#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vrp n PRO 3 N 1.55 0.35 -1.27 0.00 -0.04 -1.26 -4.76 135.00 129.58 2vrp n PRO 3 Ca -0.18 0.14 -0.43 0.00 -0.04 0.00 0.00 63.50 62.99 2vrp n PRO 3 Cb 0.53 -1.44 -0.02 0.00 -0.04 0.00 0.00 33.50 32.53 2vrp n PRO 3 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2vrp n SER 4 N 1.27 -1.48 0.00 3.54 2.88 -1.26 -1.56 113.62 117.01 2vrp n SER 4 Ca 0.10 0.97 0.00 0.00 -1.33 0.00 0.00 58.87 58.62 2vrp n SER 4 Cb 0.46 -0.86 0.00 0.00 -0.75 0.00 0.00 64.21 63.06 2vrp n SER 4 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2vrp n GLY 5 N 1.91 2.86 3.97 0.46 0.00 -1.26 -4.99 105.19 108.14 2vrp n GLY 5 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 2vrp n GLY 5 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2vrp s TRP 6 N -2.24 3.29 -0.00 1.61 0.52 -0.60 -4.83 118.94 116.68 2vrp s TRP 6 Ca 0.00 -0.11 0.04 0.00 0.02 0.00 0.00 56.10 56.04 2vrp s TRP 6 Cb 0.00 -1.75 -0.01 0.00 -1.15 0.00 0.00 33.47 30.56 2vrp s TRP 6 CO 0.00 0.25 -0.12 -1.12 0.02 0.00 0.00 176.95 175.98 2vrp s SER 7 N -4.06 1.40 -0.12 2.95 0.01 0.43 -4.82 113.70 109.49 2vrp s SER 7 Ca 0.39 -0.24 -0.07 0.00 1.31 0.00 0.00 55.95 57.33 2vrp s SER 7 Cb -0.09 -0.14 -0.04 0.00 0.21 0.00 0.00 66.02 65.95 2vrp s SER 7 CO 0.30 0.13 0.14 -0.94 0.41 0.00 0.00 173.24 173.27 2vrp s SER 8 N -0.39 6.35 -0.06 2.44 1.04 -1.26 0.53 113.70 122.34 2vrp s SER 8 Ca 0.04 0.45 -0.03 0.00 0.48 0.00 0.00 55.95 56.89 2vrp s SER 8 Cb -0.05 -2.06 0.04 0.00 0.10 0.00 0.00 66.02 64.05 2vrp s SER 8 CO -0.00 0.39 0.10 -0.47 0.98 0.00 0.00 173.24 174.24 2vrp s TYR 9 N -0.93 -0.04 -1.28 5.02 5.04 -0.52 -4.97 117.35 119.67 2vrp s TYR 9 Ca 0.14 0.40 -0.00 0.00 -2.44 0.00 0.00 57.07 55.17 2vrp s TYR 9 Cb -0.12 -0.39 -0.00 0.00 0.35 0.00 0.00 41.96 41.80 2vrp s TYR 9 CO 0.04 -0.23 0.77 -1.91 -1.34 0.00 0.00 175.55 172.87 2vrp n GLU 10 N 5.31 -5.15 -0.89 4.97 2.13 -1.26 -2.05 120.64 123.70 2vrp n GLU 10 Ca -0.04 0.67 0.00 0.00 0.66 0.00 0.00 57.16 58.45 2vrp n GLU 10 Cb 0.50 -5.32 0.00 0.00 0.27 0.00 0.00 31.44 26.89 2vrp n GLU 10 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2vrp n GLY 11 N -1.48 0.76 3.26 8.31 0.00 -1.26 -5.03 105.19 109.76 2vrp n GLY 11 Ca -0.29 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 2vrp n GLY 11 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vrp s HIS 12 N -2.94 1.45 -0.00 1.61 3.76 -0.87 -0.75 115.29 117.55 2vrp s HIS 12 Ca 0.00 -0.57 0.08 0.00 -0.15 0.00 0.00 55.06 54.42 2vrp s HIS 12 Cb 0.00 -0.74 -0.02 0.00 1.11 0.00 0.00 32.58 32.92 2vrp s HIS 12 CO 0.00 0.17 -0.24 0.00 -0.85 0.00 0.00 174.74 173.82 2vrp s TYR 14 N -0.69 1.02 -0.04 0.00 1.51 0.19 -1.34 117.35 118.00 2vrp s TYR 14 Ca 0.11 -0.24 -0.01 0.00 -1.01 0.00 0.00 57.07 55.92 2vrp s TYR 14 Cb -0.10 -0.64 0.03 0.00 -0.11 0.00 0.00 41.96 41.14 2vrp s TYR 14 CO 0.00 -0.01 0.07 0.21 -1.11 0.00 0.00 175.55 174.72 2vrp s LYS 15 N -0.54 -0.01 0.45 -0.62 2.20 -0.54 -0.43 119.74 120.27 2vrp s LYS 15 Ca 0.03 0.28 -0.21 0.00 -0.36 0.00 0.00 55.97 55.72 2vrp s LYS 15 Cb -0.05 -0.27 -0.10 0.00 -1.51 0.00 0.00 37.83 35.90 2vrp s LYS 15 CO 0.00 -0.20 0.99 -1.25 -0.36 0.00 0.00 175.35 174.53 2vrp s PRO 16 N 1.32 4.06 -0.11 4.03 0.04 -1.26 -0.71 135.00 142.36 2vrp s PRO 16 Ca -0.06 1.22 -0.04 0.00 0.04 0.00 0.00 61.00 62.16 2vrp s PRO 16 Cb -0.12 -2.15 0.06 0.00 0.04 0.00 0.00 34.50 32.33 2vrp s PRO 16 CO -0.04 -0.19 0.16 -0.06 0.04 0.00 0.00 177.00 176.91 2vrp s PHE 17 N -2.10 -0.13 -1.19 0.56 0.08 -0.25 -4.95 117.98 110.00 2vrp s PHE 17 Ca 0.64 0.40 -0.12 0.00 0.12 0.00 0.00 56.93 57.97 2vrp s PHE 17 Cb -0.12 -0.35 0.21 0.00 -0.57 0.00 0.00 43.02 42.19 2vrp s PHE 17 CO 0.16 -0.36 1.40 -1.71 -0.10 0.00 0.00 175.22 174.61 2vrp n ASN 18 N 5.32 5.35 -3.16 1.36 2.85 -1.26 -2.35 115.26 123.37 2vrp n ASN 18 Ca -0.05 -3.03 0.03 0.00 -0.11 0.00 0.00 54.58 51.43 2vrp n ASN 18 Cb 0.50 -1.50 -0.00 0.00 1.24 0.00 0.00 39.78 40.02 2vrp n ASN 18 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 2vrp s GLU 19 N 0.49 0.58 -0.19 1.20 2.56 -1.26 -5.03 118.70 117.05 2vrp s GLU 19 Ca 0.39 0.34 -0.34 0.00 0.00 0.00 0.00 54.97 55.36 2vrp s GLU 19 Cb -0.03 0.20 -0.11 0.00 2.00 0.00 0.00 34.13 36.19 2vrp s GLU 19 CO -0.01 -1.02 2.00 -2.30 -0.56 0.00 0.00 175.26 173.36 2vrp n PRO 20 N 5.16 1.80 -4.26 4.30 -0.02 -1.25 -4.55 135.00 136.18 2vrp n PRO 20 Ca 0.07 0.61 -0.20 0.00 -2.02 0.00 0.00 63.50 61.95 2vrp n PRO 20 Cb 0.55 -2.64 -0.12 0.00 -0.02 0.00 0.00 33.50 31.28 2vrp n PRO 20 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2vrp s LYS 21 N 4.90 1.06 0.81 -0.52 1.02 0.21 -4.77 119.74 122.45 2vrp s LYS 21 Ca 0.99 -1.21 -0.11 0.00 0.02 0.00 0.00 55.97 55.66 2vrp s LYS 21 Cb -0.71 -1.09 0.08 0.00 -0.52 0.00 0.00 37.83 35.58 2vrp s LYS 21 CO 0.50 0.23 1.10 0.54 -0.92 0.00 0.00 175.35 176.80 2vrp s ASN 22 N -2.24 4.16 0.20 2.83 2.20 -1.24 -1.16 114.94 119.68 2vrp s ASN 22 Ca 0.08 1.81 -0.16 0.00 -0.94 0.00 0.00 52.86 53.65 2vrp s ASN 22 Cb -0.07 -2.47 0.19 0.00 -2.00 0.00 0.00 41.25 36.90 2vrp s ASN 22 CO 0.04 -2.25 1.62 -0.25 -2.94 0.00 0.00 177.10 173.31 2vrp h TRP 23 N -1.28 -0.48 -0.45 1.54 7.01 -1.60 0.99 115.95 121.68 2vrp h TRP 23 Ca -0.45 0.06 0.00 0.00 2.11 0.00 0.00 58.89 60.61 2vrp h TRP 23 Cb 1.24 0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 28.58 2vrp h TRP 23 CO 0.55 -0.30 0.28 0.00 -2.79 0.00 0.00 178.44 176.18 2vrp h ALA 24 N 1.41 0.57 -0.76 2.65 0.00 -1.93 0.14 119.26 121.35 2vrp h ALA 24 Ca 0.27 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 2vrp h ALA 24 Cb 0.48 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2vrp h ALA 24 CO -0.62 0.04 0.25 -0.44 0.00 0.00 0.00 179.25 178.48 2vrp h ASP 25 N 0.60 1.08 -0.36 0.00 3.45 -1.72 0.35 116.42 119.82 2vrp h ASP 25 Ca 0.16 -0.19 -0.08 0.00 0.43 0.00 0.00 57.03 57.35 2vrp h ASP 25 Cb -0.04 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.44 2vrp h ASP 25 CO -0.03 0.99 -0.09 0.00 -1.57 0.00 0.00 179.24 178.53 2vrp h ALA 26 N 1.15 0.50 -0.37 3.45 0.00 -0.48 -0.17 119.26 123.34 2vrp h ALA 26 Ca 0.25 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2vrp h ALA 26 Cb 0.28 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2vrp h ALA 26 CO -0.01 0.35 -0.15 1.49 0.00 0.00 0.00 179.25 180.93 2vrp h GLU 27 N 0.49 0.75 -0.53 0.00 4.57 -0.63 -2.63 114.58 116.61 2vrp h GLU 27 Ca 0.09 -0.32 0.08 0.00 -1.18 0.00 0.00 59.36 58.03 2vrp h GLU 27 Cb 0.60 -0.03 -0.10 0.00 -0.16 0.00 0.00 28.75 29.07 2vrp h GLU 27 CO 0.04 0.93 -0.44 -0.09 -1.18 0.00 0.00 179.01 178.27 2vrp h ARG 28 N 0.55 -0.25 -0.97 1.92 2.43 -0.22 -1.51 114.38 116.33 2vrp h ARG 28 Ca 0.09 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.34 2vrp h ARG 28 Cb 0.69 0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 30.23 2vrp h ARG 28 CO 0.05 -0.17 0.62 0.35 -1.51 0.00 0.00 179.97 179.32 2vrp h PHE 29 N -0.26 1.16 -0.10 2.20 3.57 -0.85 -0.15 116.94 122.51 2vrp h PHE 29 Ca 0.16 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.69 2vrp h PHE 29 Cb 0.57 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 38.93 2vrp h PHE 29 CO -0.69 0.59 0.05 0.00 -2.23 0.00 0.00 178.31 176.03 2vrp h LYS 31 N 0.06 0.84 0.00 0.00 1.79 -0.03 -1.19 116.57 118.03 2vrp h LYS 31 Ca 0.04 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2vrp h LYS 31 Cb 0.10 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 30.56 2vrp h LYS 31 CO -0.01 0.55 0.00 1.28 -1.08 0.00 0.00 179.45 180.20 2vrp n LEU 32 N -4.48 0.00 -4.75 2.94 4.32 -0.25 -4.27 117.00 110.51 2vrp n LEU 32 Ca 0.12 0.32 -0.37 0.00 -0.02 0.00 0.00 56.01 56.05 2vrp n LEU 32 Cb 0.21 -0.32 0.03 0.00 -1.62 0.00 0.00 43.42 41.72 2vrp n LEU 32 CO 0.33 -0.21 0.91 -1.10 -1.22 0.00 0.00 177.39 176.10 2vrp s GLN 33 N -2.63 3.21 0.25 3.23 -1.52 -0.49 -4.92 119.66 116.79 2vrp s GLN 33 Ca 0.09 2.01 -0.04 0.00 -1.95 0.00 0.00 55.36 55.48 2vrp s GLN 33 Cb 0.07 -2.19 0.45 0.00 -0.22 0.00 0.00 33.01 31.12 2vrp s GLN 33 CO 0.16 -1.06 1.75 -1.35 -0.25 0.00 0.00 175.29 174.54 2vrp h PRO 34 N 1.41 0.54 -5.52 2.91 0.11 -1.90 -2.98 132.00 126.57 2vrp h PRO 34 Ca -0.50 -0.03 -0.62 0.00 0.11 0.00 0.00 66.00 64.95 2vrp h PRO 34 Cb 1.29 -0.12 -0.13 0.00 0.11 0.00 0.00 31.00 32.15 2vrp h PRO 34 CO 0.57 0.35 0.17 0.21 -0.21 0.00 0.00 178.00 179.09 2vrp s LYS 35 N -6.01 3.79 0.18 1.05 2.47 -1.26 -5.04 119.74 114.92 2vrp s LYS 35 Ca -0.12 0.19 -0.32 0.00 -1.56 0.00 0.00 55.97 54.15 2vrp s LYS 35 Cb 0.20 -3.77 -0.12 0.00 -1.46 0.00 0.00 37.83 32.68 2vrp s LYS 35 CO 0.77 -0.67 1.72 1.58 0.16 0.00 0.00 175.35 178.91 2vrp n HIS 36 N 6.00 2.63 -4.21 4.03 -0.00 -1.13 -4.98 115.22 117.57 2vrp n HIS 36 Ca -0.01 0.05 -0.12 0.00 -0.00 0.00 0.00 57.72 57.63 2vrp n HIS 36 Cb 0.49 -2.66 -0.10 0.00 -0.00 0.00 0.00 29.99 27.71 2vrp n HIS 36 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2vrp s SER 37 N 1.47 0.28 0.34 0.26 1.04 -0.99 -4.90 113.70 111.20 2vrp s SER 37 Ca 0.77 -1.38 0.07 0.00 0.48 0.00 0.00 55.95 55.89 2vrp s SER 37 Cb -0.54 0.35 -0.07 0.00 0.10 0.00 0.00 66.02 65.87 2vrp s SER 37 CO 0.35 -0.82 -0.02 -1.00 0.98 0.00 0.00 173.24 172.73 2vrp s HIS 38 N -4.11 2.20 0.49 5.02 3.76 -0.95 -1.61 115.29 120.09 2vrp s HIS 38 Ca 0.38 -0.72 -0.23 0.00 -0.15 0.00 0.00 55.06 54.34 2vrp s HIS 38 Cb 0.07 -1.40 -0.08 0.00 1.11 0.00 0.00 32.58 32.28 2vrp s HIS 38 CO 0.11 0.32 1.18 1.28 -0.85 0.00 0.00 174.74 176.78 2vrp n LEU 39 N -0.76 4.05 -4.69 0.89 4.77 -1.26 -1.00 117.00 118.99 2vrp n LEU 39 Ca -0.04 1.00 -0.43 0.00 -0.03 0.00 0.00 56.01 56.51 2vrp n LEU 39 Cb 0.65 -1.47 -0.01 0.00 -2.33 0.00 0.00 43.42 40.26 2vrp n LEU 39 CO 0.44 -1.04 0.91 0.55 -1.33 0.00 0.00 177.39 176.92 2vrp n VAL 40 N -0.77 1.79 -4.23 4.08 3.14 0.00 -4.24 118.33 118.11 2vrp n VAL 40 Ca 0.09 -0.45 -0.27 0.00 -2.96 0.00 0.00 64.34 60.76 2vrp n VAL 40 Cb 0.42 -1.53 -0.08 0.00 -1.06 0.00 0.00 33.84 31.59 2vrp n VAL 40 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 2vrp s SER 41 N -0.20 4.59 -0.14 6.55 1.04 -1.26 -0.42 113.70 123.87 2vrp s SER 41 Ca 0.58 -0.45 0.01 0.00 0.48 0.00 0.00 55.95 56.57 2vrp s SER 41 Cb -0.59 -0.92 -0.00 0.00 0.10 0.00 0.00 66.02 64.61 2vrp s SER 41 CO 0.60 0.10 -0.17 -0.36 0.98 0.00 0.00 173.24 174.39 2vrp s PHE 42 N -1.68 2.73 -0.38 5.02 0.08 -1.26 -4.98 117.98 117.52 2vrp s PHE 42 Ca 0.26 -0.96 0.11 0.00 0.12 0.00 0.00 56.93 56.47 2vrp s PHE 42 Cb -0.09 -1.83 -0.13 0.00 -0.57 0.00 0.00 43.02 40.39 2vrp s PHE 42 CO 0.17 -0.40 0.40 1.04 -0.10 0.00 0.00 175.22 176.34 2vrp n GLN 43 N 3.80 2.53 -3.76 0.44 1.13 -1.26 -5.04 117.38 115.21 2vrp n GLN 43 Ca -0.19 -0.03 -0.10 0.00 -1.94 0.00 0.00 57.00 54.75 2vrp n GLN 43 Cb 0.52 -1.09 -0.05 0.00 0.11 0.00 0.00 30.24 29.73 2vrp n GLN 43 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2vrp s SER 44 N -2.39 -0.12 0.24 1.08 1.04 -1.26 -5.05 113.70 107.24 2vrp s SER 44 Ca 0.02 -0.52 -0.07 0.00 0.48 0.00 0.00 55.95 55.85 2vrp s SER 44 Cb 0.08 0.46 0.23 0.00 0.10 0.00 0.00 66.02 66.89 2vrp s SER 44 CO 0.46 -0.88 1.91 0.00 0.98 0.00 0.00 173.24 175.71 2vrp h ALA 45 N 2.44 1.16 -0.15 5.32 0.00 -1.99 -2.46 119.26 123.58 2vrp h ALA 45 Ca -0.32 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.46 2vrp h ALA 45 Cb 1.24 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2vrp h ALA 45 CO 0.47 0.54 -0.21 0.93 0.00 0.00 0.00 179.25 180.98 2vrp h GLU 46 N 1.22 0.26 -0.22 0.00 3.07 -1.98 0.12 114.58 117.05 2vrp h GLU 46 Ca 0.34 -0.08 -0.21 0.00 -0.50 0.00 0.00 59.36 58.91 2vrp h GLU 46 Cb -0.12 -0.03 0.01 0.00 -0.84 0.00 0.00 28.75 27.77 2vrp h GLU 46 CO -0.08 0.47 -0.67 1.49 -1.40 0.00 0.00 179.01 178.82 2vrp h GLU 47 N 0.24 0.84 -0.52 2.33 4.81 -1.93 -2.07 114.58 118.28 2vrp h GLU 47 Ca 0.04 -0.61 -0.01 0.00 -0.13 0.00 0.00 59.36 58.66 2vrp h GLU 47 Cb 0.52 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 2vrp h GLU 47 CO 0.04 1.23 0.29 0.00 -0.73 0.00 0.00 179.01 179.83 2vrp h ALA 48 N 0.62 0.66 -0.23 2.92 0.00 -0.93 -1.63 119.26 120.68 2vrp h ALA 48 Ca -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2vrp h ALA 48 Cb 1.29 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2vrp h ALA 48 CO 0.14 0.17 0.08 -0.44 0.00 0.00 0.00 179.25 179.21 2vrp h ASP 49 N 0.69 0.29 -0.09 0.00 3.32 -0.78 -1.76 116.42 118.09 2vrp h ASP 49 Ca 0.18 -0.02 -0.24 0.00 0.02 0.00 0.00 57.03 56.97 2vrp h ASP 49 Cb 0.03 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.52 2vrp h ASP 49 CO -0.03 0.27 -0.86 0.15 -1.72 0.00 0.00 179.24 177.05 2vrp h PHE 50 N 0.32 1.04 -0.50 4.55 3.57 -1.15 -3.00 116.94 121.78 2vrp h PHE 50 Ca 0.08 -0.50 -0.11 0.00 3.53 0.00 0.00 57.97 60.97 2vrp h PHE 50 Cb 0.09 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 2vrp h PHE 50 CO 0.00 1.34 -0.14 0.28 -2.23 0.00 0.00 178.31 177.56 2vrp h VAL 51 N 0.45 1.27 0.00 1.41 2.07 -1.02 -2.80 116.25 117.62 2vrp h VAL 51 Ca -0.08 -1.27 -0.08 0.00 0.82 0.00 0.00 66.70 66.09 2vrp h VAL 51 Cb 1.51 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 2vrp h VAL 51 CO 0.17 0.44 -0.37 -0.37 0.02 0.00 0.00 177.57 177.47 2vrp h VAL 52 N 0.84 0.97 -0.88 2.57 -1.51 -1.41 -1.24 116.25 115.59 2vrp h VAL 52 Ca 0.13 -1.41 0.00 0.00 -1.23 0.00 0.00 66.70 64.18 2vrp h VAL 52 Cb 0.68 1.83 -0.04 0.00 -2.13 0.00 0.00 31.29 31.64 2vrp h VAL 52 CO 0.05 0.36 0.55 0.50 -1.23 0.00 0.00 177.57 177.80 2vrp h LYS 53 N 0.00 1.18 -0.42 5.19 3.64 -1.35 -1.61 116.57 123.19 2vrp h LYS 53 Ca -0.00 -0.09 -0.08 0.00 -1.27 0.00 0.00 60.65 59.20 2vrp h LYS 53 Cb 0.81 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 2vrp h LYS 53 CO 0.05 0.81 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.93 2vrp h LEU 54 N 1.20 0.77 -0.45 5.20 3.38 -1.18 -3.32 115.31 120.90 2vrp h LEU 54 Ca 0.32 -0.33 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 2vrp h LEU 54 Cb -0.08 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 2vrp h LEU 54 CO -0.06 0.91 -0.57 0.71 0.09 0.00 0.00 178.44 179.53 2vrp h THR 55 N 0.60 1.31 -0.36 0.22 1.35 -1.01 -3.37 112.91 111.65 2vrp h THR 55 Ca 0.11 -1.81 0.08 0.00 -0.55 0.00 0.00 66.41 64.24 2vrp h THR 55 Cb 0.55 1.76 -0.08 0.00 -1.73 0.00 0.00 68.15 68.65 2vrp h THR 55 CO 0.03 0.57 -0.16 0.03 -0.25 0.00 0.00 175.52 175.74 2vrp h ARG 56 N 0.48 -0.09 -0.58 4.72 3.08 -1.27 0.14 114.38 120.85 2vrp h ARG 56 Ca 0.01 0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.10 2vrp h ARG 56 Cb 1.13 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 31.16 2vrp h ARG 56 CO 0.11 -0.06 0.33 -1.35 -1.07 0.00 0.00 179.97 177.93 2vrp h PRO 57 N -0.10 0.62 0.00 0.04 0.11 -1.76 -3.18 132.00 127.73 2vrp h PRO 57 Ca 0.18 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 66.11 2vrp h PRO 57 Cb 0.37 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.32 2vrp h PRO 57 CO -0.42 0.41 -1.53 -2.13 -0.21 0.00 0.00 178.00 174.11 2vrp n ARG 58 N -4.80 0.23 0.13 1.05 0.63 -1.18 -4.76 116.66 107.97 2vrp n ARG 58 Ca 0.06 0.06 0.02 0.00 -0.92 0.00 0.00 57.85 57.06 2vrp n ARG 58 Cb 0.12 -1.17 0.01 0.00 0.45 0.00 0.00 32.46 31.87 2vrp n ARG 58 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2vrp h LEU 59 N -0.02 0.00 -9.78 6.15 4.07 -0.89 -3.47 115.31 111.38 2vrp h LEU 59 Ca -0.21 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.23 2vrp h LEU 59 Cb 1.32 0.00 0.05 0.00 1.08 0.00 0.00 40.66 43.11 2vrp h LEU 59 CO -0.04 0.54 0.65 -0.75 -1.08 0.00 0.00 178.44 177.76 2vrp s LYS 60 N -2.94 4.38 -0.75 1.13 2.20 -0.99 -1.24 119.74 121.53 2vrp s LYS 60 Ca 0.04 2.13 0.03 0.00 -0.36 0.00 0.00 55.97 57.81 2vrp s LYS 60 Cb 0.08 -3.14 0.23 0.00 -1.51 0.00 0.00 37.83 33.49 2vrp s LYS 60 CO 0.75 -0.21 0.77 0.00 -0.36 0.00 0.00 175.35 176.30 2vrp n ALA 61 N 1.77 3.97 -2.30 3.13 0.00 -1.26 -4.99 120.51 120.83 2vrp n ALA 61 Ca 0.03 -4.69 -0.28 0.00 0.00 0.00 0.00 53.44 48.50 2vrp n ALA 61 Cb 0.42 -1.22 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 2vrp n ALA 61 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2vrp s ASN 62 N -1.75 6.37 0.38 0.00 0.01 -0.37 -4.66 114.94 114.92 2vrp s ASN 62 Ca 0.33 0.94 -0.26 0.00 -0.71 0.00 0.00 52.86 53.15 2vrp s ASN 62 Cb 0.05 -2.24 -0.09 0.00 0.41 0.00 0.00 41.25 39.38 2vrp s ASN 62 CO -0.06 -0.46 1.20 -0.76 -1.51 0.00 0.00 177.10 175.51 2vrp s LEU 63 N -4.28 4.27 -0.08 0.60 1.02 -1.26 -1.21 118.68 117.74 2vrp s LEU 63 Ca 0.48 2.43 0.03 0.00 0.02 0.00 0.00 54.13 57.08 2vrp s LEU 63 Cb -0.10 -3.91 0.01 0.00 0.02 0.00 0.00 46.19 42.21 2vrp s LEU 63 CO 0.38 -0.62 -0.15 0.54 0.02 0.00 0.00 176.35 176.52 2vrp s VAL 64 N -1.33 1.40 0.32 -1.59 0.11 0.31 -1.43 120.40 118.20 2vrp s VAL 64 Ca 0.54 -0.63 -0.29 0.00 -2.93 0.00 0.00 61.98 58.68 2vrp s VAL 64 Cb -0.33 -1.26 -0.10 0.00 -1.53 0.00 0.00 36.38 33.16 2vrp s VAL 64 CO 0.42 0.42 1.37 0.26 -3.33 0.00 0.00 175.10 174.24 2vrp s TRP 65 N 0.65 2.97 0.47 1.54 0.23 0.19 -2.11 118.94 122.89 2vrp s TRP 65 Ca -0.14 1.28 0.06 0.00 -2.03 0.00 0.00 56.10 55.27 2vrp s TRP 65 Cb -0.16 -3.77 -0.01 0.00 0.03 0.00 0.00 33.47 29.56 2vrp s TRP 65 CO 0.04 -2.24 0.28 0.00 0.96 0.00 0.00 176.95 175.99 2vrp s MET 66 N -1.46 2.29 -0.15 4.98 0.23 -0.80 -3.92 119.30 120.46 2vrp s MET 66 Ca 0.52 -1.90 -0.01 0.00 -1.03 0.00 0.00 55.69 53.28 2vrp s MET 66 Cb -0.41 -2.06 0.09 0.00 -1.53 0.00 0.00 34.83 30.92 2vrp s MET 66 CO 0.52 -0.33 2.08 0.41 -2.03 0.00 0.00 175.02 175.67 2vrp n GLY 67 N -1.48 3.28 3.10 3.16 0.00 0.44 -4.69 105.19 109.00 2vrp n GLY 67 Ca -0.02 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 45.10 2vrp n GLY 67 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vrp s LEU 68 N -0.87 2.44 0.18 0.99 1.43 -1.26 -4.99 118.68 116.60 2vrp s LEU 68 Ca 0.17 -0.84 0.07 0.00 -1.03 0.00 0.00 54.13 52.50 2vrp s LEU 68 Cb 0.13 -1.47 -0.04 0.00 0.03 0.00 0.00 46.19 44.83 2vrp s LEU 68 CO -0.01 -0.06 -0.14 -0.94 0.23 0.00 0.00 176.35 175.44 2vrp s SER 69 N 1.26 2.38 -1.23 2.29 1.04 -1.26 -0.79 113.70 117.39 2vrp s SER 69 Ca 0.01 -0.98 -0.12 0.00 0.48 0.00 0.00 55.95 55.34 2vrp s SER 69 Cb -0.15 -0.11 -0.01 0.00 0.10 0.00 0.00 66.02 65.86 2vrp s SER 69 CO -0.11 -0.18 0.69 0.59 0.98 0.00 0.00 173.24 175.21 2vrp n ASN 70 N -0.17 -3.48 0.12 7.02 5.03 0.63 -4.87 115.26 119.53 2vrp n ASN 70 Ca -0.10 -0.97 0.13 0.00 0.87 0.00 0.00 54.58 54.51 2vrp n ASN 70 Cb 0.60 -3.47 0.36 0.00 -1.02 0.00 0.00 39.78 36.25 2vrp n ASN 70 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.26 175.59 2vrp h ILE 71 N -1.85 0.00 -0.38 2.41 3.07 -1.77 -2.60 117.51 116.38 2vrp h ILE 71 Ca -0.65 -0.55 0.00 0.00 1.55 0.00 0.00 64.86 65.22 2vrp h ILE 71 Cb 1.36 1.52 0.00 0.00 -0.27 0.00 0.00 36.82 39.43 2vrp h ILE 71 CO 0.53 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 178.42 2vrp n TRP 72 N -2.36 0.69 -0.00 0.16 5.03 -1.26 -4.81 117.44 114.89 2vrp n TRP 72 Ca 0.05 -0.59 -0.00 0.00 3.03 0.00 0.00 57.50 59.99 2vrp n TRP 72 Cb 0.44 -0.11 -0.00 0.00 -1.03 0.00 0.00 31.31 30.62 2vrp n TRP 72 CO 0.00 0.00 0.00 0.45 -0.03 0.00 0.00 177.69 178.11 2vrp h HIS 73 N 2.29 0.00 -0.70 -5.99 3.86 -1.84 -3.39 115.15 109.38 2vrp h HIS 73 Ca 0.00 0.00 -0.39 0.00 -1.16 0.00 0.00 60.37 58.82 2vrp h HIS 73 Cb 0.96 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 29.29 2vrp h HIS 73 CO 0.35 0.00 0.16 0.41 0.86 0.00 0.00 177.93 179.71 2vrp n GLY 74 N 1.99 3.91 3.87 2.45 0.00 -1.26 -4.90 105.19 111.24 2vrp n GLY 74 Ca -0.00 -1.61 -0.31 0.00 0.00 0.00 0.00 46.02 44.10 2vrp n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vrp s ASN 76 N -3.24 6.74 0.20 0.00 3.84 -1.26 -4.96 114.94 116.25 2vrp s ASN 76 Ca 0.53 -2.16 -0.30 0.00 0.21 0.00 0.00 52.86 51.14 2vrp s ASN 76 Cb -0.10 -2.56 -0.08 0.00 -0.55 0.00 0.00 41.25 37.96 2vrp s ASN 76 CO 0.33 -1.25 1.10 0.26 -2.79 0.00 0.00 177.10 174.76 2vrp s TRP 77 N 4.27 3.59 0.22 0.43 0.52 -1.26 -5.06 118.94 121.65 2vrp s TRP 77 Ca 0.50 1.61 -0.02 0.00 0.02 0.00 0.00 56.10 58.21 2vrp s TRP 77 Cb 0.02 -3.28 -0.03 0.00 -1.15 0.00 0.00 33.47 29.03 2vrp s TRP 77 CO 0.01 -0.61 0.20 -0.65 0.02 0.00 0.00 176.95 175.92 2vrp s GLN 78 N -0.56 1.29 -0.04 4.98 -0.21 -1.26 -4.89 119.66 118.97 2vrp s GLN 78 Ca 0.49 -1.60 -0.11 0.00 0.02 0.00 0.00 55.36 54.15 2vrp s GLN 78 Cb -0.30 0.31 -0.05 0.00 1.00 0.00 0.00 33.01 33.97 2vrp s GLN 78 CO 0.36 -0.45 0.30 -1.58 -2.12 0.00 0.00 175.29 171.80 2vrp s TRP 79 N -4.08 3.67 0.18 0.91 0.52 -1.26 -4.99 118.94 113.89 2vrp s TRP 79 Ca 0.37 0.80 0.32 0.00 0.02 0.00 0.00 56.10 57.60 2vrp s TRP 79 Cb 0.05 -2.14 1.35 0.00 -1.15 0.00 0.00 33.47 31.58 2vrp s TRP 79 CO 0.13 0.68 1.98 0.66 0.02 0.00 0.00 176.95 180.42 2vrp h SER 80 N 4.76 0.00 0.12 2.95 4.64 -2.01 -1.39 113.55 122.62 2vrp h SER 80 Ca -0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 2vrp h SER 80 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2vrp h SER 80 CO 0.60 0.06 -0.06 -0.90 -0.87 0.00 0.00 176.83 175.67 2vrp n ASP 81 N -3.21 0.80 0.00 4.97 3.85 -1.26 -4.95 116.55 116.75 2vrp n ASP 81 Ca -0.00 -1.05 0.00 0.00 -0.71 0.00 0.00 54.79 53.03 2vrp n ASP 81 Cb 0.31 -0.01 0.00 0.00 -1.35 0.00 0.00 41.12 40.07 2vrp n ASP 81 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2vrp n GLY 82 N 1.18 1.62 3.54 6.12 0.00 -0.52 -5.03 105.19 112.09 2vrp n GLY 82 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 2vrp n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vrp n ALA 83 N 0.26 -0.53 -2.08 4.61 0.00 -1.26 -4.89 120.51 116.62 2vrp n ALA 83 Ca 0.00 -0.05 -0.42 0.00 0.00 0.00 0.00 53.44 52.97 2vrp n ALA 83 Cb 0.00 -1.98 -0.03 0.00 0.00 0.00 0.00 19.45 17.44 2vrp n ALA 83 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2vrp s ARG 84 N -2.56 4.28 -1.28 0.00 1.81 -1.26 -4.26 118.95 115.69 2vrp s ARG 84 Ca 0.72 2.18 -0.19 0.00 -1.72 0.00 0.00 55.73 56.72 2vrp s ARG 84 Cb -0.41 -3.27 0.04 0.00 -0.45 0.00 0.00 34.95 30.86 2vrp s ARG 84 CO 0.51 -0.52 1.77 -1.17 -0.68 0.00 0.00 175.30 175.21 2vrp s LEU 85 N 1.32 3.70 -0.02 2.53 2.96 -1.26 -4.61 118.68 123.30 2vrp s LEU 85 Ca 0.67 -2.31 -0.02 0.00 -0.22 0.00 0.00 54.13 52.25 2vrp s LEU 85 Cb -0.39 -2.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.71 2vrp s LEU 85 CO 0.30 -1.50 -0.03 -3.20 -1.32 0.00 0.00 176.35 170.61 2vrp n ASN 86 N 9.41 0.19 -4.70 3.68 5.15 -1.26 -4.93 115.26 122.81 2vrp n ASN 86 Ca 0.48 0.07 -0.43 0.00 -0.60 0.00 0.00 54.58 54.10 2vrp n ASN 86 Cb 0.46 -0.53 -0.02 0.00 -0.53 0.00 0.00 39.78 39.17 2vrp n ASN 86 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2vrp n TYR 87 N -2.66 2.38 -4.09 1.20 4.19 -1.26 -5.02 117.16 111.89 2vrp n TYR 87 Ca -0.01 0.43 -0.14 0.00 3.31 0.00 0.00 57.90 61.49 2vrp n TYR 87 Cb 0.05 -2.48 -0.11 0.00 0.49 0.00 0.00 39.34 37.29 2vrp n TYR 87 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 2vrp s LYS 88 N -0.97 0.60 -0.46 2.98 1.02 -1.26 -5.10 119.74 116.55 2vrp s LYS 88 Ca 0.63 -0.83 0.06 0.00 0.02 0.00 0.00 55.97 55.85 2vrp s LYS 88 Cb -0.58 -0.38 0.28 0.00 -0.52 0.00 0.00 37.83 36.63 2vrp s LYS 88 CO 0.54 0.07 0.96 -3.47 -0.92 0.00 0.00 175.35 172.53 2vrp n ASP 89 N 1.32 -2.24 -4.81 2.83 2.03 -1.26 -5.16 116.55 109.27 2vrp n ASP 89 Ca -0.22 -3.43 -0.37 0.00 0.52 0.00 0.00 54.79 51.30 2vrp n ASP 89 Cb 0.55 1.58 -0.06 0.00 -0.72 0.00 0.00 41.12 42.47 2vrp n ASP 89 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 2vrp s TRP 90 N 0.20 3.72 0.77 -0.67 0.52 -1.26 -5.09 118.94 117.13 2vrp s TRP 90 Ca 0.28 1.43 -0.14 0.00 0.02 0.00 0.00 56.10 57.69 2vrp s TRP 90 Cb 0.26 -2.64 0.06 0.00 -1.15 0.00 0.00 33.47 30.00 2vrp s TRP 90 CO -0.14 0.39 1.22 -0.65 0.02 0.00 0.00 176.95 177.79 2vrp s GLN 91 N -1.74 1.86 -0.74 4.98 -1.52 -1.26 -4.96 119.66 116.29 2vrp s GLN 91 Ca 0.40 1.82 -0.02 0.00 -1.95 0.00 0.00 55.36 55.61 2vrp s GLN 91 Cb -0.18 -1.79 0.00 0.00 -0.22 0.00 0.00 33.01 30.82 2vrp s GLN 91 CO 0.22 -2.06 0.25 0.39 -0.25 0.00 0.00 175.29 173.84 2vrp n GLU 92 N -2.97 -2.08 -3.63 2.91 -0.58 -1.26 -4.95 120.64 108.07 2vrp n GLU 92 Ca 0.14 0.43 -0.12 0.00 -0.42 0.00 0.00 57.16 57.19 2vrp n GLU 92 Cb 0.50 -4.30 -0.07 0.00 -0.57 0.00 0.00 31.44 27.00 2vrp n GLU 92 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 2vrp s GLN 93 N -4.99 0.77 -0.04 3.49 -2.07 -1.26 -5.16 119.66 110.40 2vrp s GLN 93 Ca 0.12 1.01 -0.02 0.00 -1.82 0.00 0.00 55.36 54.64 2vrp s GLN 93 Cb -0.05 0.33 0.02 0.00 -1.09 0.00 0.00 33.01 32.21 2vrp s GLN 93 CO 0.15 -0.11 0.09 0.45 -1.32 0.00 0.00 175.29 174.55 2vrp s SER 94 N 0.66 -0.07 0.10 12.60 0.15 -1.26 -5.06 113.70 120.82 2vrp s SER 94 Ca -0.02 0.18 0.07 0.00 0.70 0.00 0.00 55.95 56.88 2vrp s SER 94 Cb -0.05 0.14 -0.04 0.00 -1.71 0.00 0.00 66.02 64.36 2vrp s SER 94 CO -0.05 -0.07 -0.11 -1.61 1.20 0.00 0.00 173.24 172.61 2vrp s GLU 95 N 0.44 2.12 0.15 5.44 2.02 -1.26 -1.38 118.70 126.23 2vrp s GLU 95 Ca -0.03 -1.02 0.04 0.00 0.02 0.00 0.00 54.97 53.97 2vrp s GLU 95 Cb -0.05 -2.30 -0.05 0.00 0.10 0.00 0.00 34.13 31.84 2vrp s GLU 95 CO -0.02 0.51 -0.07 0.00 0.02 0.00 0.00 175.26 175.70 2vrp s LEU 97 N -3.17 3.81 0.17 0.00 1.43 0.03 -0.47 118.68 120.48 2vrp s LEU 97 Ca 0.18 0.17 -0.04 0.00 -1.03 0.00 0.00 54.13 53.41 2vrp s LEU 97 Cb 0.04 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 2vrp s LEU 97 CO 0.01 0.33 0.17 0.00 0.23 0.00 0.00 176.35 177.09 2vrp s ALA 98 N -1.06 0.62 0.09 4.21 0.00 -0.02 -1.91 121.76 123.70 2vrp s ALA 98 Ca 0.18 -1.33 0.03 0.00 0.00 0.00 0.00 51.96 50.84 2vrp s ALA 98 Cb -0.12 1.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.99 2vrp s ALA 98 CO 0.08 -0.59 -0.08 -0.59 0.00 0.00 0.00 175.76 174.58 2vrp s PHE 99 N -4.05 0.95 0.53 0.00 -0.12 -0.90 0.58 117.98 114.97 2vrp s PHE 99 Ca 0.26 -0.74 -0.18 0.00 -0.05 0.00 0.00 56.93 56.21 2vrp s PHE 99 Cb 0.06 -0.53 -0.07 0.00 -0.63 0.00 0.00 43.02 41.85 2vrp s PHE 99 CO 0.05 -0.06 1.04 1.03 -0.05 0.00 0.00 175.22 177.23 2vrp s ARG 100 N -3.10 3.62 0.00 1.99 0.52 -1.26 -0.53 118.95 120.19 2vrp s ARG 100 Ca 0.07 1.29 0.06 0.00 -0.52 0.00 0.00 55.73 56.62 2vrp s ARG 100 Cb -0.00 -2.07 0.34 0.00 0.52 0.00 0.00 34.95 33.73 2vrp s ARG 100 CO -0.02 -0.57 0.77 0.41 0.02 0.00 0.00 175.30 175.91 2vrp n GLY 101 N -0.58 -0.20 0.00 -3.53 0.00 -0.35 -2.97 105.19 97.55 2vrp n GLY 101 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2vrp n GLY 101 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2vrp n VAL 102 N -0.93 0.00 -4.47 1.61 3.14 -1.26 -3.24 118.33 113.17 2vrp n VAL 102 Ca 0.04 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.19 2vrp n VAL 102 Cb 0.02 -0.49 -0.10 0.00 -1.06 0.00 0.00 33.84 32.21 2vrp n VAL 102 CO 0.00 0.00 0.00 -1.00 -6.46 0.00 0.00 176.83 169.37 2vrp s HIS 103 N -1.79 1.93 -0.90 1.45 3.76 -1.16 -5.03 115.29 113.56 2vrp s HIS 103 Ca 0.00 -1.02 0.25 0.00 -0.15 0.00 0.00 55.06 54.14 2vrp s HIS 103 Cb 0.00 -1.27 0.41 0.00 1.11 0.00 0.00 32.58 32.82 2vrp s HIS 103 CO 0.00 -0.04 1.34 0.25 -0.85 0.00 0.00 174.74 175.44 2vrp n THR 104 N -0.75 0.08 -1.67 1.30 -2.24 -1.26 -4.13 114.28 105.60 2vrp n THR 104 Ca -0.04 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.25 2vrp n THR 104 Cb 0.66 0.20 -0.03 0.00 -2.10 0.00 0.00 70.33 69.06 2vrp n THR 104 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2vrp n GLU 105 N -1.65 2.84 -1.85 -0.78 0.00 -1.26 -4.97 120.64 112.96 2vrp n GLU 105 Ca 0.05 1.04 -0.31 0.00 0.00 0.00 0.00 57.16 57.93 2vrp n GLU 105 Cb 0.36 -2.96 0.02 0.00 0.00 0.00 0.00 31.44 28.86 2vrp n GLU 105 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 2vrp s TRP 106 N 3.66 3.29 -0.08 -1.84 0.52 -1.26 -4.03 118.94 119.20 2vrp s TRP 106 Ca 0.86 1.40 -0.04 0.00 0.02 0.00 0.00 56.10 58.35 2vrp s TRP 106 Cb -0.46 -2.84 0.04 0.00 -1.15 0.00 0.00 33.47 29.06 2vrp s TRP 106 CO 0.40 -0.93 0.18 -1.17 0.02 0.00 0.00 176.95 175.44 2vrp s LEU 107 N -5.07 0.45 -0.09 2.99 1.98 0.19 -4.95 118.68 114.19 2vrp s LEU 107 Ca 0.58 0.37 -0.25 0.00 -2.89 0.00 0.00 54.13 51.94 2vrp s LEU 107 Cb -0.13 0.44 -0.03 0.00 0.66 0.00 0.00 46.19 47.14 2vrp s LEU 107 CO 0.49 -0.18 0.77 0.54 -1.89 0.00 0.00 176.35 176.08 2vrp s ASN 108 N 1.47 7.02 0.06 3.68 2.20 -1.26 -0.84 114.94 127.27 2vrp s ASN 108 Ca -0.06 1.23 0.03 0.00 -0.94 0.00 0.00 52.86 53.12 2vrp s ASN 108 Cb -0.11 -2.44 -0.03 0.00 -2.00 0.00 0.00 41.25 36.66 2vrp s ASN 108 CO -0.07 -0.23 -0.09 -0.04 -2.94 0.00 0.00 177.10 173.74 2vrp s MET 109 N 1.27 0.67 0.07 3.55 -1.94 0.38 -4.96 119.30 118.34 2vrp s MET 109 Ca 0.39 -0.95 -0.34 0.00 -1.71 0.00 0.00 55.69 53.09 2vrp s MET 109 Cb -0.18 -0.38 -0.13 0.00 2.01 0.00 0.00 34.83 36.15 2vrp s MET 109 CO 0.17 0.06 1.68 -3.47 -0.01 0.00 0.00 175.02 173.45 2vrp n ASP 110 N 1.04 3.18 0.22 3.03 2.03 -1.26 -0.12 116.55 124.65 2vrp n ASP 110 Ca -0.20 1.05 0.12 0.00 0.52 0.00 0.00 54.79 56.28 2vrp n ASP 110 Cb 0.56 -1.40 0.63 0.00 -0.72 0.00 0.00 41.12 40.19 2vrp n ASP 110 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2vrp n SER 112 N -2.40 3.93 -4.80 0.00 3.41 -1.26 -2.41 113.62 110.10 2vrp n SER 112 Ca -0.02 -2.10 -0.29 0.00 -0.26 0.00 0.00 58.87 56.20 2vrp n SER 112 Cb 0.20 -0.46 0.11 0.00 -0.26 0.00 0.00 64.21 63.79 2vrp n SER 112 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2vrp s SER 113 N -1.00 4.16 -0.24 4.04 1.04 -0.37 -4.79 113.70 116.54 2vrp s SER 113 Ca 0.45 0.76 0.02 0.00 0.48 0.00 0.00 55.95 57.66 2vrp s SER 113 Cb 0.25 -1.22 0.05 0.00 0.10 0.00 0.00 66.02 65.20 2vrp s SER 113 CO 0.28 -2.12 -0.11 -0.89 0.98 0.00 0.00 173.24 171.38 2vrp s THR 114 N -3.55 1.93 0.39 2.02 2.01 -1.26 -3.62 115.64 113.56 2vrp s THR 114 Ca 0.64 -1.38 0.04 0.00 0.31 0.00 0.00 61.69 61.29 2vrp s THR 114 Cb -0.11 -2.04 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 2vrp s THR 114 CO 0.50 0.04 0.11 0.00 -0.69 0.00 0.00 174.62 174.58 2vrp n SER 116 N -1.12 -0.22 -3.72 0.00 7.64 -0.51 -0.62 113.62 115.07 2vrp n SER 116 Ca -0.05 -1.33 -0.06 0.00 1.01 0.00 0.00 58.87 58.44 2vrp n SER 116 Cb 0.65 -0.80 -0.02 0.00 -1.01 0.00 0.00 64.21 63.03 2vrp n SER 116 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2vrp s PHE 117 N -3.19 -0.21 -0.06 1.43 -0.12 -0.99 0.55 117.98 115.39 2vrp s PHE 117 Ca 0.59 -0.10 0.03 0.00 -0.05 0.00 0.00 56.93 57.40 2vrp s PHE 117 Cb -0.02 0.64 0.00 0.00 -0.63 0.00 0.00 43.02 43.01 2vrp s PHE 117 CO 0.42 -0.90 -0.16 0.08 -0.05 0.00 0.00 175.22 174.60 2vrp s VAL 118 N -3.47 1.43 0.29 -2.49 1.01 -1.25 -1.09 120.40 114.83 2vrp s VAL 118 Ca 0.10 -0.68 -0.03 0.00 0.00 0.00 0.00 61.98 61.37 2vrp s VAL 118 Cb -0.03 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 35.06 2vrp s VAL 118 CO 0.01 0.42 0.54 0.00 0.00 0.00 0.00 175.10 176.06 2vrp s LYS 120 N -3.69 0.25 0.15 0.00 2.20 -0.17 -1.46 119.74 117.01 2vrp s LYS 120 Ca 0.42 0.41 -0.03 0.00 -0.36 0.00 0.00 55.97 56.42 2vrp s LYS 120 Cb -0.11 0.03 -0.03 0.00 -1.51 0.00 0.00 37.83 36.21 2vrp s LYS 120 CO 0.31 -0.09 0.13 -0.59 -0.36 0.00 0.00 175.35 174.75 2vrp s PHE 121 N 0.59 0.77 0.16 4.03 -0.71 -0.45 -2.23 117.98 120.15 2vrp s PHE 121 Ca -0.04 -1.13 -0.28 0.00 -1.04 0.00 0.00 56.93 54.44 2vrp s PHE 121 Cb -0.05 -0.38 -0.08 0.00 -1.21 0.00 0.00 43.02 41.31 2vrp s PHE 121 CO -0.03 -0.59 0.87 0.21 -1.34 0.00 0.00 175.22 174.33 2vrp s LYS 122 N -4.04 4.68 0.00 1.99 2.20 -1.26 -0.43 119.74 122.88 2vrp s LYS 122 Ca 0.24 1.32 0.26 0.00 -0.36 0.00 0.00 55.97 57.43 2vrp s LYS 122 Cb 0.06 -3.31 1.58 0.00 -1.51 0.00 0.00 37.83 34.66 2vrp s LYS 122 CO 0.03 0.44 1.93 0.00 -0.36 0.00 0.00 175.35 177.39