#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vpn s GLY 33 N 0.00 2.27 -1.02 -0.02 0.00 -1.22 -4.92 107.32 102.41 1vpn s GLY 33 Ca 0.00 0.66 -0.07 0.00 0.00 0.00 0.00 44.72 45.31 1vpn s GLY 33 CO 0.00 2.10 2.36 -0.13 0.00 0.00 0.00 173.10 177.43 1vpn n MET 34 N 4.74 2.43 -3.71 2.90 0.00 -1.26 -3.73 117.12 118.48 1vpn n MET 34 Ca 0.10 -1.58 -0.36 0.00 0.00 0.00 0.00 57.70 55.86 1vpn n MET 34 Cb 0.47 -2.49 -0.09 0.00 0.00 0.00 0.00 33.22 31.11 1vpn n MET 34 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 1vpn s GLU 35 N 2.97 4.09 -0.00 2.12 2.12 -1.26 -4.95 118.70 123.79 1vpn s GLU 35 Ca 0.47 -0.27 -0.24 0.00 0.36 0.00 0.00 54.97 55.30 1vpn s GLU 35 Cb 0.13 -3.47 -0.05 0.00 0.26 0.00 0.00 34.13 31.00 1vpn s GLU 35 CO -0.04 0.15 0.73 0.08 -0.54 0.00 0.00 175.26 175.64 1vpn s VAL 36 N 0.80 4.87 0.00 3.70 1.01 -1.26 -0.81 120.40 128.70 1vpn s VAL 36 Ca 0.07 1.53 0.00 0.00 0.00 0.00 0.00 61.98 63.58 1vpn s VAL 36 Cb -0.13 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1vpn s VAL 36 CO 0.02 0.32 0.00 0.18 0.00 0.00 0.00 175.10 175.62 1vpn n LEU 37 N 3.18 0.00 -4.85 3.92 4.77 0.11 -4.97 117.00 119.16 1vpn n LEU 37 Ca -0.02 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.66 1vpn n LEU 37 Cb 0.51 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.68 1vpn n LEU 37 CO 0.47 0.00 0.75 -1.81 -1.33 0.00 0.00 177.39 175.47 1vpn s ASP 38 N 0.63 4.67 0.13 -1.43 1.11 -1.26 -4.69 116.67 115.83 1vpn s ASP 38 Ca 0.00 1.05 -0.27 0.00 0.18 0.00 0.00 52.55 53.51 1vpn s ASP 38 Cb 0.00 -1.72 -0.07 0.00 1.07 0.00 0.00 42.92 42.20 1vpn s ASP 38 CO 0.00 -1.83 0.83 -0.76 1.18 0.00 0.00 175.17 174.59 1vpn s LEU 39 N -5.62 4.54 0.18 1.23 1.43 -1.26 -0.73 118.68 118.45 1vpn s LEU 39 Ca 0.61 1.65 -0.30 0.00 -1.03 0.00 0.00 54.13 55.06 1vpn s LEU 39 Cb -0.12 -3.37 -0.08 0.00 0.03 0.00 0.00 46.19 42.65 1vpn s LEU 39 CO 0.52 0.10 1.08 -0.69 0.23 0.00 0.00 176.35 177.59 1vpn s VAL 40 N -0.62 3.91 0.42 -1.59 1.01 -0.39 -4.86 120.40 118.28 1vpn s VAL 40 Ca 0.39 1.67 0.07 0.00 0.00 0.00 0.00 61.98 64.11 1vpn s VAL 40 Cb -0.23 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 32.04 1vpn s VAL 40 CO 0.27 0.30 0.19 0.42 0.00 0.00 0.00 175.10 176.27 1vpn s THR 41 N -0.31 2.28 0.00 3.92 -4.23 -1.26 -4.68 115.64 111.36 1vpn s THR 41 Ca 0.48 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 59.31 1vpn s THR 41 Cb -0.29 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.58 1vpn s THR 41 CO 0.35 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.04 1vpn n GLY 42 N -1.26 -1.23 3.73 3.99 0.00 -1.26 -4.84 105.19 104.31 1vpn n GLY 42 Ca -0.01 -2.21 -0.42 0.00 0.00 0.00 0.00 46.02 43.38 1vpn n GLY 42 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1vpn n PRO 43 N -0.25 2.75 -1.61 1.61 -0.02 -1.26 -2.69 135.00 133.52 1vpn n PRO 43 Ca 0.00 0.99 -0.16 0.00 -2.02 0.00 0.00 63.50 62.31 1vpn n PRO 43 Cb 0.00 -2.81 -0.06 0.00 -0.02 0.00 0.00 33.50 30.61 1vpn n PRO 43 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1vpn n ASP 44 N 3.25 -4.87 0.25 2.55 8.00 -1.26 -4.89 116.55 119.58 1vpn n ASP 44 Ca 0.13 0.32 0.16 0.00 0.71 0.00 0.00 54.79 56.10 1vpn n ASP 44 Cb 0.36 -3.81 0.54 0.00 -0.02 0.00 0.00 41.12 38.18 1vpn n ASP 44 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1vpn h SER 45 N 0.00 0.00 -4.29 -2.24 4.64 -1.83 -3.44 113.55 106.39 1vpn h SER 45 Ca -0.33 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.43 1vpn h SER 45 Cb 1.08 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 62.91 1vpn h SER 45 CO 0.47 0.00 -0.83 -0.69 -0.87 0.00 0.00 176.83 174.91 1vpn s VAL 46 N -3.52 1.57 0.24 0.95 1.01 -1.26 -1.22 120.40 118.16 1vpn s VAL 46 Ca 0.03 -1.13 -0.10 0.00 0.00 0.00 0.00 61.98 60.77 1vpn s VAL 46 Cb 0.08 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 1vpn s VAL 46 CO 0.57 0.19 0.41 0.28 0.00 0.00 0.00 175.10 176.55 1vpn s THR 47 N -0.78 0.00 0.00 3.92 -1.32 -0.22 -5.01 115.64 112.24 1vpn s THR 47 Ca 0.07 -1.53 0.04 0.00 -1.21 0.00 0.00 61.69 59.05 1vpn s THR 47 Cb -0.08 -2.27 -0.01 0.00 -1.51 0.00 0.00 72.50 68.63 1vpn s THR 47 CO 0.01 0.00 -0.12 -1.61 -2.21 0.00 0.00 174.62 170.69 1vpn s GLU 48 N -4.04 0.94 -0.07 7.08 2.02 -1.26 -1.14 118.70 122.23 1vpn s GLU 48 Ca 0.26 -0.52 0.03 0.00 0.02 0.00 0.00 54.97 54.76 1vpn s GLU 48 Cb 0.01 -0.91 0.01 0.00 0.10 0.00 0.00 34.13 33.33 1vpn s GLU 48 CO 0.10 0.24 -0.17 0.42 0.02 0.00 0.00 175.26 175.87 1vpn s ILE 49 N -0.45 1.48 0.09 -1.63 -1.09 -0.01 -4.97 121.20 114.62 1vpn s ILE 49 Ca 0.03 -0.69 0.07 0.00 -2.23 0.00 0.00 60.65 57.84 1vpn s ILE 49 Cb -0.06 -1.31 -0.04 0.00 -1.58 0.00 0.00 42.46 39.48 1vpn s ILE 49 CO 0.00 0.43 -0.13 -1.61 -1.23 0.00 0.00 174.94 172.40 1vpn s GLU 50 N 0.48 2.08 -0.21 2.79 2.02 -1.26 -0.48 118.70 124.11 1vpn s GLU 50 Ca -0.15 -1.02 -0.31 0.00 0.02 0.00 0.00 54.97 53.51 1vpn s GLU 50 Cb -0.16 -2.26 0.15 0.00 0.10 0.00 0.00 34.13 31.97 1vpn s GLU 50 CO 0.05 0.52 1.19 0.00 0.02 0.00 0.00 175.26 177.04 1vpn s ALA 51 N -1.12 -2.04 -0.01 5.21 0.00 -0.50 -5.01 121.76 118.29 1vpn s ALA 51 Ca 0.19 1.69 0.05 0.00 0.00 0.00 0.00 51.96 53.88 1vpn s ALA 51 Cb -0.11 -0.83 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 1vpn s ALA 51 CO 0.11 -0.37 -0.15 -0.59 0.00 0.00 0.00 175.76 174.76 1vpn s PHE 52 N -1.49 1.35 -0.23 0.00 -0.12 -1.26 -0.09 117.98 116.14 1vpn s PHE 52 Ca 0.05 -0.27 -0.02 0.00 -0.05 0.00 0.00 56.93 56.65 1vpn s PHE 52 Cb -0.01 -0.88 0.01 0.00 -0.63 0.00 0.00 43.02 41.52 1vpn s PHE 52 CO -0.04 -0.03 -0.07 -0.51 -0.05 0.00 0.00 175.22 174.51 1vpn s LEU 53 N -0.31 2.98 0.45 -1.99 1.02 -0.04 -4.97 118.68 115.81 1vpn s LEU 53 Ca 0.05 -0.70 -0.22 0.00 0.02 0.00 0.00 54.13 53.28 1vpn s LEU 53 Cb -0.06 -1.67 -0.09 0.00 0.02 0.00 0.00 46.19 44.40 1vpn s LEU 53 CO -0.00 -0.08 1.05 0.20 0.02 0.00 0.00 176.35 177.54 1vpn s ASN 54 N 1.37 6.50 0.71 2.29 0.01 -1.26 -1.55 114.94 123.01 1vpn s ASN 54 Ca 0.03 2.00 -0.15 0.00 -0.71 0.00 0.00 52.86 54.02 1vpn s ASN 54 Cb -0.15 -2.57 0.03 0.00 0.41 0.00 0.00 41.25 38.96 1vpn s ASN 54 CO -0.05 -0.67 1.17 -2.16 -1.51 0.00 0.00 177.10 173.88 1vpn s PRO 55 N -2.89 2.36 -0.59 -0.60 0.04 -1.26 -4.86 135.00 127.20 1vpn s PRO 55 Ca 0.63 1.64 0.06 0.00 0.04 0.00 0.00 61.00 63.37 1vpn s PRO 55 Cb -0.19 -1.87 0.22 0.00 0.04 0.00 0.00 34.50 32.70 1vpn s PRO 55 CO 0.24 -1.64 0.61 0.54 0.04 0.00 0.00 177.00 176.79 1vpn n ARG 56 N -2.60 1.81 0.14 4.56 5.12 -1.26 -4.82 116.66 119.60 1vpn n ARG 56 Ca 0.12 -4.22 0.13 0.00 -1.93 0.00 0.00 57.85 51.95 1vpn n ARG 56 Cb 0.51 -2.01 0.30 0.00 -1.16 0.00 0.00 32.46 30.10 1vpn n ARG 56 CO 0.00 0.00 0.00 0.52 -1.93 0.00 0.00 177.63 176.22 1vpn h MET 57 N 4.54 0.00 0.00 5.56 2.86 -1.85 0.13 114.93 126.18 1vpn h MET 57 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1vpn h MET 57 Cb 0.75 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.41 1vpn h MET 57 CO 0.70 0.00 0.00 0.41 1.06 0.00 0.00 176.91 179.08 1vpn n GLY 58 N 1.25 1.86 3.68 8.32 0.00 -1.25 -3.49 105.19 115.55 1vpn n GLY 58 Ca 0.05 -0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 1vpn n GLY 58 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1vpn s GLN 59 N 0.00 4.35 0.93 1.61 2.00 -1.10 -4.40 119.66 123.05 1vpn s GLN 59 Ca 0.00 1.50 -0.11 0.00 -2.00 0.00 0.00 55.36 54.74 1vpn s GLN 59 Cb 0.00 -3.59 0.15 0.00 0.80 0.00 0.00 33.01 30.37 1vpn s GLN 59 CO 0.00 -0.47 1.10 -2.14 -0.50 0.00 0.00 175.29 173.28 1vpn s PRO 60 N 2.50 0.91 0.58 1.67 0.02 -1.26 -4.56 135.00 134.86 1vpn s PRO 60 Ca 0.50 1.10 0.28 0.00 0.02 0.00 0.00 61.00 62.90 1vpn s PRO 60 Cb -0.20 -1.75 1.75 0.00 0.02 0.00 0.00 34.50 34.32 1vpn s PRO 60 CO 0.16 -2.56 2.24 -1.35 -0.33 0.00 0.00 177.00 175.16 1vpn h PRO 61 N -1.79 0.00 -6.31 5.54 0.11 -1.97 -3.43 132.00 124.15 1vpn h PRO 61 Ca -0.49 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.03 1vpn h PRO 61 Cb 1.28 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.19 1vpn h PRO 61 CO 0.49 0.00 -0.82 0.95 -0.21 0.00 0.00 178.00 178.41 1vpn s THR 62 N -4.70 1.95 0.53 -1.15 -4.23 -1.26 -4.10 115.64 102.68 1vpn s THR 62 Ca -0.05 -1.77 -0.21 0.00 -1.18 0.00 0.00 61.69 58.48 1vpn s THR 62 Cb 0.15 -1.81 -0.05 0.00 1.34 0.00 0.00 72.50 72.13 1vpn s THR 62 CO 0.56 -0.11 1.22 -2.16 -0.54 0.00 0.00 174.62 173.59 1vpn s PRO 63 N -2.31 3.31 0.29 3.99 0.04 -1.26 -4.97 135.00 134.09 1vpn s PRO 63 Ca 0.13 1.87 0.25 0.00 0.04 0.00 0.00 61.00 63.29 1vpn s PRO 63 Cb -0.08 -2.17 0.68 0.00 0.04 0.00 0.00 34.50 32.97 1vpn s PRO 63 CO 0.06 -0.95 1.73 0.93 0.04 0.00 0.00 177.00 178.81 1vpn h GLU 64 N 1.43 0.00 -6.52 4.56 5.08 -1.95 -3.14 114.58 114.04 1vpn h GLU 64 Ca -0.50 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.30 1vpn h GLU 64 Cb 1.28 0.00 0.05 0.00 0.50 0.00 0.00 28.75 30.58 1vpn h GLU 64 CO 0.57 0.00 0.96 0.45 -1.00 0.00 0.00 179.01 180.00 1vpn n SER 65 N -2.53 3.59 0.00 1.42 2.88 -1.26 -4.61 113.62 113.11 1vpn n SER 65 Ca 0.05 1.04 0.05 0.00 -1.33 0.00 0.00 58.87 58.68 1vpn n SER 65 Cb 0.45 -1.49 0.32 0.00 -0.75 0.00 0.00 64.21 62.74 1vpn n SER 65 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1vpn n LEU 66 N 4.47 0.00 0.00 2.46 4.77 -1.26 -0.98 117.00 126.46 1vpn n LEU 66 Ca 0.18 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1vpn n LEU 66 Cb 0.32 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1vpn n LEU 66 CO 0.65 0.00 0.05 0.35 -1.33 0.00 0.00 177.39 177.11 1vpn n THR 67 N -0.78 0.00 -0.60 -5.08 -2.24 -1.26 -4.35 114.28 99.97 1vpn n THR 67 Ca 0.08 -0.37 0.07 0.00 -2.27 0.00 0.00 64.05 61.55 1vpn n THR 67 Cb 0.04 1.07 0.17 0.00 -2.10 0.00 0.00 70.33 69.51 1vpn n THR 67 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vpn n GLU 68 N -0.54 2.67 0.00 -0.78 1.02 -0.92 -4.94 120.64 117.15 1vpn n GLU 68 Ca 0.00 -2.35 0.00 0.00 -0.02 0.00 0.00 57.16 54.79 1vpn n GLU 68 Cb 0.02 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 29.95 1vpn n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vpn n GLY 69 N -0.32 1.36 0.32 0.62 0.00 -1.21 -4.81 105.19 101.14 1vpn n GLY 69 Ca 0.14 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.34 1vpn n GLY 69 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1vpn h GLY 70 N 0.00 0.00 2.00 -0.02 0.00 -1.01 -0.51 103.07 103.53 1vpn h GLY 70 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1vpn h GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1vpn n GLN 71 N -3.63 0.07 0.00 4.80 0.00 -1.25 -1.71 117.38 115.66 1vpn n GLN 71 Ca -0.02 0.38 0.12 0.00 0.00 0.00 0.00 57.00 57.49 1vpn n GLN 71 Cb 0.14 -1.65 0.19 0.00 0.00 0.00 0.00 30.24 28.92 1vpn n GLN 71 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1vpn n TYR 72 N -1.79 0.00 -1.75 2.61 4.01 -0.20 -4.94 117.16 115.10 1vpn n TYR 72 Ca 0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.34 1vpn n TYR 72 Cb 0.14 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.13 1vpn n TYR 72 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1vpn s TYR 73 N -2.13 1.80 0.00 -0.72 5.04 -0.69 -0.36 117.35 120.28 1vpn s TYR 73 Ca 0.28 -0.14 0.00 0.00 -2.44 0.00 0.00 57.07 54.77 1vpn s TYR 73 Cb 0.20 -4.15 0.00 0.00 0.35 0.00 0.00 41.96 38.35 1vpn s TYR 73 CO 0.38 -4.94 0.00 0.41 -1.34 0.00 0.00 175.55 170.06 1vpn n GLY 74 N 4.32 0.56 3.43 8.97 0.00 -1.26 -5.06 105.19 116.14 1vpn n GLY 74 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 1vpn n GLY 74 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1vpn s TRP 75 N -2.00 1.80 0.44 1.61 0.52 0.51 -2.14 118.94 119.70 1vpn s TRP 75 Ca 0.00 -1.11 0.05 0.00 0.02 0.00 0.00 56.10 55.07 1vpn s TRP 75 Cb 0.00 -1.14 0.01 0.00 -1.15 0.00 0.00 33.47 31.19 1vpn s TRP 75 CO 0.00 -0.17 0.62 -1.54 0.02 0.00 0.00 176.95 175.88 1vpn s SER 76 N -3.47 5.62 0.81 2.95 1.04 -0.71 -2.71 113.70 117.24 1vpn s SER 76 Ca 0.34 -0.22 -0.10 0.00 0.48 0.00 0.00 55.95 56.44 1vpn s SER 76 Cb 0.07 -0.87 0.12 0.00 0.10 0.00 0.00 66.02 65.44 1vpn s SER 76 CO 0.15 -0.81 1.15 -0.13 0.98 0.00 0.00 173.24 174.58 1vpn s ARG 77 N -4.45 1.56 -0.02 4.02 1.81 0.09 -4.50 118.95 117.46 1vpn s ARG 77 Ca 0.54 -0.34 -0.34 0.00 -1.72 0.00 0.00 55.73 53.86 1vpn s ARG 77 Cb -0.10 -2.04 -0.13 0.00 -0.45 0.00 0.00 34.95 32.24 1vpn s ARG 77 CO 0.34 -1.74 1.78 0.41 -0.68 0.00 0.00 175.30 175.42 1vpn n GLY 78 N -3.28 1.32 3.67 -3.53 0.00 -1.26 -4.64 105.19 97.46 1vpn n GLY 78 Ca 0.11 0.80 -0.42 0.00 0.00 0.00 0.00 46.02 46.51 1vpn n GLY 78 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vpn s ILE 79 N 3.06 3.27 -0.15 -0.61 1.01 -0.67 -4.88 121.20 122.24 1vpn s ILE 79 Ca 0.89 0.46 -0.10 0.00 0.00 0.00 0.00 60.65 61.90 1vpn s ILE 79 Cb -0.71 -3.30 -0.05 0.00 0.01 0.00 0.00 42.46 38.42 1vpn s ILE 79 CO 0.48 -0.03 0.18 0.54 0.00 0.00 0.00 174.94 176.11 1vpn s ASN 80 N 3.35 6.35 0.24 3.58 4.22 -1.26 -4.73 114.94 126.70 1vpn s ASN 80 Ca 0.77 0.41 -0.04 0.00 -2.14 0.00 0.00 52.86 51.86 1vpn s ASN 80 Cb -0.38 -2.11 -0.05 0.00 1.28 0.00 0.00 41.25 39.99 1vpn s ASN 80 CO 0.33 0.26 0.49 -0.76 -2.04 0.00 0.00 177.10 175.39 1vpn s LEU 81 N -0.23 4.13 0.67 3.54 1.43 -1.26 -4.75 118.68 122.21 1vpn s LEU 81 Ca 0.13 0.65 -0.17 0.00 -1.03 0.00 0.00 54.13 53.71 1vpn s LEU 81 Cb -0.12 -3.44 -0.01 0.00 0.03 0.00 0.00 46.19 42.66 1vpn s LEU 81 CO 0.02 -0.12 1.16 0.00 0.23 0.00 0.00 176.35 177.64 1vpn n ALA 82 N -0.66 0.60 0.88 4.21 0.00 -1.26 -4.89 120.51 119.38 1vpn n ALA 82 Ca -0.02 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.46 1vpn n ALA 82 Cb 0.53 -2.24 0.01 0.00 0.00 0.00 0.00 19.45 17.76 1vpn n ALA 82 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1vpn n THR 83 N -2.12 0.03 -3.84 0.00 -2.24 -0.45 -5.00 114.28 100.67 1vpn n THR 83 Ca 0.15 -0.07 -0.05 0.00 -2.27 0.00 0.00 64.05 61.81 1vpn n THR 83 Cb 0.48 0.59 0.01 0.00 -2.10 0.00 0.00 70.33 69.32 1vpn n THR 83 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1vpn s SER 84 N -3.24 -0.04 0.43 3.42 1.04 -1.24 -4.96 113.70 109.11 1vpn s SER 84 Ca 0.07 -0.75 0.30 0.00 0.48 0.00 0.00 55.95 56.06 1vpn s SER 84 Cb 0.16 0.60 1.33 0.00 0.10 0.00 0.00 66.02 68.21 1vpn s SER 84 CO 0.81 -1.17 1.89 -0.78 0.98 0.00 0.00 173.24 174.97 1vpn h ASP 85 N 2.00 0.00 -0.04 7.02 3.58 -2.05 -2.95 116.42 123.98 1vpn h ASP 85 Ca -0.28 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.17 1vpn h ASP 85 Cb 1.23 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.28 1vpn h ASP 85 CO 0.35 0.00 0.00 0.35 -2.88 0.00 0.00 179.24 177.06 1vpn n THR 86 N -2.66 0.33 -3.70 2.25 -2.24 -1.26 -4.87 114.28 102.14 1vpn n THR 86 Ca 0.00 -0.67 -0.28 0.00 -2.27 0.00 0.00 64.05 60.83 1vpn n THR 86 Cb 0.21 0.89 -0.12 0.00 -2.10 0.00 0.00 70.33 69.21 1vpn n THR 86 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1vpn s GLU 87 N -0.55 1.61 -0.35 -0.78 0.41 -1.11 -5.02 118.70 112.92 1vpn s GLU 87 Ca 0.06 -2.52 0.03 0.00 -0.41 0.00 0.00 54.97 52.13 1vpn s GLU 87 Cb 0.03 -2.49 0.10 0.00 -1.78 0.00 0.00 34.13 30.00 1vpn s GLU 87 CO 0.05 -1.27 0.06 0.34 -0.49 0.00 0.00 175.26 173.96 1vpn s ASP 88 N -0.37 4.83 -0.60 -0.19 2.15 -1.26 -1.35 116.67 119.88 1vpn s ASP 88 Ca 0.24 -2.09 0.04 0.00 0.43 0.00 0.00 52.55 51.18 1vpn s ASP 88 Cb -0.10 -1.66 0.16 0.00 -0.30 0.00 0.00 42.92 41.02 1vpn s ASP 88 CO -0.11 -0.39 0.39 -0.44 -0.17 0.00 0.00 175.17 174.45 1vpn s SER 89 N 1.06 4.13 0.34 -0.34 0.01 -1.26 -0.35 113.70 117.29 1vpn s SER 89 Ca 0.09 -3.43 -0.28 0.00 1.31 0.00 0.00 55.95 53.65 1vpn s SER 89 Cb -0.20 -1.40 -0.10 0.00 0.21 0.00 0.00 66.02 64.54 1vpn s SER 89 CO -0.07 -0.15 1.23 -2.16 0.41 0.00 0.00 173.24 172.50 1vpn s PRO 90 N -0.80 4.32 0.39 12.44 0.04 -1.26 -4.99 135.00 145.13 1vpn s PRO 90 Ca 0.23 2.04 -0.25 0.00 0.04 0.00 0.00 61.00 63.07 1vpn s PRO 90 Cb -0.10 -2.98 -0.09 0.00 0.04 0.00 0.00 34.50 31.37 1vpn s PRO 90 CO -0.12 -0.16 1.06 0.20 0.04 0.00 0.00 177.00 178.02 1vpn s GLY 91 N -0.73 2.78 0.29 0.56 0.00 -1.26 -4.56 107.32 104.39 1vpn s GLY 91 Ca 0.50 0.73 0.01 0.00 0.00 0.00 0.00 44.72 45.97 1vpn s GLY 91 CO 0.47 1.18 1.84 3.43 0.00 0.00 0.00 173.10 180.02 1vpn h ASN 92 N 2.65 0.92 0.00 1.64 2.35 -1.95 -1.13 115.58 120.06 1vpn h ASN 92 Ca -0.48 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 1vpn h ASN 92 Cb 1.22 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.44 1vpn h ASN 92 CO 0.63 0.50 0.00 -0.46 -1.65 0.00 0.00 177.43 176.45 1vpn n ASN 93 N -4.60 0.00 -0.35 5.81 0.23 -1.26 -2.32 115.26 112.76 1vpn n ASN 93 Ca 0.19 -1.37 0.04 0.00 -0.53 0.00 0.00 54.58 52.91 1vpn n ASN 93 Cb 0.35 0.00 0.04 0.00 -2.08 0.00 0.00 39.78 38.08 1vpn n ASN 93 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1vpn n THR 94 N -0.63 0.00 -3.79 5.53 -2.24 -0.43 -0.73 114.28 111.99 1vpn n THR 94 Ca 0.05 -0.50 -0.37 0.00 -2.27 0.00 0.00 64.05 60.96 1vpn n THR 94 Cb 0.02 1.18 -0.13 0.00 -2.10 0.00 0.00 70.33 69.31 1vpn n THR 94 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1vpn s LEU 95 N -0.78 3.85 0.28 3.22 1.43 -0.98 -4.87 118.68 120.84 1vpn s LEU 95 Ca 0.10 -0.84 -0.29 0.00 -1.03 0.00 0.00 54.13 52.07 1vpn s LEU 95 Cb 0.07 -1.84 -0.10 0.00 0.03 0.00 0.00 46.19 44.35 1vpn s LEU 95 CO 0.12 -0.21 1.41 -2.84 0.23 0.00 0.00 176.35 175.05 1vpn s PRO 96 N 1.45 4.28 0.29 1.29 0.02 -1.23 -4.32 135.00 136.77 1vpn s PRO 96 Ca 0.01 2.30 0.10 0.00 0.02 0.00 0.00 61.00 63.43 1vpn s PRO 96 Cb -0.18 -3.09 -0.06 0.00 0.02 0.00 0.00 34.50 31.20 1vpn s PRO 96 CO 0.01 -0.37 -0.14 0.95 -0.33 0.00 0.00 177.00 177.13 1vpn s THR 97 N -0.39 2.15 0.48 0.99 -4.23 0.46 -1.54 115.64 113.55 1vpn s THR 97 Ca 0.56 -2.27 -0.23 0.00 -1.18 0.00 0.00 61.69 58.57 1vpn s THR 97 Cb -0.42 -2.38 -0.07 0.00 1.34 0.00 0.00 72.50 70.97 1vpn s THR 97 CO 0.47 -0.36 1.29 0.26 -0.54 0.00 0.00 174.62 175.74 1vpn s TRP 98 N -2.70 2.61 -0.06 3.99 0.52 -0.05 -4.31 118.94 118.94 1vpn s TRP 98 Ca 0.29 1.43 -0.02 0.00 0.02 0.00 0.00 56.10 57.82 1vpn s TRP 98 Cb -0.01 -3.64 -0.04 0.00 -1.15 0.00 0.00 33.47 28.64 1vpn s TRP 98 CO 0.14 -2.25 0.07 -1.12 0.02 0.00 0.00 176.95 173.80 1vpn s SER 99 N -1.01 5.69 0.04 2.95 0.01 0.27 -0.87 113.70 120.78 1vpn s SER 99 Ca 0.65 0.22 -0.21 0.00 1.31 0.00 0.00 55.95 57.93 1vpn s SER 99 Cb -0.36 -1.68 0.05 0.00 0.21 0.00 0.00 66.02 64.23 1vpn s SER 99 CO 0.44 0.34 0.48 0.00 0.41 0.00 0.00 173.24 174.91 1vpn s MET 100 N -1.27 0.97 -0.09 12.44 0.23 -1.26 -1.07 119.30 129.25 1vpn s MET 100 Ca 0.18 -0.25 -0.11 0.00 -1.03 0.00 0.00 55.69 54.47 1vpn s MET 100 Cb -0.12 0.44 0.03 0.00 -1.53 0.00 0.00 34.83 33.65 1vpn s MET 100 CO 0.07 -0.34 0.30 0.00 -2.03 0.00 0.00 175.02 173.03 1vpn s ALA 101 N -2.31 -0.76 -0.28 3.16 0.00 -0.33 -4.55 121.76 116.70 1vpn s ALA 101 Ca -0.06 0.73 -0.03 0.00 0.00 0.00 0.00 51.96 52.60 1vpn s ALA 101 Cb -0.01 -0.37 0.04 0.00 0.00 0.00 0.00 23.12 22.77 1vpn s ALA 101 CO -0.01 -0.17 -0.01 0.21 0.00 0.00 0.00 175.76 175.78 1vpn s LYS 102 N -0.19 2.66 -0.11 0.00 2.20 -1.26 -1.08 119.74 121.97 1vpn s LYS 102 Ca -0.03 -1.11 -0.04 0.00 -0.36 0.00 0.00 55.97 54.43 1vpn s LYS 102 Cb -0.03 -3.15 -0.04 0.00 -1.51 0.00 0.00 37.83 33.11 1vpn s LYS 102 CO 0.01 -0.52 0.04 -0.51 -0.36 0.00 0.00 175.35 174.01 1vpn s LEU 103 N 1.32 3.81 0.11 5.43 1.43 0.65 -4.89 118.68 126.53 1vpn s LEU 103 Ca -0.02 0.21 -0.25 0.00 -1.03 0.00 0.00 54.13 53.03 1vpn s LEU 103 Cb -0.18 -1.90 -0.07 0.00 0.03 0.00 0.00 46.19 44.07 1vpn s LEU 103 CO -0.02 0.35 0.78 -1.10 0.23 0.00 0.00 176.35 176.59 1vpn s GLN 104 N -0.68 4.54 0.07 1.70 -1.52 -1.26 -0.31 119.66 122.20 1vpn s GLN 104 Ca 0.11 1.14 0.05 0.00 -1.95 0.00 0.00 55.36 54.71 1vpn s GLN 104 Cb -0.12 -3.32 -0.04 0.00 -0.22 0.00 0.00 33.01 29.32 1vpn s GLN 104 CO 0.02 0.42 -0.05 -0.51 -0.25 0.00 0.00 175.29 174.92 1vpn s LEU 105 N -0.57 3.24 0.30 2.90 1.43 -0.93 -4.96 118.68 120.08 1vpn s LEU 105 Ca 0.38 -0.23 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 1vpn s LEU 105 Cb -0.22 -1.96 -0.13 0.00 0.03 0.00 0.00 46.19 43.91 1vpn s LEU 105 CO 0.25 0.21 1.36 -0.81 0.23 0.00 0.00 176.35 177.59 1vpn n PRO 106 N 0.94 2.13 -1.72 1.29 -0.04 -1.26 -4.93 135.00 131.41 1vpn n PRO 106 Ca -0.13 0.75 -0.38 0.00 -0.04 0.00 0.00 63.50 63.70 1vpn n PRO 106 Cb 0.52 -2.38 0.05 0.00 -0.04 0.00 0.00 33.50 31.65 1vpn n PRO 106 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1vpn n MET 107 N 1.28 1.48 0.00 0.54 2.81 -1.26 -4.99 117.12 116.99 1vpn n MET 107 Ca 0.08 0.55 0.00 0.00 -1.81 0.00 0.00 57.70 56.52 1vpn n MET 107 Cb 0.34 -2.50 0.00 0.00 -0.71 0.00 0.00 33.22 30.35 1vpn n MET 107 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1vpn n LEU 108 N -1.08 0.03 -4.59 4.03 4.77 -1.26 -5.04 117.00 113.87 1vpn n LEU 108 Ca 0.12 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.68 1vpn n LEU 108 Cb 0.45 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.49 1vpn n LEU 108 CO 0.52 -0.05 0.67 0.20 -1.33 0.00 0.00 177.39 177.40 1vpn s ASN 109 N -5.03 6.60 -0.11 -1.43 0.01 -1.26 -4.93 114.94 108.79 1vpn s ASN 109 Ca 0.00 0.42 -0.12 0.00 -0.71 0.00 0.00 52.86 52.45 1vpn s ASN 109 Cb 0.00 -2.43 -0.11 0.00 0.41 0.00 0.00 41.25 39.12 1vpn s ASN 109 CO 0.00 -0.82 0.36 -0.33 -1.51 0.00 0.00 177.10 174.79 1vpn h GLU 110 N 8.54 -0.03 -4.03 -0.60 4.39 -2.00 -3.41 114.58 117.43 1vpn h GLU 110 Ca -0.24 0.00 -0.76 0.00 0.34 0.00 0.00 59.36 58.70 1vpn h GLU 110 Cb 1.09 0.01 -0.25 0.00 -0.10 0.00 0.00 28.75 29.49 1vpn h GLU 110 CO 0.95 0.36 -0.16 0.34 -1.16 0.00 0.00 179.01 179.34 1vpn s ASP 111 N -5.76 6.27 0.28 1.42 2.15 -1.26 -4.94 116.67 114.83 1vpn s ASP 111 Ca -0.08 -2.06 0.23 0.00 0.43 0.00 0.00 52.55 51.07 1vpn s ASP 111 Cb -0.01 -2.18 1.04 0.00 -0.30 0.00 0.00 42.92 41.47 1vpn s ASP 111 CO 0.29 -0.76 1.69 0.18 -0.17 0.00 0.00 175.17 176.39 1vpn n LEU 112 N 4.85 0.63 -1.19 -1.34 4.77 -1.26 -2.73 117.00 120.73 1vpn n LEU 112 Ca -0.06 0.70 0.07 0.00 -0.03 0.00 0.00 56.01 56.69 1vpn n LEU 112 Cb 0.42 -0.67 0.26 0.00 -2.33 0.00 0.00 43.42 41.10 1vpn n LEU 112 CO 0.47 -0.70 0.70 0.35 -1.33 0.00 0.00 177.39 176.88 1vpn n THR 113 N -2.24 1.20 -2.75 -5.08 -2.24 -1.26 -4.96 114.28 96.96 1vpn n THR 113 Ca 0.01 -0.83 -0.35 0.00 -2.27 0.00 0.00 64.05 60.61 1vpn n THR 113 Cb 0.16 0.09 -0.06 0.00 -2.10 0.00 0.00 70.33 68.42 1vpn n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vpn h ASP 115 N 2.49 0.81 -3.56 0.00 3.58 -1.92 -3.40 116.42 114.42 1vpn h ASP 115 Ca -0.48 0.03 -0.61 0.00 0.42 0.00 0.00 57.03 56.39 1vpn h ASP 115 Cb 1.19 -0.13 -0.33 0.00 1.72 0.00 0.00 39.33 41.78 1vpn h ASP 115 CO 0.63 0.45 -0.85 -0.89 -2.88 0.00 0.00 179.24 175.69 1vpn s THR 116 N -5.83 1.68 0.43 2.25 2.01 -1.26 -4.57 115.64 110.35 1vpn s THR 116 Ca -0.11 -0.82 0.04 0.00 0.31 0.00 0.00 61.69 61.12 1vpn s THR 116 Cb 0.21 -1.46 -0.05 0.00 0.01 0.00 0.00 72.50 71.21 1vpn s THR 116 CO 0.80 0.48 0.03 -0.76 -0.69 0.00 0.00 174.62 174.47 1vpn s LEU 117 N 0.30 2.50 -0.06 4.42 1.43 0.43 -4.94 118.68 122.76 1vpn s LEU 117 Ca -0.13 -1.49 0.03 0.00 -1.03 0.00 0.00 54.13 51.51 1vpn s LEU 117 Cb -0.16 -0.69 -0.03 0.00 0.03 0.00 0.00 46.19 45.35 1vpn s LEU 117 CO 0.06 -0.64 -0.12 -1.10 0.23 0.00 0.00 176.35 174.77 1vpn s GLN 118 N -3.79 2.62 0.02 1.70 -0.21 -1.26 -0.24 119.66 118.50 1vpn s GLN 118 Ca 0.25 -0.65 0.02 0.00 0.02 0.00 0.00 55.36 55.01 1vpn s GLN 118 Cb 0.07 -2.45 -0.02 0.00 1.00 0.00 0.00 33.01 31.61 1vpn s GLN 118 CO 0.13 0.61 -0.08 -1.64 -2.12 0.00 0.00 175.29 172.19 1vpn s MET 119 N -0.69 0.57 0.25 2.91 -1.94 -0.16 -4.67 119.30 115.56 1vpn s MET 119 Ca 0.11 -0.54 -0.30 0.00 -1.71 0.00 0.00 55.69 53.25 1vpn s MET 119 Cb -0.11 -0.46 -0.09 0.00 2.01 0.00 0.00 34.83 36.18 1vpn s MET 119 CO 0.01 0.11 1.06 -1.58 -0.01 0.00 0.00 175.02 174.61 1vpn s TRP 120 N -0.79 3.69 -0.10 -0.03 0.52 -1.26 -0.37 118.94 120.60 1vpn s TRP 120 Ca -0.03 1.74 0.01 0.00 0.02 0.00 0.00 56.10 57.84 1vpn s TRP 120 Cb -0.07 -3.20 0.02 0.00 -1.15 0.00 0.00 33.47 29.07 1vpn s TRP 120 CO 0.00 -0.30 -0.12 -2.00 0.02 0.00 0.00 176.95 174.55 1vpn s GLU 121 N -1.16 1.87 -0.26 4.98 2.12 0.33 -0.65 118.70 125.93 1vpn s GLU 121 Ca 0.45 -0.43 -0.29 0.00 0.36 0.00 0.00 54.97 55.05 1vpn s GLU 121 Cb -0.30 -1.65 0.01 0.00 0.26 0.00 0.00 34.13 32.45 1vpn s GLU 121 CO 0.38 -0.09 1.09 0.00 -0.54 0.00 0.00 175.26 176.09 1vpn s ALA 122 N 1.07 3.61 -0.17 6.30 0.00 -0.32 -1.19 121.76 131.05 1vpn s ALA 122 Ca -0.06 0.12 -0.16 0.00 0.00 0.00 0.00 51.96 51.86 1vpn s ALA 122 Cb -0.15 -3.61 -0.22 0.00 0.00 0.00 0.00 23.12 19.15 1vpn s ALA 122 CO -0.02 -1.24 0.28 0.28 0.00 0.00 0.00 175.76 175.06 1vpn h VAL 123 N 5.57 0.81 -3.00 0.00 2.07 -1.08 -3.31 116.25 117.32 1vpn h VAL 123 Ca -0.21 -2.24 0.06 0.00 0.82 0.00 0.00 66.70 65.14 1vpn h VAL 123 Cb 1.07 2.33 -0.06 0.00 -1.52 0.00 0.00 31.29 33.11 1vpn h VAL 123 CO 1.00 0.53 0.23 -0.94 0.02 0.00 0.00 177.57 178.41 1vpn s SER 124 N -6.93 -0.28 -0.04 0.57 1.04 -1.19 -0.98 113.70 105.88 1vpn s SER 124 Ca -0.26 -0.56 -0.04 0.00 0.48 0.00 0.00 55.95 55.56 1vpn s SER 124 Cb 0.06 0.72 0.01 0.00 0.10 0.00 0.00 66.02 66.91 1vpn s SER 124 CO 0.66 -1.32 0.12 0.54 0.98 0.00 0.00 173.24 174.22 1vpn s VAL 125 N -3.91 -0.00 -0.33 5.02 0.11 0.25 -1.08 120.40 120.46 1vpn s VAL 125 Ca 0.10 0.01 -0.07 0.00 -2.93 0.00 0.00 61.98 59.09 1vpn s VAL 125 Cb -0.06 -0.17 0.03 0.00 -1.53 0.00 0.00 36.38 34.65 1vpn s VAL 125 CO 0.05 0.01 0.12 -0.54 -3.33 0.00 0.00 175.10 171.41 1vpn s LYS 126 N 0.14 2.82 0.13 1.54 1.02 0.21 -0.42 119.74 125.18 1vpn s LYS 126 Ca -0.01 -1.05 0.10 0.00 0.02 0.00 0.00 55.97 55.03 1vpn s LYS 126 Cb -0.02 -3.48 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 1vpn s LYS 126 CO -0.00 -0.60 -0.25 -0.08 -0.92 0.00 0.00 175.35 173.50 1vpn s THR 127 N 1.46 2.13 -0.25 2.17 -1.32 -1.26 -0.65 115.64 117.92 1vpn s THR 127 Ca 0.00 -1.76 -0.19 0.00 -1.21 0.00 0.00 61.69 58.54 1vpn s THR 127 Cb -0.19 -1.91 0.07 0.00 -1.51 0.00 0.00 72.50 68.96 1vpn s THR 127 CO 0.03 0.01 0.64 -0.70 -2.21 0.00 0.00 174.62 172.40 1vpn s GLU 128 N -2.15 0.70 -0.27 7.08 2.12 -0.69 -4.93 118.70 120.57 1vpn s GLU 128 Ca 0.13 1.03 -0.20 0.00 0.36 0.00 0.00 54.97 56.29 1vpn s GLU 128 Cb -0.09 0.24 -0.02 0.00 0.26 0.00 0.00 34.13 34.52 1vpn s GLU 128 CO 0.06 -0.12 0.62 0.08 -0.54 0.00 0.00 175.26 175.36 1vpn s VAL 129 N 0.99 4.97 -0.09 3.70 1.01 -1.26 -0.16 120.40 129.55 1vpn s VAL 129 Ca -0.05 1.03 -0.06 0.00 0.00 0.00 0.00 61.98 62.90 1vpn s VAL 129 Cb -0.05 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1vpn s VAL 129 CO -0.09 -0.02 0.15 -0.69 0.00 0.00 0.00 175.10 174.45 1vpn s VAL 130 N 2.53 5.49 0.00 2.92 1.01 -0.59 -4.67 120.40 127.09 1vpn s VAL 130 Ca 0.26 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1vpn s VAL 130 Cb -0.15 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.79 1vpn s VAL 130 CO 0.09 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.36 1vpn n GLY 131 N 1.76 0.91 0.33 4.51 0.00 -1.26 -4.01 105.19 107.43 1vpn n GLY 131 Ca -0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.99 1vpn n GLY 131 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vpn h SER 132 N 0.00 0.05 0.11 1.61 4.64 -1.99 -0.46 113.55 117.51 1vpn h SER 132 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1vpn h SER 132 Cb 0.00 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1vpn h SER 132 CO 0.00 0.03 -0.03 1.23 -0.87 0.00 0.00 176.83 177.19 1vpn h GLY 133 N 0.06 0.00 2.00 -0.77 0.00 -1.98 -1.15 103.07 101.23 1vpn h GLY 133 Ca 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.49 1vpn h GLY 133 CO -0.01 0.00 -0.01 1.48 0.00 0.00 0.00 176.54 178.00 1vpn h SER 134 N 0.00 0.00 0.56 0.19 4.64 -1.50 -1.75 113.55 115.70 1vpn h SER 134 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1vpn h SER 134 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1vpn h SER 134 CO 0.00 0.01 0.00 0.18 -0.87 0.00 0.00 176.83 176.15 1vpn n LEU 135 N -3.11 0.08 0.00 5.97 4.77 -0.43 -2.01 117.00 122.26 1vpn n LEU 135 Ca -0.00 0.52 0.12 0.00 -0.03 0.00 0.00 56.01 56.62 1vpn n LEU 135 Cb 0.25 -0.51 0.70 0.00 -2.33 0.00 0.00 43.42 41.53 1vpn n LEU 135 CO 0.26 -0.27 0.92 0.18 -1.33 0.00 0.00 177.39 177.15 1vpn n LEU 136 N -1.58 0.00 -4.55 2.23 4.77 -0.66 -4.59 117.00 112.61 1vpn n LEU 136 Ca 0.04 0.13 -0.40 0.00 -0.03 0.00 0.00 56.01 55.74 1vpn n LEU 136 Cb 0.19 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1vpn n LEU 136 CO 0.15 -0.03 1.30 -0.62 -1.33 0.00 0.00 177.39 176.86 1vpn s ASP 137 N -2.26 5.91 -0.23 -1.43 2.15 -0.85 -4.78 116.67 115.18 1vpn s ASP 137 Ca 0.32 -0.19 0.10 0.00 0.43 0.00 0.00 52.55 53.21 1vpn s ASP 137 Cb 0.17 -2.55 0.44 0.00 -0.30 0.00 0.00 42.92 40.68 1vpn s ASP 137 CO 0.33 -1.98 1.28 1.33 -0.17 0.00 0.00 175.17 175.96 1vpn n VAL 138 N 6.64 2.30 -0.38 1.11 0.24 -1.26 -4.59 118.33 122.38 1vpn n VAL 138 Ca 0.08 -3.12 0.05 0.00 -2.04 0.00 0.00 64.34 59.31 1vpn n VAL 138 Cb 0.50 -0.26 0.10 0.00 -1.47 0.00 0.00 33.84 32.71 1vpn n VAL 138 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vpn n HIS 139 N -1.12 0.25 -0.05 6.34 1.44 -1.26 -0.85 115.22 119.97 1vpn n HIS 139 Ca 0.23 -0.64 0.00 0.00 -2.01 0.00 0.00 57.72 55.29 1vpn n HIS 139 Cb 0.78 -0.10 0.00 0.00 0.12 0.00 0.00 29.99 30.79 1vpn n HIS 139 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1vpn n GLY 140 N -0.40 0.01 1.22 -1.39 0.00 -1.26 -4.92 105.19 98.44 1vpn n GLY 140 Ca 0.09 -1.58 -0.02 0.00 0.00 0.00 0.00 46.02 44.51 1vpn n GLY 140 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1vpn n PHE 141 N 0.00 1.29 -1.36 1.61 7.35 -1.26 -4.60 117.46 120.49 1vpn n PHE 141 Ca 0.00 -1.38 -0.30 0.00 -0.76 0.00 0.00 57.45 55.01 1vpn n PHE 141 Cb 0.00 -0.49 0.21 0.00 0.35 0.00 0.00 39.48 39.55 1vpn n PHE 141 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 1vpn s ASN 142 N -2.17 1.83 0.10 -2.13 0.01 -1.26 -4.31 114.94 107.01 1vpn s ASN 142 Ca 0.46 0.58 -0.33 0.00 -0.71 0.00 0.00 52.86 52.86 1vpn s ASN 142 Cb 0.39 -0.82 -0.13 0.00 0.41 0.00 0.00 41.25 41.11 1vpn s ASN 142 CO 0.04 -3.56 1.71 1.17 -1.51 0.00 0.00 177.10 174.96 1vpn n LYS 143 N -4.37 2.34 -1.72 -0.60 4.81 0.72 -4.60 118.16 114.73 1vpn n LYS 143 Ca 0.13 0.85 -0.32 0.00 -0.87 0.00 0.00 58.31 58.10 1vpn n LYS 143 Cb 0.59 -2.67 0.04 0.00 0.02 0.00 0.00 35.03 33.01 1vpn n LYS 143 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1vpn s PRO 144 N 2.01 3.05 0.42 1.64 0.04 -1.26 -1.64 135.00 139.27 1vpn s PRO 144 Ca 0.82 1.03 0.21 0.00 0.04 0.00 0.00 61.00 63.11 1vpn s PRO 144 Cb -0.63 -2.00 0.92 0.00 0.04 0.00 0.00 34.50 32.83 1vpn s PRO 144 CO 0.40 -1.01 1.85 1.79 0.04 0.00 0.00 177.00 180.07 1vpn h THR 145 N -0.35 0.78 -3.59 1.26 1.35 -1.20 -3.32 112.91 107.84 1vpn h THR 145 Ca -0.45 -1.16 -0.71 0.00 -0.55 0.00 0.00 66.41 63.53 1vpn h THR 145 Cb 1.21 1.72 -0.34 0.00 -1.73 0.00 0.00 68.15 69.02 1vpn h THR 145 CO 0.57 0.27 -0.25 -0.62 -0.25 0.00 0.00 175.52 175.24 1vpn s ASP 146 N -6.38 5.58 0.33 5.36 -1.08 -0.62 -4.90 116.67 114.96 1vpn s ASP 146 Ca -0.01 -2.92 0.15 0.00 -0.52 0.00 0.00 52.55 49.26 1vpn s ASP 146 Cb 0.12 -1.93 0.52 0.00 -1.46 0.00 0.00 42.92 40.17 1vpn s ASP 146 CO 0.66 -0.39 1.67 0.71 0.52 0.00 0.00 175.17 178.34 1vpn h THR 147 N 5.06 1.09 -0.69 1.71 1.35 -1.83 0.30 112.91 119.89 1vpn h THR 147 Ca 0.02 -1.80 -0.00 0.00 -0.55 0.00 0.00 66.41 64.08 1vpn h THR 147 Cb 0.95 2.05 -0.03 0.00 -1.73 0.00 0.00 68.15 69.39 1vpn h THR 147 CO 0.73 0.47 0.43 0.58 -0.25 0.00 0.00 175.52 177.48 1vpn h VAL 148 N 0.00 1.19 -0.05 6.82 2.07 -1.94 -3.26 116.25 121.09 1vpn h VAL 148 Ca -0.00 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1vpn h VAL 148 Cb 1.01 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1vpn h VAL 148 CO 0.06 0.20 0.00 0.59 0.02 0.00 0.00 177.57 178.44 1vpn n ASN 149 N -4.57 1.80 -3.37 0.57 3.02 -1.20 -5.01 115.26 106.50 1vpn n ASN 149 Ca 0.06 -1.44 -0.17 0.00 -0.03 0.00 0.00 54.58 52.99 1vpn n ASN 149 Cb 0.04 -0.03 0.07 0.00 -0.61 0.00 0.00 39.78 39.26 1vpn n ASN 149 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1vpn n THR 150 N 0.34 -7.55 -3.62 3.41 -1.04 0.94 -5.01 114.28 101.75 1vpn n THR 150 Ca 0.05 -0.97 0.00 0.00 -2.04 0.00 0.00 64.05 61.09 1vpn n THR 150 Cb 0.22 -5.67 0.00 0.00 -1.82 0.00 0.00 70.33 63.05 1vpn n THR 150 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1vpn n LYS 151 N -3.68 0.15 0.00 -2.82 4.76 -0.45 -5.01 118.16 111.12 1vpn n LYS 151 Ca -0.17 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.27 1vpn n LYS 151 Cb 0.64 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.83 1vpn n LYS 151 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1vpn n GLY 152 N 0.28 0.85 3.39 0.72 0.00 -1.26 -1.59 105.19 107.56 1vpn n GLY 152 Ca 0.00 -0.95 -0.19 0.00 0.00 0.00 0.00 46.02 44.88 1vpn n GLY 152 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vpn s ILE 153 N 0.00 1.13 -0.33 -0.61 -4.36 -1.26 -4.91 121.20 110.86 1vpn s ILE 153 Ca 0.00 -2.03 -0.29 0.00 -0.26 0.00 0.00 60.65 58.07 1vpn s ILE 153 Cb 0.00 -2.55 0.01 0.00 1.25 0.00 0.00 42.46 41.17 1vpn s ILE 153 CO 0.00 -0.17 1.28 -0.55 0.24 0.00 0.00 174.94 175.74 1vpn s SER 154 N -3.39 6.66 -0.19 4.36 0.15 -0.03 -1.35 113.70 119.90 1vpn s SER 154 Ca 0.32 1.10 -0.39 0.00 0.70 0.00 0.00 55.95 57.69 1vpn s SER 154 Cb 0.07 -2.54 -0.15 0.00 -1.71 0.00 0.00 66.02 61.68 1vpn s SER 154 CO 0.12 -1.11 1.71 0.41 1.20 0.00 0.00 173.24 175.57 1vpn n THR 155 N 6.31 0.30 -1.27 6.45 -1.04 -0.65 -4.55 114.28 119.83 1vpn n THR 155 Ca 0.14 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.05 61.81 1vpn n THR 155 Cb 0.47 -1.27 0.14 0.00 -1.82 0.00 0.00 70.33 67.85 1vpn n THR 155 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1vpn s PRO 156 N 3.16 1.07 0.23 -2.82 0.04 -1.26 -4.75 135.00 130.67 1vpn s PRO 156 Ca 0.95 0.64 -0.32 0.00 0.04 0.00 0.00 61.00 62.32 1vpn s PRO 156 Cb -0.99 -1.80 -0.12 0.00 0.04 0.00 0.00 34.50 31.62 1vpn s PRO 156 CO 0.61 -2.32 1.66 0.28 0.04 0.00 0.00 177.00 177.27 1vpn n VAL 157 N -3.91 0.34 -4.08 -0.36 0.31 -1.26 -4.86 118.33 104.51 1vpn n VAL 157 Ca 0.06 -0.09 -0.11 0.00 -0.01 0.00 0.00 64.34 64.20 1vpn n VAL 157 Cb 0.56 -1.93 -0.07 0.00 -0.91 0.00 0.00 33.84 31.50 1vpn n VAL 157 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1vpn s GLU 158 N 0.59 1.51 0.00 5.55 2.02 -0.79 -4.60 118.70 122.98 1vpn s GLU 158 Ca 0.72 -1.47 0.00 0.00 0.02 0.00 0.00 54.97 54.24 1vpn s GLU 158 Cb -0.52 0.40 0.00 0.00 0.10 0.00 0.00 34.13 34.11 1vpn s GLU 158 CO 0.38 -0.59 0.00 0.41 0.02 0.00 0.00 175.26 175.48 1vpn n GLY 159 N -0.38 -0.16 3.74 -1.39 0.00 -0.15 -0.56 105.19 106.30 1vpn n GLY 159 Ca 0.00 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.60 1vpn n GLY 159 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vpn s SER 160 N -4.00 6.58 0.06 1.61 0.01 -1.04 -4.34 113.70 112.58 1vpn s SER 160 Ca 0.00 2.74 0.07 0.00 1.31 0.00 0.00 55.95 60.07 1vpn s SER 160 Cb 0.00 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 1vpn s SER 160 CO 0.00 -0.76 -0.19 -1.10 0.41 0.00 0.00 173.24 171.59 1vpn s GLN 161 N -0.33 1.23 -0.17 12.44 -0.21 0.10 -2.80 119.66 129.92 1vpn s GLN 161 Ca 0.61 -0.97 -0.06 0.00 0.02 0.00 0.00 55.36 54.96 1vpn s GLN 161 Cb -0.43 -1.36 0.08 0.00 1.00 0.00 0.00 33.01 32.30 1vpn s GLN 161 CO 0.44 0.34 0.35 -0.47 -2.12 0.00 0.00 175.29 173.83 1vpn s TYR 162 N -0.92 -0.64 -0.14 0.91 5.04 -0.86 -1.51 117.35 119.23 1vpn s TYR 162 Ca 0.06 1.29 -0.01 0.00 -2.44 0.00 0.00 57.07 55.97 1vpn s TYR 162 Cb -0.09 0.16 0.03 0.00 0.35 0.00 0.00 41.96 42.41 1vpn s TYR 162 CO 0.02 -0.43 -0.05 -1.01 -1.34 0.00 0.00 175.55 172.74 1vpn s HIS 163 N 2.53 1.44 -0.00 4.97 3.76 -0.68 -0.68 115.29 126.63 1vpn s HIS 163 Ca -0.00 -0.82 0.00 0.00 -0.15 0.00 0.00 55.06 54.09 1vpn s HIS 163 Cb -0.12 -1.20 0.00 0.00 1.11 0.00 0.00 32.58 32.37 1vpn s HIS 163 CO -0.11 -0.54 -0.01 0.08 -0.85 0.00 0.00 174.74 173.32 1vpn s VAL 164 N 1.72 0.06 0.01 -0.90 1.01 -0.50 -1.11 120.40 120.69 1vpn s VAL 164 Ca 0.03 -0.01 -0.05 0.00 0.00 0.00 0.00 61.98 61.95 1vpn s VAL 164 Cb -0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 36.38 36.17 1vpn s VAL 164 CO -0.08 0.02 0.08 0.72 0.00 0.00 0.00 175.10 175.85 1vpn s PHE 165 N 0.08 0.12 0.01 5.22 -0.12 -0.80 -1.63 117.98 120.86 1vpn s PHE 165 Ca -0.01 -0.29 -0.14 0.00 -0.05 0.00 0.00 56.93 56.45 1vpn s PHE 165 Cb -0.01 -0.10 0.02 0.00 -0.63 0.00 0.00 43.02 42.30 1vpn s PHE 165 CO -0.00 -0.26 0.30 0.00 -0.05 0.00 0.00 175.22 175.20 1vpn s ALA 166 N -1.51 -0.71 -0.04 1.99 0.00 0.23 -0.94 121.76 120.78 1vpn s ALA 166 Ca -0.14 0.17 -0.00 0.00 0.00 0.00 0.00 51.96 51.99 1vpn s ALA 166 Cb -0.08 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.24 1vpn s ALA 166 CO 0.00 -0.31 -0.00 0.08 0.00 0.00 0.00 175.76 175.53 1vpn s VAL 167 N -1.79 0.25 0.30 0.00 1.01 -0.71 -1.81 120.40 117.65 1vpn s VAL 167 Ca -0.10 0.09 -0.18 0.00 0.00 0.00 0.00 61.98 61.79 1vpn s VAL 167 Cb -0.04 -0.36 0.02 0.00 0.00 0.00 0.00 36.38 36.00 1vpn s VAL 167 CO 0.01 0.18 0.69 -0.83 0.00 0.00 0.00 175.10 175.16 1vpn s GLY 168 N 1.29 0.19 -0.04 4.51 0.00 -0.57 -1.38 107.32 111.32 1vpn s GLY 168 Ca -0.06 -0.56 0.21 0.00 0.00 0.00 0.00 44.72 44.31 1vpn s GLY 168 CO -0.02 -0.27 1.55 0.61 0.00 0.00 0.00 173.10 174.97 1vpn n GLY 169 N -0.47 2.42 3.44 0.20 0.00 -0.54 -0.66 105.19 109.58 1vpn n GLY 169 Ca -0.04 -0.79 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 1vpn n GLY 169 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vpn s GLU 170 N -1.30 1.30 0.56 1.61 2.02 -1.26 -4.06 118.70 117.57 1vpn s GLU 170 Ca 0.48 -1.10 -0.20 0.00 0.02 0.00 0.00 54.97 54.17 1vpn s GLU 170 Cb 0.27 0.44 -0.04 0.00 0.10 0.00 0.00 34.13 34.89 1vpn s GLU 170 CO 0.30 -0.52 1.25 -2.14 0.02 0.00 0.00 175.26 174.17 1vpn s PRO 171 N -3.95 3.14 0.17 0.39 0.02 -1.26 -4.69 135.00 128.82 1vpn s PRO 171 Ca 0.16 1.94 -0.32 0.00 0.02 0.00 0.00 61.00 62.81 1vpn s PRO 171 Cb 0.01 -2.10 -0.11 0.00 0.02 0.00 0.00 34.50 32.32 1vpn s PRO 171 CO 0.01 -1.10 1.77 -1.17 -0.33 0.00 0.00 177.00 176.18 1vpn s LEU 172 N -3.74 4.38 -0.00 -5.54 2.96 -1.26 -4.72 118.68 110.77 1vpn s LEU 172 Ca 0.74 2.82 -0.30 0.00 -0.22 0.00 0.00 54.13 57.16 1vpn s LEU 172 Cb -0.33 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.74 1vpn s LEU 172 CO 0.38 -0.99 1.06 -1.81 -1.32 0.00 0.00 176.35 173.67 1vpn s ASP 173 N 1.89 7.25 0.03 3.68 1.01 -1.26 -0.91 116.67 128.36 1vpn s ASP 173 Ca 0.78 1.75 0.04 0.00 0.71 0.00 0.00 52.55 55.83 1vpn s ASP 173 Cb -0.48 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 40.84 1vpn s ASP 173 CO 0.34 -0.37 -0.05 -0.76 0.21 0.00 0.00 175.17 174.54 1vpn s LEU 174 N 1.24 3.24 -0.13 1.23 1.43 0.41 -0.18 118.68 125.93 1vpn s LEU 174 Ca 0.54 -0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.49 1vpn s LEU 174 Cb -0.23 -1.90 0.01 0.00 0.03 0.00 0.00 46.19 44.09 1vpn s LEU 174 CO 0.27 0.25 -0.20 -1.58 0.23 0.00 0.00 176.35 175.31 1vpn s GLN 175 N -1.70 2.78 0.17 1.70 2.00 0.12 -1.88 119.66 122.86 1vpn s GLN 175 Ca 0.19 -0.77 -0.22 0.00 -2.00 0.00 0.00 55.36 52.57 1vpn s GLN 175 Cb -0.11 -2.26 -0.08 0.00 0.80 0.00 0.00 33.01 31.36 1vpn s GLN 175 CO 0.11 -0.01 0.71 0.20 -0.50 0.00 0.00 175.29 175.79 1vpn s GLY 176 N 0.82 2.73 -0.29 2.59 0.00 0.50 -0.79 107.32 112.87 1vpn s GLY 176 Ca -0.08 0.20 -0.14 0.00 0.00 0.00 0.00 44.72 44.71 1vpn s GLY 176 CO -0.01 0.63 0.80 -2.27 0.00 0.00 0.00 173.10 172.25 1vpn s LEU 177 N -1.51 -0.84 0.36 0.66 0.20 -0.15 -4.58 118.68 112.82 1vpn s LEU 177 Ca 0.37 1.23 0.09 0.00 0.69 0.00 0.00 54.13 56.51 1vpn s LEU 177 Cb -0.20 2.06 -0.07 0.00 -0.43 0.00 0.00 46.19 47.56 1vpn s LEU 177 CO 0.22 -0.18 -0.04 0.68 -0.29 0.00 0.00 176.35 176.74 1vpn s VAL 178 N 2.20 2.26 0.08 1.68 -7.23 -0.26 -4.26 120.40 114.88 1vpn s VAL 178 Ca -0.07 -2.10 -0.14 0.00 -1.81 0.00 0.00 61.98 57.86 1vpn s VAL 178 Cb -0.07 -2.76 -0.18 0.00 0.56 0.00 0.00 36.38 33.92 1vpn s VAL 178 CO -0.18 -0.15 1.26 0.74 -0.31 0.00 0.00 175.10 176.46 1vpn h THR 179 N 1.90 1.29 -3.23 5.32 2.02 -1.88 -3.38 112.91 114.96 1vpn h THR 179 Ca -0.43 -2.02 -0.41 0.00 0.77 0.00 0.00 66.41 64.32 1vpn h THR 179 Cb 1.25 2.13 -0.40 0.00 -1.74 0.00 0.00 68.15 69.39 1vpn h THR 179 CO 0.72 0.63 -0.75 -0.62 0.37 0.00 0.00 175.52 175.87 1vpn s ASP 180 N -7.08 1.61 0.10 4.18 -1.08 -1.26 -4.94 116.67 108.19 1vpn s ASP 180 Ca -0.11 -0.17 0.14 0.00 -0.52 0.00 0.00 52.55 51.89 1vpn s ASP 180 Cb 0.08 -0.22 0.64 0.00 -1.46 0.00 0.00 42.92 41.95 1vpn s ASP 180 CO 0.90 -0.28 1.45 0.00 0.52 0.00 0.00 175.17 177.76 1vpn n ALA 181 N 5.27 1.46 1.06 3.66 0.00 -1.26 -1.56 120.51 129.12 1vpn n ALA 181 Ca -0.05 0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.53 1vpn n ALA 181 Cb 0.50 -1.23 0.23 0.00 0.00 0.00 0.00 19.45 18.94 1vpn n ALA 181 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1vpn n ARG 182 N -1.76 0.23 -1.69 0.00 1.74 -1.26 -4.45 116.66 109.48 1vpn n ARG 182 Ca 0.02 -0.15 -0.44 0.00 -0.77 0.00 0.00 57.85 56.51 1vpn n ARG 182 Cb 0.13 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.05 1vpn n ARG 182 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1vpn n THR 183 N -1.25 0.70 -3.25 0.55 -1.04 -0.60 -4.75 114.28 104.63 1vpn n THR 183 Ca 0.07 -0.18 -0.45 0.00 -2.04 0.00 0.00 64.05 61.45 1vpn n THR 183 Cb 0.34 -1.60 -0.01 0.00 -1.82 0.00 0.00 70.33 67.25 1vpn n THR 183 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1vpn s LYS 184 N -0.06 4.03 0.56 -2.82 1.02 0.53 -5.03 119.74 117.97 1vpn s LYS 184 Ca 0.70 -2.89 -0.18 0.00 0.02 0.00 0.00 55.97 53.62 1vpn s LYS 184 Cb -0.62 -4.63 -0.05 0.00 -0.52 0.00 0.00 37.83 32.01 1vpn s LYS 184 CO 0.46 -1.36 1.06 0.71 -0.92 0.00 0.00 175.35 175.30 1vpn s TYR 185 N -0.32 2.94 0.51 3.18 2.02 -1.26 -4.23 117.35 120.18 1vpn s TYR 185 Ca 0.30 1.54 -0.22 0.00 -0.37 0.00 0.00 57.07 58.31 1vpn s TYR 185 Cb -0.09 -3.07 -0.06 0.00 -0.40 0.00 0.00 41.96 38.35 1vpn s TYR 185 CO -0.07 -1.10 1.29 0.15 -1.57 0.00 0.00 175.55 174.25 1vpn s LYS 186 N -3.71 3.41 0.25 -0.62 -0.14 -1.26 -4.91 119.74 112.75 1vpn s LYS 186 Ca 0.66 2.08 0.25 0.00 -1.36 0.00 0.00 55.97 57.60 1vpn s LYS 186 Cb -0.17 -2.34 0.70 0.00 -1.68 0.00 0.00 37.83 34.33 1vpn s LYS 186 CO 0.30 -0.92 1.72 0.93 -0.76 0.00 0.00 175.35 176.62 1vpn h GLU 187 N 1.75 0.00 -5.38 1.68 5.08 -1.94 -3.43 114.58 112.33 1vpn h GLU 187 Ca -0.50 0.00 -0.42 0.00 -1.00 0.00 0.00 59.36 57.44 1vpn h GLU 187 Cb 1.28 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.32 1vpn h GLU 187 CO 0.59 0.00 -0.78 -1.21 -1.00 0.00 0.00 179.01 176.61 1vpn s GLU 188 N -3.13 0.84 0.00 2.33 2.02 -1.26 -4.77 118.70 114.74 1vpn s GLU 188 Ca 0.10 -0.98 0.00 0.00 0.02 0.00 0.00 54.97 54.11 1vpn s GLU 188 Cb 0.11 -0.85 0.00 0.00 0.10 0.00 0.00 34.13 33.49 1vpn s GLU 188 CO 0.62 0.19 0.00 0.41 0.02 0.00 0.00 175.26 176.50 1vpn n GLY 189 N 1.23 3.05 3.14 -1.39 0.00 -1.26 -5.02 105.19 104.94 1vpn n GLY 189 Ca -0.21 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 1vpn n GLY 189 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1vpn s VAL 190 N -2.76 0.13 -0.34 1.61 -7.23 -1.26 -4.85 120.40 105.70 1vpn s VAL 190 Ca 0.00 -1.11 -0.09 0.00 -1.81 0.00 0.00 61.98 58.97 1vpn s VAL 190 Cb 0.00 -0.98 0.02 0.00 0.56 0.00 0.00 36.38 35.98 1vpn s VAL 190 CO 0.00 -0.61 0.15 -0.69 -0.31 0.00 0.00 175.10 173.64 1vpn s VAL 191 N -2.81 4.32 0.51 1.32 1.01 0.09 -4.91 120.40 119.93 1vpn s VAL 191 Ca -0.03 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.21 1vpn s VAL 191 Cb 0.00 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 1vpn s VAL 191 CO -0.05 -0.09 0.07 0.42 0.00 0.00 0.00 175.10 175.45 1vpn s THR 192 N 1.53 1.29 0.26 3.92 -4.23 -1.26 -4.36 115.64 112.79 1vpn s THR 192 Ca 0.02 -1.91 -0.02 0.00 -1.18 0.00 0.00 61.69 58.60 1vpn s THR 192 Cb -0.18 -2.20 0.23 0.00 1.34 0.00 0.00 72.50 71.69 1vpn s THR 192 CO 0.05 0.00 1.79 0.40 -0.54 0.00 0.00 174.62 176.32 1vpn h ILE 193 N 1.26 0.82 -0.39 2.99 2.04 -1.97 -0.82 117.51 121.44 1vpn h ILE 193 Ca -0.43 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.16 1vpn h ILE 193 Cb 1.31 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1vpn h ILE 193 CO 0.71 0.13 0.14 0.50 0.00 0.00 0.00 178.15 179.64 1vpn h LYS 194 N 0.72 0.55 -0.68 2.37 3.64 -1.94 -0.62 116.57 120.60 1vpn h LYS 194 Ca 0.44 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.77 1vpn h LYS 194 Cb 0.52 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.20 1vpn h LYS 194 CO -0.31 0.47 0.45 1.15 -2.27 0.00 0.00 179.45 178.94 1vpn h THR 195 N 0.55 1.11 0.00 1.00 2.02 -1.46 0.33 112.91 116.46 1vpn h THR 195 Ca 0.13 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 1vpn h THR 195 Cb 0.13 0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 66.74 1vpn h THR 195 CO -0.01 0.15 -0.16 0.40 0.37 0.00 0.00 175.52 176.27 1vpn h ILE 196 N 0.84 0.95 0.00 3.11 1.08 -1.16 -3.38 117.51 118.95 1vpn h ILE 196 Ca 0.27 -1.76 0.00 0.00 -0.39 0.00 0.00 64.86 62.97 1vpn h ILE 196 Cb 0.03 1.85 0.00 0.00 -3.07 0.00 0.00 36.82 35.62 1vpn h ILE 196 CO -0.07 0.32 0.00 0.71 -0.69 0.00 0.00 178.15 178.42 1vpn h THR 197 N -1.00 0.00 -0.10 -0.27 1.35 -1.14 -3.47 112.91 108.28 1vpn h THR 197 Ca -0.04 -0.87 -0.04 0.00 -0.55 0.00 0.00 66.41 64.91 1vpn h THR 197 Cb 0.64 1.87 -0.02 0.00 -1.73 0.00 0.00 68.15 68.92 1vpn h THR 197 CO -0.02 0.00 -0.04 0.29 -0.25 0.00 0.00 175.52 175.50 1vpn n LYS 198 N -3.09 -0.93 -4.25 4.72 4.76 0.12 -4.97 118.16 114.52 1vpn n LYS 198 Ca 0.03 0.37 -0.14 0.00 -2.87 0.00 0.00 58.31 55.70 1vpn n LYS 198 Cb 0.47 -4.14 -0.10 0.00 -1.84 0.00 0.00 35.03 29.42 1vpn n LYS 198 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1vpn s LYS 199 N -1.35 1.15 0.68 1.97 1.02 -1.25 -5.05 119.74 116.91 1vpn s LYS 199 Ca 0.00 -1.57 -0.15 0.00 0.02 0.00 0.00 55.97 54.28 1vpn s LYS 199 Cb 0.00 -0.21 0.01 0.00 -0.52 0.00 0.00 37.83 37.11 1vpn s LYS 199 CO 0.00 -0.17 1.13 -0.51 -0.92 0.00 0.00 175.35 174.87 1vpn s ASP 200 N -3.19 4.89 0.62 2.83 1.01 -1.26 -4.22 116.67 117.35 1vpn s ASP 200 Ca 0.26 2.06 -0.18 0.00 0.71 0.00 0.00 52.55 55.41 1vpn s ASP 200 Cb 0.06 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.41 1vpn s ASP 200 CO 0.06 -1.78 1.21 -0.04 0.21 0.00 0.00 175.17 174.82 1vpn s MET 201 N -4.09 2.82 0.42 8.23 -1.94 -1.26 -4.97 119.30 118.50 1vpn s MET 201 Ca 0.68 1.82 0.07 0.00 -1.71 0.00 0.00 55.69 56.55 1vpn s MET 201 Cb -0.22 -1.91 -0.04 0.00 2.01 0.00 0.00 34.83 34.67 1vpn s MET 201 CO 0.43 -1.32 0.28 0.14 -0.01 0.00 0.00 175.02 174.54 1vpn s VAL 202 N -1.66 2.47 0.51 -6.03 -7.23 -1.26 -4.91 120.40 102.28 1vpn s VAL 202 Ca 0.77 -1.51 0.21 0.00 -1.81 0.00 0.00 61.98 59.64 1vpn s VAL 202 Cb -0.30 -2.99 0.28 0.00 0.56 0.00 0.00 36.38 33.93 1vpn s VAL 202 CO 0.36 0.00 2.13 -0.55 -0.31 0.00 0.00 175.10 176.73 1vpn h ASN 203 N 1.21 0.00 0.21 4.85 -1.07 -1.96 -1.59 115.58 117.23 1vpn h ASN 203 Ca -0.42 0.00 -0.00 0.00 0.07 0.00 0.00 56.30 55.95 1vpn h ASN 203 Cb 1.26 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.51 1vpn h ASN 203 CO 0.63 0.06 -0.02 0.11 0.07 0.00 0.00 177.43 178.29 1vpn h LYS 204 N 0.00 0.00 0.00 4.14 1.57 -1.95 -1.72 116.57 118.61 1vpn h LYS 204 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1vpn h LYS 204 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1vpn h LYS 204 CO 0.01 0.02 0.00 -0.25 -0.57 0.00 0.00 179.45 178.66 1vpn n ASP 205 N -3.34 0.00 0.02 0.86 8.00 -0.60 -1.45 116.55 120.05 1vpn n ASP 205 Ca -0.02 0.21 0.12 0.00 0.71 0.00 0.00 54.79 55.81 1vpn n ASP 205 Cb 0.13 -0.35 0.28 0.00 -0.02 0.00 0.00 41.12 41.16 1vpn n ASP 205 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vpn n GLN 206 N -1.35 0.10 0.00 -1.24 6.02 -0.65 -1.10 117.38 119.16 1vpn n GLN 206 Ca 0.06 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1vpn n GLN 206 Cb 0.13 -1.57 0.00 0.00 1.02 0.00 0.00 30.24 29.83 1vpn n GLN 206 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1vpn n VAL 207 N -1.71 0.00 -3.27 5.09 0.24 -0.53 -4.69 118.33 113.46 1vpn n VAL 207 Ca 0.05 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.93 1vpn n VAL 207 Cb 0.37 0.00 -0.08 0.00 -1.47 0.00 0.00 33.84 32.66 1vpn n VAL 207 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1vpn s LEU 208 N 0.00 4.57 -0.33 1.34 0.20 -1.25 -4.72 118.68 118.50 1vpn s LEU 208 Ca 0.00 -0.35 -0.02 0.00 0.69 0.00 0.00 54.13 54.46 1vpn s LEU 208 Cb 0.00 -2.50 0.07 0.00 -0.43 0.00 0.00 46.19 43.33 1vpn s LEU 208 CO 0.00 -0.55 0.05 0.21 -0.29 0.00 0.00 176.35 175.77 1vpn s ASN 209 N 1.82 4.97 0.57 3.68 3.84 -1.24 -4.96 114.94 123.62 1vpn s ASN 209 Ca 0.16 -1.53 0.30 0.00 0.21 0.00 0.00 52.86 52.01 1vpn s ASN 209 Cb -0.16 -1.73 1.44 0.00 -0.55 0.00 0.00 41.25 40.25 1vpn s ASN 209 CO 0.14 -0.34 1.83 -0.65 -2.79 0.00 0.00 177.10 175.29 1vpn h PRO 210 N 7.98 0.00 -0.17 0.43 0.11 -1.95 -1.09 132.00 137.31 1vpn h PRO 210 Ca -0.18 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.81 1vpn h PRO 210 Cb 1.05 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1vpn h PRO 210 CO 0.57 0.00 -0.43 0.82 -0.21 0.00 0.00 178.00 178.75 1vpn h ILE 211 N 0.00 1.31 -0.55 4.15 2.04 -1.99 -3.38 117.51 119.09 1vpn h ILE 211 Ca 0.33 -1.59 -0.70 0.00 1.00 0.00 0.00 64.86 63.90 1vpn h ILE 211 Cb 1.60 1.65 -0.07 0.00 -0.74 0.00 0.00 36.82 39.27 1vpn h ILE 211 CO -0.00 0.49 2.57 -1.20 0.00 0.00 0.00 178.15 180.01 1vpn n SER 212 N -4.01 4.49 -4.28 1.72 7.64 -0.41 -4.93 113.62 113.84 1vpn n SER 212 Ca -0.02 -2.89 -0.21 0.00 1.01 0.00 0.00 58.87 56.76 1vpn n SER 212 Cb 0.51 -1.70 -0.12 0.00 -1.01 0.00 0.00 64.21 61.90 1vpn n SER 212 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1vpn s LYS 213 N 3.57 1.12 0.32 1.43 1.02 -1.26 -0.37 119.74 125.56 1vpn s LYS 213 Ca 0.50 -1.26 -0.06 0.00 0.02 0.00 0.00 55.97 55.17 1vpn s LYS 213 Cb 0.08 -1.17 0.03 0.00 -0.52 0.00 0.00 37.83 36.25 1vpn s LYS 213 CO 0.00 0.25 0.53 0.00 -0.92 0.00 0.00 175.35 175.21 1vpn n ALA 214 N 0.65 -0.82 -2.81 5.17 0.00 -0.79 -4.97 120.51 116.93 1vpn n ALA 214 Ca -0.16 -1.27 -0.20 0.00 0.00 0.00 0.00 53.44 51.81 1vpn n ALA 214 Cb 0.56 1.02 -0.15 0.00 0.00 0.00 0.00 19.45 20.87 1vpn n ALA 214 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1vpn s LYS 215 N -2.43 0.95 -1.20 0.00 1.02 -1.26 -0.44 119.74 116.38 1vpn s LYS 215 Ca 0.20 -0.36 -0.21 0.00 0.02 0.00 0.00 55.97 55.62 1vpn s LYS 215 Cb -0.02 -0.90 -0.00 0.00 -0.52 0.00 0.00 37.83 36.39 1vpn s LYS 215 CO 0.15 0.18 1.81 -1.17 -0.92 0.00 0.00 175.35 175.40 1vpn s LEU 216 N -0.06 3.43 0.00 3.17 2.96 -0.09 -4.67 118.68 123.44 1vpn s LEU 216 Ca 0.01 -1.90 0.18 0.00 -0.22 0.00 0.00 54.13 52.20 1vpn s LEU 216 Cb -0.06 -2.58 -0.04 0.00 0.50 0.00 0.00 46.19 44.01 1vpn s LEU 216 CO 0.00 -2.10 0.90 -0.90 -1.32 0.00 0.00 176.35 172.93 1vpn n ASP 217 N 11.31 1.60 -3.97 3.68 5.68 -1.26 -4.27 116.55 129.33 1vpn n ASP 217 Ca 0.45 -1.30 -0.17 0.00 -0.50 0.00 0.00 54.79 53.27 1vpn n ASP 217 Cb 0.47 0.56 -0.15 0.00 -1.14 0.00 0.00 41.12 40.86 1vpn n ASP 217 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1vpn s LYS 218 N -2.18 0.54 0.27 0.11 1.02 -1.26 -5.09 119.74 113.15 1vpn s LYS 218 Ca 0.14 -0.21 -0.29 0.00 0.02 0.00 0.00 55.97 55.63 1vpn s LYS 218 Cb 0.14 -0.53 -0.09 0.00 -0.52 0.00 0.00 37.83 36.83 1vpn s LYS 218 CO 0.50 0.11 1.01 0.34 -0.92 0.00 0.00 175.35 176.39 1vpn s ASP 219 N -0.01 7.42 -1.43 2.83 2.15 -1.26 -4.01 116.67 122.36 1vpn s ASP 219 Ca 0.01 2.08 -0.09 0.00 0.43 0.00 0.00 52.55 54.98 1vpn s ASP 219 Cb -0.04 -2.61 0.05 0.00 -0.30 0.00 0.00 42.92 40.01 1vpn s ASP 219 CO -0.00 -0.01 0.95 0.61 -0.17 0.00 0.00 175.17 176.54 1vpn n GLY 220 N 1.25 -0.45 0.00 2.66 0.00 -0.05 -4.86 105.19 103.74 1vpn n GLY 220 Ca -0.01 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1vpn n GLY 220 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1vpn n MET 221 N -4.61 2.47 -3.48 1.61 2.81 -1.26 -4.95 117.12 109.71 1vpn n MET 221 Ca -0.06 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.40 1vpn n MET 221 Cb 0.58 -0.64 -0.10 0.00 -0.71 0.00 0.00 33.22 32.35 1vpn n MET 221 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 1vpn s TYR 222 N -0.98 3.25 0.28 2.03 1.51 -1.26 -0.74 117.35 121.44 1vpn s TYR 222 Ca 0.00 -0.78 -0.30 0.00 -1.01 0.00 0.00 57.07 54.98 1vpn s TYR 222 Cb 0.00 -2.69 -0.11 0.00 -0.11 0.00 0.00 41.96 39.04 1vpn s TYR 222 CO 0.00 -0.66 1.61 -2.14 -1.11 0.00 0.00 175.55 173.25 1vpn s PRO 223 N 1.63 4.12 0.37 -1.71 0.02 -1.26 -0.87 135.00 137.30 1vpn s PRO 223 Ca 0.04 2.58 0.27 0.00 0.02 0.00 0.00 61.00 63.92 1vpn s PRO 223 Cb -0.20 -3.03 1.08 0.00 0.02 0.00 0.00 34.50 32.37 1vpn s PRO 223 CO 0.08 -0.65 1.81 -0.39 -0.33 0.00 0.00 177.00 177.53 1vpn h VAL 224 N 3.44 0.00 -0.01 3.83 -1.51 -1.55 -1.30 116.25 119.15 1vpn h VAL 224 Ca -0.47 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 64.62 1vpn h VAL 224 Cb 1.22 1.24 0.00 0.00 -2.13 0.00 0.00 31.29 31.62 1vpn h VAL 224 CO 0.81 0.00 -0.00 -1.84 -1.23 0.00 0.00 177.57 175.31 1vpn n GLU 225 N -2.58 1.27 -0.01 5.19 0.28 -1.26 -4.14 120.64 119.40 1vpn n GLU 225 Ca 0.02 -0.40 -0.02 0.00 -0.16 0.00 0.00 57.16 56.60 1vpn n GLU 225 Cb 0.29 -1.49 -0.01 0.00 1.43 0.00 0.00 31.44 31.66 1vpn n GLU 225 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 1vpn n ILE 226 N -0.52 0.11 -3.60 3.84 5.41 -0.85 -4.50 119.36 119.25 1vpn n ILE 226 Ca 0.22 -0.03 -0.37 0.00 1.00 0.00 0.00 62.75 63.57 1vpn n ILE 226 Cb 0.21 -1.52 -0.10 0.00 -0.71 0.00 0.00 39.64 37.52 1vpn n ILE 226 CO 0.00 0.00 0.00 0.26 0.00 0.00 0.00 176.55 176.81 1vpn s TRP 227 N -2.04 3.30 0.21 1.39 0.52 -0.55 -0.98 118.94 120.80 1vpn s TRP 227 Ca -0.03 0.26 0.10 0.00 0.02 0.00 0.00 56.10 56.45 1vpn s TRP 227 Cb 0.01 -2.34 -0.05 0.00 -1.15 0.00 0.00 33.47 29.94 1vpn s TRP 227 CO 0.03 -0.00 -0.19 -1.01 0.02 0.00 0.00 176.95 175.80 1vpn s HIS 228 N 1.28 2.00 0.21 -1.98 3.76 0.03 -4.68 115.29 115.92 1vpn s HIS 228 Ca 0.09 -0.44 -0.32 0.00 -0.15 0.00 0.00 55.06 54.25 1vpn s HIS 228 Cb -0.14 -0.94 -0.12 0.00 1.11 0.00 0.00 32.58 32.48 1vpn s HIS 228 CO 0.06 0.47 1.73 -2.30 -0.85 0.00 0.00 174.74 173.85 1vpn n PRO 229 N -0.10 2.79 -2.80 8.40 -0.02 -1.26 0.15 135.00 142.16 1vpn n PRO 229 Ca -0.10 1.01 -0.43 0.00 -2.02 0.00 0.00 63.50 61.96 1vpn n PRO 229 Cb 0.58 -2.86 -0.04 0.00 -0.02 0.00 0.00 33.50 31.17 1vpn n PRO 229 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1vpn s ASP 230 N 1.19 6.45 0.38 2.55 -1.08 0.75 -4.61 116.67 122.29 1vpn s ASP 230 Ca 0.75 -0.03 0.28 0.00 -0.52 0.00 0.00 52.55 53.03 1vpn s ASP 230 Cb -0.50 -2.46 1.16 0.00 -1.46 0.00 0.00 42.92 39.66 1vpn s ASP 230 CO 0.32 -1.15 1.83 1.55 0.52 0.00 0.00 175.17 178.23 1vpn h PRO 231 N 9.20 0.00 0.00 4.34 0.13 -1.91 -2.70 132.00 141.06 1vpn h PRO 231 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1vpn h PRO 231 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1vpn h PRO 231 CO 1.06 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.83 1vpn h ALA 232 N 2.16 1.00 -3.00 -0.56 0.00 -1.98 -3.46 119.26 113.42 1vpn h ALA 232 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1vpn h ALA 232 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1vpn h ALA 232 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.88 1vpn n LYS 233 N -2.35 1.52 -3.87 0.00 5.02 -1.02 -4.96 118.16 112.50 1vpn n LYS 233 Ca 0.05 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.07 1vpn n LYS 233 Cb 0.41 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.44 1vpn n LYS 233 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1vpn n ASN 234 N 0.00 -3.08 0.26 4.39 3.02 -1.26 -4.86 115.26 113.74 1vpn n ASN 234 Ca 0.00 -0.83 0.14 0.00 -0.03 0.00 0.00 54.58 53.86 1vpn n ASN 234 Cb 0.00 -3.79 0.66 0.00 -0.61 0.00 0.00 39.78 36.04 1vpn n ASN 234 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1vpn h GLU 235 N -1.96 0.00 -0.09 3.52 4.57 -1.93 -2.93 114.58 115.76 1vpn h GLU 235 Ca -0.60 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 57.55 1vpn h GLU 235 Cb 1.37 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.94 1vpn h GLU 235 CO 0.64 0.10 -0.19 -1.71 -1.18 0.00 0.00 179.01 176.67 1vpn n ASN 236 N -3.31 2.31 -3.91 1.04 5.15 -1.26 -4.97 115.26 110.32 1vpn n ASN 236 Ca -0.00 -3.49 -0.11 0.00 -0.60 0.00 0.00 54.58 50.38 1vpn n ASN 236 Cb 0.32 -0.51 -0.13 0.00 -0.53 0.00 0.00 39.78 38.93 1vpn n ASN 236 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1vpn s THR 237 N -3.07 0.04 -0.16 -0.44 2.01 -1.11 -1.47 115.64 111.45 1vpn s THR 237 Ca 0.37 -0.36 0.01 0.00 0.31 0.00 0.00 61.69 62.02 1vpn s THR 237 Cb 0.34 -0.14 0.00 0.00 0.01 0.00 0.00 72.50 72.71 1vpn s THR 237 CO -0.00 -0.20 -0.17 -0.13 -0.69 0.00 0.00 174.62 173.43 1vpn s ARG 238 N -0.59 3.14 0.07 4.92 1.81 -0.48 -4.93 118.95 122.90 1vpn s ARG 238 Ca -0.07 -0.78 0.07 0.00 -1.72 0.00 0.00 55.73 53.24 1vpn s ARG 238 Cb -0.04 -2.60 -0.03 0.00 -0.45 0.00 0.00 34.95 31.83 1vpn s ARG 238 CO -0.00 -0.04 -0.19 1.52 -0.68 0.00 0.00 175.30 175.90 1vpn s TYR 239 N 0.94 1.68 -0.07 -0.53 -0.85 -1.26 -1.74 117.35 115.52 1vpn s TYR 239 Ca -0.03 -0.40 -0.01 0.00 -0.52 0.00 0.00 57.07 56.10 1vpn s TYR 239 Cb -0.15 -0.96 0.03 0.00 0.38 0.00 0.00 41.96 41.26 1vpn s TYR 239 CO -0.03 0.14 0.01 -0.06 -1.52 0.00 0.00 175.55 174.09 1vpn s PHE 240 N -1.02 0.61 0.07 -3.49 0.40 -0.11 -5.00 117.98 109.44 1vpn s PHE 240 Ca 0.05 -0.13 0.01 0.00 -0.60 0.00 0.00 56.93 56.27 1vpn s PHE 240 Cb -0.09 -0.77 -0.03 0.00 0.51 0.00 0.00 43.02 42.63 1vpn s PHE 240 CO 0.03 -0.32 -0.06 0.20 0.70 0.00 0.00 175.22 175.77 1vpn s GLY 241 N 1.99 0.60 -0.04 4.36 0.00 -1.26 -1.90 107.32 111.07 1vpn s GLY 241 Ca 0.05 -1.08 -0.17 0.00 0.00 0.00 0.00 44.72 43.53 1vpn s GLY 241 CO -0.05 -1.16 0.37 0.54 0.00 0.00 0.00 173.10 172.80 1vpn s ASN 242 N -2.41 -0.29 0.01 1.64 2.20 -0.26 -4.99 114.94 110.83 1vpn s ASN 242 Ca 0.02 0.28 0.03 0.00 -0.94 0.00 0.00 52.86 52.24 1vpn s ASN 242 Cb -0.01 0.42 -0.01 0.00 -2.00 0.00 0.00 41.25 39.65 1vpn s ASN 242 CO -0.03 -0.42 -0.09 -0.47 -2.94 0.00 0.00 177.10 173.14 1vpn s TYR 243 N -1.08 0.82 -0.10 1.54 5.04 -1.26 -1.68 117.35 120.63 1vpn s TYR 243 Ca -0.11 -0.21 -0.03 0.00 -2.44 0.00 0.00 57.07 54.28 1vpn s TYR 243 Cb -0.04 -0.51 0.04 0.00 0.35 0.00 0.00 41.96 41.80 1vpn s TYR 243 CO 0.04 -0.01 0.05 0.99 -1.34 0.00 0.00 175.55 175.28 1vpn s THR 244 N -0.43 0.11 0.00 4.34 2.01 -0.57 -5.02 115.64 116.08 1vpn s THR 244 Ca 0.02 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.08 1vpn s THR 244 Cb -0.05 -0.48 0.00 0.00 0.01 0.00 0.00 72.50 71.98 1vpn s THR 244 CO 0.00 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.57 1vpn n GLY 245 N 5.22 0.93 0.00 4.40 0.00 -1.26 0.03 105.19 114.50 1vpn n GLY 245 Ca -0.06 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1vpn n GLY 245 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vpn n GLY 246 N 5.00 0.81 0.11 -0.02 0.00 -1.26 -4.20 105.19 105.63 1vpn n GLY 246 Ca 0.00 -1.97 -0.15 0.00 0.00 0.00 0.00 46.02 43.90 1vpn n GLY 246 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1vpn n THR 247 N 1.16 1.34 -1.05 2.61 -2.24 -1.26 -2.48 114.28 112.36 1vpn n THR 247 Ca 0.00 -0.57 0.06 0.00 -2.27 0.00 0.00 64.05 61.28 1vpn n THR 247 Cb 0.00 -1.20 0.09 0.00 -2.10 0.00 0.00 70.33 67.12 1vpn n THR 247 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1vpn n THR 248 N -3.11 1.36 -1.66 4.28 -2.24 -1.26 -3.43 114.28 108.22 1vpn n THR 248 Ca -0.40 -1.60 -0.46 0.00 -2.27 0.00 0.00 64.05 59.32 1vpn n THR 248 Cb 0.97 0.05 -0.04 0.00 -2.10 0.00 0.00 70.33 69.22 1vpn n THR 248 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1vpn n THR 249 N -0.99 0.35 -1.96 4.28 -1.04 -1.26 -4.31 114.28 109.35 1vpn n THR 249 Ca 0.10 -0.09 -0.42 0.00 -2.04 0.00 0.00 64.05 61.61 1vpn n THR 249 Cb 0.58 -1.47 -0.03 0.00 -1.82 0.00 0.00 70.33 67.60 1vpn n THR 249 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1vpn s PRO 250 N 0.39 4.23 0.24 -2.82 0.02 -1.26 -0.97 135.00 134.83 1vpn s PRO 250 Ca 0.75 2.34 -0.30 0.00 0.02 0.00 0.00 61.00 63.81 1vpn s PRO 250 Cb -0.68 -3.14 -0.09 0.00 0.02 0.00 0.00 34.50 30.61 1vpn s PRO 250 CO 0.43 -0.54 1.11 -2.14 -0.33 0.00 0.00 177.00 175.52 1vpn s PRO 251 N 0.64 4.61 -0.00 5.54 0.02 -1.26 -4.92 135.00 139.63 1vpn s PRO 251 Ca 0.66 1.79 0.05 0.00 0.02 0.00 0.00 61.00 63.52 1vpn s PRO 251 Cb -0.43 -3.22 -0.02 0.00 0.02 0.00 0.00 34.50 30.86 1vpn s PRO 251 CO 0.35 0.15 -0.17 0.08 -0.33 0.00 0.00 177.00 177.08 1vpn s VAL 252 N -0.79 1.32 -0.25 3.83 1.01 -1.26 -5.14 120.40 119.12 1vpn s VAL 252 Ca 0.47 -0.80 -0.23 0.00 0.00 0.00 0.00 61.98 61.42 1vpn s VAL 252 Cb -0.31 -1.12 0.07 0.00 0.00 0.00 0.00 36.38 35.01 1vpn s VAL 252 CO 0.39 0.31 0.67 -0.22 0.00 0.00 0.00 175.10 176.24 1vpn s LEU 253 N -0.57 -0.56 0.10 3.92 2.96 -1.26 -5.15 118.68 118.12 1vpn s LEU 253 Ca 0.06 1.35 0.08 0.00 -0.22 0.00 0.00 54.13 55.40 1vpn s LEU 253 Cb -0.07 2.28 -0.04 0.00 0.50 0.00 0.00 46.19 48.87 1vpn s LEU 253 CO -0.00 -0.23 -0.17 -1.10 -1.32 0.00 0.00 176.35 173.53 1vpn s GLN 254 N 0.42 1.90 -0.16 1.98 1.11 -1.26 -5.12 119.66 118.53 1vpn s GLN 254 Ca -0.01 -1.11 -0.09 0.00 0.01 0.00 0.00 55.36 54.17 1vpn s GLN 254 Cb -0.05 -2.16 0.05 0.00 -1.01 0.00 0.00 33.01 29.85 1vpn s GLN 254 CO -0.00 0.50 0.38 -0.59 0.01 0.00 0.00 175.29 175.59 1vpn s PHE 255 N -1.10 -0.54 -0.09 0.91 -0.71 -1.26 -4.77 117.98 110.43 1vpn s PHE 255 Ca 0.17 1.18 -0.30 0.00 -1.04 0.00 0.00 56.93 56.94 1vpn s PHE 255 Cb -0.11 0.22 0.08 0.00 -1.21 0.00 0.00 43.02 42.01 1vpn s PHE 255 CO 0.09 -0.31 0.75 -0.08 -1.34 0.00 0.00 175.22 174.33 1vpn s THR 256 N 1.27 0.00 -0.60 -4.49 -1.32 -1.26 -5.03 115.64 104.21 1vpn s THR 256 Ca -0.09 0.00 0.11 0.00 -1.21 0.00 0.00 61.69 60.51 1vpn s THR 256 Cb -0.08 -1.00 0.61 0.00 -1.51 0.00 0.00 72.50 70.52 1vpn s THR 256 CO -0.11 0.00 1.45 -0.46 -2.21 0.00 0.00 174.62 173.29 1vpn n ASN 257 N 0.99 4.45 -0.25 8.08 6.94 -1.26 -4.10 115.26 130.11 1vpn n ASN 257 Ca -0.17 -2.63 0.06 0.00 -0.02 0.00 0.00 54.58 51.82 1vpn n ASN 257 Cb 0.57 -0.61 -0.01 0.00 -2.36 0.00 0.00 39.78 37.37 1vpn n ASN 257 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1vpn n THR 258 N 0.55 0.00 -3.57 5.53 -2.24 -1.26 -4.96 114.28 108.33 1vpn n THR 258 Ca 0.21 -0.36 -0.38 0.00 -2.27 0.00 0.00 64.05 61.25 1vpn n THR 258 Cb 0.92 1.13 -0.10 0.00 -2.10 0.00 0.00 70.33 70.18 1vpn n THR 258 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1vpn s LEU 259 N -1.82 4.07 -0.13 3.22 2.96 -1.26 -5.07 118.68 120.65 1vpn s LEU 259 Ca 0.09 0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 54.12 1vpn s LEU 259 Cb 0.10 -2.19 -0.02 0.00 0.50 0.00 0.00 46.19 44.57 1vpn s LEU 259 CO 0.32 -0.03 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.34 1vpn s THR 260 N 1.49 3.44 -0.29 3.68 2.01 -1.26 -4.52 115.64 120.19 1vpn s THR 260 Ca 0.09 -0.53 -0.11 0.00 0.31 0.00 0.00 61.69 61.45 1vpn s THR 260 Cb -0.15 -2.47 -0.04 0.00 0.01 0.00 0.00 72.50 69.85 1vpn s THR 260 CO 0.08 0.52 0.20 -0.89 -0.69 0.00 0.00 174.62 173.84 1vpn s THR 261 N 0.23 5.30 0.14 -0.82 2.01 0.44 -4.96 115.64 117.97 1vpn s THR 261 Ca -0.06 0.10 -0.30 0.00 0.31 0.00 0.00 61.69 61.74 1vpn s THR 261 Cb -0.15 -3.57 -0.07 0.00 0.01 0.00 0.00 72.50 68.73 1vpn s THR 261 CO 0.04 0.20 1.09 -0.69 -0.69 0.00 0.00 174.62 174.57 1vpn s VAL 262 N 1.75 4.03 -1.77 3.82 1.01 -1.26 -0.58 120.40 127.40 1vpn s VAL 262 Ca 0.07 1.66 0.16 0.00 0.00 0.00 0.00 61.98 63.87 1vpn s VAL 262 Cb -0.16 -4.06 0.07 0.00 0.00 0.00 0.00 36.38 32.23 1vpn s VAL 262 CO 0.11 0.24 0.94 0.18 0.00 0.00 0.00 175.10 176.57 1vpn n LEU 263 N 2.80 2.03 -4.76 3.92 4.77 -0.15 -4.92 117.00 120.69 1vpn n LEU 263 Ca 0.04 -0.90 -0.40 0.00 -0.03 0.00 0.00 56.01 54.72 1vpn n LEU 263 Cb 0.47 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.51 1vpn n LEU 263 CO 0.54 0.37 0.79 -0.76 -1.33 0.00 0.00 177.39 176.99 1vpn s LEU 264 N -1.62 4.55 0.00 2.23 1.43 -1.23 -4.22 118.68 119.82 1vpn s LEU 264 Ca 0.16 2.26 -0.05 0.00 -1.03 0.00 0.00 54.13 55.47 1vpn s LEU 264 Cb 0.13 -3.63 0.08 0.00 0.03 0.00 0.00 46.19 42.80 1vpn s LEU 264 CO 0.28 -0.14 0.49 -0.90 0.23 0.00 0.00 176.35 176.31 1vpn n ASP 265 N 1.18 0.14 0.26 2.29 5.68 0.66 -4.83 116.55 121.92 1vpn n ASP 265 Ca -0.01 -1.24 0.18 0.00 -0.50 0.00 0.00 54.79 53.22 1vpn n ASP 265 Cb 0.45 -0.36 0.89 0.00 -1.14 0.00 0.00 41.12 40.95 1vpn n ASP 265 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1vpn h GLU 266 N 0.00 0.00 -0.64 0.11 9.09 -1.97 -0.35 114.58 120.82 1vpn h GLU 266 Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.25 1vpn h GLU 266 Cb 0.46 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.56 1vpn h GLU 266 CO 0.12 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.27 1vpn n ASN 267 N -3.37 4.93 -0.73 3.06 3.02 -1.26 -4.94 115.26 115.98 1vpn n ASN 267 Ca 0.00 -2.53 -0.09 0.00 -0.03 0.00 0.00 54.58 51.94 1vpn n ASN 267 Cb 0.33 -0.60 -0.03 0.00 -0.61 0.00 0.00 39.78 38.87 1vpn n ASN 267 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vpn n GLY 268 N 1.05 0.96 3.32 7.41 0.00 -0.14 -5.02 105.19 112.77 1vpn n GLY 268 Ca 0.26 -0.61 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 1vpn n GLY 268 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vpn s VAL 269 N -2.35 2.77 0.49 1.61 1.01 -1.26 -4.80 120.40 117.88 1vpn s VAL 269 Ca 0.00 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.25 1vpn s VAL 269 Cb 0.00 -2.14 0.09 0.00 0.00 0.00 0.00 36.38 34.33 1vpn s VAL 269 CO 0.00 0.53 0.68 0.61 0.00 0.00 0.00 175.10 176.92 1vpn n GLY 270 N 3.58 1.30 3.76 4.51 0.00 -1.26 -0.25 105.19 116.83 1vpn n GLY 270 Ca -0.18 -2.10 -0.41 0.00 0.00 0.00 0.00 46.02 43.32 1vpn n GLY 270 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1vpn s PRO 271 N -4.21 4.18 -0.16 1.61 0.02 -1.25 -4.69 135.00 130.50 1vpn s PRO 271 Ca 0.48 2.47 -0.05 0.00 0.02 0.00 0.00 61.00 63.92 1vpn s PRO 271 Cb -0.03 -3.03 -0.04 0.00 0.02 0.00 0.00 34.50 31.43 1vpn s PRO 271 CO 0.31 -0.50 0.02 -0.51 -0.33 0.00 0.00 177.00 176.00 1vpn s LEU 272 N -1.21 3.61 -0.95 -5.54 1.43 -1.26 -1.18 118.68 113.58 1vpn s LEU 272 Ca 0.57 0.03 -0.24 0.00 -1.03 0.00 0.00 54.13 53.46 1vpn s LEU 272 Cb -0.45 -1.89 0.05 0.00 0.03 0.00 0.00 46.19 43.93 1vpn s LEU 272 CO 0.53 0.21 1.40 0.00 0.23 0.00 0.00 176.35 178.72 1vpn h LYS 274 N 9.83 0.05 -0.13 0.00 2.10 -1.88 -3.07 116.57 123.48 1vpn h LYS 274 Ca 0.08 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.70 1vpn h LYS 274 Cb 1.02 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.33 1vpn h LYS 274 CO 1.39 0.35 -0.06 0.41 -2.00 0.00 0.00 179.45 179.54 1vpn n GLY 275 N -0.63 4.63 2.33 0.07 0.00 -1.26 -4.96 105.19 105.36 1vpn n GLY 275 Ca -0.02 -1.13 -0.17 0.00 0.00 0.00 0.00 46.02 44.70 1vpn n GLY 275 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vpn n GLU 276 N -1.06 -1.47 -4.51 1.61 1.02 -1.16 -4.95 120.64 110.13 1vpn n GLU 276 Ca 0.20 0.98 -0.32 0.00 -0.02 0.00 0.00 57.16 57.99 1vpn n GLU 276 Cb 0.78 -5.35 -0.16 0.00 -0.02 0.00 0.00 31.44 26.68 1vpn n GLU 276 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1vpn s GLY 277 N -2.38 1.35 -0.18 0.62 0.00 -1.26 -2.19 107.32 103.27 1vpn s GLY 277 Ca 0.00 -1.11 -0.15 0.00 0.00 0.00 0.00 44.72 43.46 1vpn s GLY 277 CO 0.00 0.07 0.34 -2.27 0.00 0.00 0.00 173.10 171.25 1vpn s LEU 278 N 0.96 4.19 -0.21 0.66 2.96 0.58 -4.58 118.68 123.25 1vpn s LEU 278 Ca -0.04 0.50 -0.08 0.00 -0.22 0.00 0.00 54.13 54.29 1vpn s LEU 278 Cb -0.15 -2.44 -0.04 0.00 0.50 0.00 0.00 46.19 44.06 1vpn s LEU 278 CO -0.05 0.01 0.09 -0.31 -1.32 0.00 0.00 176.35 174.77 1vpn s TYR 279 N 0.91 3.26 -0.11 5.38 1.51 0.16 -0.25 117.35 128.21 1vpn s TYR 279 Ca 0.18 0.07 0.02 0.00 -1.01 0.00 0.00 57.07 56.33 1vpn s TYR 279 Cb -0.14 -2.15 -0.01 0.00 -0.11 0.00 0.00 41.96 39.55 1vpn s TYR 279 CO 0.06 0.08 -0.19 -0.51 -1.11 0.00 0.00 175.55 173.89 1vpn s LEU 280 N 0.68 2.40 0.03 -1.29 1.43 -0.24 -1.51 118.68 120.18 1vpn s LEU 280 Ca 0.05 -0.44 0.03 0.00 -1.03 0.00 0.00 54.13 52.74 1vpn s LEU 280 Cb -0.13 -1.51 -0.02 0.00 0.03 0.00 0.00 46.19 44.57 1vpn s LEU 280 CO 0.02 0.17 -0.09 -0.44 0.23 0.00 0.00 176.35 176.24 1vpn s SER 281 N 0.29 1.02 -0.10 2.29 0.01 -0.75 -1.18 113.70 115.28 1vpn s SER 281 Ca -0.14 -0.39 -0.32 0.00 1.31 0.00 0.00 55.95 56.41 1vpn s SER 281 Cb -0.17 -0.03 0.12 0.00 0.21 0.00 0.00 66.02 66.15 1vpn s SER 281 CO 0.07 -0.06 1.15 0.00 0.41 0.00 0.00 173.24 174.81 1vpn s VAL 283 N -2.61 -0.06 -0.41 0.00 0.11 -0.64 -0.57 120.40 116.22 1vpn s VAL 283 Ca 0.10 0.07 0.02 0.00 -2.93 0.00 0.00 61.98 59.24 1vpn s VAL 283 Cb 0.00 -0.72 0.15 0.00 -1.53 0.00 0.00 36.38 34.28 1vpn s VAL 283 CO -0.05 0.03 0.27 -1.81 -3.33 0.00 0.00 175.10 170.22 1vpn s ASP 284 N 1.54 2.68 -0.15 3.54 1.01 -1.25 -1.41 116.67 122.63 1vpn s ASP 284 Ca -0.09 -2.65 -0.19 0.00 0.71 0.00 0.00 52.55 50.32 1vpn s ASP 284 Cb -0.08 -0.59 -0.03 0.00 1.01 0.00 0.00 42.92 43.22 1vpn s ASP 284 CO -0.15 -0.24 0.55 -0.63 0.21 0.00 0.00 175.17 174.91 1vpn s ILE 285 N 0.46 5.11 -0.60 0.77 1.01 0.14 -2.03 121.20 126.07 1vpn s ILE 285 Ca 0.23 1.06 0.22 0.00 0.00 0.00 0.00 60.65 62.16 1vpn s ILE 285 Cb -0.13 -3.88 -0.18 0.00 0.01 0.00 0.00 42.46 38.28 1vpn s ILE 285 CO -0.07 0.23 0.90 0.23 0.00 0.00 0.00 174.94 176.22 1vpn n MET 286 N 4.32 0.29 0.00 2.79 2.81 0.12 -2.04 117.12 125.41 1vpn n MET 286 Ca -0.04 -0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.81 1vpn n MET 286 Cb 0.51 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 31.46 1vpn n MET 286 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1vpn n GLY 287 N 1.38 0.62 3.23 3.03 0.00 -1.12 -4.54 105.19 107.79 1vpn n GLY 287 Ca 0.01 -1.73 -0.15 0.00 0.00 0.00 0.00 46.02 44.15 1vpn n GLY 287 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1vpn s TRP 288 N -2.92 1.26 0.07 1.61 0.51 0.28 -0.90 118.94 118.85 1vpn s TRP 288 Ca 0.00 -0.66 0.06 0.00 -2.12 0.00 0.00 56.10 53.37 1vpn s TRP 288 Cb 0.00 -0.65 -0.04 0.00 -0.81 0.00 0.00 33.47 31.97 1vpn s TRP 288 CO 0.00 0.09 -0.08 -0.98 -0.51 0.00 0.00 176.95 175.46 1vpn s ARG 289 N -3.16 2.29 -0.02 4.98 1.70 -0.64 -1.88 118.95 122.22 1vpn s ARG 289 Ca 0.11 -0.92 0.03 0.00 -0.47 0.00 0.00 55.73 54.48 1vpn s ARG 289 Cb -0.01 -2.38 -0.00 0.00 -0.57 0.00 0.00 34.95 31.99 1vpn s ARG 289 CO 0.01 0.54 -0.11 0.54 -1.08 0.00 0.00 175.30 175.20 1vpn s VAL 290 N -1.16 0.95 1.06 4.99 0.11 -1.26 -1.83 120.40 123.27 1vpn s VAL 290 Ca 0.21 -0.47 -0.15 0.00 -2.93 0.00 0.00 61.98 58.63 1vpn s VAL 290 Cb -0.11 -0.83 0.22 0.00 -1.53 0.00 0.00 36.38 34.13 1vpn s VAL 290 CO 0.12 0.28 1.12 0.42 -3.33 0.00 0.00 175.10 173.71 1vpn s THR 291 N 0.03 1.86 -2.30 5.04 -4.23 -0.64 -0.20 115.64 115.21 1vpn s THR 291 Ca -0.01 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 60.79 1vpn s THR 291 Cb -0.08 -2.55 0.67 0.00 1.34 0.00 0.00 72.50 71.88 1vpn s THR 291 CO 0.00 0.00 1.90 0.54 -0.54 0.00 0.00 174.62 176.53 1vpn n ARG 292 N -4.32 1.41 -3.97 3.99 1.74 -1.26 -3.96 116.66 110.29 1vpn n ARG 292 Ca 0.08 -0.60 -0.34 0.00 -0.77 0.00 0.00 57.85 56.23 1vpn n ARG 292 Cb 0.58 -1.48 -0.14 0.00 -1.02 0.00 0.00 32.46 30.41 1vpn n ARG 292 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1vpn s ASN 293 N -1.96 4.73 -1.67 0.55 0.01 -1.26 -4.74 114.94 110.59 1vpn s ASN 293 Ca 0.41 -1.41 0.00 0.00 -0.71 0.00 0.00 52.86 51.15 1vpn s ASN 293 Cb 0.21 -1.65 0.00 0.00 0.41 0.00 0.00 41.25 40.22 1vpn s ASN 293 CO 0.34 -0.25 0.00 -1.22 -1.51 0.00 0.00 177.10 174.46 1vpn n TYR 294 N 4.52 -0.99 -3.90 2.20 4.01 -1.26 -2.91 117.16 118.83 1vpn n TYR 294 Ca -0.12 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.31 1vpn n TYR 294 Cb 0.43 -3.68 -0.00 0.00 -0.31 0.00 0.00 39.34 35.78 1vpn n TYR 294 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1vpn n ASP 295 N -1.89 -3.96 -4.69 7.72 9.92 -1.26 -4.88 116.55 117.52 1vpn n ASP 295 Ca -0.22 -0.77 -0.42 0.00 -0.53 0.00 0.00 54.79 52.84 1vpn n ASP 295 Cb 0.67 -3.21 -0.03 0.00 -0.64 0.00 0.00 41.12 37.91 1vpn n ASP 295 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1vpn s VAL 296 N -3.19 3.18 0.07 2.53 1.01 -1.15 -4.75 120.40 118.09 1vpn s VAL 296 Ca 0.64 0.66 -0.08 0.00 0.00 0.00 0.00 61.98 63.19 1vpn s VAL 296 Cb -0.34 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 1vpn s VAL 296 CO 0.78 0.01 0.36 -1.00 0.00 0.00 0.00 175.10 175.25 1vpn s HIS 297 N 2.35 3.57 -0.08 5.22 3.76 -1.26 -1.61 115.29 127.23 1vpn s HIS 297 Ca 0.71 0.71 -0.01 0.00 -0.15 0.00 0.00 55.06 56.31 1vpn s HIS 297 Cb -0.38 -2.10 0.03 0.00 1.11 0.00 0.00 32.58 31.24 1vpn s HIS 297 CO 0.31 0.54 -0.02 -1.01 -0.85 0.00 0.00 174.74 173.70 1vpn s HIS 298 N -1.40 0.91 0.51 1.40 3.76 -0.76 -1.68 115.29 118.03 1vpn s HIS 298 Ca 0.32 -0.33 -0.23 0.00 -0.15 0.00 0.00 55.06 54.67 1vpn s HIS 298 Cb -0.14 -0.92 -0.06 0.00 1.11 0.00 0.00 32.58 32.57 1vpn s HIS 298 CO 0.18 -0.37 1.34 -1.58 -0.85 0.00 0.00 174.74 173.46 1vpn s TRP 299 N 1.84 2.43 -0.09 1.40 0.52 -1.26 -1.61 118.94 122.17 1vpn s TRP 299 Ca 0.04 1.38 0.04 0.00 0.02 0.00 0.00 56.10 57.58 1vpn s TRP 299 Cb -0.12 -3.76 -0.00 0.00 -1.15 0.00 0.00 33.47 28.44 1vpn s TRP 299 CO -0.06 -2.67 -0.22 0.50 0.02 0.00 0.00 176.95 174.52 1vpn s ARG 300 N -2.75 2.73 0.14 4.98 6.06 -0.07 -1.74 118.95 128.30 1vpn s ARG 300 Ca 0.68 -0.82 0.07 0.00 -2.50 0.00 0.00 55.73 53.16 1vpn s ARG 300 Cb -0.39 -2.13 -0.04 0.00 0.06 0.00 0.00 34.95 32.45 1vpn s ARG 300 CO 0.48 0.20 -0.15 0.20 -2.50 0.00 0.00 175.30 173.53 1vpn s GLY 301 N 0.27 1.21 0.11 8.12 0.00 -0.91 -0.70 107.32 115.42 1vpn s GLY 301 Ca -0.15 -1.40 0.08 0.00 0.00 0.00 0.00 44.72 43.25 1vpn s GLY 301 CO 0.07 -1.46 -0.19 1.08 0.00 0.00 0.00 173.10 172.60 1vpn s LEU 302 N -2.63 2.33 0.55 0.66 1.43 -0.86 -4.84 118.68 115.32 1vpn s LEU 302 Ca 0.13 -0.72 -0.19 0.00 -1.03 0.00 0.00 54.13 52.32 1vpn s LEU 302 Cb -0.04 -0.82 -0.05 0.00 0.03 0.00 0.00 46.19 45.30 1vpn s LEU 302 CO 0.04 0.02 1.12 -2.16 0.23 0.00 0.00 176.35 175.60 1vpn s PRO 303 N -2.09 3.32 -0.10 1.29 0.04 -1.26 -4.35 135.00 131.85 1vpn s PRO 303 Ca 0.07 1.55 0.04 0.00 0.04 0.00 0.00 61.00 62.70 1vpn s PRO 303 Cb -0.09 -2.01 -0.00 0.00 0.04 0.00 0.00 34.50 32.44 1vpn s PRO 303 CO 0.04 -0.87 -0.23 0.50 0.04 0.00 0.00 177.00 176.49 1vpn s ARG 304 N -3.40 3.06 0.04 4.56 3.52 -0.60 -1.54 118.95 124.59 1vpn s ARG 304 Ca 0.71 -0.86 -0.08 0.00 -0.13 0.00 0.00 55.73 55.38 1vpn s ARG 304 Cb -0.23 -2.33 -0.05 0.00 -1.56 0.00 0.00 34.95 30.78 1vpn s ARG 304 CO 0.28 0.20 0.32 -0.47 -0.81 0.00 0.00 175.30 174.82 1vpn s TYR 305 N 0.31 3.58 -0.04 5.12 5.04 0.77 -0.86 117.35 131.28 1vpn s TYR 305 Ca -0.17 0.66 0.02 0.00 -2.44 0.00 0.00 57.07 55.13 1vpn s TYR 305 Cb -0.18 -2.06 0.01 0.00 0.35 0.00 0.00 41.96 40.09 1vpn s TYR 305 CO 0.08 0.58 -0.07 -0.06 -1.34 0.00 0.00 175.55 174.74 1vpn s PHE 306 N -1.33 0.89 -0.31 4.97 0.40 0.87 -1.70 117.98 121.77 1vpn s PHE 306 Ca 0.30 -0.25 -0.02 0.00 -0.60 0.00 0.00 56.93 56.35 1vpn s PHE 306 Cb -0.14 -0.70 0.10 0.00 0.51 0.00 0.00 43.02 42.80 1vpn s PHE 306 CO 0.17 -0.16 0.12 0.21 0.70 0.00 0.00 175.22 176.26 1vpn s LYS 307 N 0.57 0.53 -0.11 0.44 2.20 0.18 -1.41 119.74 122.14 1vpn s LYS 307 Ca -0.09 -0.90 -0.11 0.00 -0.36 0.00 0.00 55.97 54.51 1vpn s LYS 307 Cb -0.12 -1.67 -0.05 0.00 -1.51 0.00 0.00 37.83 34.48 1vpn s LYS 307 CO 0.01 -1.01 0.25 0.42 -0.36 0.00 0.00 175.35 174.66 1vpn s ILE 308 N 1.75 5.31 -0.22 5.43 1.09 0.37 -0.62 121.20 134.30 1vpn s ILE 308 Ca 0.10 0.47 -0.08 0.00 -1.10 0.00 0.00 60.65 60.04 1vpn s ILE 308 Cb -0.17 -3.56 -0.04 0.00 -1.06 0.00 0.00 42.46 37.63 1vpn s ILE 308 CO -0.28 0.52 0.08 -0.89 -0.10 0.00 0.00 174.94 174.28 1vpn s THR 309 N -0.47 4.71 0.13 2.92 2.01 -0.24 -0.83 115.64 123.87 1vpn s THR 309 Ca 0.17 -0.05 0.08 0.00 0.31 0.00 0.00 61.69 62.20 1vpn s THR 309 Cb -0.13 -3.17 -0.04 0.00 0.01 0.00 0.00 72.50 69.17 1vpn s THR 309 CO 0.06 0.39 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.42 1vpn s LEU 310 N 1.00 2.35 0.06 4.42 1.02 -0.29 -0.41 118.68 126.83 1vpn s LEU 310 Ca 0.05 -0.75 0.01 0.00 0.02 0.00 0.00 54.13 53.45 1vpn s LEU 310 Cb -0.14 -0.83 -0.03 0.00 0.02 0.00 0.00 46.19 45.20 1vpn s LEU 310 CO 0.03 0.01 -0.06 0.00 0.02 0.00 0.00 176.35 176.35 1vpn s ARG 311 N -2.27 0.65 0.22 1.70 1.70 -0.33 -1.06 118.95 119.56 1vpn s ARG 311 Ca 0.10 -1.07 -0.27 0.00 -0.47 0.00 0.00 55.73 54.02 1vpn s ARG 311 Cb -0.08 -0.12 -0.09 0.00 -0.57 0.00 0.00 34.95 34.09 1vpn s ARG 311 CO 0.05 -0.02 0.86 0.15 -1.08 0.00 0.00 175.30 175.26 1vpn s LYS 312 N -2.93 4.68 -0.04 3.89 1.02 -0.36 -0.51 119.74 125.48 1vpn s LYS 312 Ca 0.02 1.30 0.04 0.00 0.02 0.00 0.00 55.97 57.34 1vpn s LYS 312 Cb -0.00 -3.20 -0.00 0.00 -0.52 0.00 0.00 37.83 34.10 1vpn s LYS 312 CO -0.04 0.51 -0.16 0.50 -0.92 0.00 0.00 175.35 175.25 1vpn s ARG 313 N -1.30 1.69 -0.01 1.68 6.06 0.51 -1.26 118.95 126.32 1vpn s ARG 313 Ca 0.40 -0.55 -0.30 0.00 -2.50 0.00 0.00 55.73 52.78 1vpn s ARG 313 Cb -0.24 -1.46 -0.03 0.00 0.06 0.00 0.00 34.95 33.28 1vpn s ARG 313 CO 0.28 0.20 1.05 -1.58 -2.50 0.00 0.00 175.30 172.75 1vpn s TRP 314 N 0.13 3.55 0.12 5.12 0.52 0.10 -0.99 118.94 127.49 1vpn s TRP 314 Ca -0.05 1.56 0.05 0.00 0.02 0.00 0.00 56.10 57.69 1vpn s TRP 314 Cb -0.12 -3.22 -0.04 0.00 -1.15 0.00 0.00 33.47 28.95 1vpn s TRP 314 CO 0.02 -0.40 -0.13 0.14 0.02 0.00 0.00 176.95 176.60 1vpn s VAL 315 N 1.28 1.25 -2.00 4.03 -7.23 0.67 0.10 120.40 118.50 1vpn s VAL 315 Ca 0.53 -1.71 0.12 0.00 -1.81 0.00 0.00 61.98 59.11 1vpn s VAL 315 Cb -0.23 -1.51 0.33 0.00 0.56 0.00 0.00 36.38 35.54 1vpn s VAL 315 CO 0.26 -0.45 1.14 1.17 -0.31 0.00 0.00 175.10 176.90