#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mvs n GLY 2 N 0.00 1.14 3.76 7.63 0.00 0.30 -5.03 105.19 112.99 1mvs n GLY 2 Ca 0.00 -1.40 -0.38 0.00 0.00 0.00 0.00 46.02 44.23 1mvs n GLY 2 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mvs s SER 3 N -1.00 5.77 -0.25 1.61 0.01 -1.26 -4.75 113.70 113.84 1mvs s SER 3 Ca 0.00 2.59 -0.09 0.00 1.31 0.00 0.00 55.95 59.76 1mvs s SER 3 Cb 0.00 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 1mvs s SER 3 CO 0.00 -1.21 0.11 -0.22 0.41 0.00 0.00 173.24 172.33 1mvs s LEU 4 N -3.15 3.70 0.06 2.44 2.96 -1.26 -0.50 118.68 122.94 1mvs s LEU 4 Ca 0.66 -0.09 0.04 0.00 -0.22 0.00 0.00 54.13 54.53 1mvs s LEU 4 Cb -0.36 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.31 1mvs s LEU 4 CO 0.43 0.00 -0.12 0.20 -1.32 0.00 0.00 176.35 175.54 1mvs s ASN 5 N 1.41 1.44 -0.00 3.68 0.01 0.19 -3.00 114.94 118.67 1mvs s ASN 5 Ca 0.06 -0.59 0.05 0.00 -0.71 0.00 0.00 52.86 51.66 1mvs s ASN 5 Cb -0.15 -0.03 -0.03 0.00 0.41 0.00 0.00 41.25 41.46 1mvs s ASN 5 CO 0.05 -0.11 -0.14 0.00 -1.51 0.00 0.00 177.10 175.39 1mvs s ILE 7 N -0.86 0.94 -0.04 0.00 2.07 -1.01 -0.68 121.20 121.62 1mvs s ILE 7 Ca 0.14 -0.32 -0.15 0.00 -1.41 0.00 0.00 60.65 58.91 1mvs s ILE 7 Cb -0.11 -0.91 0.03 0.00 0.13 0.00 0.00 42.46 41.60 1mvs s ILE 7 CO 0.04 0.33 0.33 0.54 -1.91 0.00 0.00 174.94 174.27 1mvs s VAL 8 N 1.08 0.04 -0.23 4.00 0.11 -1.00 -4.46 120.40 119.94 1mvs s VAL 8 Ca -0.07 -0.35 0.00 0.00 -2.93 0.00 0.00 61.98 58.63 1mvs s VAL 8 Cb -0.14 -0.60 0.03 0.00 -1.53 0.00 0.00 36.38 34.13 1mvs s VAL 8 CO -0.01 -0.19 -0.12 0.00 -3.33 0.00 0.00 175.10 171.45 1mvs s ALA 9 N -0.99 2.56 0.05 1.54 0.00 -1.26 -0.84 121.76 122.82 1mvs s ALA 9 Ca -0.10 -1.44 0.09 0.00 0.00 0.00 0.00 51.96 50.50 1mvs s ALA 9 Cb -0.04 -1.51 -0.03 0.00 0.00 0.00 0.00 23.12 21.54 1mvs s ALA 9 CO 0.04 -0.74 -0.25 0.14 0.00 0.00 0.00 175.76 174.95 1mvs s VAL 10 N 1.27 2.05 0.90 0.00 -7.23 -0.85 -4.74 120.40 111.81 1mvs s VAL 10 Ca -0.00 -1.36 -0.11 0.00 -1.81 0.00 0.00 61.98 58.70 1mvs s VAL 10 Cb -0.16 -1.76 0.20 0.00 0.56 0.00 0.00 36.38 35.22 1mvs s VAL 10 CO -0.07 0.33 1.23 -1.54 -0.31 0.00 0.00 175.10 174.74 1mvs n SER 11 N 1.77 0.55 0.23 4.85 3.41 -0.84 -0.43 113.62 123.15 1mvs n SER 11 Ca -0.17 -1.73 0.07 0.00 -0.26 0.00 0.00 58.87 56.78 1mvs n SER 11 Cb 0.52 -0.90 0.54 0.00 -0.26 0.00 0.00 64.21 64.11 1mvs n SER 11 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1mvs h GLN 12 N 0.00 0.00 -0.46 4.33 4.15 -0.60 -2.05 115.11 120.48 1mvs h GLN 12 Ca -0.40 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.02 1mvs h GLN 12 Cb 1.22 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.91 1mvs h GLN 12 CO 0.33 0.18 0.00 0.27 -1.93 0.00 0.00 178.83 177.68 1mvs n ASN 13 N -4.17 2.30 -0.07 -0.69 6.94 -1.26 -4.90 115.26 113.41 1mvs n ASN 13 Ca -0.02 -2.09 -0.01 0.00 -0.02 0.00 0.00 54.58 52.44 1mvs n ASN 13 Cb 0.25 -0.32 -0.00 0.00 -2.36 0.00 0.00 39.78 37.35 1mvs n ASN 13 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 1mvs n MET 14 N 0.56 -0.59 -2.12 -3.83 2.81 -0.77 -4.98 117.12 108.20 1mvs n MET 14 Ca 0.13 0.24 -0.41 0.00 -1.81 0.00 0.00 57.70 55.85 1mvs n MET 14 Cb 0.40 -3.74 -0.03 0.00 -0.71 0.00 0.00 33.22 29.14 1mvs n MET 14 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1mvs s GLY 15 N -2.14 2.31 -0.00 3.03 0.00 -1.26 -1.07 107.32 108.20 1mvs s GLY 15 Ca 0.00 1.21 0.01 0.00 0.00 0.00 0.00 44.72 45.94 1mvs s GLY 15 CO 0.00 2.21 0.05 0.29 0.00 0.00 0.00 173.10 175.64 1mvs n ILE 16 N 2.70 0.00 -3.51 0.90 -5.35 0.79 -2.00 119.36 112.89 1mvs n ILE 16 Ca 0.07 -0.37 -0.09 0.00 -0.27 0.00 0.00 62.75 62.10 1mvs n ILE 16 Cb 0.41 0.88 -0.02 0.00 -1.74 0.00 0.00 39.64 39.18 1mvs n ILE 16 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1mvs s GLY 17 N -1.35 -0.47 -0.16 3.28 0.00 -1.12 -4.53 107.32 102.98 1mvs s GLY 17 Ca 0.00 0.84 -0.04 0.00 0.00 0.00 0.00 44.72 45.52 1mvs s GLY 17 CO 0.05 0.28 0.15 1.25 0.00 0.00 0.00 173.10 174.82 1mvs s LYS 18 N -3.25 0.10 -1.40 2.90 2.20 0.13 -0.36 119.74 120.06 1mvs s LYS 18 Ca 0.05 0.15 -0.01 0.00 -0.36 0.00 0.00 55.97 55.80 1mvs s LYS 18 Cb -0.01 -1.28 0.01 0.00 -1.51 0.00 0.00 37.83 35.04 1mvs s LYS 18 CO -0.09 -0.59 0.49 0.09 -0.36 0.00 0.00 175.35 174.90 1mvs n ASN 19 N 5.30 -0.62 -0.32 1.43 3.02 -1.26 -0.83 115.26 121.98 1mvs n ASN 19 Ca -0.06 -0.97 -0.04 0.00 -0.03 0.00 0.00 54.58 53.48 1mvs n ASN 19 Cb 0.49 -3.25 -0.02 0.00 -0.61 0.00 0.00 39.78 36.40 1mvs n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mvs n GLY 20 N -1.89 0.61 3.52 7.41 0.00 -1.26 -4.99 105.19 108.60 1mvs n GLY 20 Ca -0.29 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.29 1mvs n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mvs s ASP 21 N -2.33 2.78 0.21 1.61 2.15 -0.01 -4.60 116.67 116.48 1mvs s ASP 21 Ca 0.00 -1.53 -0.30 0.00 0.43 0.00 0.00 52.55 51.16 1mvs s ASP 21 Cb 0.00 0.20 -0.08 0.00 -0.30 0.00 0.00 42.92 42.74 1mvs s ASP 21 CO 0.00 -0.76 1.22 -0.76 -0.17 0.00 0.00 175.17 174.70 1mvs s LEU 22 N -3.58 4.45 0.59 -1.34 1.43 -1.26 -0.70 118.68 118.27 1mvs s LEU 22 Ca 0.28 2.30 0.30 0.00 -1.03 0.00 0.00 54.13 55.98 1mvs s LEU 22 Cb 0.06 -3.61 1.84 0.00 0.03 0.00 0.00 46.19 44.51 1mvs s LEU 22 CO 0.14 -0.39 2.25 -0.65 0.23 0.00 0.00 176.35 177.93 1mvs h PRO 23 N 5.02 0.00 -5.98 1.29 0.11 -1.84 -3.43 132.00 127.17 1mvs h PRO 23 Ca -0.45 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.08 1mvs h PRO 23 Cb 1.21 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.22 1mvs h PRO 23 CO 0.74 0.00 -0.58 1.67 -0.21 0.00 0.00 178.00 179.62 1mvs s TRP 24 N -4.61 2.58 0.79 0.65 -2.14 -1.26 -4.68 118.94 110.26 1mvs s TRP 24 Ca -0.05 -0.48 -0.11 0.00 2.66 0.00 0.00 56.10 58.13 1mvs s TRP 24 Cb 0.15 -1.63 0.07 0.00 -3.10 0.00 0.00 33.47 28.96 1mvs s TRP 24 CO 0.54 0.39 1.10 -1.25 -2.66 0.00 0.00 176.95 175.08 1mvs s PRO 25 N -3.77 2.09 0.32 3.25 0.04 -1.26 -4.92 135.00 130.75 1mvs s PRO 25 Ca 0.37 1.24 -0.29 0.00 0.04 0.00 0.00 61.00 62.35 1mvs s PRO 25 Cb 0.01 -1.87 -0.11 0.00 0.04 0.00 0.00 34.50 32.57 1mvs s PRO 25 CO 0.20 -1.78 1.45 -2.14 0.04 0.00 0.00 177.00 174.78 1mvs s PRO 26 N -4.83 4.21 -0.40 0.56 0.02 -1.26 -4.99 135.00 128.31 1mvs s PRO 26 Ca 0.62 2.42 0.03 0.00 0.02 0.00 0.00 61.00 64.09 1mvs s PRO 26 Cb -0.18 -3.04 0.11 0.00 0.02 0.00 0.00 34.50 31.41 1mvs s PRO 26 CO 0.56 -0.44 0.13 -0.51 -0.33 0.00 0.00 177.00 176.41 1mvs s LEU 27 N -1.34 4.77 0.31 -5.54 1.43 -1.26 -4.98 118.68 112.06 1mvs s LEU 27 Ca 0.55 -2.34 0.08 0.00 -1.03 0.00 0.00 54.13 51.40 1mvs s LEU 27 Cb -0.44 -1.67 0.89 0.00 0.03 0.00 0.00 46.19 45.00 1mvs s LEU 27 CO 0.53 -0.37 1.66 0.03 0.23 0.00 0.00 176.35 178.43 1mvs h ARG 28 N 7.43 0.29 0.00 1.70 -0.00 -1.99 -0.95 114.38 120.86 1mvs h ARG 28 Ca -0.06 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.40 1mvs h ARG 28 Cb 1.00 -0.07 0.00 0.00 0.00 0.00 0.00 29.97 30.90 1mvs h ARG 28 CO 0.59 0.19 -0.12 -0.91 0.00 0.00 0.00 179.97 179.71 1mvs h ASN 29 N 0.30 0.00 -0.21 7.04 2.35 -1.99 -2.30 115.58 120.77 1mvs h ASN 29 Ca 0.64 -0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 56.23 1mvs h ASN 29 Cb 1.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.73 1mvs h ASN 29 CO -0.61 0.00 -0.47 -0.08 -1.65 0.00 0.00 177.43 174.61 1mvs h GLU 30 N 0.00 0.69 -0.33 0.81 4.22 -1.62 -2.66 114.58 115.68 1mvs h GLU 30 Ca 0.00 -0.46 -0.04 0.00 0.08 0.00 0.00 59.36 58.94 1mvs h GLU 30 Cb 0.98 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.28 1mvs h GLU 30 CO 0.00 1.08 0.05 0.74 -2.18 0.00 0.00 179.01 178.70 1mvs h PHE 31 N 0.39 0.49 -0.33 0.92 0.04 -1.42 0.11 116.94 117.14 1mvs h PHE 31 Ca -0.00 -0.03 -0.16 0.00 2.80 0.00 0.00 57.97 60.58 1mvs h PHE 31 Cb 1.08 -0.15 -0.00 0.00 2.20 0.00 0.00 35.95 39.08 1mvs h PHE 31 CO 0.09 0.46 -0.41 -0.09 -0.60 0.00 0.00 178.31 177.76 1mvs h ARG 32 N 0.48 0.85 0.15 1.51 2.43 -1.38 -1.76 114.38 116.66 1mvs h ARG 32 Ca 0.11 -0.48 -0.01 0.00 -0.81 0.00 0.00 59.98 58.79 1mvs h ARG 32 Cb 0.23 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1mvs h ARG 32 CO 0.00 1.12 -0.07 -0.92 -1.51 0.00 0.00 179.97 178.59 1mvs h TYR 33 N 0.64 -0.18 -0.22 2.20 5.03 -1.09 -0.93 116.97 122.41 1mvs h TYR 33 Ca 0.04 -0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.41 1mvs h TYR 33 Cb 1.00 0.06 -0.07 0.00 1.55 0.00 0.00 36.73 39.27 1mvs h TYR 33 CO 0.07 -0.01 -0.25 0.35 -1.32 0.00 0.00 178.16 177.01 1mvs h PHE 34 N -0.32 -0.66 -0.52 -3.82 3.57 -0.77 0.83 116.94 115.24 1mvs h PHE 34 Ca -0.02 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 1mvs h PHE 34 Cb 0.26 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 1mvs h PHE 34 CO -0.03 -0.32 0.13 1.96 -2.23 0.00 0.00 178.31 177.82 1mvs h GLN 35 N -0.26 0.79 -0.08 1.11 1.08 -1.23 -2.58 115.11 113.94 1mvs h GLN 35 Ca 0.13 -0.15 -0.03 0.00 -1.45 0.00 0.00 58.65 57.14 1mvs h GLN 35 Cb 0.46 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1mvs h GLN 35 CO -0.38 0.71 -0.08 -0.09 -0.95 0.00 0.00 178.83 178.04 1mvs h ARG 36 N 0.77 0.20 0.00 1.46 2.43 -0.69 -0.91 114.38 117.63 1mvs h ARG 36 Ca 0.17 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1mvs h ARG 36 Cb 0.27 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1mvs h ARG 36 CO -0.00 0.63 -0.00 0.52 -1.51 0.00 0.00 179.97 179.61 1mvs h MET 37 N -0.23 -0.00 -0.02 0.20 2.86 -0.84 -1.70 114.93 115.20 1mvs h MET 37 Ca 0.01 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.51 1mvs h MET 37 Cb 0.60 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.24 1mvs h MET 37 CO 0.02 0.04 -0.65 1.79 1.06 0.00 0.00 176.91 179.17 1mvs h THR 38 N -0.04 1.44 0.00 2.22 1.35 -1.55 -3.32 112.91 113.02 1mvs h THR 38 Ca -0.00 -2.17 -0.25 0.00 -0.55 0.00 0.00 66.41 63.44 1mvs h THR 38 Cb 0.04 2.15 -0.04 0.00 -1.73 0.00 0.00 68.15 68.57 1mvs h THR 38 CO 0.00 0.63 -1.41 0.74 -0.25 0.00 0.00 175.52 175.22 1mvs h THR 39 N 0.06 1.13 -2.85 6.82 2.02 -1.06 -3.43 112.91 115.61 1mvs h THR 39 Ca -0.01 -2.90 -0.56 0.00 0.77 0.00 0.00 66.41 63.71 1mvs h THR 39 Cb 1.16 2.55 -0.03 0.00 -1.74 0.00 0.00 68.15 70.08 1mvs h THR 39 CO 0.09 0.64 1.04 -0.89 0.37 0.00 0.00 175.52 176.77 1mvs s THR 40 N -2.66 3.90 -0.18 3.16 2.01 -0.65 -4.69 115.64 116.52 1mvs s THR 40 Ca -0.02 1.05 -0.09 0.00 0.31 0.00 0.00 61.69 62.94 1mvs s THR 40 Cb 0.09 -3.83 -0.05 0.00 0.01 0.00 0.00 72.50 68.72 1mvs s THR 40 CO 0.82 -0.26 0.12 -0.55 -0.69 0.00 0.00 174.62 174.06 1mvs s SER 41 N 3.28 6.10 -0.25 3.53 0.15 -1.26 -4.95 113.70 120.30 1mvs s SER 41 Ca 0.65 0.24 -0.02 0.00 0.70 0.00 0.00 55.95 57.52 1mvs s SER 41 Cb -0.24 -2.05 0.11 0.00 -1.71 0.00 0.00 66.02 62.13 1mvs s SER 41 CO 0.25 0.22 2.26 -1.54 1.20 0.00 0.00 173.24 175.62 1mvs n SER 42 N 3.26 6.14 -3.65 5.45 3.41 -1.26 -4.74 113.62 122.23 1mvs n SER 42 Ca -0.17 -2.90 -0.01 0.00 -0.26 0.00 0.00 58.87 55.53 1mvs n SER 42 Cb 0.53 -1.13 -0.06 0.00 -0.26 0.00 0.00 64.21 63.28 1mvs n SER 42 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1mvs s VAL 43 N -1.55 0.00 0.18 -3.33 0.11 -1.26 -5.15 120.40 109.40 1mvs s VAL 43 Ca 0.32 0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 59.06 1mvs s VAL 43 Cb 0.22 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.98 1mvs s VAL 43 CO -0.04 0.00 1.38 -1.61 -3.33 0.00 0.00 175.10 171.50 1mvs s GLU 44 N 1.21 4.33 0.00 1.54 2.02 -1.26 -3.06 118.70 123.47 1mvs s GLU 44 Ca -0.08 2.13 0.00 0.00 0.02 0.00 0.00 54.97 57.04 1mvs s GLU 44 Cb -0.03 -3.19 0.00 0.00 0.10 0.00 0.00 34.13 31.01 1mvs s GLU 44 CO -0.13 -0.37 0.00 0.41 0.02 0.00 0.00 175.26 175.19 1mvs n GLY 45 N 2.79 0.80 3.79 -1.39 0.00 -1.26 -5.05 105.19 104.88 1mvs n GLY 45 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 1mvs n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mvs s LYS 46 N -0.06 2.45 0.13 1.61 -0.14 -1.17 -4.90 119.74 117.65 1mvs s LYS 46 Ca 0.00 -1.56 0.01 0.00 -1.36 0.00 0.00 55.97 53.06 1mvs s LYS 46 Cb 0.00 -2.24 -0.04 0.00 -1.68 0.00 0.00 37.83 33.86 1mvs s LYS 46 CO 0.00 -0.01 -0.00 -0.65 -0.76 0.00 0.00 175.35 173.92 1mvs s GLN 47 N -3.96 0.92 0.36 1.68 -0.21 0.36 -4.85 119.66 113.97 1mvs s GLN 47 Ca 0.42 -1.42 -0.13 0.00 0.02 0.00 0.00 55.36 54.25 1mvs s GLN 47 Cb -0.02 -0.04 -0.08 0.00 1.00 0.00 0.00 33.01 33.87 1mvs s GLN 47 CO 0.25 -0.14 0.76 -0.80 -2.12 0.00 0.00 175.29 173.24 1mvs s ASN 48 N -3.07 6.66 -0.20 5.90 0.01 -1.26 -0.90 114.94 122.07 1mvs s ASN 48 Ca 0.19 1.22 -0.08 0.00 -0.71 0.00 0.00 52.86 53.48 1mvs s ASN 48 Cb 0.07 -2.35 -0.04 0.00 0.41 0.00 0.00 41.25 39.33 1mvs s ASN 48 CO -0.01 -0.30 0.09 -0.22 -1.51 0.00 0.00 177.10 175.15 1mvs s LEU 49 N -3.39 3.91 -0.22 0.60 2.96 -0.71 -0.88 118.68 120.94 1mvs s LEU 49 Ca 0.53 0.09 -0.07 0.00 -0.22 0.00 0.00 54.13 54.46 1mvs s LEU 49 Cb -0.10 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 1mvs s LEU 49 CO 0.24 0.14 0.05 0.68 -1.32 0.00 0.00 176.35 176.15 1mvs s VAL 50 N 0.57 4.35 -0.23 1.68 -7.23 0.62 -1.01 120.40 119.15 1mvs s VAL 50 Ca 0.05 -0.17 -0.07 0.00 -1.81 0.00 0.00 61.98 59.98 1mvs s VAL 50 Cb -0.12 -3.00 -0.03 0.00 0.56 0.00 0.00 36.38 33.78 1mvs s VAL 50 CO 0.01 0.38 0.07 -0.63 -0.31 0.00 0.00 175.10 174.62 1mvs s ILE 51 N 1.21 4.42 0.03 -0.62 1.01 -0.16 -1.61 121.20 125.48 1mvs s ILE 51 Ca 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 60.65 60.53 1mvs s ILE 51 Cb -0.14 -3.05 -0.02 0.00 0.01 0.00 0.00 42.46 39.26 1mvs s ILE 51 CO 0.03 0.37 0.02 0.00 0.00 0.00 0.00 174.94 175.35 1mvs s MET 52 N 1.32 0.48 0.99 2.79 0.23 -0.19 -1.78 119.30 123.14 1mvs s MET 52 Ca 0.05 -0.79 -0.16 0.00 -1.03 0.00 0.00 55.69 53.76 1mvs s MET 52 Cb -0.15 0.18 0.20 0.00 -1.53 0.00 0.00 34.83 33.53 1mvs s MET 52 CO 0.04 -0.10 1.24 0.20 -2.03 0.00 0.00 175.02 174.37 1mvs s GLY 53 N -2.02 1.69 0.11 3.16 0.00 -0.78 -1.25 107.32 108.23 1mvs s GLY 53 Ca -0.07 -1.01 -0.19 0.00 0.00 0.00 0.00 44.72 43.46 1mvs s GLY 53 CO -0.04 -0.27 1.71 1.70 0.00 0.00 0.00 173.10 176.20 1mvs h LYS 54 N -1.77 0.34 -0.65 2.90 3.64 -1.90 -1.43 116.57 117.71 1mvs h LYS 54 Ca -0.45 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 58.84 1mvs h LYS 54 Cb 1.27 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 33.00 1mvs h LYS 54 CO 0.43 0.31 0.23 -0.22 -2.27 0.00 0.00 179.45 177.94 1mvs h LYS 55 N 0.28 0.99 -0.19 1.90 3.64 -1.94 -2.24 116.57 119.01 1mvs h LYS 55 Ca 0.09 -0.20 0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1mvs h LYS 55 Cb 0.07 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1mvs h LYS 55 CO -0.01 0.85 0.10 1.15 -2.27 0.00 0.00 179.45 179.26 1mvs h THR 56 N 0.93 1.00 -0.40 1.00 2.02 -1.87 0.13 112.91 115.73 1mvs h THR 56 Ca 0.21 -0.07 0.06 0.00 0.77 0.00 0.00 66.41 67.38 1mvs h THR 56 Cb 0.25 0.78 -0.05 0.00 -1.74 0.00 0.00 68.15 67.39 1mvs h THR 56 CO -0.01 0.04 0.10 -0.25 0.37 0.00 0.00 175.52 175.77 1mvs h TRP 57 N 0.21 0.18 0.00 3.16 2.91 -1.09 -0.98 115.95 120.33 1mvs h TRP 57 Ca 0.07 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.12 1mvs h TRP 57 Cb 0.01 -0.02 0.00 0.00 -0.51 0.00 0.00 29.16 28.64 1mvs h TRP 57 CO -0.09 0.05 0.00 0.74 -1.03 0.00 0.00 178.44 178.11 1mvs h PHE 58 N 0.24 0.00 0.00 2.65 -1.00 -1.07 -2.82 116.94 114.95 1mvs h PHE 58 Ca 0.19 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.97 1mvs h PHE 58 Cb 0.21 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.77 1mvs h PHE 58 CO -0.18 0.00 0.00 -1.13 -1.61 0.00 0.00 178.31 175.39 1mvs n SER 59 N -2.73 0.00 -4.78 2.17 3.41 0.44 -4.79 113.62 107.35 1mvs n SER 59 Ca 0.01 0.19 -0.38 0.00 -0.26 0.00 0.00 58.87 58.43 1mvs n SER 59 Cb 0.28 -0.39 -0.06 0.00 -0.26 0.00 0.00 64.21 63.78 1mvs n SER 59 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1mvs s ILE 60 N -2.78 5.08 0.27 -1.33 1.01 -1.07 -4.92 121.20 117.47 1mvs s ILE 60 Ca 0.20 0.91 -0.31 0.00 0.00 0.00 0.00 60.65 61.45 1mvs s ILE 60 Cb 0.18 -3.77 -0.12 0.00 0.01 0.00 0.00 42.46 38.76 1mvs s ILE 60 CO 0.46 0.46 1.61 -2.65 0.00 0.00 0.00 174.94 174.81 1mvs n PRO 61 N 2.72 2.67 -0.17 2.79 -0.02 -1.26 -4.81 135.00 136.92 1mvs n PRO 61 Ca -0.10 0.95 0.29 0.00 -2.02 0.00 0.00 63.50 62.62 1mvs n PRO 61 Cb 0.52 -2.74 0.72 0.00 -0.02 0.00 0.00 33.50 31.98 1mvs n PRO 61 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1mvs h GLU 62 N 5.12 0.00 -0.54 -0.52 4.81 -1.93 1.09 114.58 122.61 1mvs h GLU 62 Ca -0.46 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.72 1mvs h GLU 62 Cb 1.22 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.58 1mvs h GLU 62 CO 0.82 0.00 0.15 0.87 -0.73 0.00 0.00 179.01 180.12 1mvs h LYS 63 N 0.00 0.81 -0.67 1.92 1.79 -2.00 -2.43 116.57 115.99 1mvs h LYS 63 Ca 0.43 -0.15 0.00 0.00 -2.18 0.00 0.00 60.65 58.74 1mvs h LYS 63 Cb 1.84 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 32.37 1mvs h LYS 63 CO -0.00 0.72 0.00 0.09 -1.08 0.00 0.00 179.45 179.17 1mvs n ASN 64 N -4.29 3.76 -4.34 0.86 3.02 0.37 -4.89 115.26 109.75 1mvs n ASN 64 Ca 0.04 -2.47 -0.33 0.00 -0.03 0.00 0.00 54.58 51.79 1mvs n ASN 64 Cb 0.21 -0.56 -0.15 0.00 -0.61 0.00 0.00 39.78 38.68 1mvs n ASN 64 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1mvs s ARG 65 N -1.97 3.34 0.92 3.52 0.52 -0.91 -3.69 118.95 120.67 1mvs s ARG 65 Ca 0.35 -0.71 -0.13 0.00 -0.52 0.00 0.00 55.73 54.72 1mvs s ARG 65 Cb 0.25 -2.60 0.14 0.00 0.52 0.00 0.00 34.95 33.26 1mvs s ARG 65 CO 0.13 0.19 1.16 -1.25 0.02 0.00 0.00 175.30 175.54 1mvs s PRO 66 N 0.41 1.09 -0.21 3.54 0.04 -1.26 -4.94 135.00 133.68 1mvs s PRO 66 Ca -0.11 0.18 -0.29 0.00 0.04 0.00 0.00 61.00 60.82 1mvs s PRO 66 Cb -0.16 -1.84 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 1mvs s PRO 66 CO 0.05 -2.21 1.67 -0.51 0.04 0.00 0.00 177.00 176.04 1mvs s LEU 67 N -6.00 3.90 0.43 -3.56 1.43 -1.24 -4.96 118.68 108.68 1mvs s LEU 67 Ca 0.65 1.70 -0.24 0.00 -1.03 0.00 0.00 54.13 55.21 1mvs s LEU 67 Cb -0.13 -3.53 -0.08 0.00 0.03 0.00 0.00 46.19 42.48 1mvs s LEU 67 CO 0.53 -1.29 1.12 -1.59 0.23 0.00 0.00 176.35 175.35 1mvs s LYS 68 N 4.76 3.96 0.00 1.70 -2.85 -1.26 -3.05 119.74 122.99 1mvs s LYS 68 Ca 0.74 1.67 0.00 0.00 -1.00 0.00 0.00 55.97 57.38 1mvs s LYS 68 Cb -0.26 -2.49 0.00 0.00 -2.06 0.00 0.00 37.83 33.02 1mvs s LYS 68 CO 0.30 -0.36 0.00 0.41 0.10 0.00 0.00 175.35 175.81 1mvs n GLY 69 N 0.42 0.92 3.31 0.59 0.00 -1.26 -4.96 105.19 104.21 1mvs n GLY 69 Ca 0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 1mvs n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mvs s ARG 70 N -0.14 1.22 -0.26 1.61 0.52 -1.17 -4.50 118.95 116.22 1mvs s ARG 70 Ca 0.00 -1.35 -0.24 0.00 -0.52 0.00 0.00 55.73 53.63 1mvs s ARG 70 Cb 0.00 -1.28 -0.01 0.00 0.52 0.00 0.00 34.95 34.18 1mvs s ARG 70 CO 0.00 0.26 0.80 0.42 0.02 0.00 0.00 175.30 176.80 1mvs s ILE 71 N -1.92 4.84 -0.30 1.52 1.01 -0.05 -4.81 121.20 121.48 1mvs s ILE 71 Ca 0.13 1.42 -0.15 0.00 0.00 0.00 0.00 60.65 62.05 1mvs s ILE 71 Cb -0.06 -4.10 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 1mvs s ILE 71 CO 0.06 -0.11 0.39 0.20 0.00 0.00 0.00 174.94 175.48 1mvs s ASN 72 N 1.43 6.24 -0.17 3.58 0.02 -1.26 -0.27 114.94 124.51 1mvs s ASN 72 Ca 0.33 0.10 0.01 0.00 -1.02 0.00 0.00 52.86 52.29 1mvs s ASN 72 Cb -0.15 -2.21 0.02 0.00 0.02 0.00 0.00 41.25 38.92 1mvs s ASN 72 CO 0.09 -0.27 -0.20 -0.22 0.02 0.00 0.00 177.10 176.52 1mvs s LEU 73 N 2.10 2.16 -0.15 0.60 0.20 -0.63 -2.31 118.68 120.65 1mvs s LEU 73 Ca 0.15 -0.62 -0.07 0.00 0.69 0.00 0.00 54.13 54.28 1mvs s LEU 73 Cb -0.16 -1.48 -0.04 0.00 -0.43 0.00 0.00 46.19 44.08 1mvs s LEU 73 CO 0.11 0.02 0.08 -0.69 -0.29 0.00 0.00 176.35 175.58 1mvs s VAL 74 N 1.16 4.94 -0.30 1.68 1.01 -0.77 -1.02 120.40 127.10 1mvs s VAL 74 Ca 0.02 0.01 -0.10 0.00 0.00 0.00 0.00 61.98 61.90 1mvs s VAL 74 Cb -0.14 -3.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.03 1mvs s VAL 74 CO -0.09 0.52 0.16 -0.76 0.00 0.00 0.00 175.10 174.92 1mvs s LEU 75 N -0.16 4.02 -0.08 3.92 1.43 -0.38 -1.15 118.68 126.29 1mvs s LEU 75 Ca 0.08 -0.33 -0.24 0.00 -1.03 0.00 0.00 54.13 52.61 1mvs s LEU 75 Cb -0.12 -2.03 0.05 0.00 0.03 0.00 0.00 46.19 44.12 1mvs s LEU 75 CO 0.01 -0.14 0.54 -0.55 0.23 0.00 0.00 176.35 176.45 1mvs s SER 76 N 1.66 -0.50 -0.10 2.29 0.15 0.24 -2.97 113.70 114.48 1mvs s SER 76 Ca 0.06 0.63 0.09 0.00 0.70 0.00 0.00 55.95 57.43 1mvs s SER 76 Cb -0.16 0.61 -0.13 0.00 -1.71 0.00 0.00 66.02 64.63 1mvs s SER 76 CO 0.07 -0.47 0.05 0.54 1.20 0.00 0.00 173.24 174.64 1mvs n ARG 77 N 1.44 2.18 0.02 5.44 1.74 -1.26 -3.54 116.66 122.69 1mvs n ARG 77 Ca -0.19 -0.01 -0.08 0.00 -0.77 0.00 0.00 57.85 56.81 1mvs n ARG 77 Cb 0.56 -1.26 -0.13 0.00 -1.02 0.00 0.00 32.46 30.61 1mvs n ARG 77 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1mvs h GLU 78 N 0.00 0.00 -6.68 5.56 5.08 -1.96 -3.47 114.58 113.12 1mvs h GLU 78 Ca -0.26 -0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.60 1mvs h GLU 78 Cb 1.55 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.78 1mvs h GLU 78 CO 0.01 0.77 0.36 -0.51 -1.00 0.00 0.00 179.01 178.65 1mvs s LEU 79 N -6.43 4.58 0.02 1.33 1.43 -1.26 -4.98 118.68 113.37 1mvs s LEU 79 Ca -0.02 1.90 -0.02 0.00 -1.03 0.00 0.00 54.13 54.97 1mvs s LEU 79 Cb 0.09 -3.60 -0.27 0.00 0.03 0.00 0.00 46.19 42.44 1mvs s LEU 79 CO 0.82 0.05 0.92 0.11 0.23 0.00 0.00 176.35 178.49 1mvs h LYS 80 N 4.72 0.22 -4.03 1.70 1.79 -1.95 -3.48 116.57 115.55 1mvs h LYS 80 Ca -0.44 -0.38 -0.13 0.00 -2.18 0.00 0.00 60.65 57.52 1mvs h LYS 80 Cb 1.20 0.14 -0.17 0.00 -1.58 0.00 0.00 32.23 31.83 1mvs h LYS 80 CO 0.70 1.09 -0.62 -1.83 -1.08 0.00 0.00 179.45 177.71 1mvs s GLU 81 N -2.63 0.55 0.35 3.15 -1.05 -1.26 -5.11 118.70 112.70 1mvs s GLU 81 Ca -0.07 -0.93 -0.29 0.00 -0.15 0.00 0.00 54.97 53.54 1mvs s GLU 81 Cb 0.07 0.20 -0.11 0.00 -0.44 0.00 0.00 34.13 33.85 1mvs s GLU 81 CO 0.85 -0.12 1.51 -0.35 0.95 0.00 0.00 175.26 178.10 1mvs n PRO 82 N 0.64 2.66 -0.61 -4.83 -0.04 -1.26 -4.94 135.00 126.62 1mvs n PRO 82 Ca -0.18 0.93 -0.30 0.00 -0.04 0.00 0.00 63.50 63.91 1mvs n PRO 82 Cb 0.59 -2.67 0.20 0.00 -0.04 0.00 0.00 33.50 31.58 1mvs n PRO 82 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1mvs n PRO 83 N 0.88 -1.22 -1.69 0.54 -0.02 -1.26 -4.83 135.00 127.40 1mvs n PRO 83 Ca 0.03 -0.30 -0.44 0.00 -2.02 0.00 0.00 63.50 60.77 1mvs n PRO 83 Cb 0.38 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.58 1mvs n PRO 83 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1mvs n GLN 84 N -4.32 2.32 0.00 -0.52 7.27 -1.26 -2.10 117.38 118.77 1mvs n GLN 84 Ca 0.08 0.83 0.00 0.00 0.07 0.00 0.00 57.00 57.98 1mvs n GLN 84 Cb 0.53 -2.57 0.00 0.00 2.41 0.00 0.00 30.24 30.61 1mvs n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1mvs n GLY 85 N 2.72 2.90 3.81 1.69 0.00 -1.26 -4.94 105.19 110.11 1mvs n GLY 85 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1mvs n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mvs s ALA 86 N -2.20 2.43 -0.14 4.61 0.00 -0.89 -4.22 121.76 121.35 1mvs s ALA 86 Ca 0.00 -0.12 0.07 0.00 0.00 0.00 0.00 51.96 51.91 1mvs s ALA 86 Cb 0.00 -3.12 -0.13 0.00 0.00 0.00 0.00 23.12 19.86 1mvs s ALA 86 CO 0.00 -1.52 -0.03 0.72 0.00 0.00 0.00 175.76 174.92 1mvs n HIS 87 N -3.31 0.00 -3.90 0.00 -0.00 -0.98 -4.86 115.22 102.18 1mvs n HIS 87 Ca 0.07 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.70 1mvs n HIS 87 Cb 0.55 -0.62 -0.08 0.00 -0.00 0.00 0.00 29.99 29.84 1mvs n HIS 87 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1mvs s PHE 88 N -2.31 0.19 -0.02 4.41 0.08 -1.05 -5.01 117.98 114.28 1mvs s PHE 88 Ca -0.13 -0.58 0.02 0.00 0.12 0.00 0.00 56.93 56.37 1mvs s PHE 88 Cb 0.04 -0.12 0.00 0.00 -0.57 0.00 0.00 43.02 42.38 1mvs s PHE 88 CO 0.45 -0.46 -0.06 -1.17 -0.10 0.00 0.00 175.22 173.87 1mvs s LEU 89 N -2.58 1.81 0.06 -0.37 2.96 -1.26 -1.84 118.68 117.46 1mvs s LEU 89 Ca 0.01 -0.13 0.02 0.00 -0.22 0.00 0.00 54.13 53.82 1mvs s LEU 89 Cb 0.03 -0.39 -0.03 0.00 0.50 0.00 0.00 46.19 46.30 1mvs s LEU 89 CO -0.08 0.05 -0.08 -0.44 -1.32 0.00 0.00 176.35 174.48 1mvs s SER 90 N 0.15 0.97 0.05 3.68 0.01 -0.30 -4.97 113.70 113.30 1mvs s SER 90 Ca -0.02 -0.69 -0.04 0.00 1.31 0.00 0.00 55.95 56.52 1mvs s SER 90 Cb -0.06 0.05 -0.28 0.00 0.21 0.00 0.00 66.02 65.94 1mvs s SER 90 CO -0.00 -0.28 1.06 0.03 0.41 0.00 0.00 173.24 174.46 1mvs h ARG 91 N 4.02 0.26 -4.43 12.44 2.47 -1.87 0.71 114.38 128.00 1mvs h ARG 91 Ca -0.36 -0.44 -0.30 0.00 -1.26 0.00 0.00 59.98 57.62 1mvs h ARG 91 Cb 1.19 0.17 -0.12 0.00 -1.65 0.00 0.00 29.97 29.56 1mvs h ARG 91 CO 0.48 1.18 -0.39 -1.54 0.56 0.00 0.00 179.97 180.26 1mvs s SER 92 N -7.08 0.81 0.15 7.04 1.04 -1.26 -4.21 113.70 110.19 1mvs s SER 92 Ca -0.05 -1.47 -0.11 0.00 0.48 0.00 0.00 55.95 54.79 1mvs s SER 92 Cb 0.07 0.55 0.01 0.00 0.10 0.00 0.00 66.02 66.75 1mvs s SER 92 CO 0.87 -1.08 1.57 0.25 0.98 0.00 0.00 173.24 175.83 1mvs h LEU 93 N 2.27 0.94 -1.56 2.42 5.85 -1.98 -1.85 115.31 121.41 1mvs h LEU 93 Ca -0.29 -0.36 -0.05 0.00 0.84 0.00 0.00 57.88 58.03 1mvs h LEU 93 Cb 1.24 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 1mvs h LEU 93 CO 0.41 1.08 -0.22 0.44 -0.34 0.00 0.00 178.44 179.81 1mvs h ASP 94 N 0.79 0.00 0.61 1.25 3.45 -2.00 -2.28 116.42 118.24 1mvs h ASP 94 Ca 0.13 0.00 -0.28 0.00 0.43 0.00 0.00 57.03 57.31 1mvs h ASP 94 Cb 0.66 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.44 1mvs h ASP 94 CO 0.05 0.22 -1.26 0.44 -1.57 0.00 0.00 179.24 177.12 1mvs h ASP 95 N 0.00 0.44 -0.59 6.45 3.32 -1.89 -2.75 116.42 121.40 1mvs h ASP 95 Ca -0.00 -0.48 -0.03 0.00 0.02 0.00 0.00 57.03 56.54 1mvs h ASP 95 Cb 0.40 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 1mvs h ASP 95 CO 0.03 1.37 0.26 0.00 -1.72 0.00 0.00 179.24 179.19 1mvs h ALA 96 N 0.56 0.76 -0.30 3.45 0.00 -0.98 -2.84 119.26 119.91 1mvs h ALA 96 Ca -0.14 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 1mvs h ALA 96 Cb 1.98 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 1mvs h ALA 96 CO 0.21 0.35 -0.15 -0.07 0.00 0.00 0.00 179.25 179.58 1mvs h LEU 97 N 0.81 0.65 -2.47 0.00 3.38 -1.51 -3.02 115.31 113.14 1mvs h LEU 97 Ca 0.20 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 1mvs h LEU 97 Cb 0.15 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1mvs h LEU 97 CO -0.02 0.92 -0.01 0.11 0.09 0.00 0.00 178.44 179.52 1mvs h LYS 98 N 0.39 0.00 0.00 1.13 1.57 -1.40 -0.77 116.57 117.49 1mvs h LYS 98 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1mvs h LYS 98 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1mvs h LYS 98 CO 0.04 0.01 0.00 1.25 -0.57 0.00 0.00 179.45 180.19 1mvs h LEU 99 N 0.00 0.00 -0.05 2.94 6.46 -1.37 -1.11 115.31 122.19 1mvs h LEU 99 Ca -0.00 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.72 1mvs h LEU 99 Cb 0.03 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.96 1mvs h LEU 99 CO 0.00 0.00 -0.12 0.74 -0.62 0.00 0.00 178.44 178.44 1mvs h THR 100 N 0.00 1.44 0.00 1.05 2.02 -1.18 -3.07 112.91 113.17 1mvs h THR 100 Ca 0.00 -1.49 -0.03 0.00 0.77 0.00 0.00 66.41 65.65 1mvs h THR 100 Cb 0.57 2.31 -0.00 0.00 -1.74 0.00 0.00 68.15 69.28 1mvs h THR 100 CO 0.00 0.41 -0.15 -0.33 0.37 0.00 0.00 175.52 175.82 1mvs h GLU 101 N -0.36 0.00 -6.99 6.66 3.07 -1.43 -0.94 114.58 114.58 1mvs h GLU 101 Ca -0.00 0.00 -0.47 0.00 -0.50 0.00 0.00 59.36 58.38 1mvs h GLU 101 Cb 0.73 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.65 1mvs h GLU 101 CO 0.03 0.15 0.39 -0.65 -1.40 0.00 0.00 179.01 177.53 1mvs s GLN 102 N -3.54 4.12 -1.32 2.33 -1.52 -0.45 -4.84 119.66 114.42 1mvs s GLN 102 Ca 0.02 1.42 -0.17 0.00 -1.95 0.00 0.00 55.36 54.68 1mvs s GLN 102 Cb 0.09 -2.42 0.05 0.00 -0.22 0.00 0.00 33.01 30.51 1mvs s GLN 102 CO 0.62 -0.17 1.88 -0.35 -0.25 0.00 0.00 175.29 177.03 1mvs n PRO 103 N -0.29 2.98 0.11 2.91 -0.05 -1.26 -2.24 135.00 137.15 1mvs n PRO 103 Ca 0.06 -3.02 0.00 0.00 -0.05 0.00 0.00 63.50 60.49 1mvs n PRO 103 Cb 0.51 -3.44 0.00 0.00 -0.05 0.00 0.00 33.50 30.51 1mvs n PRO 103 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 175.50 175.84 1mvs n GLU 104 N 7.75 0.00 -0.02 0.54 1.02 -1.26 -4.87 120.64 123.80 1mvs n GLU 104 Ca 0.50 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.69 1mvs n GLU 104 Cb 0.44 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.92 1mvs n GLU 104 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1mvs n LEU 105 N -3.10 2.05 -0.12 -4.62 4.77 -1.14 -4.80 117.00 110.05 1mvs n LEU 105 Ca 0.00 -1.10 -0.05 0.00 -0.03 0.00 0.00 56.01 54.84 1mvs n LEU 105 Cb 0.00 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.09 1mvs n LEU 105 CO 0.00 0.41 0.84 0.00 -1.33 0.00 0.00 177.39 177.30 1mvs h ALA 106 N 2.24 0.34 0.00 -1.18 0.00 -0.70 -3.00 119.26 116.96 1mvs h ALA 106 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1mvs h ALA 106 Cb 0.50 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1mvs h ALA 106 CO 0.00 -0.41 -0.87 0.27 0.00 0.00 0.00 179.25 178.24 1mvs n ASN 107 N -5.22 0.74 -0.20 0.00 2.04 -1.26 -4.56 115.26 106.79 1mvs n ASN 107 Ca 0.03 0.14 0.09 0.00 -0.44 0.00 0.00 54.58 54.40 1mvs n ASN 107 Cb 0.21 0.42 -0.05 0.00 -2.53 0.00 0.00 39.78 37.83 1mvs n ASN 107 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1mvs n LYS 108 N -2.32 1.37 -4.35 -3.83 4.76 -1.14 -4.85 118.16 107.79 1mvs n LYS 108 Ca 0.02 -0.43 -0.35 0.00 -2.87 0.00 0.00 58.31 54.68 1mvs n LYS 108 Cb 0.49 -1.34 -0.10 0.00 -1.84 0.00 0.00 35.03 32.24 1mvs n LYS 108 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1mvs s VAL 109 N -2.39 4.26 0.00 -0.18 1.01 -1.17 -0.49 120.40 121.45 1mvs s VAL 109 Ca 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1mvs s VAL 109 Cb 0.14 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.70 1mvs s VAL 109 CO 0.60 0.57 0.00 -0.67 0.00 0.00 0.00 175.10 175.59 1mvs n ASP 110 N 2.55 0.00 -4.89 3.32 4.64 -0.08 -3.91 116.55 118.19 1mvs n ASP 110 Ca -0.18 0.00 -0.33 0.00 -1.38 0.00 0.00 54.79 52.90 1mvs n ASP 110 Cb 0.53 0.00 -0.05 0.00 -1.04 0.00 0.00 41.12 40.56 1mvs n ASP 110 CO 0.00 0.00 0.00 -0.04 -0.82 0.00 0.00 177.20 176.34 1mvs s MET 111 N 0.00 3.63 -0.17 -0.67 -1.94 -1.26 0.11 119.30 119.00 1mvs s MET 111 Ca 0.00 -0.05 -0.02 0.00 -1.71 0.00 0.00 55.69 53.91 1mvs s MET 111 Cb 0.00 -2.96 -0.01 0.00 2.01 0.00 0.00 34.83 33.86 1mvs s MET 111 CO 0.00 0.55 -0.08 0.14 -0.01 0.00 0.00 175.02 175.62 1mvs s VAL 112 N -1.48 3.29 -0.18 -6.03 -7.23 0.35 -1.75 120.40 107.36 1mvs s VAL 112 Ca 0.35 -0.55 -0.03 0.00 -1.81 0.00 0.00 61.98 59.94 1mvs s VAL 112 Cb -0.13 -2.44 -0.01 0.00 0.56 0.00 0.00 36.38 34.36 1mvs s VAL 112 CO 0.21 0.48 -0.07 0.26 -0.31 0.00 0.00 175.10 175.68 1mvs s TRP 113 N 0.78 2.93 -0.35 2.82 0.52 -0.18 -0.64 118.94 124.82 1mvs s TRP 113 Ca -0.03 -0.74 -0.16 0.00 0.02 0.00 0.00 56.10 55.19 1mvs s TRP 113 Cb -0.15 -2.01 -0.01 0.00 -1.15 0.00 0.00 33.47 30.16 1mvs s TRP 113 CO 0.01 -0.36 0.39 0.42 0.02 0.00 0.00 176.95 177.44 1mvs s ILE 114 N 0.96 5.14 -1.28 2.03 1.01 0.71 -0.98 121.20 128.77 1mvs s ILE 114 Ca -0.01 0.09 0.18 0.00 0.00 0.00 0.00 60.65 60.92 1mvs s ILE 114 Cb -0.15 -3.86 0.60 0.00 0.01 0.00 0.00 42.46 39.06 1mvs s ILE 114 CO 0.00 -0.13 1.51 1.33 0.00 0.00 0.00 174.94 177.66 1mvs n VAL 115 N 5.28 1.43 0.00 2.92 0.24 -0.73 -2.40 118.33 125.07 1mvs n VAL 115 Ca -0.08 -1.15 0.00 0.00 -2.04 0.00 0.00 64.34 61.07 1mvs n VAL 115 Cb 0.49 0.30 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 1mvs n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1mvs n GLY 116 N 1.04 4.19 0.00 7.63 0.00 -1.26 -4.92 105.19 111.87 1mvs n GLY 116 Ca 0.22 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1mvs n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mvs n GLY 117 N -1.99 2.30 0.36 -0.02 0.00 -1.26 -1.86 105.19 102.73 1mvs n GLY 117 Ca 0.00 -1.99 0.07 0.00 0.00 0.00 0.00 46.02 44.11 1mvs n GLY 117 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1mvs h SER 118 N 0.00 0.93 -0.17 1.61 4.64 -1.98 0.25 113.55 118.82 1mvs h SER 118 Ca 0.00 0.05 0.03 0.00 -0.47 0.00 0.00 61.79 61.40 1mvs h SER 118 Cb 0.00 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 61.92 1mvs h SER 118 CO 0.00 0.49 -0.02 0.28 -0.87 0.00 0.00 176.83 176.71 1mvs h SER 119 N 0.99 -0.11 -0.35 4.97 0.02 -1.94 0.72 113.55 117.86 1mvs h SER 119 Ca 0.50 0.04 -0.12 0.00 -0.84 0.00 0.00 61.79 61.37 1mvs h SER 119 Cb 0.49 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1mvs h SER 119 CO -0.26 -0.03 -0.26 0.58 -1.14 0.00 0.00 176.83 175.72 1mvs h VAL 120 N 0.03 1.29 -0.22 2.27 2.07 -1.60 -2.90 116.25 117.18 1mvs h VAL 120 Ca 0.08 -1.41 -0.21 0.00 0.82 0.00 0.00 66.70 65.98 1mvs h VAL 120 Cb 0.11 1.43 0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1mvs h VAL 120 CO -0.15 0.46 -0.66 1.88 0.02 0.00 0.00 177.57 179.12 1mvs h TYR 121 N 0.57 1.09 -0.36 1.57 0.99 -0.32 -2.63 116.97 117.89 1mvs h TYR 121 Ca 0.07 -0.44 0.10 0.00 2.00 0.00 0.00 58.73 60.46 1mvs h TYR 121 Cb 0.82 -0.19 -0.01 0.00 1.00 0.00 0.00 36.73 38.35 1mvs h TYR 121 CO 0.06 1.27 0.27 -0.22 -0.00 0.00 0.00 178.16 179.55 1mvs h LYS 122 N 0.60 0.00 0.00 4.88 3.64 0.55 -1.98 116.57 124.27 1mvs h LYS 122 Ca -0.02 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.12 1mvs h LYS 122 Cb 1.28 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.06 1mvs h LYS 122 CO 0.14 0.00 -1.66 -1.91 -2.27 0.00 0.00 179.45 173.75 1mvs n GLU 123 N -4.32 0.63 -0.14 1.90 2.13 -1.11 -4.03 120.64 115.70 1mvs n GLU 123 Ca 0.06 0.22 -0.12 0.00 0.66 0.00 0.00 57.16 57.98 1mvs n GLU 123 Cb 0.45 -1.76 -0.01 0.00 0.27 0.00 0.00 31.44 30.38 1mvs n GLU 123 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1mvs h ALA 124 N 1.21 0.61 0.00 4.31 0.00 -1.02 -2.93 119.26 121.43 1mvs h ALA 124 Ca -0.25 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1mvs h ALA 124 Cb 1.83 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1mvs h ALA 124 CO 0.06 0.59 0.00 -1.33 0.00 0.00 0.00 179.25 178.57 1mvs n MET 125 N -4.17 0.06 -3.16 0.00 2.81 -0.80 -2.85 117.12 109.02 1mvs n MET 125 Ca -0.01 0.21 -0.18 0.00 -1.81 0.00 0.00 57.70 55.91 1mvs n MET 125 Cb 0.45 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.44 1mvs n MET 125 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1mvs n ASN 126 N -1.23 1.06 -3.72 7.83 3.02 -1.11 -5.04 115.26 116.07 1mvs n ASN 126 Ca 0.02 -3.04 -0.17 0.00 -0.03 0.00 0.00 54.58 51.36 1mvs n ASN 126 Cb 0.03 -0.61 -0.17 0.00 -0.61 0.00 0.00 39.78 38.41 1mvs n ASN 126 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1mvs s HIS 127 N -2.51 0.04 0.68 3.10 5.65 -1.13 -4.95 115.29 116.15 1mvs s HIS 127 Ca 0.40 0.20 -0.17 0.00 0.25 0.00 0.00 55.06 55.74 1mvs s HIS 127 Cb 0.35 -0.35 -0.01 0.00 -1.18 0.00 0.00 32.58 31.40 1mvs s HIS 127 CO -0.08 -0.14 1.06 -2.30 -0.65 0.00 0.00 174.74 172.63 1mvs n PRO 128 N 4.71 0.75 0.00 2.88 -0.02 -1.26 -4.76 135.00 137.29 1mvs n PRO 128 Ca -0.16 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 1mvs n PRO 128 Cb 0.50 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1mvs n PRO 128 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mvs n GLY 129 N 1.08 0.50 3.69 -1.23 0.00 -1.26 -4.97 105.19 102.99 1mvs n GLY 129 Ca 0.14 -2.23 -0.36 0.00 0.00 0.00 0.00 46.02 43.57 1mvs n GLY 129 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1mvs s HIS 130 N -0.56 3.38 -0.02 1.61 5.65 -1.26 -1.67 115.29 122.42 1mvs s HIS 130 Ca 0.00 0.41 -0.06 0.00 0.25 0.00 0.00 55.06 55.67 1mvs s HIS 130 Cb 0.00 -2.32 0.01 0.00 -1.18 0.00 0.00 32.58 29.09 1mvs s HIS 130 CO 0.00 0.13 0.13 -1.17 -0.65 0.00 0.00 174.74 173.18 1mvs s LEU 131 N 0.84 1.56 -0.07 8.88 2.96 -0.11 -4.42 118.68 128.32 1mvs s LEU 131 Ca 0.12 -0.01 0.05 0.00 -0.22 0.00 0.00 54.13 54.07 1mvs s LEU 131 Cb -0.13 0.55 -0.00 0.00 0.50 0.00 0.00 46.19 47.10 1mvs s LEU 131 CO 0.04 -0.22 -0.22 -0.54 -1.32 0.00 0.00 176.35 174.08 1mvs s LYS 132 N -0.74 2.47 -0.26 1.98 1.02 -1.16 -0.38 119.74 122.67 1mvs s LYS 132 Ca -0.08 -0.81 -0.08 0.00 0.02 0.00 0.00 55.97 55.02 1mvs s LYS 132 Cb -0.05 -2.02 -0.03 0.00 -0.52 0.00 0.00 37.83 35.21 1mvs s LYS 132 CO 0.01 0.28 0.09 -0.51 -0.92 0.00 0.00 175.35 174.30 1mvs s LEU 133 N 0.07 3.58 -0.56 3.17 1.02 0.92 -1.23 118.68 125.65 1mvs s LEU 133 Ca -0.08 -0.21 -0.12 0.00 0.02 0.00 0.00 54.13 53.74 1mvs s LEU 133 Cb -0.15 -1.96 0.14 0.00 0.02 0.00 0.00 46.19 44.25 1mvs s LEU 133 CO 0.05 -0.05 0.47 -0.36 0.02 0.00 0.00 176.35 176.47 1mvs s PHE 134 N 1.64 3.41 -0.22 0.29 0.40 0.14 -0.75 117.98 122.89 1mvs s PHE 134 Ca 0.06 -1.75 -0.08 0.00 -0.60 0.00 0.00 56.93 54.56 1mvs s PHE 134 Cb -0.15 -3.63 -0.04 0.00 0.51 0.00 0.00 43.02 39.70 1mvs s PHE 134 CO 0.05 -0.99 0.09 0.08 0.70 0.00 0.00 175.22 175.15 1mvs s VAL 135 N 1.18 4.84 -0.53 -0.44 1.01 -0.50 -2.38 120.40 123.58 1mvs s VAL 135 Ca 0.07 -0.01 -0.16 0.00 0.00 0.00 0.00 61.98 61.89 1mvs s VAL 135 Cb -0.25 -3.23 0.12 0.00 0.00 0.00 0.00 36.38 33.03 1mvs s VAL 135 CO -0.01 0.39 0.49 -0.89 0.00 0.00 0.00 175.10 175.08 1mvs s THR 136 N 0.92 5.20 -0.37 3.92 2.01 -0.02 0.63 115.64 127.93 1mvs s THR 136 Ca 0.05 -1.41 -0.27 0.00 0.31 0.00 0.00 61.69 60.37 1mvs s THR 136 Cb -0.14 -4.31 0.02 0.00 0.01 0.00 0.00 72.50 68.08 1mvs s THR 136 CO 0.03 -0.83 0.99 -0.13 -0.69 0.00 0.00 174.62 173.99 1mvs s ARG 137 N 1.64 3.88 -0.52 4.92 1.81 0.03 -2.01 118.95 128.70 1mvs s ARG 137 Ca 0.03 0.69 -0.24 0.00 -1.72 0.00 0.00 55.73 54.50 1mvs s ARG 137 Cb -0.29 -3.80 0.04 0.00 -0.45 0.00 0.00 34.95 30.45 1mvs s ARG 137 CO 0.04 -1.00 0.88 0.42 -0.68 0.00 0.00 175.30 174.96 1mvs s ILE 138 N 3.66 4.49 0.00 1.52 -1.09 0.43 -1.56 121.20 128.65 1mvs s ILE 138 Ca 0.41 0.29 0.00 0.00 -2.23 0.00 0.00 60.65 59.12 1mvs s ILE 138 Cb -0.11 -4.46 0.00 0.00 -1.58 0.00 0.00 42.46 36.30 1mvs s ILE 138 CO 0.20 -0.98 0.44 0.23 -1.23 0.00 0.00 174.94 173.60 1mvs n MET 139 N 7.17 0.36 -3.70 2.79 2.81 0.40 -1.90 117.12 125.04 1mvs n MET 139 Ca 0.02 0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 55.81 1mvs n MET 139 Cb 0.47 -1.32 -0.03 0.00 -0.71 0.00 0.00 33.22 31.63 1mvs n MET 139 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 1mvs s GLN 140 N 0.80 1.37 0.01 0.03 -2.07 -1.26 -4.88 119.66 113.67 1mvs s GLN 140 Ca 0.00 -0.81 -0.30 0.00 -1.82 0.00 0.00 55.36 52.43 1mvs s GLN 140 Cb 0.00 0.53 -0.04 0.00 -1.09 0.00 0.00 33.01 32.42 1mvs s GLN 140 CO 0.00 -0.59 1.06 -0.51 -1.32 0.00 0.00 175.29 173.93 1mvs s ASP 141 N -2.86 7.26 -0.05 12.60 1.11 -1.26 -1.67 116.67 131.80 1mvs s ASP 141 Ca 0.08 1.77 0.03 0.00 0.18 0.00 0.00 52.55 54.60 1mvs s ASP 141 Cb -0.01 -2.57 0.01 0.00 1.07 0.00 0.00 42.92 41.42 1mvs s ASP 141 CO -0.04 -0.35 -0.12 -0.36 1.18 0.00 0.00 175.17 175.49 1mvs s PHE 142 N 1.12 1.31 0.07 4.23 0.08 -1.26 -4.98 117.98 118.54 1mvs s PHE 142 Ca 0.54 -0.42 -0.31 0.00 0.12 0.00 0.00 56.93 56.86 1mvs s PHE 142 Cb -0.24 -0.95 -0.09 0.00 -0.57 0.00 0.00 43.02 41.18 1mvs s PHE 142 CO 0.28 -0.21 1.72 -2.00 -0.10 0.00 0.00 175.22 174.91 1mvs s GLU 143 N 0.46 4.18 0.22 0.44 2.12 -1.26 -4.79 118.70 120.06 1mvs s GLU 143 Ca -0.10 2.40 0.01 0.00 0.36 0.00 0.00 54.97 57.64 1mvs s GLU 143 Cb -0.13 -3.68 -0.05 0.00 0.26 0.00 0.00 34.13 30.53 1mvs s GLU 143 CO 0.02 -0.79 0.09 -1.12 -0.54 0.00 0.00 175.26 172.92 1mvs s SER 144 N 2.72 0.86 0.00 -1.70 0.01 -1.26 -4.67 113.70 109.66 1mvs s SER 144 Ca 0.77 -1.33 0.00 0.00 1.31 0.00 0.00 55.95 56.69 1mvs s SER 144 Cb -0.41 0.22 0.00 0.00 0.21 0.00 0.00 66.02 66.04 1mvs s SER 144 CO 0.34 -0.73 0.04 -0.90 0.41 0.00 0.00 173.24 172.40 1mvs n ASP 145 N -0.35 0.08 -4.02 2.44 5.68 0.52 -4.96 116.55 115.95 1mvs n ASP 145 Ca -0.01 -0.56 -0.15 0.00 -0.50 0.00 0.00 54.79 53.57 1mvs n ASP 145 Cb 0.65 0.07 -0.13 0.00 -1.14 0.00 0.00 41.12 40.58 1mvs n ASP 145 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1mvs s THR 146 N -0.07 0.52 0.08 2.12 -1.32 -1.03 -5.01 115.64 110.93 1mvs s THR 146 Ca 0.00 -0.64 0.01 0.00 -1.21 0.00 0.00 61.69 59.85 1mvs s THR 146 Cb 0.00 -0.51 -0.04 0.00 -1.51 0.00 0.00 72.50 70.44 1mvs s THR 146 CO 0.00 -0.10 -0.06 -0.36 -2.21 0.00 0.00 174.62 171.89 1mvs s PHE 147 N -0.71 0.78 0.31 9.09 0.40 -1.26 -0.15 117.98 126.44 1mvs s PHE 147 Ca -0.03 -0.89 -0.27 0.00 -0.60 0.00 0.00 56.93 55.14 1mvs s PHE 147 Cb -0.06 -0.47 -0.10 0.00 0.51 0.00 0.00 43.02 42.91 1mvs s PHE 147 CO 0.00 -0.19 0.97 0.12 0.70 0.00 0.00 175.22 176.82 1mvs s PHE 148 N -3.37 3.70 0.96 0.36 5.36 -0.23 -4.70 117.98 120.07 1mvs s PHE 148 Ca 0.08 1.79 -0.12 0.00 -0.96 0.00 0.00 56.93 57.72 1mvs s PHE 148 Cb 0.04 -2.99 0.17 0.00 -0.34 0.00 0.00 43.02 39.90 1mvs s PHE 148 CO -0.05 0.11 1.09 -1.25 -1.46 0.00 0.00 175.22 173.66 1mvs s PRO 149 N -1.86 0.68 0.35 10.12 0.04 -1.26 -4.94 135.00 138.14 1mvs s PRO 149 Ca 0.48 0.90 -0.26 0.00 0.04 0.00 0.00 61.00 62.16 1mvs s PRO 149 Cb -0.22 -1.74 -0.09 0.00 0.04 0.00 0.00 34.50 32.50 1mvs s PRO 149 CO 0.27 -2.66 1.08 -1.83 0.04 0.00 0.00 177.00 173.91 1mvs s GLU 150 N -4.80 4.33 -0.13 4.56 -1.05 -1.26 -5.00 118.70 115.36 1mvs s GLU 150 Ca 0.65 1.65 -0.23 0.00 -0.15 0.00 0.00 54.97 56.90 1mvs s GLU 150 Cb -0.20 -2.80 -0.03 0.00 -0.44 0.00 0.00 34.13 30.66 1mvs s GLU 150 CO 0.59 -0.02 0.70 0.42 0.95 0.00 0.00 175.26 177.89 1mvs s ILE 151 N -1.44 5.01 -0.79 1.83 1.01 -1.26 -5.00 121.20 120.56 1mvs s ILE 151 Ca 0.53 1.38 -0.24 0.00 0.00 0.00 0.00 60.65 62.32 1mvs s ILE 151 Cb -0.27 -4.02 0.06 0.00 0.01 0.00 0.00 42.46 38.24 1mvs s ILE 151 CO 0.34 0.17 1.21 -0.62 0.00 0.00 0.00 174.94 176.04 1mvs s ASP 152 N 0.97 6.28 0.20 3.58 3.68 -1.26 -4.88 116.67 125.24 1mvs s ASP 152 Ca 0.35 -0.97 0.18 0.00 2.13 0.00 0.00 52.55 54.24 1mvs s ASP 152 Cb -0.17 -2.51 0.83 0.00 -1.45 0.00 0.00 42.92 39.63 1mvs s ASP 152 CO 0.14 -1.58 1.55 0.18 0.13 0.00 0.00 175.17 175.59 1mvs n LEU 153 N 8.53 0.42 0.19 -1.34 4.77 -1.26 0.89 117.00 129.20 1mvs n LEU 153 Ca 0.09 0.64 0.08 0.00 -0.03 0.00 0.00 56.01 56.80 1mvs n LEU 153 Cb 0.48 -0.63 0.21 0.00 -2.33 0.00 0.00 43.42 41.15 1mvs n LEU 153 CO 0.66 -0.62 0.69 -0.33 -1.33 0.00 0.00 177.39 176.46 1mvs h GLU 154 N 0.00 0.00 0.00 3.23 4.39 -2.03 -3.34 114.58 116.83 1mvs h GLU 154 Ca 0.00 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.40 1mvs h GLU 154 Cb 0.18 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.78 1mvs h GLU 154 CO 0.00 0.25 -2.08 1.63 -1.16 0.00 0.00 179.01 177.64 1mvs n LYS 155 N -3.21 0.46 -3.47 2.33 5.02 0.21 -4.99 118.16 114.51 1mvs n LYS 155 Ca 0.02 0.13 -0.37 0.00 -2.02 0.00 0.00 58.31 56.07 1mvs n LYS 155 Cb 0.57 -1.33 -0.07 0.00 -0.02 0.00 0.00 35.03 34.18 1mvs n LYS 155 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1mvs s TYR 156 N -2.37 3.50 -0.18 2.13 1.51 0.26 -4.58 117.35 117.61 1mvs s TYR 156 Ca -0.26 0.72 -0.07 0.00 -1.01 0.00 0.00 57.07 56.45 1mvs s TYR 156 Cb 0.08 -2.40 -0.04 0.00 -0.11 0.00 0.00 41.96 39.49 1mvs s TYR 156 CO 0.41 0.26 0.06 0.15 -1.11 0.00 0.00 175.55 175.32 1mvs s LYS 157 N 0.37 3.96 -0.04 -0.62 -0.14 0.07 -4.39 119.74 118.94 1mvs s LYS 157 Ca 0.20 -0.34 -0.30 0.00 -1.36 0.00 0.00 55.97 54.17 1mvs s LYS 157 Cb -0.14 -3.21 -0.04 0.00 -1.68 0.00 0.00 37.83 32.76 1mvs s LYS 157 CO 0.07 0.29 1.30 -1.17 -0.76 0.00 0.00 175.35 175.08 1mvs s LEU 158 N 0.31 4.29 0.29 3.17 2.96 -1.26 -1.12 118.68 127.32 1mvs s LEU 158 Ca 0.03 1.94 -0.28 0.00 -0.22 0.00 0.00 54.13 55.61 1mvs s LEU 158 Cb -0.12 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 42.92 1mvs s LEU 158 CO 0.00 -0.67 0.96 -0.76 -1.32 0.00 0.00 176.35 174.56 1mvs s LEU 159 N 2.47 4.47 0.50 -0.68 1.43 -0.14 -4.94 118.68 121.79 1mvs s LEU 159 Ca 0.60 1.92 0.28 0.00 -1.03 0.00 0.00 54.13 55.89 1mvs s LEU 159 Cb -0.27 -3.84 1.23 0.00 0.03 0.00 0.00 46.19 43.34 1mvs s LEU 159 CO 0.23 -0.00 1.95 -0.65 0.23 0.00 0.00 176.35 178.11 1mvs h PRO 160 N 3.57 0.00 -1.91 1.29 0.11 -1.95 -3.43 132.00 129.68 1mvs h PRO 160 Ca -0.46 0.00 0.26 0.00 0.11 0.00 0.00 66.00 65.90 1mvs h PRO 160 Cb 1.20 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.21 1mvs h PRO 160 CO 0.66 0.14 0.67 -1.83 -0.21 0.00 0.00 178.00 177.44 1mvs s GLU 161 N -3.83 0.79 -0.26 1.05 -1.05 -1.26 -5.05 118.70 109.08 1mvs s GLU 161 Ca -0.01 -0.45 -0.14 0.00 -0.15 0.00 0.00 54.97 54.23 1mvs s GLU 161 Cb 0.11 0.26 0.08 0.00 -0.44 0.00 0.00 34.13 34.14 1mvs s GLU 161 CO 0.59 -0.36 0.63 -0.47 0.95 0.00 0.00 175.26 176.60 1mvs s TYR 162 N -2.75 -1.02 0.06 4.83 5.04 -1.26 -5.05 117.35 117.20 1mvs s TYR 162 Ca 0.14 2.00 -0.35 0.00 -2.44 0.00 0.00 57.07 56.43 1mvs s TYR 162 Cb 0.02 0.59 -0.14 0.00 0.35 0.00 0.00 41.96 42.77 1mvs s TYR 162 CO -0.01 -0.51 1.60 -2.30 -1.34 0.00 0.00 175.55 172.99 1mvs n PRO 163 N 4.47 1.85 -0.65 4.97 -0.02 -1.26 -2.82 135.00 141.55 1mvs n PRO 163 Ca -0.19 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1mvs n PRO 163 Cb 0.57 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1mvs n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mvs n GLY 164 N 3.48 0.80 3.23 -1.23 0.00 -1.26 -5.04 105.19 105.17 1mvs n GLY 164 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1mvs n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mvs s VAL 165 N -3.08 2.58 -0.04 1.61 1.01 -1.13 -5.10 120.40 116.26 1mvs s VAL 165 Ca 0.00 -0.78 -0.30 0.00 0.00 0.00 0.00 61.98 60.90 1mvs s VAL 165 Cb 0.00 -2.10 -0.05 0.00 0.00 0.00 0.00 36.38 34.23 1mvs s VAL 165 CO 0.00 0.51 1.43 -0.76 0.00 0.00 0.00 175.10 176.28 1mvs s LEU 166 N 1.06 4.29 0.19 3.92 1.02 -1.26 -4.70 118.68 123.20 1mvs s LEU 166 Ca -0.01 2.07 0.26 0.00 0.02 0.00 0.00 54.13 56.47 1mvs s LEU 166 Cb -0.14 -3.55 0.76 0.00 0.02 0.00 0.00 46.19 43.27 1mvs s LEU 166 CO -0.04 -0.77 1.72 -1.20 0.02 0.00 0.00 176.35 176.08 1mvs n SER 167 N 5.95 0.78 -4.88 2.29 7.64 -1.26 -4.20 113.62 119.94 1mvs n SER 167 Ca 0.14 0.51 -0.21 0.00 1.01 0.00 0.00 58.87 60.32 1mvs n SER 167 Cb 0.44 -0.66 -0.03 0.00 -1.01 0.00 0.00 64.21 62.94 1mvs n SER 167 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1mvs s ASP 168 N -4.45 5.82 0.17 6.43 3.84 -1.26 -4.92 116.67 122.30 1mvs s ASP 168 Ca 0.10 -0.14 -0.34 0.00 -0.00 0.00 0.00 52.55 52.18 1mvs s ASP 168 Cb 0.13 -1.56 -0.14 0.00 -1.38 0.00 0.00 42.92 39.97 1mvs s ASP 168 CO 0.61 -0.07 1.55 0.52 -0.00 0.00 0.00 175.17 177.79 1mvs n VAL 169 N -1.28 0.11 -3.58 2.11 0.31 -1.26 -4.77 118.33 109.97 1mvs n VAL 169 Ca -0.08 -0.03 -0.20 0.00 -0.01 0.00 0.00 64.34 64.02 1mvs n VAL 169 Cb 0.58 -1.52 -0.02 0.00 -0.91 0.00 0.00 33.84 31.97 1mvs n VAL 169 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1mvs s GLN 170 N 0.74 2.88 -0.16 5.55 -1.52 0.24 -4.94 119.66 122.45 1mvs s GLN 170 Ca 0.78 -1.20 -0.06 0.00 -1.95 0.00 0.00 55.36 52.93 1mvs s GLN 170 Cb -0.68 -2.63 0.07 0.00 -0.22 0.00 0.00 33.01 29.55 1mvs s GLN 170 CO 0.39 0.02 0.35 -2.00 -0.25 0.00 0.00 175.29 173.81 1mvs s GLU 171 N -4.11 0.26 -0.01 2.91 2.12 -1.26 -1.66 118.70 116.96 1mvs s GLU 171 Ca 0.44 0.86 -0.02 0.00 0.36 0.00 0.00 54.97 56.61 1mvs s GLU 171 Cb -0.07 0.11 -0.00 0.00 0.26 0.00 0.00 34.13 34.43 1mvs s GLU 171 CO 0.29 -0.24 0.05 -1.21 -0.54 0.00 0.00 175.26 173.61 1mvs s GLU 172 N 2.24 0.20 -1.55 4.30 2.02 0.18 -4.85 118.70 121.25 1mvs s GLU 172 Ca -0.03 -0.17 -0.01 0.00 0.02 0.00 0.00 54.97 54.78 1mvs s GLU 172 Cb -0.11 0.08 0.01 0.00 0.10 0.00 0.00 34.13 34.21 1mvs s GLU 172 CO -0.11 -0.04 0.02 1.63 0.02 0.00 0.00 175.26 176.79 1mvs n LYS 173 N 2.42 -0.93 -1.77 1.61 5.02 -1.26 0.16 118.16 123.41 1mvs n LYS 173 Ca -0.17 0.09 -0.18 0.00 -2.02 0.00 0.00 58.31 56.03 1mvs n LYS 173 Cb 0.58 -3.60 -0.06 0.00 -0.02 0.00 0.00 35.03 31.93 1mvs n LYS 173 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mvs n GLY 174 N -2.52 1.18 3.19 0.72 0.00 -1.26 -4.98 105.19 101.52 1mvs n GLY 174 Ca -0.31 -0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.25 1mvs n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mvs s ILE 175 N -2.75 2.39 -0.08 -0.61 1.01 0.43 -5.13 121.20 116.46 1mvs s ILE 175 Ca 0.00 -0.85 -0.14 0.00 0.00 0.00 0.00 60.65 59.66 1mvs s ILE 175 Cb 0.00 -2.01 -0.05 0.00 0.01 0.00 0.00 42.46 40.41 1mvs s ILE 175 CO 0.00 0.52 0.36 -0.54 0.00 0.00 0.00 174.94 175.28 1mvs s LYS 176 N 1.09 4.04 0.09 2.79 -0.14 -1.26 -0.64 119.74 125.70 1mvs s LYS 176 Ca -0.00 0.27 -0.11 0.00 -1.36 0.00 0.00 55.97 54.78 1mvs s LYS 176 Cb -0.14 -3.31 0.01 0.00 -1.68 0.00 0.00 37.83 32.70 1mvs s LYS 176 CO -0.06 0.48 0.24 1.52 -0.76 0.00 0.00 175.35 176.77 1mvs s TYR 177 N -0.35 0.06 0.05 3.18 -0.85 -0.66 -0.46 117.35 118.32 1mvs s TYR 177 Ca 0.21 -0.43 -0.01 0.00 -0.52 0.00 0.00 57.07 56.32 1mvs s TYR 177 Cb -0.15 0.02 -0.04 0.00 0.38 0.00 0.00 41.96 42.17 1mvs s TYR 177 CO 0.09 -0.57 -0.03 -1.59 -1.52 0.00 0.00 175.55 171.93 1mvs s LYS 178 N -3.70 0.59 -0.16 -3.49 -2.85 -0.60 0.81 119.74 110.35 1mvs s LYS 178 Ca 0.03 -1.15 -0.13 0.00 -1.00 0.00 0.00 55.97 53.72 1mvs s LYS 178 Cb 0.04 0.16 -0.05 0.00 -2.06 0.00 0.00 37.83 35.92 1mvs s LYS 178 CO -0.10 -0.09 0.27 -0.06 0.10 0.00 0.00 175.35 175.46 1mvs s PHE 179 N -3.58 3.47 0.07 1.78 0.40 -1.26 -0.79 117.98 118.08 1mvs s PHE 179 Ca 0.04 0.58 0.06 0.00 -0.60 0.00 0.00 56.93 57.01 1mvs s PHE 179 Cb 0.05 -2.30 -0.03 0.00 0.51 0.00 0.00 43.02 41.25 1mvs s PHE 179 CO -0.08 0.28 -0.16 -1.21 0.70 0.00 0.00 175.22 174.75 1mvs s GLU 180 N 0.32 0.95 -0.13 0.44 2.02 0.20 -4.80 118.70 117.71 1mvs s GLU 180 Ca 0.16 -0.97 0.01 0.00 0.02 0.00 0.00 54.97 54.19 1mvs s GLU 180 Cb -0.13 -1.03 0.02 0.00 0.10 0.00 0.00 34.13 33.09 1mvs s GLU 180 CO 0.04 0.24 -0.16 0.08 0.02 0.00 0.00 175.26 175.47 1mvs s VAL 181 N -1.14 1.62 -0.04 2.63 1.01 -1.26 -1.41 120.40 121.81 1mvs s VAL 181 Ca 0.01 -0.70 0.05 0.00 0.00 0.00 0.00 61.98 61.34 1mvs s VAL 181 Cb -0.10 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 1mvs s VAL 181 CO 0.03 0.47 -0.17 -0.31 0.00 0.00 0.00 175.10 175.11 1mvs s TYR 182 N 1.13 2.62 0.02 5.22 1.51 0.07 -0.97 117.35 126.96 1mvs s TYR 182 Ca -0.03 -0.22 0.06 0.00 -1.01 0.00 0.00 57.07 55.87 1mvs s TYR 182 Cb -0.14 -1.60 -0.02 0.00 -0.11 0.00 0.00 41.96 40.09 1mvs s TYR 182 CO -0.05 0.14 -0.18 -2.00 -1.11 0.00 0.00 175.55 172.35 1mvs s GLU 183 N -0.72 1.29 0.03 -0.62 2.12 -0.28 -0.06 118.70 120.47 1mvs s GLU 183 Ca 0.11 -0.80 -0.03 0.00 0.36 0.00 0.00 54.97 54.61 1mvs s GLU 183 Cb -0.10 -1.33 -0.02 0.00 0.26 0.00 0.00 34.13 32.94 1mvs s GLU 183 CO 0.00 0.35 0.03 0.21 -0.54 0.00 0.00 175.26 175.31 1mvs s LYS 184 N -0.93 0.45 -0.33 4.30 2.20 0.49 -0.75 119.74 125.17 1mvs s LYS 184 Ca 0.06 -0.70 0.05 0.00 -0.36 0.00 0.00 55.97 55.02 1mvs s LYS 184 Cb -0.08 0.17 0.18 0.00 -1.51 0.00 0.00 37.83 36.59 1mvs s LYS 184 CO 0.01 -0.09 0.52 1.21 -0.36 0.00 0.00 175.35 176.63 1mvs s ASN 185 N -1.83 -0.61 0.00 1.43 3.04 -1.26 -0.93 114.94 114.79 1mvs s ASN 185 Ca -0.10 -0.50 0.00 0.00 0.04 0.00 0.00 52.86 52.31 1mvs s ASN 185 Cb -0.05 1.53 0.00 0.00 -1.54 0.00 0.00 41.25 41.19 1mvs s ASN 185 CO -0.03 -0.28 0.00 -0.90 -3.04 0.00 0.00 177.10 172.86