0.02 0.00 0.00 57.16 55.54 1pvm n GLU 68 Cb 0.18 -1.28 -0.16 0.00 -0.02 0.00 0.00 31.44 30.16 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 -1.10 1.41 0.33 2.62 1.01 -1.24 -4.98 120.40 118.46 1pvm s VAL 69 Ca 0.19 -0.64 -0.27 0.00 0.00 0.00 0.00 61.98 61.25 1pvm s VAL 69 Cb 0.12 -1.41 -0.09 0.00 0.00 0.00 0.00 36.38 34.99 1pvm s VAL 69 CO 0.18 0.33 1.11 -2.16 0.00 0.00 0.00 175.10 174.55 1pvm s PRO 70 N 1.53 4.41 0.45 2.72 0.04 -1.26 -1.28 135.00 141.61 1pvm s PRO 70 Ca 0.03 1.75 0.31 0.00 0.04 0.00 0.00 61.00 63.13 1pvm s PRO 70 Cb -0.14 -2.93 1.62 0.00 0.04 0.00 0.00 34.50 33.09 1pvm s PRO 70 CO -0.09 0.02 1.94 -0.84 0.04 0.00 0.00 177.00 178.06 1pvm h ILE 71 N 2.73 0.00 -0.11 0.56 3.07 -0.90 -2.02 117.51 120.85 1pvm h ILE 71 Ca -0.48 -0.05 0.03 0.00 1.55 0.00 0.00 64.86 65.92 1pvm h ILE 71 Cb 1.22 0.77 -0.00 0.00 -0.27 0.00 0.00 36.82 38.53 1pvm h ILE 71 CO 0.65 0.00 0.09 0.08 -1.05 0.00 0.00 178.15 177.92 1pvm h ARG 72 N 0.00 0.00 -0.00 0.16 0.11 -1.65 0.23 114.38 113.23 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 0.06 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.14 1pvm h ARG 72 CO 0.00 0.00 -0.15 1.28 0.10 0.00 0.00 179.97 181.20 1pvm n LEU 73 N -4.19 0.27 -0.03 0.08 4.77 -0.76 -4.29 117.00 112.84 1pvm n LEU 73 Ca -0.00 0.21 -0.05 0.00 -0.03 0.00 0.00 56.01 56.14 1pvm n LEU 73 Cb 0.20 -0.32 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 1pvm n LEU 73 CO 0.31 0.06 -0.71 0.52 -1.33 0.00 0.00 177.39 176.24 1pvm n VAL 74 N -1.30 0.37 -1.08 4.08 0.31 0.43 -4.89 118.33 116.25 1pvm n VAL 74 Ca 0.10 -0.14 -0.35 0.00 -0.01 0.00 0.00 64.34 63.94 1pvm n VAL 74 Cb 0.31 -0.74 0.10 0.00 -0.91 0.00 0.00 33.84 32.59 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 -2.70 0.09 -2.46 5.55 0.00 0.53 -4.72 117.12 113.41 1pvm n MET 75 Ca -0.12 0.08 -0.42 0.00 0.00 0.00 0.00 57.70 57.24 1pvm n MET 75 Cb 0.62 -1.94 -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 -3.29 4.42 -0.10 3.17 1.81 0.76 -4.83 118.95 120.90 1pvm s ARG 76 Ca 0.64 1.71 -0.10 0.00 -1.72 0.00 0.00 55.73 56.25 1pvm s ARG 76 Cb -0.29 -3.43 0.03 0.00 -0.45 0.00 0.00 34.95 30.81 1pvm s ARG 76 CO 0.60 -0.30 0.28 -1.59 -0.68 0.00 0.00 175.30 173.62 1pvm s LYS 77 N 1.42 0.36 0.97 3.54 -2.85 -1.26 -1.27 119.74 120.64 1pvm s LYS 77 Ca 0.57 0.34 -0.11 0.00 -1.00 0.00 0.00 55.97 55.77 1pvm s LYS 77 Cb -0.27 0.17 0.17 0.00 -2.06 0.00 0.00 37.83 35.84 1pvm s LYS 77 CO 0.27 -0.05 1.10 -2.14 0.10 0.00 0.00 175.35 174.63 1pvm s PRO 78 N 0.02 0.63 0.07 1.78 0.02 -1.26 -1.11 135.00 135.15 1pvm s PRO 78 Ca -0.01 1.23 -0.34 0.00 0.02 0.00 0.00 61.00 61.90 1pvm s PRO 78 Cb -0.02 -1.71 -0.13 0.00 0.02 0.00 0.00 34.50 32.66 1pvm s PRO 78 CO 0.01 -2.79 1.70 1.51 -0.33 0.00 0.00 177.00 177.09 1pvm n ILE 79 N -4.31 0.23 -2.17 2.83 3.06 -1.21 -4.85 119.36 112.93 1pvm n ILE 79 Ca 0.09 -0.04 -0.41 0.00 -2.50 0.00 0.00 62.75 59.88 1pvm n ILE 79 Cb 0.53 -1.69 -0.03 0.00 0.54 0.00 0.00 39.64 38.99 1pvm n ILE 79 CO 0.00 0.00 0.00 -2.84 -2.50 0.00 0.00 176.55 171.21 1pvm s PRO 80 N 2.12 4.37 0.13 9.51 0.02 -1.26 -4.96 135.00 144.93 1pvm s PRO 80 Ca 0.84 2.12 -0.24 0.00 0.02 0.00 0.00 61.00 63.74 1pvm s PRO 80 Cb -0.67 -3.16 0.07 0.00 0.02 0.00 0.00 34.50 30.76 1pvm s PRO 80 CO 0.42 -0.26 0.60 -1.59 -0.33 0.00 0.00 177.00 175.84 1pvm s LYS 81 N -0.44 1.24 0.09 5.54 -2.85 -1.26 -0.94 119.74 121.13 1pvm s LYS 81 Ca 0.56 -0.38 0.02 0.00 -1.00 0.00 0.00 55.97 55.17 1pvm s LYS 81 Cb -0.38 0.57 -0.04 0.00 -2.06 0.00 0.00 37.83 35.93 1pvm s LYS 81 CO 0.41 -0.52 -0.08 0.14 0.10 0.00 0.00 175.35 175.40 1pvm s VAL 82 N -3.41 0.75 0.45 1.79 -7.23 -0.70 -4.94 120.40 107.11 1pvm s VAL 82 Ca -0.01 -1.77 -0.21 0.00 -1.81 0.00 0.00 61.98 58.18 1pvm s VAL 82 Cb -0.01 -1.48 -0.09 0.00 0.56 0.00 0.00 36.38 35.36 1pvm s VAL 82 CO -0.10 -0.74 1.02 -0.54 -0.31 0.00 0.00 175.10 174.43 1pvm s LYS 83 N -3.32 3.98 0.57 4.82 -0.14 -1.26 -1.12 119.74 123.27 1pvm s LYS 83 Ca 0.08 1.35 0.38 0.00 -1.36 0.00 0.00 55.97 56.42 1pvm s LYS 83 Cb 0.01 -2.23 2.02 0.00 -1.68 0.00 0.00 37.83 35.95 1pvm s LYS 83 CO -0.03 -0.27 2.16 0.66 -0.76 0.00 0.00 175.35 177.11 1pvm h SER 84 N 1.88 0.00 -0.09 2.83 4.64 -1.28 -1.88 113.55 119.65 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 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1pvm h SER 84 CO 0.60 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.66 1pvm n ASP 85 N -2.86 2.00 -4.77 4.97 5.75 -1.26 -2.53 116.55 117.84 1pvm n ASP 85 Ca -0.02 -1.69 -0.40 0.00 -0.01 0.00 0.00 54.79 52.67 1pvm n ASP 85 Cb 0.08 -0.05 0.01 0.00 -1.03 0.00 0.00 41.12 40.13 1pvm n ASP 85 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1pvm s TYR 86 N -1.90 2.58 0.53 2.11 1.51 -0.71 -4.76 117.35 116.72 1pvm s TYR 86 Ca 0.35 1.29 -0.14 0.00 -1.01 0.00 0.00 57.07 57.56 1pvm s TYR 86 Cb 0.20 -3.86 -0.06 0.00 -0.11 0.00 0.00 41.96 38.13 1pvm s TYR 86 CO 0.31 -2.70 0.96 0.34 -1.11 0.00 0.00 175.55 173.35 1pvm s ASP 87 N -0.52 6.48 0.49 2.29 2.15 -1.26 -0.50 116.67 125.80 1pvm s ASP 87 Ca 0.59 1.44 0.21 0.00 0.43 0.00 0.00 52.55 55.21 1pvm s ASP 87 Cb -0.42 -2.46 1.26 0.00 -0.30 0.00 0.00 42.92 40.99 1pvm s ASP 87 CO 0.55 -0.65 2.00 -0.37 -0.17 0.00 0.00 175.17 176.53 1pvm h VAL 88 N 0.54 0.80 -0.80 1.11 -1.51 -1.65 -0.58 116.25 114.16 1pvm h VAL 88 Ca -0.46 -0.05 -0.03 0.00 -1.23 0.00 0.00 66.70 64.93 1pvm h VAL 88 Cb 1.19 0.64 -0.04 0.00 -2.13 0.00 0.00 31.29 30.95 1pvm h VAL 88 CO 0.62 0.03 0.40 0.50 -1.23 0.00 0.00 177.57 177.88 1pvm h LYS 89 N 0.15 1.15 -0.30 5.19 3.64 -1.89 -0.21 116.57 124.29 1pvm h LYS 89 Ca 0.25 -0.16 -0.12 0.00 -1.27 0.00 0.00 60.65 59.35 1pvm h LYS 89 Cb 0.80 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 1pvm h LYS 89 CO -0.03 0.88 -0.31 -0.44 -2.27 0.00 0.00 179.45 177.27 1pvm h ASP 90 N 1.13 0.66 -0.39 4.20 3.45 -1.49 -2.38 116.42 121.61 1pvm h ASP 90 Ca 0.28 -0.26 -0.11 0.00 0.43 0.00 0.00 57.03 57.37 1pvm h ASP 90 Cb 0.10 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.68 1pvm h ASP 90 CO -0.04 0.93 -0.18 0.58 -1.57 0.00 0.00 179.24 178.96 1pvm h VAL 91 N 0.54 1.28 -0.35 -1.35 2.07 -0.98 -2.12 116.25 115.34 1pvm h VAL 91 Ca 0.06 -1.31 0.03 0.00 0.82 0.00 0.00 66.70 66.30 1pvm h VAL 91 Cb 0.80 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1pvm h VAL 91 CO 0.07 0.44 0.15 0.00 0.02 0.00 0.00 177.57 178.25 1pvm h ALA 92 N 0.81 0.42 -0.86 1.67 0.00 -0.91 -0.18 119.26 120.22 1pvm h ALA 92 Ca 0.09 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1pvm h ALA 92 Cb 0.73 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 1pvm h ALA 92 CO 0.06 -0.23 0.50 0.00 0.00 0.00 0.00 179.25 179.58 1pvm h ALA 93 N 1.20 1.26 -0.15 0.00 0.00 -1.33 -0.36 119.26 119.88 1pvm h ALA 93 Ca 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1pvm h ALA 93 Cb 0.09 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1pvm h ALA 93 CO -0.13 0.62 0.01 -0.92 0.00 0.00 0.00 179.25 178.83 1pvm h TYR 94 N 1.19 0.27 -0.13 0.00 3.20 -0.74 -1.06 116.97 119.70 1pvm h TYR 94 Ca 0.31 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.13 1pvm h TYR 94 Cb -0.02 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 1pvm h TYR 94 CO 0.01 0.46 0.07 -0.07 -1.64 0.00 0.00 178.16 176.98 1pvm h LEU 95 N 0.01 0.16 -0.76 2.82 3.38 -0.81 -2.71 115.31 117.40 1pvm h LEU 95 Ca 0.04 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1pvm h LEU 95 Cb 0.34 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1pvm h LEU 95 CO 0.01 0.20 0.50 -1.28 0.09 0.00 0.00 178.44 177.96 1pvm h SER 96 N 0.10 0.85 -0.24 -0.43 0.87 -1.05 0.40 113.55 114.05 1pvm h SER 96 Ca 0.04 -0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.60 1pvm h SER 96 Cb 0.08 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 1pvm h SER 96 CO -0.01 0.61 0.16 -0.08 -0.53 0.00 0.00 176.83 176.99 1pvm h GLU 97 N 1.01 0.25 -0.24 2.24 4.57 -1.08 -2.69 114.58 118.64 1pvm h GLU 97 Ca 0.28 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.45 1pvm h GLU 97 Cb -0.09 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.44 1pvm h GLU 97 CO -0.07 0.16 0.00 0.09 -1.18 0.00 0.00 179.01 178.01 1pvm n ASN 98 N -4.50 2.92 -1.38 1.04 3.02 -0.84 -4.97 115.26 110.56 1pvm n ASN 98 Ca 0.01 -1.86 -0.14 0.00 -0.03 0.00 0.00 54.58 52.56 1pvm n ASN 98 Cb 0.13 -0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.11 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 1.09 0.64 3.95 7.41 0.00 -0.17 -3.10 105.19 115.00 1pvm n GLY 99 Ca 0.14 -0.31 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.73 4.23 0.00 0.99 1.43 -0.05 -4.24 118.68 117.31 1pvm s LEU 100 Ca 0.00 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.38 1pvm s LEU 100 Cb 0.00 -3.04 0.03 0.00 0.03 0.00 0.00 46.19 43.21 1pvm s LEU 100 CO 0.00 -0.09 0.69 -1.84 0.23 0.00 0.00 176.35 175.34 1pvm n GLU 101 N -1.17 0.18 -3.49 1.70 -0.00 -1.26 -4.42 120.64 112.18 1pvm n GLU 101 Ca -0.07 -0.88 -0.10 0.00 -0.00 0.00 0.00 57.16 56.11 1pvm n GLU 101 Cb 0.56 -1.05 -0.03 0.00 -0.00 0.00 0.00 31.44 30.92 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 -0.40 0.93 0.22 3.44 1.70 -1.26 -0.85 118.95 122.74 1pvm s ARG 102 Ca 0.04 -0.26 -0.22 0.00 -0.47 0.00 0.00 55.73 54.81 1pvm s ARG 102 Cb 0.02 0.43 0.04 0.00 -0.57 0.00 0.00 34.95 34.87 1pvm s ARG 102 CO 0.03 -0.39 0.75 0.00 -1.08 0.00 0.00 175.30 174.61 1pvm s ALA 104 N -3.74 3.20 -0.10 0.00 0.00 -0.11 -1.16 121.76 119.85 1pvm s ALA 104 Ca 0.09 -0.38 0.04 0.00 0.00 0.00 0.00 51.96 51.71 1pvm s ALA 104 Cb -0.04 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 20.26 1pvm s ALA 104 CO 0.02 -0.68 -0.22 0.08 0.00 0.00 0.00 175.76 174.96 1pvm s VAL 105 N -3.04 1.93 0.12 0.00 1.01 0.21 -1.72 120.40 118.90 1pvm s VAL 105 Ca 0.53 -0.94 0.10 0.00 0.00 0.00 0.00 61.98 61.67 1pvm s VAL 105 Cb -0.11 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1pvm s VAL 105 CO 0.49 0.53 -0.23 0.68 0.00 0.00 0.00 175.10 176.57 1pvm s VAL 106 N 0.45 2.48 0.79 2.92 -7.23 -0.28 -0.30 120.40 119.24 1pvm s VAL 106 Ca -0.17 -1.62 -0.05 0.00 -1.81 0.00 0.00 61.98 58.33 1pvm s VAL 106 Cb -0.17 -2.11 0.15 0.00 0.56 0.00 0.00 36.38 34.81 1pvm s VAL 106 CO 0.07 0.12 1.09 1.51 -0.31 0.00 0.00 175.10 177.57 1pvm s ASP 107 N -2.02 3.98 0.19 4.85 1.47 -0.38 -0.75 116.67 124.02 1pvm s ASP 107 Ca 0.15 -0.25 -0.17 0.00 1.18 0.00 0.00 52.55 53.46 1pvm s ASP 107 Cb -0.10 -0.02 0.16 0.00 -0.34 0.00 0.00 42.92 42.62 1pvm s ASP 107 CO 0.07 -2.12 1.62 -0.78 0.68 0.00 0.00 175.17 174.64 1pvm h ASP 108 N -0.83 -0.76 0.15 2.11 1.82 -2.00 0.13 116.42 117.04 1pvm h ASP 108 Ca -0.38 0.18 0.00 0.00 -0.39 0.00 0.00 57.03 56.45 1pvm h ASP 108 Cb 1.26 0.42 0.00 0.00 0.68 0.00 0.00 39.33 41.69 1pvm h ASP 108 CO 0.39 -0.24 0.00 -2.65 -1.61 0.00 0.00 179.24 175.12 1pvm n PRO 109 N -5.41 0.14 0.00 0.28 -0.02 -1.26 -4.84 135.00 123.88 1pvm n PRO 109 Ca 0.05 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1pvm n PRO 109 Cb 0.32 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1pvm n PRO 109 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pvm n GLY 110 N -1.04 0.71 3.77 -1.23 0.00 0.46 -5.08 105.19 102.78 1pvm n GLY 110 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 1pvm n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pvm s ARG 111 N -0.98 4.71 -0.17 1.61 0.52 -1.26 -4.74 118.95 118.64 1pvm s ARG 111 Ca 0.00 1.42 -0.29 0.00 -0.52 0.00 0.00 55.73 56.34 1pvm s ARG 111 Cb 0.00 -3.03 -0.01 0.00 0.52 0.00 0.00 34.95 32.44 1pvm s ARG 111 CO 0.00 0.38 1.18 0.08 0.02 0.00 0.00 175.30 176.96 1pvm s VAL 112 N -1.41 4.42 -0.88 3.52 1.01 -1.26 -1.25 120.40 124.55 1pvm s VAL 112 Ca 0.46 1.71 0.12 0.00 0.00 0.00 0.00 61.98 64.27 1pvm s VAL 112 Cb -0.22 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.00 1pvm s VAL 112 CO 0.28 -0.13 0.62 1.33 0.00 0.00 0.00 175.10 177.20 1pvm n VAL 113 N 5.25 0.00 -1.12 2.92 0.24 0.59 -4.96 118.33 121.24 1pvm n VAL 113 Ca 0.13 -0.31 0.00 0.00 -2.04 0.00 0.00 64.34 62.11 1pvm n VAL 113 Cb 0.45 1.08 0.00 0.00 -1.47 0.00 0.00 33.84 33.91 1pvm n VAL 113 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1pvm n GLY 114 N 1.10 -1.41 3.04 7.63 0.00 -1.16 -4.43 105.19 109.96 1pvm n GLY 114 Ca 0.04 -1.01 -0.20 0.00 0.00 0.00 0.00 46.02 44.84 1pvm n GLY 114 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pvm s ILE 115 N -2.35 0.84 -0.06 -0.61 1.01 -0.90 -0.62 121.20 118.51 1pvm s ILE 115 Ca 0.00 -0.43 0.06 0.00 0.00 0.00 0.00 60.65 60.28 1pvm s ILE 115 Cb 0.00 -0.72 -0.01 0.00 0.01 0.00 0.00 42.46 41.74 1pvm s ILE 115 CO 0.00 0.25 -0.23 0.54 0.00 0.00 0.00 174.94 175.49 1pvm s VAL 116 N -0.08 2.21 0.41 2.92 0.11 -0.31 -0.54 120.40 125.11 1pvm s VAL 116 Ca 0.01 -1.02 0.07 0.00 -2.93 0.00 0.00 61.98 58.12 1pvm s VAL 116 Cb -0.06 -1.81 -0.08 0.00 -1.53 0.00 0.00 36.38 32.91 1pvm s VAL 116 CO -0.00 0.57 0.01 0.42 -3.33 0.00 0.00 175.10 172.77 1pvm s THR 117 N -0.24 2.02 0.36 5.04 -4.23 -1.26 -1.68 115.64 115.66 1pvm s THR 117 Ca -0.01 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.53 1pvm s THR 117 Cb -0.13 -2.98 0.26 0.00 1.34 0.00 0.00 72.50 70.98 1pvm s THR 117 CO 0.03 -0.01 2.01 0.25 -0.54 0.00 0.00 174.62 176.36 1pvm h LEU 118 N 1.77 0.64 -0.45 4.79 5.85 -1.39 -1.74 115.31 124.79 1pvm h LEU 118 Ca -0.44 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1pvm h LEU 118 Cb 1.24 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 1pvm h LEU 118 CO 0.80 0.48 0.29 0.74 -0.34 0.00 0.00 178.44 180.41 1pvm h THR 119 N 0.75 1.13 -0.26 1.05 2.02 -1.96 0.34 112.91 115.99 1pvm h THR 119 Ca 0.20 -0.27 0.02 0.00 0.77 0.00 0.00 66.41 67.13 1pvm h THR 119 Cb -0.06 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 1pvm h THR 119 CO -0.04 0.13 0.11 0.44 0.37 0.00 0.00 175.52 176.53 1pvm h ASP 120 N 0.61 0.16 0.55 4.18 3.45 -1.71 -2.77 116.42 120.89 1pvm h ASP 120 Ca 0.16 0.02 -0.07 0.00 0.43 0.00 0.00 57.03 57.57 1pvm h ASP 120 Cb -0.04 -0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 38.71 1pvm h ASP 120 CO -0.03 0.13 -0.35 -0.07 -1.57 0.00 0.00 179.24 177.34 1pvm h LEU 121 N 0.25 0.00 -2.37 1.55 3.38 -0.90 -3.23 115.31 113.98 1pvm h LEU 121 Ca 0.11 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.10 1pvm h LEU 121 Cb 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1pvm h LEU 121 CO -0.09 0.35 0.20 0.77 0.09 0.00 0.00 178.44 179.76 1pvm h SER 122 N 0.00 0.00 1.25 -0.43 4.64 -0.02 0.01 113.55 119.01 1pvm h SER 122 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pvm h SER 122 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1pvm h SER 122 CO 0.05 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.55 1pvm n ARG 123 N -3.24 0.21 0.00 4.77 1.74 -1.22 -4.25 116.66 114.67 1pvm n ARG 123 Ca -0.01 0.22 0.00 0.00 -0.77 0.00 0.00 57.85 57.29 1pvm n ARG 123 Cb 0.28 -1.76 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 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 -2.13 0.00 -1.27 -1.55 4.02 -0.13 -4.36 117.16 111.75 1pvm n TYR 124 Ca 0.05 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.62 1pvm n TYR 124 Cb 0.38 0.00 0.10 0.00 -0.02 0.00 0.00 39.34 39.80 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 -4.19 3.12 0.71 7.72 1.43 -0.49 -4.63 118.68 122.36 1pvm s LEU 125 Ca 0.00 2.06 -0.11 0.00 -1.03 0.00 0.00 54.13 55.05 1pvm s LEU 125 Cb 0.00 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.68 1pvm s LEU 125 CO 0.00 -2.25 1.07 -0.94 0.23 0.00 0.00 176.35 174.46 1pvm s SER 126 N -2.77 5.28 0.19 2.29 1.04 -1.26 -4.87 113.70 113.60 1pvm s SER 126 Ca 0.66 1.54 -0.12 0.00 0.48 0.00 0.00 55.95 58.52 1pvm s SER 126 Cb -0.22 -2.40 0.20 0.00 0.10 0.00 0.00 66.02 63.70 1pvm s SER 126 CO 0.51 -1.50 1.75 -0.09 0.98 0.00 0.00 173.24 174.90 1pvm h ARG 127 N -0.76 0.39 -0.62 4.02 2.43 -1.97 -2.00 114.38 115.88 1pvm h ARG 127 Ca -0.44 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 58.66 1pvm h ARG 127 Cb 1.22 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.65 1pvm h ARG 127 CO 0.58 0.26 0.23 0.00 -1.51 0.00 0.00 179.97 179.52 1pvm h ALA 128 N 1.35 1.24 -0.45 2.80 0.00 -1.99 -1.84 119.26 120.36 1pvm h ALA 128 Ca 0.26 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1pvm h ALA 128 Cb 0.27 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1pvm h ALA 128 CO -0.24 0.55 -0.14 1.03 0.00 0.00 0.00 179.25 180.45 1pvm h SER 129 N 0.89 0.84 -0.32 0.00 0.87 -1.76 -0.66 113.55 113.42 1pvm h SER 129 Ca 0.21 -0.27 -0.04 0.00 -1.23 0.00 0.00 61.79 60.46 1pvm h SER 129 Cb 0.20 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 1pvm h SER 129 CO -0.02 0.99 0.05 0.40 -0.53 0.00 0.00 176.83 177.72 1pvm h ILE 130 N 0.75 1.24 -0.83 2.23 2.04 -1.05 -1.88 117.51 120.01 1pvm h ILE 130 Ca 0.12 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 65.14 1pvm h ILE 130 Cb 0.65 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.84 1pvm h ILE 130 CO 0.05 0.27 0.45 0.74 0.00 0.00 0.00 178.15 179.65 1pvm h THR 131 N 0.36 1.25 -0.01 -0.27 2.02 -1.17 -1.61 112.91 113.48 1pvm h THR 131 Ca 0.10 -0.63 0.01 0.00 0.77 0.00 0.00 66.41 66.66 1pvm h THR 131 Cb 0.35 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 1pvm h THR 131 CO 0.01 0.28 -0.04 -0.78 0.37 0.00 0.00 175.52 175.36 1pvm h ASP 132 N 1.17 -0.10 -0.65 4.18 3.58 -0.80 0.56 116.42 124.35 1pvm h ASP 132 Ca 0.29 0.02 0.02 0.00 0.42 0.00 0.00 57.03 57.78 1pvm h ASP 132 Cb 0.04 0.05 -0.04 0.00 1.72 0.00 0.00 39.33 41.10 1pvm h ASP 132 CO -0.05 -0.05 0.41 0.40 -2.88 0.00 0.00 179.24 177.08 1pvm h ILE 133 N -0.06 1.12 -0.56 2.25 2.04 -1.08 0.52 117.51 121.74 1pvm h ILE 133 Ca 0.02 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 1pvm h ILE 133 Cb 0.08 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.36 1pvm h ILE 133 CO -0.04 0.15 0.32 -0.07 0.00 0.00 0.00 178.15 178.51 1pvm h LEU 134 N 0.83 0.69 -0.44 1.44 3.38 -0.92 -0.10 115.31 120.19 1pvm h LEU 134 Ca 0.25 -0.08 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 1pvm h LEU 134 Cb -0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1pvm h LEU 134 CO -0.08 0.57 -0.21 -0.07 0.09 0.00 0.00 178.44 178.74 1pvm h LEU 135 N 0.76 0.95 -1.04 1.67 3.38 -0.55 -2.73 115.31 117.75 1pvm h LEU 135 Ca 0.20 -0.40 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 1pvm h LEU 135 Cb 0.02 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1pvm h LEU 135 CO -0.03 1.14 -0.22 0.28 0.09 0.00 0.00 178.44 179.70 1pvm h SER 136 N 0.76 0.42 0.36 -0.43 0.02 -0.68 -2.20 113.55 111.80 1pvm h SER 136 Ca 0.10 -0.13 -0.11 0.00 -0.84 0.00 0.00 61.79 60.81 1pvm h SER 136 Cb 0.78 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1pvm h SER 136 CO 0.06 0.65 -0.46 -0.74 -1.14 0.00 0.00 176.83 175.21 1pvm h HIS 137 N 0.38 0.15 0.00 3.45 -0.00 -0.90 0.73 115.15 118.97 1pvm h HIS 137 Ca 0.06 -0.04 -0.24 0.00 -0.00 0.00 0.00 60.37 60.15 1pvm h HIS 137 Cb 0.60 -0.03 0.01 0.00 -0.00 0.00 0.00 27.41 27.99 1pvm h HIS 137 CO 0.02 0.56 -0.98 -0.09 -0.00 0.00 0.00 177.93 177.44 1pvm h ARG 138 N 0.10 0.50 0.00 5.26 2.43 -1.18 -3.38 114.38 118.11 1pvm h ARG 138 Ca 0.00 -0.54 -0.19 0.00 -0.81 0.00 0.00 59.98 58.45 1pvm h ARG 138 Cb 0.85 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.52 1pvm h ARG 138 CO 0.07 1.18 -1.96 0.25 -1.51 0.00 0.00 179.97 177.99 1pvm n THR 139 N -3.77 0.87 -4.18 0.20 -2.24 -0.86 -4.99 114.28 99.31 1pvm n THR 139 Ca -0.08 -0.69 -0.25 0.00 -2.27 0.00 0.00 64.05 60.76 1pvm n THR 139 Cb 0.85 -0.39 -0.07 0.00 -2.10 0.00 0.00 70.33 68.63 1pvm n THR 139 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1pvm s LYS 140 N -2.96 2.56 -0.04 -0.78 1.02 0.24 -5.09 119.74 114.70 1pvm s LYS 140 Ca -0.07 -1.11 0.02 0.00 0.02 0.00 0.00 55.97 54.83 1pvm s LYS 140 Cb 0.09 -2.41 0.01 0.00 -0.52 0.00 0.00 37.83 35.00 1pvm s LYS 140 CO 0.85 0.44 -0.10 0.16 -0.92 0.00 0.00 175.35 175.78 1pvm s ASP 141 N -3.24 1.40 0.26 2.83 -4.77 -1.26 -4.61 116.67 107.27 1pvm s ASP 141 Ca 0.30 -0.22 -0.31 0.00 -3.30 0.00 0.00 52.55 49.02 1pvm s ASP 141 Cb -0.09 -0.47 -0.13 0.00 -1.09 0.00 0.00 42.92 41.14 1pvm s ASP 141 CO 0.21 0.06 1.41 0.00 0.70 0.00 0.00 175.17 177.54 1pvm n TYR 142 N 3.46 2.25 -2.69 2.11 9.36 -1.18 -4.89 117.16 125.58 1pvm n TYR 142 Ca -0.20 0.43 -0.43 0.00 3.32 0.00 0.00 57.90 61.02 1pvm n TYR 142 Cb 0.53 -2.47 -0.03 0.00 -0.63 0.00 0.00 39.34 36.74 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 -0.61 3.68 -0.04 2.98 -0.21 -1.26 -5.01 119.66 119.19 1pvm s GLN 143 Ca 0.66 0.44 -0.26 0.00 0.02 0.00 0.00 55.36 56.23 1pvm s GLN 143 Cb -0.62 -3.90 -0.03 0.00 1.00 0.00 0.00 33.01 29.45 1pvm s GLN 143 CO 0.51 -1.29 0.80 -1.01 -2.12 0.00 0.00 175.29 172.19 1pvm s HIS 144 N 4.13 3.61 0.04 0.91 3.76 -1.26 -4.76 115.29 121.71 1pvm s HIS 144 Ca 0.44 1.41 -0.02 0.00 -0.15 0.00 0.00 55.06 56.73 1pvm s HIS 144 Cb -0.09 -2.92 -0.04 0.00 1.11 0.00 0.00 32.58 30.64 1pvm s HIS 144 CO 0.29 0.05 0.23 -0.51 -0.85 0.00 0.00 174.74 173.94 1pvm s LEU 145 N 0.89 4.35 0.16 0.89 1.43 -0.27 -0.70 118.68 125.44 1pvm s LEU 145 Ca 0.43 0.37 -0.32 0.00 -1.03 0.00 0.00 54.13 53.59 1pvm s LEU 145 Cb -0.19 -2.84 -0.11 0.00 0.03 0.00 0.00 46.19 43.08 1pvm s LEU 145 CO 0.22 0.20 1.67 0.00 0.23 0.00 0.00 176.35 178.67 1pvm n PRO 147 N 4.43 0.22 -0.08 0.00 -0.04 -1.26 0.14 135.00 138.42 1pvm n PRO 147 Ca 0.15 0.32 -0.15 0.00 -0.04 0.00 0.00 63.50 63.79 1pvm n PRO 147 Cb 0.38 -1.84 -0.13 0.00 -0.04 0.00 0.00 33.50 31.87 1pvm n PRO 147 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1pvm h LYS 148 N 0.00 0.00 0.00 0.54 3.64 -1.99 -3.39 116.57 115.37 1pvm h LYS 148 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1pvm h LYS 148 Cb 0.53 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1pvm h LYS 148 CO 0.00 0.98 -1.21 0.00 -2.27 0.00 0.00 179.45 176.95 1pvm n GLY 150 N 1.51 1.98 0.02 0.00 0.00 0.12 -4.72 105.19 104.10 1pvm n GLY 150 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.98 0.32 -2.00 1.61 0.24 -1.26 -4.65 118.33 110.61 1pvm n VAL 151 Ca 0.00 -0.28 -0.33 0.00 -2.04 0.00 0.00 64.34 61.69 1pvm n VAL 151 Cb 0.00 -0.31 0.02 0.00 -1.47 0.00 0.00 33.84 32.08 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 -3.57 2.22 -0.20 7.63 0.00 -1.26 -4.83 107.32 107.31 1pvm s GLY 152 Ca -0.04 0.51 -0.12 0.00 0.00 0.00 0.00 44.72 45.08 1pvm s GLY 152 CO 0.35 0.85 0.21 0.14 0.00 0.00 0.00 173.10 174.65 1pvm s VAL 153 N -2.30 5.34 -0.31 1.40 1.01 -1.26 -0.14 120.40 124.14 1pvm s VAL 153 Ca 0.66 0.34 -0.29 0.00 0.00 0.00 0.00 61.98 62.69 1pvm s VAL 153 Cb -0.19 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.66 1pvm s VAL 153 CO 0.36 0.37 1.14 -0.76 0.00 0.00 0.00 175.10 176.22 1pvm s LEU 154 N 0.73 3.92 0.02 3.92 1.43 0.12 -0.79 118.68 128.04 1pvm s LEU 154 Ca 0.11 1.09 0.04 0.00 -1.03 0.00 0.00 54.13 54.35 1pvm s LEU 154 Cb -0.13 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.52 1pvm s LEU 154 CO 0.03 -0.94 -0.08 -1.61 0.23 0.00 0.00 176.35 173.97 1pvm s GLU 155 N 3.81 2.46 0.29 1.70 0.41 -0.08 -4.68 118.70 122.61 1pvm s GLU 155 Ca 0.49 -0.78 -0.29 0.00 -0.41 0.00 0.00 54.97 53.98 1pvm s GLU 155 Cb -0.13 -2.45 -0.10 0.00 -1.78 0.00 0.00 34.13 29.67 1pvm s GLU 155 CO 0.18 0.59 1.28 -2.14 -0.49 0.00 0.00 175.26 174.68 1pvm s PRO 156 N -1.50 4.40 -0.23 0.39 0.02 -1.26 -0.14 135.00 136.69 1pvm s PRO 156 Ca 0.17 2.12 0.02 0.00 0.02 0.00 0.00 61.00 63.33 1pvm s PRO 156 Cb -0.11 -3.12 0.05 0.00 0.02 0.00 0.00 34.50 31.34 1pvm s PRO 156 CO 0.08 -0.16 -0.13 0.08 -0.33 0.00 0.00 177.00 176.54 1pvm s VAL 157 N -0.77 2.06 0.21 3.83 1.01 -0.45 -4.88 120.40 121.40 1pvm s VAL 157 Ca 0.51 -1.37 0.02 0.00 0.00 0.00 0.00 61.98 61.14 1pvm s VAL 157 Cb -0.38 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 1pvm s VAL 157 CO 0.47 0.15 0.36 -0.31 0.00 0.00 0.00 175.10 175.77 1pvm s TYR 158 N 1.19 3.48 0.20 5.22 1.51 -1.26 -0.43 117.35 127.25 1pvm s TYR 158 Ca -0.04 0.18 0.02 0.00 -1.01 0.00 0.00 57.07 56.21 1pvm s TYR 158 Cb -0.18 -1.72 0.02 0.00 -0.11 0.00 0.00 41.96 39.97 1pvm s TYR 158 CO -0.08 0.42 0.14 0.27 -1.11 0.00 0.00 175.55 175.19 1pvm n ASN 159 N -0.91 1.66 0.29 2.29 2.04 -0.78 -4.88 115.26 114.98 1pvm n ASN 159 Ca -0.07 -1.69 0.19 0.00 -0.44 0.00 0.00 54.58 52.58 1pvm n ASN 159 Cb 0.55 -0.01 0.96 0.00 -2.53 0.00 0.00 39.78 38.75 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 -0.01 -3.83 4.11 -2.00 -1.50 114.58 111.34 1pvm h GLU 160 Ca -0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.30 1pvm h GLU 160 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1pvm h GLU 160 CO 0.20 0.00 -0.15 1.63 0.07 0.00 0.00 179.01 180.76 1pvm n LYS 161 N -2.94 1.20 -0.84 1.06 5.02 -1.26 -4.91 118.16 115.49 1pvm n LYS 161 Ca -0.02 -0.72 0.00 0.00 -2.02 0.00 0.00 58.31 55.56 1pvm n LYS 161 Cb 0.14 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 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 1.28 0.65 3.77 0.72 0.00 -0.57 -5.02 105.19 106.02 1pvm n GLY 162 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.16 4.55 -0.41 1.61 2.02 -1.26 -4.79 118.70 120.26 1pvm s GLU 163 Ca 0.00 1.45 -0.27 0.00 0.02 0.00 0.00 54.97 56.17 1pvm s GLU 163 Cb 0.00 -2.87 0.02 0.00 0.10 0.00 0.00 34.13 31.38 1pvm s GLU 163 CO 0.00 0.22 1.02 0.42 0.02 0.00 0.00 175.26 176.94 1pvm s ILE 164 N -1.50 4.43 -0.03 -1.63 1.01 0.37 -1.86 121.20 122.00 1pvm s ILE 164 Ca 0.50 1.21 -0.23 0.00 0.00 0.00 0.00 60.65 62.12 1pvm s ILE 164 Cb -0.22 -4.45 -0.23 0.00 0.01 0.00 0.00 42.46 37.57 1pvm s ILE 164 CO 0.28 -0.73 1.07 0.11 0.00 0.00 0.00 174.94 175.67 1pvm h LYS 165 N 8.76 0.23 -3.21 2.79 1.79 -1.08 -3.40 116.57 122.47 1pvm h LYS 165 Ca -0.23 -0.23 0.02 0.00 -2.18 0.00 0.00 60.65 58.03 1pvm h LYS 165 Cb 1.07 0.06 -0.06 0.00 -1.58 0.00 0.00 32.23 31.72 1pvm h LYS 165 CO 1.05 0.94 0.13 0.14 -1.08 0.00 0.00 179.45 180.62 1pvm s VAL 166 N -3.25 0.00 -0.15 0.50 -7.23 -1.23 -4.99 120.40 104.04 1pvm s VAL 166 Ca -0.15 -1.13 -0.01 0.00 -1.81 0.00 0.00 61.98 58.88 1pvm s VAL 166 Cb 0.02 -2.12 -0.01 0.00 0.56 0.00 0.00 36.38 34.82 1pvm s VAL 166 CO 0.76 0.00 -0.11 -0.36 -0.31 0.00 0.00 175.10 175.07 1pvm s PHE 167 N -3.84 2.85 -0.08 2.82 0.40 -0.04 -1.35 117.98 118.75 1pvm s PHE 167 Ca 0.15 -0.70 0.02 0.00 -0.60 0.00 0.00 56.93 55.80 1pvm s PHE 167 Cb -0.04 -1.90 -0.02 0.00 0.51 0.00 0.00 43.02 41.57 1pvm s PHE 167 CO 0.08 -0.27 -0.12 0.50 0.70 0.00 0.00 175.22 176.11 1pvm s ARG 168 N 0.56 2.81 0.28 0.44 3.52 0.81 -1.80 118.95 125.57 1pvm s ARG 168 Ca -0.07 -0.66 -0.29 0.00 -0.13 0.00 0.00 55.73 54.58 1pvm s ARG 168 Cb -0.15 -2.50 -0.10 0.00 -1.56 0.00 0.00 34.95 30.63 1pvm s ARG 168 CO 0.03 0.52 1.39 0.00 -0.81 0.00 0.00 175.30 176.43 1pvm n SER 170 N 1.76 0.73 -4.64 0.00 3.41 0.03 -4.83 113.62 110.08 1pvm n SER 170 Ca 0.04 -0.85 -0.43 0.00 -0.26 0.00 0.00 58.87 57.37 1pvm n SER 170 Cb 0.41 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.33 1pvm n SER 170 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1pvm s ASN 171 N -2.35 6.62 0.24 4.04 3.84 -1.26 -4.86 114.94 121.20 1pvm s ASN 171 Ca 0.31 1.69 -0.05 0.00 0.21 0.00 0.00 52.86 55.02 1pvm s ASN 171 Cb 0.20 -2.53 0.36 0.00 -0.55 0.00 0.00 41.25 38.72 1pvm s ASN 171 CO 0.45 -1.05 1.82 -0.65 -2.79 0.00 0.00 177.10 174.88 1pvm h PRO 172 N 9.66 0.79 0.00 0.43 0.11 -2.03 -0.89 132.00 140.08 1pvm h PRO 172 Ca -0.32 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1pvm h PRO 172 Cb 1.14 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1pvm h PRO 172 CO 0.99 0.52 0.00 0.00 -0.21 0.00 0.00 178.00 179.30 1pvm n ALA 173 N -2.37 2.24 -2.42 -0.75 0.00 -1.26 -4.77 120.51 111.18 1pvm n ALA 173 Ca 0.12 -0.12 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1pvm n ALA 173 Cb 0.24 -1.37 -0.13 0.00 0.00 0.00 0.00 19.45 18.18 1pvm n ALA 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pvm s ASP 175 N -1.25 4.45 -0.02 0.00 2.15 -1.26 -4.72 116.67 116.03 1pvm s ASP 175 Ca 0.13 -3.22 0.00 0.00 0.43 0.00 0.00 52.55 49.90 1pvm s ASP 175 Cb -0.10 -1.64 0.01 0.00 -0.30 0.00 0.00 42.92 40.89 1pvm s ASP 175 CO 0.03 -0.20 -0.01 -0.47 -0.17 0.00 0.00 175.17 174.36 1pvm s TYR 176 N -0.58 0.22 -0.00 -5.34 5.04 -1.26 -5.08 117.35 110.35 1pvm s TYR 176 Ca 0.19 -0.00 -0.04 0.00 -2.44 0.00 0.00 57.07 54.78 1pvm s TYR 176 Cb -0.21 -0.25 -0.00 0.00 0.35 0.00 0.00 41.96 41.85 1pvm s TYR 176 CO -0.04 -0.06 0.07 -1.21 -1.34 0.00 0.00 175.55 172.97 1pvm s GLU 177 N 0.52 0.32 0.00 4.97 2.02 -1.26 -1.43 118.70 123.84 1pvm s GLU 177 Ca -0.05 -0.30 0.00 0.00 0.02 0.00 0.00 54.97 54.64 1pvm s GLU 177 Cb -0.08 0.13 0.00 0.00 0.10 0.00 0.00 34.13 34.28 1pvm s GLU 177 CO -0.01 -0.06 0.00 -0.85 0.02 0.00 0.00 175.26 174.35