#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bpc s ILE 2 N 0.00 3.97 -0.20 2.12 1.01 -1.26 -4.87 121.20 121.97 3bpc s ILE 2 Ca 0.00 -0.97 -0.18 0.00 0.00 0.00 0.00 60.65 59.50 3bpc s ILE 2 Cb 0.00 -3.19 -0.03 0.00 0.01 0.00 0.00 42.46 39.25 3bpc s ILE 2 CO 0.00 -0.12 0.49 -0.69 0.00 0.00 0.00 174.94 174.62 3bpc s VAL 3 N 1.45 5.13 -0.18 2.92 1.01 -1.26 -4.89 120.40 124.59 3bpc s VAL 3 Ca 0.00 0.90 -0.06 0.00 0.00 0.00 0.00 61.98 62.82 3bpc s VAL 3 Cb -0.19 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 3bpc s VAL 3 CO 0.03 0.20 0.02 -0.04 0.00 0.00 0.00 175.10 175.32 3bpc s MET 4 N 1.53 3.83 -0.02 2.72 1.00 -1.26 -1.29 119.30 125.81 3bpc s MET 4 Ca 0.23 -0.42 0.05 0.00 0.00 0.00 0.00 55.69 55.54 3bpc s MET 4 Cb -0.15 -3.11 -0.01 0.00 0.00 0.00 0.00 34.83 31.56 3bpc s MET 4 CO 0.09 0.22 -0.16 -1.12 0.00 0.00 0.00 175.02 174.05 3bpc s SER 5 N 0.48 1.97 0.19 3.03 0.01 0.45 -4.27 113.70 115.55 3bpc s SER 5 Ca 0.01 -0.31 0.10 0.00 1.31 0.00 0.00 55.95 57.06 3bpc s SER 5 Cb -0.13 -0.32 -0.04 0.00 0.21 0.00 0.00 66.02 65.73 3bpc s SER 5 CO 0.02 0.18 -0.21 -1.10 0.41 0.00 0.00 173.24 172.54 3bpc s GLN 6 N -0.25 1.42 -0.14 12.44 -0.21 -1.26 0.45 119.66 132.11 3bpc s GLN 6 Ca 0.03 -1.49 -0.17 0.00 0.02 0.00 0.00 55.36 53.76 3bpc s GLN 6 Cb -0.08 -1.61 0.04 0.00 1.00 0.00 0.00 33.01 32.37 3bpc s GLN 6 CO 0.00 0.34 0.45 0.45 -2.12 0.00 0.00 175.29 174.40 3bpc s SER 7 N -2.73 -0.44 1.00 5.90 0.15 -0.77 -4.62 113.70 112.19 3bpc s SER 7 Ca 0.19 0.79 -0.15 0.00 0.70 0.00 0.00 55.95 57.48 3bpc s SER 7 Cb -0.07 0.82 0.19 0.00 -1.71 0.00 0.00 66.02 65.25 3bpc s SER 7 CO 0.09 -0.23 1.17 -2.16 1.20 0.00 0.00 173.24 173.31 3bpc s PRO 8 N -0.07 0.42 0.18 5.44 0.04 -1.26 -0.23 135.00 139.53 3bpc s PRO 8 Ca -0.03 0.05 -0.09 0.00 0.04 0.00 0.00 61.00 60.97 3bpc s PRO 8 Cb -0.03 -1.78 0.07 0.00 0.04 0.00 0.00 34.50 32.80 3bpc s PRO 8 CO 0.02 -2.64 1.64 0.77 0.04 0.00 0.00 177.00 176.83 3bpc h SER 9 N -1.81 1.06 -5.01 6.66 0.02 -1.84 -3.40 113.55 109.22 3bpc h SER 9 Ca -0.48 -0.30 -0.03 0.00 -0.84 0.00 0.00 61.79 60.14 3bpc h SER 9 Cb 1.30 -0.28 -0.13 0.00 0.14 0.00 0.00 62.40 63.43 3bpc h SER 9 CO 0.50 1.10 0.16 -0.94 -1.14 0.00 0.00 176.83 176.50 3bpc s SER 10 N -6.56 -0.52 0.14 3.07 1.04 -1.26 -1.24 113.70 108.37 3bpc s SER 10 Ca -0.12 0.04 -0.24 0.00 0.48 0.00 0.00 55.95 56.12 3bpc s SER 10 Cb 0.14 0.57 0.07 0.00 0.10 0.00 0.00 66.02 66.90 3bpc s SER 10 CO 0.86 -0.90 0.64 -1.48 0.98 0.00 0.00 173.24 173.34 3bpc s LEU 11 N -2.54 -0.53 -0.02 2.42 2.34 -0.85 -4.94 118.68 114.56 3bpc s LEU 11 Ca -0.00 -0.03 0.06 0.00 0.06 0.00 0.00 54.13 54.22 3bpc s LEU 11 Cb -0.00 2.53 -0.02 0.00 -0.56 0.00 0.00 46.19 48.14 3bpc s LEU 11 CO -0.10 -0.94 -0.20 0.00 -1.06 0.00 0.00 176.35 174.06 3bpc s ALA 12 N -3.67 1.66 0.01 1.48 0.00 -1.26 -0.82 121.76 119.16 3bpc s ALA 12 Ca 0.02 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.15 3bpc s ALA 12 Cb -0.01 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 3bpc s ALA 12 CO -0.12 0.41 -0.09 0.54 0.00 0.00 0.00 175.76 176.50 3bpc s VAL 13 N -0.46 0.68 0.36 0.00 0.11 -0.77 -4.76 120.40 115.55 3bpc s VAL 13 Ca 0.07 -0.59 -0.25 0.00 -2.93 0.00 0.00 61.98 58.28 3bpc s VAL 13 Cb -0.08 -0.61 -0.09 0.00 -1.53 0.00 0.00 36.38 34.07 3bpc s VAL 13 CO -0.01 0.03 1.04 -0.44 -3.33 0.00 0.00 175.10 172.39 3bpc s SER 14 N -0.62 6.98 0.22 3.54 0.01 -1.26 -0.87 113.70 121.70 3bpc s SER 14 Ca 0.00 2.04 -0.30 0.00 1.31 0.00 0.00 55.95 59.00 3bpc s SER 14 Cb -0.05 -2.59 -0.16 0.00 0.21 0.00 0.00 66.02 63.43 3bpc s SER 14 CO 0.00 -0.33 0.88 0.00 0.41 0.00 0.00 173.24 174.20 3bpc n ALA 15 N 0.31 -1.41 -0.03 1.44 0.00 -1.25 -1.85 120.51 117.70 3bpc n ALA 15 Ca 0.03 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.91 3bpc n ALA 15 Cb 0.49 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.07 3bpc n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bpc n GLY 16 N 1.67 1.36 3.98 0.00 0.00 0.56 -4.89 105.19 107.86 3bpc n GLY 16 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 3bpc n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3bpc s GLU 17 N -0.53 2.40 0.06 1.61 8.01 -0.77 -4.08 118.70 125.40 3bpc s GLU 17 Ca 0.00 -0.89 -0.14 0.00 0.01 0.00 0.00 54.97 53.95 3bpc s GLU 17 Cb 0.00 -2.48 -0.06 0.00 -4.31 0.00 0.00 34.13 27.28 3bpc s GLU 17 CO 0.00 -0.83 0.45 0.21 0.01 0.00 0.00 175.26 175.11 3bpc s LYS 18 N -4.81 3.92 -0.07 1.61 2.20 -1.26 -0.67 119.74 120.66 3bpc s LYS 18 Ca 0.59 0.40 0.04 0.00 -0.36 0.00 0.00 55.97 56.64 3bpc s LYS 18 Cb -0.09 -3.10 -0.00 0.00 -1.51 0.00 0.00 37.83 33.13 3bpc s LYS 18 CO 0.39 0.60 -0.21 0.08 -0.36 0.00 0.00 175.35 175.85 3bpc s VAL 19 N -1.26 1.78 -0.06 4.02 1.01 0.21 -4.99 120.40 121.12 3bpc s VAL 19 Ca 0.30 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.43 3bpc s VAL 19 Cb -0.16 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.69 3bpc s VAL 19 CO 0.17 0.50 -0.16 -0.89 0.00 0.00 0.00 175.10 174.71 3bpc s THR 20 N 0.19 1.40 0.02 3.92 2.01 -1.26 -0.73 115.64 121.19 3bpc s THR 20 Ca -0.11 -0.67 -0.06 0.00 0.31 0.00 0.00 61.69 61.17 3bpc s THR 20 Cb -0.15 -1.23 -0.01 0.00 0.01 0.00 0.00 72.50 71.12 3bpc s THR 20 CO 0.05 0.41 0.10 0.00 -0.69 0.00 0.00 174.62 174.49 3bpc s MET 21 N 0.30 0.51 0.16 4.92 0.23 -0.63 -4.79 119.30 119.99 3bpc s MET 21 Ca -0.10 -0.58 0.10 0.00 -1.03 0.00 0.00 55.69 54.09 3bpc s MET 21 Cb -0.14 0.20 -0.04 0.00 -1.53 0.00 0.00 34.83 33.32 3bpc s MET 21 CO 0.04 -0.12 -0.24 -1.12 -2.03 0.00 0.00 175.02 171.55 3bpc s SER 22 N -1.71 3.17 -0.04 -1.18 0.01 0.68 -0.85 113.70 113.78 3bpc s SER 22 Ca -0.11 -0.81 -0.02 0.00 1.31 0.00 0.00 55.95 56.33 3bpc s SER 22 Cb -0.05 -0.21 0.03 0.00 0.21 0.00 0.00 66.02 66.00 3bpc s SER 22 CO -0.01 0.11 0.08 0.00 0.41 0.00 0.00 173.24 173.82 3bpc s LYS 24 N 1.59 2.08 0.00 0.00 2.20 0.17 -1.13 119.74 124.65 3bpc s LYS 24 Ca -0.03 -0.98 0.07 0.00 -0.36 0.00 0.00 55.97 54.67 3bpc s LYS 24 Cb -0.12 -2.19 -0.03 0.00 -1.51 0.00 0.00 37.83 33.98 3bpc s LYS 24 CO -0.04 0.54 -0.19 -1.54 -0.36 0.00 0.00 175.35 173.76 3bpc s SER 25 N -1.44 3.65 0.61 1.43 1.04 -0.04 -0.41 113.70 118.54 3bpc s SER 25 Ca 0.15 -0.39 0.38 0.00 0.48 0.00 0.00 55.95 56.57 3bpc s SER 25 Cb -0.10 -0.59 1.99 0.00 0.10 0.00 0.00 66.02 67.42 3bpc s SER 25 CO 0.05 0.29 2.24 0.77 0.98 0.00 0.00 173.24 177.58 3bpc h SER 26 N 4.98 0.00 -5.23 7.02 4.64 -1.51 -3.43 113.55 120.01 3bpc h SER 26 Ca -0.46 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.71 3bpc h SER 26 Cb 1.15 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.09 3bpc h SER 26 CO 0.48 0.02 -0.67 0.00 -0.87 0.00 0.00 176.83 175.79 3bpc s GLN 27 N -4.16 0.73 0.25 4.77 -2.07 -1.26 -4.98 119.66 112.94 3bpc s GLN 27 Ca -0.04 -1.30 -0.31 0.00 -1.82 0.00 0.00 55.36 51.89 3bpc s GLN 27 Cb 0.13 0.18 -0.13 0.00 -1.09 0.00 0.00 33.01 32.09 3bpc s GLN 27 CO 0.48 -0.15 1.42 0.45 -1.32 0.00 0.00 175.29 176.18 3bpc n SER 28 N 0.03 2.84 -1.03 12.60 2.88 -1.26 -4.63 113.62 125.04 3bpc n SER 28 Ca -0.11 1.14 0.11 0.00 -1.33 0.00 0.00 58.87 58.69 3bpc n SER 28 Cb 0.62 -1.44 0.25 0.00 -0.75 0.00 0.00 64.21 62.89 3bpc n SER 28 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3bpc n LEU 29 N 2.13 3.08 -4.60 2.46 4.77 -0.44 -4.89 117.00 119.51 3bpc n LEU 29 Ca 0.11 -1.34 -0.43 0.00 -0.03 0.00 0.00 56.01 54.32 3bpc n LEU 29 Cb 0.32 -0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 41.15 3bpc n LEU 29 CO 0.63 0.67 1.20 -0.22 -1.33 0.00 0.00 177.39 178.34 3bpc s LEU 30 N -1.46 3.56 -0.11 2.23 2.96 -1.26 -1.90 118.68 122.70 3bpc s LEU 30 Ca 0.38 0.65 -0.30 0.00 -0.22 0.00 0.00 54.13 54.64 3bpc s LEU 30 Cb 0.22 -3.45 -0.02 0.00 0.50 0.00 0.00 46.19 43.44 3bpc s LEU 30 CO 0.30 -1.46 1.16 0.21 -1.32 0.00 0.00 176.35 175.24 3bpc s ASN 30 N 3.78 7.07 0.49 3.68 3.84 -0.11 -4.92 114.94 128.76 3bpc s ASN 30 Ca 0.57 1.68 0.28 0.00 0.21 0.00 0.00 52.86 55.61 3bpc s ASN 30 Cb -0.12 -2.55 0.91 0.00 -0.55 0.00 0.00 41.25 38.94 3bpc s ASN 30 CO 0.31 -0.61 1.82 0.77 -2.79 0.00 0.00 177.10 176.60 3bpc h SER 30 N 7.56 0.00 -0.04 -4.21 4.64 -1.94 0.24 113.55 119.81 3bpc h SER 30 Ca -0.30 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.98 3bpc h SER 30 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3bpc h SER 30 CO 0.91 0.04 -0.15 -0.09 -0.87 0.00 0.00 176.83 176.67 3bpc h ARG 30 N 0.00 0.16 -0.00 4.77 2.43 -1.96 -3.34 114.38 116.44 3bpc h ARG 30 Ca -0.00 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 3bpc h ARG 30 Cb 0.74 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 3bpc h ARG 30 CO 0.01 0.77 -0.55 0.25 -1.51 0.00 0.00 179.97 178.94 3bpc n THR 30 N -4.61 0.00 -2.19 0.20 -2.24 -1.23 -4.99 114.28 99.23 3bpc n THR 30 Ca -0.09 -0.23 -0.18 0.00 -2.27 0.00 0.00 64.05 61.29 3bpc n THR 30 Cb 0.40 1.08 -0.02 0.00 -2.10 0.00 0.00 70.33 69.69 3bpc n THR 30 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3bpc n ARG 30 N -0.85 -1.41 -4.37 -0.78 1.74 0.84 -4.99 116.66 106.84 3bpc n ARG 30 Ca 0.04 0.93 -0.27 0.00 -0.77 0.00 0.00 57.85 57.78 3bpc n ARG 30 Cb 0.27 -5.39 -0.11 0.00 -1.02 0.00 0.00 32.46 26.21 3bpc n ARG 30 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3bpc s LYS 30 N -4.64 1.72 -0.22 5.56 1.02 -1.22 -4.89 119.74 117.07 3bpc s LYS 30 Ca 0.00 -1.40 -0.21 0.00 0.02 0.00 0.00 55.97 54.38 3bpc s LYS 30 Cb 0.00 -1.98 -0.02 0.00 -0.52 0.00 0.00 37.83 35.31 3bpc s LYS 30 CO 0.00 0.42 0.65 -0.80 -0.92 0.00 0.00 175.35 174.70 3bpc s ASN 31 N -2.66 6.66 -1.33 2.83 -0.87 -1.26 -0.93 114.94 117.38 3bpc s ASN 31 Ca 0.22 0.81 -0.12 0.00 -1.57 0.00 0.00 52.86 52.20 3bpc s ASN 31 Cb -0.08 -2.35 0.12 0.00 -0.02 0.00 0.00 41.25 38.91 3bpc s ASN 31 CO 0.11 -0.32 1.93 -1.22 -2.57 0.00 0.00 177.10 175.03 3bpc n TYR 32 N 5.33 3.45 -3.70 2.20 0.53 -0.80 -3.31 117.16 120.86 3bpc n TYR 32 Ca -0.01 -2.91 -0.18 0.00 -1.02 0.00 0.00 57.90 53.78 3bpc n TYR 32 Cb 0.49 -2.21 -0.17 0.00 -1.03 0.00 0.00 39.34 36.42 3bpc n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 3bpc s LEU 33 N 1.05 0.45 0.12 7.72 1.98 -1.26 -1.34 118.68 127.40 3bpc s LEU 33 Ca 0.43 0.07 0.08 0.00 -2.89 0.00 0.00 54.13 51.82 3bpc s LEU 33 Cb 0.09 -0.11 -0.04 0.00 0.66 0.00 0.00 46.19 46.79 3bpc s LEU 33 CO -0.02 -0.21 -0.21 0.00 -1.89 0.00 0.00 176.35 174.02 3bpc s ALA 34 N 1.81 1.89 -0.06 5.97 0.00 -0.21 -0.05 121.76 131.12 3bpc s ALA 34 Ca 0.00 -1.32 0.03 0.00 0.00 0.00 0.00 51.96 50.67 3bpc s ALA 34 Cb -0.12 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.73 3bpc s ALA 34 CO -0.03 0.35 -0.13 -1.58 0.00 0.00 0.00 175.76 174.37 3bpc s TRP 35 N -1.36 2.75 0.04 0.00 0.52 0.10 -0.80 118.94 120.19 3bpc s TRP 35 Ca 0.09 -0.15 0.05 0.00 0.02 0.00 0.00 56.10 56.11 3bpc s TRP 35 Cb -0.09 -1.65 -0.02 0.00 -1.15 0.00 0.00 33.47 30.55 3bpc s TRP 35 CO 0.05 0.19 -0.14 0.71 0.02 0.00 0.00 176.95 177.78 3bpc s TYR 36 N -0.69 1.22 -0.13 -1.98 1.51 0.40 -1.27 117.35 116.41 3bpc s TYR 36 Ca 0.10 -0.35 -0.00 0.00 -1.01 0.00 0.00 57.07 55.81 3bpc s TYR 36 Cb -0.11 -0.73 -0.01 0.00 -0.11 0.00 0.00 41.96 41.00 3bpc s TYR 36 CO 0.01 0.03 -0.13 -1.14 -1.11 0.00 0.00 175.55 173.21 3bpc s GLN 37 N -1.11 3.39 -0.31 -0.62 0.74 0.16 -0.56 119.66 121.35 3bpc s GLN 37 Ca 0.02 -0.68 0.03 0.00 0.05 0.00 0.00 55.36 54.78 3bpc s GLN 37 Cb -0.08 -2.65 0.09 0.00 1.10 0.00 0.00 33.01 31.47 3bpc s GLN 37 CO 0.01 0.21 0.00 -1.14 -0.55 0.00 0.00 175.29 173.82 3bpc s GLN 38 N 0.37 1.63 0.58 1.67 0.74 0.71 -0.56 119.66 124.79 3bpc s GLN 38 Ca -0.10 -1.61 -0.14 0.00 0.05 0.00 0.00 55.36 53.55 3bpc s GLN 38 Cb -0.16 -2.98 -0.05 0.00 1.10 0.00 0.00 33.01 30.92 3bpc s GLN 38 CO 0.05 -0.82 1.02 0.15 -0.55 0.00 0.00 175.29 175.14 3bpc s LYS 39 N 1.05 3.62 0.20 1.67 1.02 -1.26 -1.19 119.74 124.85 3bpc s LYS 39 Ca 0.04 0.96 -0.32 0.00 0.02 0.00 0.00 55.97 56.67 3bpc s LYS 39 Cb -0.19 -2.08 -0.13 0.00 -0.52 0.00 0.00 37.83 34.90 3bpc s LYS 39 CO -0.08 -0.55 1.54 -2.30 -0.92 0.00 0.00 175.35 173.04 3bpc n PRO 40 N -2.12 2.23 -1.39 -1.68 -0.02 -1.26 -1.50 135.00 129.26 3bpc n PRO 40 Ca 0.07 0.80 -0.13 0.00 -2.02 0.00 0.00 63.50 62.22 3bpc n PRO 40 Cb 0.54 -2.54 -0.06 0.00 -0.02 0.00 0.00 33.50 31.42 3bpc n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3bpc n GLY 41 N 2.94 1.29 3.76 -1.23 0.00 -1.26 -5.00 105.19 105.69 3bpc n GLY 41 Ca 0.14 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 3bpc n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3bpc s GLN 42 N -3.11 2.48 0.65 1.61 -0.21 -0.56 -5.15 119.66 115.37 3bpc s GLN 42 Ca 0.00 -1.46 -0.13 0.00 0.02 0.00 0.00 55.36 53.80 3bpc s GLN 42 Cb 0.00 -2.27 -0.01 0.00 1.00 0.00 0.00 33.01 31.73 3bpc s GLN 42 CO 0.00 0.13 1.06 -1.12 -2.12 0.00 0.00 175.29 173.24 3bpc s SER 43 N -3.87 5.57 0.55 5.90 0.01 -1.26 -4.62 113.70 115.98 3bpc s SER 43 Ca 0.38 1.68 -0.21 0.00 1.31 0.00 0.00 55.95 59.10 3bpc s SER 43 Cb -0.04 -2.51 -0.05 0.00 0.21 0.00 0.00 66.02 63.64 3bpc s SER 43 CO 0.24 -1.31 1.33 -2.84 0.41 0.00 0.00 173.24 171.06 3bpc s PRO 44 N -4.69 3.13 -0.07 12.44 0.02 -1.26 -4.54 135.00 140.03 3bpc s PRO 44 Ca 0.60 2.17 0.03 0.00 0.02 0.00 0.00 61.00 63.81 3bpc s PRO 44 Cb -0.14 -2.22 0.01 0.00 0.02 0.00 0.00 34.50 32.17 3bpc s PRO 44 CO 0.48 -1.18 -0.14 0.21 -0.33 0.00 0.00 177.00 176.04 3bpc s LYS 45 N -2.95 1.87 0.18 5.54 2.20 0.27 -4.93 119.74 121.92 3bpc s LYS 45 Ca 0.72 -0.48 -0.32 0.00 -0.36 0.00 0.00 55.97 55.53 3bpc s LYS 45 Cb -0.39 -1.52 -0.12 0.00 -1.51 0.00 0.00 37.83 34.29 3bpc s LYS 45 CO 0.45 0.05 1.76 -0.11 -0.36 0.00 0.00 175.35 177.15 3bpc n LEU 46 N 3.75 4.01 -0.07 5.43 7.94 -1.26 -0.67 117.00 136.12 3bpc n LEU 46 Ca -0.22 1.04 -0.13 0.00 -1.11 0.00 0.00 56.01 55.58 3bpc n LEU 46 Cb 0.52 -1.57 -0.04 0.00 0.53 0.00 0.00 43.42 42.86 3bpc n LEU 46 CO 0.26 0.18 -0.81 0.18 -1.11 0.00 0.00 177.39 176.09 3bpc n LEU 47 N 4.46 1.58 -3.97 -1.96 4.77 -0.40 -4.88 117.00 116.59 3bpc n LEU 47 Ca 0.17 0.26 -0.12 0.00 -0.03 0.00 0.00 56.01 56.28 3bpc n LEU 47 Cb 0.35 -0.61 -0.13 0.00 -2.33 0.00 0.00 43.42 40.71 3bpc n LEU 47 CO 0.65 -0.03 -0.38 -0.63 -1.33 0.00 0.00 177.39 175.66 3bpc s ILE 48 N -2.53 0.27 0.25 -0.08 -1.09 -1.07 -1.42 121.20 115.54 3bpc s ILE 48 Ca -0.24 -0.58 -0.02 0.00 -2.23 0.00 0.00 60.65 57.58 3bpc s ILE 48 Cb 0.07 -0.32 -0.02 0.00 -1.58 0.00 0.00 42.46 40.60 3bpc s ILE 48 CO 0.33 -0.21 0.28 -0.72 -1.23 0.00 0.00 174.94 173.39 3bpc s TYR 49 N -0.78 1.09 -1.69 3.97 1.13 -0.36 0.01 117.35 120.71 3bpc s TYR 49 Ca -0.06 -1.29 -0.17 0.00 -1.41 0.00 0.00 57.07 54.14 3bpc s TYR 49 Cb -0.06 -0.37 0.15 0.00 -1.10 0.00 0.00 41.96 40.58 3bpc s TYR 49 CO -0.00 -0.83 0.71 0.91 -2.51 0.00 0.00 175.55 173.83 3bpc n TRP 50 N -0.40 -1.65 0.00 -3.49 8.01 -1.11 -0.60 117.44 118.19 3bpc n TRP 50 Ca 0.02 0.78 0.00 0.00 -1.31 0.00 0.00 57.50 56.99 3bpc n TRP 50 Cb 0.64 -2.89 0.00 0.00 -2.01 0.00 0.00 31.31 27.05 3bpc n TRP 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3bpc n ALA 51 N -4.36 0.00 -0.38 6.99 0.00 0.93 -4.13 120.51 119.57 3bpc n ALA 51 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3bpc n ALA 51 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 3bpc n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3bpc n SER 52 N 0.92 0.17 -4.61 0.00 3.41 -1.14 -3.02 113.62 109.35 3bpc n SER 52 Ca 0.00 -0.62 -0.43 0.00 -0.26 0.00 0.00 58.87 57.56 3bpc n SER 52 Cb 0.00 0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 3bpc n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3bpc s THR 53 N -0.14 4.54 -0.25 6.66 2.01 0.23 -4.61 115.64 124.09 3bpc s THR 53 Ca 0.00 1.31 -0.26 0.00 0.31 0.00 0.00 61.69 63.05 3bpc s THR 53 Cb 0.00 -4.37 0.00 0.00 0.01 0.00 0.00 72.50 68.14 3bpc s THR 53 CO 0.00 -0.56 0.91 -0.60 -0.69 0.00 0.00 174.62 173.68 3bpc s ARG 54 N 3.58 4.19 0.39 4.92 3.52 -1.26 -1.23 118.95 133.06 3bpc s ARG 54 Ca 0.40 1.07 -0.27 0.00 -0.13 0.00 0.00 55.73 56.80 3bpc s ARG 54 Cb -0.12 -3.65 -0.11 0.00 -1.56 0.00 0.00 34.95 29.51 3bpc s ARG 54 CO 0.19 -0.58 1.30 -1.91 -0.81 0.00 0.00 175.30 173.49 3bpc n GLU 55 N 6.16 2.07 -1.71 5.12 4.07 -0.51 -4.91 120.64 130.93 3bpc n GLU 55 Ca 0.08 0.73 -0.42 0.00 -0.06 0.00 0.00 57.16 57.49 3bpc n GLU 55 Cb 0.47 -2.39 -0.01 0.00 -0.06 0.00 0.00 31.44 29.45 3bpc n GLU 55 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 3bpc n SER 56 N 0.42 2.99 0.00 4.31 7.64 -1.26 -2.03 113.62 125.69 3bpc n SER 56 Ca 0.05 1.20 0.00 0.00 1.01 0.00 0.00 58.87 61.14 3bpc n SER 56 Cb 0.38 -1.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.07 3bpc n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3bpc n GLY 57 N 0.90 1.13 3.73 0.23 0.00 -1.26 -5.04 105.19 104.87 3bpc n GLY 57 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 3bpc n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bpc s VAL 58 N -2.64 5.26 0.35 1.61 1.01 -0.86 -5.04 120.40 120.09 3bpc s VAL 58 Ca 0.00 0.69 -0.27 0.00 0.00 0.00 0.00 61.98 62.41 3bpc s VAL 58 Cb 0.00 -3.70 -0.12 0.00 0.00 0.00 0.00 36.38 32.56 3bpc s VAL 58 CO 0.00 0.37 1.08 -2.65 0.00 0.00 0.00 175.10 173.90 3bpc n PRO 59 N 3.59 1.55 -0.10 2.72 -0.02 -1.26 -4.88 135.00 136.59 3bpc n PRO 59 Ca -0.10 0.55 0.27 0.00 -2.02 0.00 0.00 63.50 62.19 3bpc n PRO 59 Cb 0.52 -2.03 0.65 0.00 -0.02 0.00 0.00 33.50 32.62 3bpc n PRO 59 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3bpc h ASP 60 N 1.98 0.00 0.75 2.55 3.45 -1.98 -2.63 116.42 120.54 3bpc h ASP 60 Ca -0.43 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.03 3bpc h ASP 60 Cb 1.32 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.09 3bpc h ASP 60 CO 0.60 0.00 0.00 0.08 -1.57 0.00 0.00 179.24 178.35 3bpc h ARG 61 N 0.00 0.00 -5.41 3.56 0.11 -1.90 -3.41 114.38 107.33 3bpc h ARG 61 Ca 0.38 0.00 -0.62 0.00 0.10 0.00 0.00 59.98 59.84 3bpc h ARG 61 Cb 1.97 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 32.93 3bpc h ARG 61 CO -0.00 0.00 0.06 -0.06 0.10 0.00 0.00 179.97 180.07 3bpc s PHE 62 N -3.62 3.25 -0.05 4.08 0.40 -0.99 -1.33 117.98 119.72 3bpc s PHE 62 Ca 0.01 0.64 0.01 0.00 -0.60 0.00 0.00 56.93 56.99 3bpc s PHE 62 Cb 0.09 -2.82 0.02 0.00 0.51 0.00 0.00 43.02 40.83 3bpc s PHE 62 CO 0.46 -0.35 -0.06 0.99 0.70 0.00 0.00 175.22 176.97 3bpc s THR 63 N 2.42 0.65 0.04 0.64 2.01 0.18 -4.97 115.64 116.62 3bpc s THR 63 Ca 0.23 -0.17 -0.02 0.00 0.31 0.00 0.00 61.69 62.04 3bpc s THR 63 Cb -0.15 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.65 3bpc s THR 63 CO 0.10 0.26 0.22 -0.83 -0.69 0.00 0.00 174.62 173.68 3bpc s GLY 64 N 1.00 2.20 0.27 4.40 0.00 -1.26 -0.77 107.32 113.16 3bpc s GLY 64 Ca -0.10 -0.76 -0.12 0.00 0.00 0.00 0.00 44.72 43.75 3bpc s GLY 64 CO -0.00 -0.68 0.51 -1.35 0.00 0.00 0.00 173.10 171.58 3bpc s SER 65 N -2.23 0.06 0.00 1.64 1.04 -0.28 -4.26 113.70 109.67 3bpc s SER 65 Ca 0.32 -1.01 0.00 0.00 0.48 0.00 0.00 55.95 55.74 3bpc s SER 65 Cb -0.13 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.62 3bpc s SER 65 CO 0.23 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.85 3bpc n GLY 66 N -0.42 -3.00 3.54 7.32 0.00 -1.26 -1.35 105.19 110.01 3bpc n GLY 66 Ca -0.02 -2.14 -0.09 0.00 0.00 0.00 0.00 46.02 43.77 3bpc n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3bpc s SER 67 N -1.09 -0.36 0.86 1.61 0.15 -0.41 -4.93 113.70 109.54 3bpc s SER 67 Ca 0.00 0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.81 3bpc s SER 67 Cb 0.00 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.65 3bpc s SER 67 CO 0.00 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.55 3bpc n GLY 68 N 0.14 1.19 0.04 9.45 0.00 -1.26 -2.57 105.19 112.19 3bpc n GLY 68 Ca -0.09 0.26 0.10 0.00 0.00 0.00 0.00 46.02 46.29 3bpc n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3bpc n THR 69 N 0.00 0.00 -4.05 2.61 -2.24 -1.26 -1.33 114.28 108.01 3bpc n THR 69 Ca 0.00 -0.02 -0.19 0.00 -2.27 0.00 0.00 64.05 61.57 3bpc n THR 69 Cb 0.00 0.97 -0.16 0.00 -2.10 0.00 0.00 70.33 69.04 3bpc n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3bpc s ASP 70 N -2.96 0.70 0.04 3.42 1.01 -1.06 -0.86 116.67 116.96 3bpc s ASP 70 Ca 0.09 -0.08 0.01 0.00 0.71 0.00 0.00 52.55 53.29 3bpc s ASP 70 Cb 0.16 -0.34 -0.02 0.00 1.01 0.00 0.00 42.92 43.73 3bpc s ASP 70 CO 0.84 -0.08 -0.06 -0.36 0.21 0.00 0.00 175.17 175.72 3bpc s PHE 71 N 0.96 0.55 -0.02 4.23 0.40 -0.29 -1.29 117.98 122.53 3bpc s PHE 71 Ca -0.11 -0.53 0.00 0.00 -0.60 0.00 0.00 56.93 55.70 3bpc s PHE 71 Cb -0.14 -0.34 0.02 0.00 0.51 0.00 0.00 43.02 43.06 3bpc s PHE 71 CO -0.01 -0.12 0.00 0.99 0.70 0.00 0.00 175.22 176.78 3bpc s THR 72 N -1.50 0.08 -0.22 0.64 2.01 -0.46 -0.61 115.64 115.59 3bpc s THR 72 Ca -0.11 0.06 -0.07 0.00 0.31 0.00 0.00 61.69 61.88 3bpc s THR 72 Cb -0.09 -0.15 -0.03 0.00 0.01 0.00 0.00 72.50 72.24 3bpc s THR 72 CO -0.00 0.08 0.05 -0.22 -0.69 0.00 0.00 174.62 173.84 3bpc s LEU 73 N 0.60 3.53 -0.11 4.42 2.96 -0.03 -1.13 118.68 128.93 3bpc s LEU 73 Ca -0.05 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 3bpc s LEU 73 Cb -0.08 -1.92 -0.02 0.00 0.50 0.00 0.00 46.19 44.67 3bpc s LEU 73 CO -0.01 0.06 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.04 3bpc s THR 74 N 1.08 2.98 -0.21 3.68 2.01 0.05 -1.60 115.64 123.62 3bpc s THR 74 Ca 0.04 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.35 3bpc s THR 74 Cb -0.14 -2.22 0.03 0.00 0.01 0.00 0.00 72.50 70.18 3bpc s THR 74 CO 0.03 0.54 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.72 3bpc s ILE 75 N 0.06 2.17 0.30 1.82 1.01 0.09 -0.65 121.20 126.00 3bpc s ILE 75 Ca -0.05 -1.19 -0.05 0.00 0.00 0.00 0.00 60.65 59.36 3bpc s ILE 75 Cb -0.15 -2.06 -0.05 0.00 0.01 0.00 0.00 42.46 40.22 3bpc s ILE 75 CO 0.04 0.31 0.57 0.42 0.00 0.00 0.00 174.94 176.29 3bpc s THR 76 N 1.23 5.01 -1.38 2.92 -4.23 -0.44 -0.62 115.64 118.13 3bpc s THR 76 Ca -0.00 0.07 -0.03 0.00 -1.18 0.00 0.00 61.69 60.55 3bpc s THR 76 Cb -0.16 -3.74 0.00 0.00 1.34 0.00 0.00 72.50 69.94 3bpc s THR 76 CO -0.09 -0.35 0.45 -1.20 -0.54 0.00 0.00 174.62 172.88 3bpc n SER 77 N -1.01 -0.88 -4.61 3.99 7.64 -1.08 -4.77 113.62 112.90 3bpc n SER 77 Ca -0.02 -1.02 -0.44 0.00 1.01 0.00 0.00 58.87 58.40 3bpc n SER 77 Cb 0.54 -3.01 -0.01 0.00 -1.01 0.00 0.00 64.21 60.72 3bpc n SER 77 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 3bpc n VAL 78 N -4.40 2.06 -4.15 0.44 3.14 0.15 -4.41 118.33 111.17 3bpc n VAL 78 Ca -0.29 -0.50 -0.23 0.00 -2.96 0.00 0.00 64.34 60.37 3bpc n VAL 78 Cb 0.67 -1.11 -0.05 0.00 -1.06 0.00 0.00 33.84 32.30 3bpc n VAL 78 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 3bpc s GLN 79 N -1.69 2.80 0.28 1.45 -0.21 -1.26 -0.32 119.66 120.71 3bpc s GLN 79 Ca 0.59 -1.10 0.02 0.00 0.02 0.00 0.00 55.36 54.89 3bpc s GLN 79 Cb -0.65 -2.50 0.65 0.00 1.00 0.00 0.00 33.01 31.51 3bpc s GLN 79 CO 0.60 0.40 1.74 0.00 -2.12 0.00 0.00 175.29 175.92 3bpc h ALA 80 N 1.67 1.43 0.00 6.09 0.00 -1.91 -0.59 119.26 125.95 3bpc h ALA 80 Ca -0.48 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3bpc h ALA 80 Cb 1.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3bpc h ALA 80 CO 0.61 -0.16 0.00 -0.85 0.00 0.00 0.00 179.25 178.85 3bpc n GLU 81 N -4.90 0.07 0.00 0.00 0.28 -1.09 -2.82 120.64 112.18 3bpc n GLU 81 Ca 0.20 0.41 0.15 0.00 -0.16 0.00 0.00 57.16 57.77 3bpc n GLU 81 Cb 0.54 -1.67 0.86 0.00 1.43 0.00 0.00 31.44 32.60 3bpc n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3bpc n ASP 82 N -1.82 0.00 -4.65 -1.84 8.00 -0.23 -4.82 116.55 111.20 3bpc n ASP 82 Ca 0.02 -0.71 -0.47 0.00 0.71 0.00 0.00 54.79 54.34 3bpc n ASP 82 Cb 0.12 -0.09 -0.05 0.00 -0.02 0.00 0.00 41.12 41.09 3bpc n ASP 82 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3bpc n LEU 83 N -1.09 3.37 -3.61 0.64 7.94 -1.13 -4.89 117.00 118.24 3bpc n LEU 83 Ca 0.20 0.81 0.01 0.00 -1.11 0.00 0.00 56.01 55.93 3bpc n LEU 83 Cb 0.14 -1.40 -0.01 0.00 0.53 0.00 0.00 43.42 42.69 3bpc n LEU 83 CO 0.19 -0.17 1.08 0.00 -1.11 0.00 0.00 177.39 177.38 3bpc s ALA 84 N 4.99 -2.26 -0.12 1.96 0.00 -1.16 -4.43 121.76 120.75 3bpc s ALA 84 Ca 0.95 0.87 -0.12 0.00 0.00 0.00 0.00 51.96 53.66 3bpc s ALA 84 Cb -0.64 0.27 -0.05 0.00 0.00 0.00 0.00 23.12 22.70 3bpc s ALA 84 CO 0.49 -0.99 0.28 0.08 0.00 0.00 0.00 175.76 175.61 3bpc s VAL 85 N -2.36 5.30 -0.13 0.00 1.01 -0.33 -0.87 120.40 123.02 3bpc s VAL 85 Ca 0.14 0.52 -0.00 0.00 0.00 0.00 0.00 61.98 62.63 3bpc s VAL 85 Cb 0.04 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.82 3bpc s VAL 85 CO -0.04 0.48 -0.12 -0.31 0.00 0.00 0.00 175.10 175.11 3bpc s TYR 86 N -0.17 2.83 -0.04 5.22 2.02 -0.07 -0.21 117.35 126.92 3bpc s TYR 86 Ca 0.17 -0.56 0.06 0.00 -0.37 0.00 0.00 57.07 56.37 3bpc s TYR 86 Cb -0.13 -1.84 -0.02 0.00 -0.40 0.00 0.00 41.96 39.57 3bpc s TYR 86 CO 0.06 -0.16 -0.23 0.71 -1.57 0.00 0.00 175.55 174.36 3bpc s TYR 87 N 0.26 2.47 0.27 2.71 1.51 0.27 -1.12 117.35 123.73 3bpc s TYR 87 Ca -0.08 -0.49 0.05 0.00 -1.01 0.00 0.00 57.07 55.54 3bpc s TYR 87 Cb -0.15 -1.58 -0.02 0.00 -0.11 0.00 0.00 41.96 40.10 3bpc s TYR 87 CO 0.05 -0.06 0.40 0.00 -1.11 0.00 0.00 175.55 174.83 3bpc s LYS 89 N -4.06 0.47 0.23 0.00 2.20 0.02 -0.83 119.74 117.78 3bpc s LYS 89 Ca 0.37 1.08 -0.14 0.00 -0.36 0.00 0.00 55.97 56.92 3bpc s LYS 89 Cb -0.09 0.28 -0.08 0.00 -1.51 0.00 0.00 37.83 36.43 3bpc s LYS 89 CO 0.30 -0.19 0.63 1.14 -0.36 0.00 0.00 175.35 176.87 3bpc s GLN 90 N 2.09 3.98 -0.03 4.03 1.03 -0.50 -1.05 119.66 129.22 3bpc s GLN 90 Ca -0.07 0.54 0.05 0.00 0.04 0.00 0.00 55.36 55.93 3bpc s GLN 90 Cb -0.09 -2.69 0.08 0.00 0.03 0.00 0.00 33.01 30.33 3bpc s GLN 90 CO -0.15 0.32 1.04 -1.13 -2.54 0.00 0.00 175.29 172.83 3bpc n SER 91 N 0.18 0.55 -0.26 12.60 3.41 -0.45 -2.49 113.62 127.16 3bpc n SER 91 Ca -0.01 -2.25 -0.06 0.00 -0.26 0.00 0.00 58.87 56.30 3bpc n SER 91 Cb 0.52 -0.26 0.05 0.00 -0.26 0.00 0.00 64.21 64.27 3bpc n SER 91 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3bpc h TYR 92 N 0.05 1.01 -2.93 7.33 3.20 -1.90 -3.42 116.97 120.32 3bpc h TYR 92 Ca -0.01 -0.03 -0.48 0.00 3.14 0.00 0.00 58.73 61.35 3bpc h TYR 92 Cb 1.33 -0.32 -0.40 0.00 1.54 0.00 0.00 36.73 38.88 3bpc h TYR 92 CO 0.09 0.73 -0.76 1.21 -1.64 0.00 0.00 178.16 177.79 3bpc s ASN 93 N -6.08 2.73 0.57 -2.11 3.04 -1.26 -5.07 114.94 106.76 3bpc s ASN 93 Ca -0.13 -0.84 0.00 0.00 0.04 0.00 0.00 52.86 51.93 3bpc s ASN 93 Cb 0.15 -0.25 0.00 0.00 -1.54 0.00 0.00 41.25 39.61 3bpc s ASN 93 CO 0.80 -0.38 0.00 0.18 -3.04 0.00 0.00 177.10 174.66 3bpc n LEU 94 N 5.27 0.00 -3.99 3.21 4.77 -1.26 -4.76 117.00 120.24 3bpc n LEU 94 Ca -0.07 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.83 3bpc n LEU 94 Cb 0.46 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 3bpc n LEU 94 CO 0.08 0.00 -0.32 -0.13 -1.33 0.00 0.00 177.39 175.68 3bpc s ARG 95 N 0.00 0.43 -0.16 3.23 3.00 -1.26 -4.20 118.95 119.99 3bpc s ARG 95 Ca 0.00 -0.75 -0.08 0.00 0.00 0.00 0.00 55.73 54.90 3bpc s ARG 95 Cb 0.00 0.16 0.06 0.00 0.00 0.00 0.00 34.95 35.17 3bpc s ARG 95 CO 0.00 -0.08 0.37 0.99 0.00 0.00 0.00 175.30 176.58 3bpc s THR 96 N -2.17 -0.13 0.12 0.02 2.01 -1.04 -5.00 115.64 109.45 3bpc s THR 96 Ca -0.09 0.13 -0.18 0.00 0.31 0.00 0.00 61.69 61.85 3bpc s THR 96 Cb -0.05 -0.56 -0.07 0.00 0.01 0.00 0.00 72.50 71.83 3bpc s THR 96 CO -0.03 0.05 0.60 -0.36 -0.69 0.00 0.00 174.62 174.19 3bpc s PHE 97 N 1.60 3.74 1.24 4.92 0.08 -1.26 -1.41 117.98 126.89 3bpc s PHE 97 Ca -0.08 1.26 -0.19 0.00 0.12 0.00 0.00 56.93 58.04 3bpc s PHE 97 Cb -0.09 -2.50 0.30 0.00 -0.57 0.00 0.00 43.02 40.16 3bpc s PHE 97 CO -0.12 0.51 1.05 0.20 -0.10 0.00 0.00 175.22 176.76 3bpc s GLY 98 N -1.34 1.53 0.00 4.36 0.00 -0.01 -4.67 107.32 107.19 3bpc s GLY 98 Ca 0.33 -0.75 0.28 0.00 0.00 0.00 0.00 44.72 44.59 3bpc s GLY 98 CO 0.20 0.12 1.84 0.61 0.00 0.00 0.00 173.10 175.87 3bpc n GLY 99 N -0.09 -1.38 0.00 0.20 0.00 -1.26 -4.78 105.19 97.88 3bpc n GLY 99 Ca 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3bpc n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bpc n GLY 100 N 1.46 0.73 2.97 -0.02 0.00 -1.26 -5.01 105.19 104.05 3bpc n GLY 100 Ca 0.08 -1.68 -0.27 0.00 0.00 0.00 0.00 46.02 44.15 3bpc n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3bpc s THR 101 N -2.79 1.21 -0.37 2.61 2.01 -0.27 -4.71 115.64 113.33 3bpc s THR 101 Ca 0.00 -0.43 -0.23 0.00 0.31 0.00 0.00 61.69 61.33 3bpc s THR 101 Cb 0.00 -1.17 0.01 0.00 0.01 0.00 0.00 72.50 71.35 3bpc s THR 101 CO 0.00 0.39 0.79 -0.75 -0.69 0.00 0.00 174.62 174.37 3bpc s LYS 102 N 1.42 3.73 -0.35 4.92 2.20 -0.37 -0.89 119.74 130.39 3bpc s LYS 102 Ca 0.01 0.29 -0.16 0.00 -0.36 0.00 0.00 55.97 55.74 3bpc s LYS 102 Cb -0.13 -3.82 -0.01 0.00 -1.51 0.00 0.00 37.83 32.36 3bpc s LYS 102 CO -0.06 -0.88 0.42 -1.17 -0.36 0.00 0.00 175.35 173.29 3bpc s LEU 103 N 3.14 4.42 0.24 5.43 2.96 -0.05 -2.01 118.68 132.82 3bpc s LEU 103 Ca 0.32 -0.17 0.05 0.00 -0.22 0.00 0.00 54.13 54.11 3bpc s LEU 103 Cb -0.13 -2.43 -0.03 0.00 0.50 0.00 0.00 46.19 44.10 3bpc s LEU 103 CO 0.18 -0.39 0.32 -1.61 -1.32 0.00 0.00 176.35 173.53 3bpc s GLU 104 N 2.15 3.33 -0.23 1.98 2.02 0.00 -2.96 118.70 125.00 3bpc s GLU 104 Ca 0.14 -0.81 -0.06 0.00 0.02 0.00 0.00 54.97 54.26 3bpc s GLU 104 Cb -0.16 -2.83 -0.03 0.00 0.10 0.00 0.00 34.13 31.21 3bpc s GLU 104 CO 0.12 0.43 0.04 0.42 0.02 0.00 0.00 175.26 176.29 3bpc s ILE 105 N -2.00 4.16 0.20 -1.63 -1.09 -1.26 -1.85 121.20 117.74 3bpc s ILE 105 Ca 0.34 -0.23 -0.30 0.00 -2.23 0.00 0.00 60.65 58.23 3bpc s ILE 105 Cb -0.09 -2.92 -0.08 0.00 -1.58 0.00 0.00 42.46 37.79 3bpc s ILE 105 CO 0.28 0.38 1.10 -0.75 -1.23 0.00 0.00 174.94 174.72 3bpc s LYS 106 N 1.31 4.61 0.24 2.79 2.20 -0.05 -4.84 119.74 126.01 3bpc s LYS 106 Ca 0.04 1.73 -0.03 0.00 -0.36 0.00 0.00 55.97 57.36 3bpc s LYS 106 Cb -0.15 -3.26 -0.03 0.00 -1.51 0.00 0.00 37.83 32.89 3bpc s LYS 106 CO 0.02 0.12 0.27 -0.98 -0.36 0.00 0.00 175.35 174.42 3bpc s ARG 107 N -0.64 1.44 0.49 4.03 1.70 -1.26 -3.90 118.95 120.79 3bpc s ARG 107 Ca 0.48 -1.61 -0.24 0.00 -0.47 0.00 0.00 55.73 53.89 3bpc s ARG 107 Cb -0.30 0.34 -0.07 0.00 -0.57 0.00 0.00 34.95 34.36 3bpc s ARG 107 CO 0.36 -0.53 1.38 0.00 -1.08 0.00 0.00 175.30 175.43 3bpc s ALA 108 N -3.91 3.07 0.29 7.88 0.00 -1.26 -4.94 121.76 122.89 3bpc s ALA 108 Ca 0.34 1.38 -0.28 0.00 0.00 0.00 0.00 51.96 53.40 3bpc s ALA 108 Cb 0.04 -3.57 -0.14 0.00 0.00 0.00 0.00 23.12 19.45 3bpc s ALA 108 CO 0.14 -1.22 1.02 -0.25 0.00 0.00 0.00 175.76 175.46 3bpc n ASP 109 N -0.51 1.36 -3.80 0.00 10.43 -1.26 -4.77 116.55 118.00 3bpc n ASP 109 Ca 0.07 1.18 -0.13 0.00 2.57 0.00 0.00 54.79 58.48 3bpc n ASP 109 Cb 0.43 -1.30 -0.14 0.00 1.84 0.00 0.00 41.12 41.96 3bpc n ASP 109 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3bpc s ALA 110 N -1.04 -0.15 0.44 2.24 0.00 0.08 -4.90 121.76 118.42 3bpc s ALA 110 Ca 0.59 0.39 -0.23 0.00 0.00 0.00 0.00 51.96 52.71 3bpc s ALA 110 Cb -0.70 -0.26 -0.08 0.00 0.00 0.00 0.00 23.12 22.07 3bpc s ALA 110 CO 0.60 -0.09 1.06 0.00 0.00 0.00 0.00 175.76 177.33 3bpc s ALA 111 N 0.66 2.99 0.56 0.00 0.00 -1.26 -1.62 121.76 123.09 3bpc s ALA 111 Ca -0.05 0.71 -0.16 0.00 0.00 0.00 0.00 51.96 52.46 3bpc s ALA 111 Cb -0.07 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 3bpc s ALA 111 CO -0.03 -0.32 1.03 -1.25 0.00 0.00 0.00 175.76 175.19 3bpc s PRO 112 N -2.78 3.56 -0.27 0.00 0.04 -1.26 -4.47 135.00 129.83 3bpc s PRO 112 Ca 0.62 1.10 -0.14 0.00 0.04 0.00 0.00 61.00 62.62 3bpc s PRO 112 Cb -0.21 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 3bpc s PRO 112 CO 0.26 -0.60 0.33 0.99 0.04 0.00 0.00 177.00 178.02 3bpc s THR 113 N -2.54 5.21 -0.13 1.26 2.01 -0.12 -4.85 115.64 116.48 3bpc s THR 113 Ca 0.62 0.48 -0.05 0.00 0.31 0.00 0.00 61.69 63.05 3bpc s THR 113 Cb -0.14 -3.66 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 3bpc s THR 113 CO 0.35 0.19 0.05 -0.69 -0.69 0.00 0.00 174.62 173.83 3bpc s VAL 114 N 1.94 4.69 -0.03 3.82 1.01 -1.26 -0.38 120.40 130.20 3bpc s VAL 114 Ca 0.13 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.03 3bpc s VAL 114 Cb -0.16 -3.04 0.02 0.00 0.00 0.00 0.00 36.38 33.20 3bpc s VAL 114 CO 0.10 0.56 -0.03 -0.44 0.00 0.00 0.00 175.10 175.28 3bpc s SER 115 N -0.46 0.70 -0.02 3.32 0.01 -0.68 -4.97 113.70 111.59 3bpc s SER 115 Ca 0.09 -0.09 0.03 0.00 1.31 0.00 0.00 55.95 57.29 3bpc s SER 115 Cb -0.12 -0.29 -0.03 0.00 0.21 0.00 0.00 66.02 65.79 3bpc s SER 115 CO 0.02 -0.03 -0.08 -0.51 0.41 0.00 0.00 173.24 173.05 3bpc s ILE 116 N 0.66 3.59 -0.11 1.44 2.07 -1.26 -1.49 121.20 126.10 3bpc s ILE 116 Ca -0.08 -0.69 0.01 0.00 -1.41 0.00 0.00 60.65 58.48 3bpc s ILE 116 Cb -0.11 -2.52 0.02 0.00 0.13 0.00 0.00 42.46 39.98 3bpc s ILE 116 CO -0.00 0.47 -0.12 -0.36 -1.91 0.00 0.00 174.94 173.02 3bpc s PHE 117 N -0.91 1.74 0.71 3.50 0.40 0.36 -5.02 117.98 118.76 3bpc s PHE 117 Ca 0.15 -0.83 -0.11 0.00 -0.60 0.00 0.00 56.93 55.54 3bpc s PHE 117 Cb -0.11 -1.32 0.01 0.00 0.51 0.00 0.00 43.02 42.12 3bpc s PHE 117 CO 0.05 -0.48 1.07 -1.25 0.70 0.00 0.00 175.22 175.31 3bpc s PRO 118 N 1.22 2.83 0.54 0.24 0.04 -1.26 -2.54 135.00 136.07 3bpc s PRO 118 Ca -0.03 1.01 -0.22 0.00 0.04 0.00 0.00 61.00 61.80 3bpc s PRO 118 Cb -0.14 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 3bpc s PRO 118 CO -0.04 -1.19 1.32 -2.30 0.04 0.00 0.00 177.00 174.83 3bpc n PRO 119 N -3.16 1.65 -2.41 0.56 -0.02 -1.22 -4.88 135.00 125.53 3bpc n PRO 119 Ca 0.08 0.61 -0.32 0.00 -2.02 0.00 0.00 63.50 61.84 3bpc n PRO 119 Cb 0.53 -2.52 -0.03 0.00 -0.02 0.00 0.00 33.50 31.46 3bpc n PRO 119 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3bpc s SER 120 N -0.90 6.51 0.36 2.55 1.04 -1.26 -4.95 113.70 117.05 3bpc s SER 120 Ca 0.71 1.65 0.09 0.00 0.48 0.00 0.00 55.95 58.88 3bpc s SER 120 Cb -0.43 -2.52 0.69 0.00 0.10 0.00 0.00 66.02 63.86 3bpc s SER 120 CO 0.50 -0.66 1.85 0.77 0.98 0.00 0.00 173.24 176.67 3bpc h SER 121 N 1.02 0.20 0.23 7.02 4.64 -1.98 -1.53 113.55 123.14 3bpc h SER 121 Ca -0.47 -0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 60.76 3bpc h SER 121 Cb 1.19 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3bpc h SER 121 CO 0.61 0.45 -0.16 1.05 -0.87 0.00 0.00 176.83 177.90 3bpc h GLU 122 N 0.18 0.00 0.12 4.77 9.09 -2.00 -1.04 114.58 125.71 3bpc h GLU 122 Ca 0.03 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.26 3bpc h GLU 122 Cb 0.53 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.65 3bpc h GLU 122 CO 0.04 0.16 -0.77 0.37 0.05 0.00 0.00 179.01 178.86 3bpc h GLN 123 N 0.00 0.31 -0.44 1.06 4.15 -1.78 -3.36 115.11 115.06 3bpc h GLN 123 Ca -0.00 -0.49 0.09 0.00 0.77 0.00 0.00 58.65 59.02 3bpc h GLN 123 Cb 0.32 0.18 -0.02 0.00 0.21 0.00 0.00 27.48 28.17 3bpc h GLN 123 CO 0.02 1.22 0.30 -0.07 -1.93 0.00 0.00 178.83 178.38 3bpc h LEU 124 N -0.35 0.17 -2.50 -2.39 3.38 -0.98 -1.13 115.31 111.51 3bpc h LEU 124 Ca -0.13 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.85 3bpc h LEU 124 Cb 1.59 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.30 3bpc h LEU 124 CO 0.15 0.10 0.04 0.74 0.09 0.00 0.00 178.44 179.56 3bpc h THR 125 N 0.19 0.42 -0.02 0.22 2.02 -1.34 -2.06 112.91 112.34 3bpc h THR 125 Ca 0.20 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.38 3bpc h THR 125 Cb 0.56 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 3bpc h THR 125 CO -0.03 0.00 -0.13 -0.24 0.37 0.00 0.00 175.52 175.48 3bpc n SER 126 N -3.69 2.13 0.00 4.18 2.88 -0.43 -4.95 113.62 113.73 3bpc n SER 126 Ca -0.02 -1.56 0.00 0.00 -1.33 0.00 0.00 58.87 55.95 3bpc n SER 126 Cb 0.13 0.18 0.00 0.00 -0.75 0.00 0.00 64.21 63.77 3bpc n SER 126 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3bpc n GLY 127 N 1.05 0.61 3.70 0.46 0.00 -0.77 -5.07 105.19 105.16 3bpc n GLY 127 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 3bpc n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3bpc s GLY 128 N -1.23 1.85 -0.27 -0.02 0.00 -1.19 -0.95 107.32 105.51 3bpc s GLY 128 Ca 0.00 -1.77 -0.01 0.00 0.00 0.00 0.00 44.72 42.94 3bpc s GLY 128 CO 0.00 -1.75 0.30 0.00 0.00 0.00 0.00 173.10 171.65 3bpc s ALA 129 N -2.39 -0.55 -0.25 3.20 0.00 -0.45 -3.21 121.76 118.10 3bpc s ALA 129 Ca 0.35 -0.04 -0.14 0.00 0.00 0.00 0.00 51.96 52.13 3bpc s ALA 129 Cb -0.04 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.32 3bpc s ALA 129 CO 0.21 -1.58 0.34 -1.12 0.00 0.00 0.00 175.76 173.62 3bpc s SER 130 N 2.39 6.26 -0.16 0.00 0.01 -1.26 -0.06 113.70 120.87 3bpc s SER 130 Ca 0.09 0.30 -0.08 0.00 1.31 0.00 0.00 55.95 57.57 3bpc s SER 130 Cb -0.14 -2.19 -0.04 0.00 0.21 0.00 0.00 66.02 63.85 3bpc s SER 130 CO -0.27 -0.12 0.12 -0.69 0.41 0.00 0.00 173.24 172.69 3bpc s VAL 131 N 1.74 5.30 -0.03 3.43 1.01 0.93 -3.37 120.40 129.40 3bpc s VAL 131 Ca 0.14 0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.33 3bpc s VAL 131 Cb -0.15 -3.37 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 3bpc s VAL 131 CO 0.09 0.51 -0.23 -0.69 0.00 0.00 0.00 175.10 174.78 3bpc s VAL 132 N -0.19 1.86 -0.08 2.92 1.01 -1.05 -0.01 120.40 124.86 3bpc s VAL 132 Ca 0.10 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 61.11 3bpc s VAL 132 Cb -0.12 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.72 3bpc s VAL 132 CO 0.01 0.52 -0.12 0.00 0.00 0.00 0.00 175.10 175.52 3bpc s PHE 134 N 0.91 3.46 -0.53 0.00 0.08 -0.56 -0.34 117.98 121.00 3bpc s PHE 134 Ca -0.10 0.45 -0.04 0.00 0.12 0.00 0.00 56.93 57.37 3bpc s PHE 134 Cb -0.15 -2.19 0.14 0.00 -0.57 0.00 0.00 43.02 40.25 3bpc s PHE 134 CO 0.01 0.35 0.35 -0.51 -0.10 0.00 0.00 175.22 175.31 3bpc s LEU 135 N 0.16 5.32 -0.12 -0.37 2.01 0.48 -1.69 118.68 124.47 3bpc s LEU 135 Ca 0.12 -2.45 -0.08 0.00 0.01 0.00 0.00 54.13 51.73 3bpc s LEU 135 Cb -0.12 -1.87 -0.04 0.00 0.01 0.00 0.00 46.19 44.17 3bpc s LEU 135 CO 0.01 -0.47 0.16 0.20 1.01 0.00 0.00 176.35 177.26 3bpc s ASN 136 N 1.35 6.40 -1.08 2.29 0.02 0.49 -0.67 114.94 123.74 3bpc s ASN 136 Ca 0.13 0.47 -0.07 0.00 -1.02 0.00 0.00 52.86 52.37 3bpc s ASN 136 Cb -0.22 -2.09 -0.05 0.00 0.02 0.00 0.00 41.25 38.91 3bpc s ASN 136 CO -0.04 0.36 0.91 0.59 0.02 0.00 0.00 177.10 178.95 3bpc n ASN 137 N 2.23 -5.85 -4.61 -1.22 3.02 -0.75 -0.94 115.26 107.14 3bpc n ASN 137 Ca -0.19 -0.73 -0.25 0.00 -0.03 0.00 0.00 54.58 53.39 3bpc n ASN 137 Cb 0.54 -5.01 -0.09 0.00 -0.61 0.00 0.00 39.78 34.61 3bpc n ASN 137 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3bpc s PHE 138 N -3.40 2.52 -0.20 3.10 -0.71 0.35 -4.49 117.98 115.15 3bpc s PHE 138 Ca 0.40 -0.43 -0.16 0.00 -1.04 0.00 0.00 56.93 55.69 3bpc s PHE 138 Cb -0.06 -1.43 0.06 0.00 -1.21 0.00 0.00 43.02 40.38 3bpc s PHE 138 CO 0.75 0.52 0.52 -0.47 -1.34 0.00 0.00 175.22 175.20 3bpc s TYR 139 N -2.52 -0.64 0.95 3.49 6.14 -0.64 -0.94 117.35 123.19 3bpc s TYR 139 Ca 0.34 1.47 -0.15 0.00 0.64 0.00 0.00 57.07 59.37 3bpc s TYR 139 Cb -0.00 0.26 0.21 0.00 0.42 0.00 0.00 41.96 42.85 3bpc s TYR 139 CO 0.19 -0.32 1.30 -1.25 0.64 0.00 0.00 175.55 176.11 3bpc s PRO 140 N 0.66 0.60 0.37 4.97 0.04 -1.26 -0.74 135.00 139.64 3bpc s PRO 140 Ca -0.03 -0.57 0.09 0.00 0.04 0.00 0.00 61.00 60.52 3bpc s PRO 140 Cb -0.05 -1.89 0.74 0.00 0.04 0.00 0.00 34.50 33.34 3bpc s PRO 140 CO -0.04 -2.40 1.89 -0.22 0.04 0.00 0.00 177.00 176.26 3bpc h LYS 141 N -1.58 0.26 -6.73 4.56 3.64 -1.98 -3.44 116.57 111.30 3bpc h LYS 141 Ca -0.43 -0.06 -0.52 0.00 -1.27 0.00 0.00 60.65 58.37 3bpc h LYS 141 Cb 1.23 -0.03 0.03 0.00 -0.41 0.00 0.00 32.23 33.05 3bpc h LYS 141 CO 0.35 0.41 0.61 -0.51 -2.27 0.00 0.00 179.45 178.04 3bpc s ASP 142 N -6.87 6.96 -0.00 4.20 1.01 -1.26 -4.98 116.67 115.73 3bpc s ASP 142 Ca -0.06 2.41 -0.29 0.00 0.71 0.00 0.00 52.55 55.33 3bpc s ASP 142 Cb 0.15 -2.62 0.08 0.00 1.01 0.00 0.00 42.92 41.54 3bpc s ASP 142 CO 0.74 -0.45 0.69 -0.51 0.21 0.00 0.00 175.17 175.85 3bpc s ILE 143 N -0.33 0.00 -0.06 0.77 2.07 -1.26 -4.72 121.20 117.66 3bpc s ILE 143 Ca 0.53 0.00 0.05 0.00 -1.41 0.00 0.00 60.65 59.82 3bpc s ILE 143 Cb -0.36 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.23 3bpc s ILE 143 CO 0.41 0.00 -0.22 0.21 -1.91 0.00 0.00 174.94 173.43 3bpc s ASN 144 N -1.65 2.76 -0.06 4.50 3.84 -0.47 -4.99 114.94 118.87 3bpc s ASN 144 Ca -0.06 -0.46 0.04 0.00 0.21 0.00 0.00 52.86 52.58 3bpc s ASN 144 Cb -0.00 -0.85 -0.00 0.00 -0.55 0.00 0.00 41.25 39.85 3bpc s ASN 144 CO 0.03 0.20 -0.19 -0.69 -2.79 0.00 0.00 177.10 173.65 3bpc s VAL 145 N -0.01 1.62 -0.01 -5.21 1.01 -1.26 -0.69 120.40 115.86 3bpc s VAL 145 Ca -0.06 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.19 3bpc s VAL 145 Cb -0.14 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.82 3bpc s VAL 145 CO 0.04 0.46 -0.23 -0.54 0.00 0.00 0.00 175.10 174.83 3bpc s LYS 146 N 0.15 2.14 -0.18 2.72 1.02 -0.26 -4.95 119.74 120.38 3bpc s LYS 146 Ca -0.08 -0.92 -0.07 0.00 0.02 0.00 0.00 55.97 54.93 3bpc s LYS 146 Cb -0.14 -2.12 -0.04 0.00 -0.52 0.00 0.00 37.83 35.02 3bpc s LYS 146 CO 0.04 0.56 0.04 -1.58 -0.92 0.00 0.00 175.35 173.49 3bpc s TRP 147 N -0.70 3.20 -0.10 3.18 0.52 -1.26 -0.72 118.94 123.06 3bpc s TRP 147 Ca 0.11 -0.02 0.04 0.00 0.02 0.00 0.00 56.10 56.25 3bpc s TRP 147 Cb -0.10 -2.05 -0.00 0.00 -1.15 0.00 0.00 33.47 30.16 3bpc s TRP 147 CO 0.00 0.11 -0.24 0.15 0.02 0.00 0.00 176.95 176.99 3bpc s LYS 148 N 0.38 3.03 -0.18 4.98 1.02 0.34 -4.03 119.74 125.29 3bpc s LYS 148 Ca 0.01 -0.88 0.00 0.00 0.02 0.00 0.00 55.97 55.13 3bpc s LYS 148 Cb -0.13 -2.29 0.01 0.00 -0.52 0.00 0.00 37.83 34.90 3bpc s LYS 148 CO 0.01 0.18 -0.16 0.42 -0.92 0.00 0.00 175.35 174.88 3bpc s ILE 149 N 0.33 2.39 -1.66 2.17 1.01 -0.44 -0.78 121.20 124.21 3bpc s ILE 149 Ca -0.19 -0.83 -0.15 0.00 0.00 0.00 0.00 60.65 59.48 3bpc s ILE 149 Cb -0.18 -2.02 0.13 0.00 0.01 0.00 0.00 42.46 40.40 3bpc s ILE 149 CO 0.09 0.51 0.64 0.47 0.00 0.00 0.00 174.94 176.65 3bpc n ASP 150 N 4.55 -2.29 0.00 3.58 8.00 0.62 -2.80 116.55 128.21 3bpc n ASP 150 Ca -0.20 -1.06 0.00 0.00 0.71 0.00 0.00 54.79 54.24 3bpc n ASP 150 Cb 0.50 -2.59 0.00 0.00 -0.02 0.00 0.00 41.12 39.02 3bpc n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3bpc n GLY 151 N -1.55 1.84 3.35 0.44 0.00 -1.26 -5.03 105.19 102.98 3bpc n GLY 151 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 3bpc n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3bpc s SER 152 N -2.31 3.05 1.03 1.61 1.04 -1.12 -5.00 113.70 111.99 3bpc s SER 152 Ca 0.00 -0.71 -0.11 0.00 0.48 0.00 0.00 55.95 55.60 3bpc s SER 152 Cb 0.00 -0.20 0.21 0.00 0.10 0.00 0.00 66.02 66.13 3bpc s SER 152 CO 0.00 0.15 1.09 -0.70 0.98 0.00 0.00 173.24 174.76 3bpc s GLU 153 N -1.94 0.12 -1.59 4.02 2.12 -1.26 -1.33 118.70 118.84 3bpc s GLU 153 Ca 0.11 1.25 -0.04 0.00 0.36 0.00 0.00 54.97 56.65 3bpc s GLU 153 Cb -0.10 -1.64 0.04 0.00 0.26 0.00 0.00 34.13 32.69 3bpc s GLU 153 CO 0.05 -3.15 0.19 0.41 -0.54 0.00 0.00 175.26 172.22 3bpc n GLY 157 N 0.52 -0.19 3.41 -1.50 0.00 -1.26 -4.87 105.19 101.30 3bpc n GLY 157 Ca 0.08 0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 3bpc n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bpc s VAL 158 N -4.11 3.80 -0.24 1.61 1.01 -1.26 -0.54 120.40 120.67 3bpc s VAL 158 Ca 0.16 -0.36 -0.07 0.00 0.00 0.00 0.00 61.98 61.70 3bpc s VAL 158 Cb -0.09 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 3bpc s VAL 158 CO 0.98 0.43 0.07 -0.76 0.00 0.00 0.00 175.10 175.83 3bpc s LEU 159 N 1.10 3.50 -0.07 3.92 2.01 -0.06 -4.96 118.68 124.12 3bpc s LEU 159 Ca 0.02 -0.17 -0.00 0.00 0.01 0.00 0.00 54.13 53.99 3bpc s LEU 159 Cb -0.14 -1.93 -0.03 0.00 0.01 0.00 0.00 46.19 44.09 3bpc s LEU 159 CO 0.01 -0.01 -0.04 0.20 1.01 0.00 0.00 176.35 177.52 3bpc s ASN 160 N 1.49 4.90 -0.05 2.29 0.02 -1.26 -1.27 114.94 121.06 3bpc s ASN 160 Ca 0.06 0.04 -0.02 0.00 -1.02 0.00 0.00 52.86 51.92 3bpc s ASN 160 Cb -0.15 -1.29 0.04 0.00 0.02 0.00 0.00 41.25 39.87 3bpc s ASN 160 CO 0.04 0.36 0.09 -0.55 0.02 0.00 0.00 177.10 177.06 3bpc s SER 161 N -0.91 0.57 0.00 -1.22 0.15 -0.46 -4.98 113.70 106.85 3bpc s SER 161 Ca 0.13 0.16 -0.11 0.00 0.70 0.00 0.00 55.95 56.84 3bpc s SER 161 Cb -0.11 0.02 -0.05 0.00 -1.71 0.00 0.00 66.02 64.17 3bpc s SER 161 CO 0.02 -0.20 0.34 0.26 1.20 0.00 0.00 173.24 174.86 3bpc s TRP 162 N 1.75 3.64 0.89 3.44 0.51 -1.26 -0.65 118.94 127.26 3bpc s TRP 162 Ca -0.01 0.79 -0.11 0.00 -2.12 0.00 0.00 56.10 54.64 3bpc s TRP 162 Cb -0.12 -2.14 0.13 0.00 -0.81 0.00 0.00 33.47 30.52 3bpc s TRP 162 CO -0.04 0.62 1.09 0.95 -0.51 0.00 0.00 176.95 179.06 3bpc s THR 163 N -1.20 2.68 0.92 2.01 -4.23 0.02 -4.99 115.64 110.85 3bpc s THR 163 Ca 0.25 0.22 -0.10 0.00 -1.18 0.00 0.00 61.69 60.88 3bpc s THR 163 Cb -0.15 -2.68 0.15 0.00 1.34 0.00 0.00 72.50 71.17 3bpc s THR 163 CO 0.14 -0.29 1.13 -1.81 -0.54 0.00 0.00 174.62 173.25 3bpc s ASP 164 N -3.37 2.90 0.46 3.99 -0.00 -1.26 -4.69 116.67 114.69 3bpc s ASP 164 Ca 0.63 2.07 -0.25 0.00 -0.00 0.00 0.00 52.55 55.00 3bpc s ASP 164 Cb -0.18 -2.53 -0.08 0.00 -0.00 0.00 0.00 42.92 40.13 3bpc s ASP 164 CO 0.57 -3.10 1.42 1.67 -0.00 0.00 0.00 175.17 175.73 3bpc n GLN 165 N -4.22 2.20 -2.29 8.23 7.27 -1.26 -4.67 117.38 122.63 3bpc n GLN 165 Ca 0.11 0.78 -0.42 0.00 0.07 0.00 0.00 57.00 57.54 3bpc n GLN 165 Cb 0.52 -2.61 -0.03 0.00 2.41 0.00 0.00 30.24 30.53 3bpc n GLN 165 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 3bpc s ASP 166 N -0.50 6.95 0.16 1.69 2.15 0.11 -4.93 116.67 122.30 3bpc s ASP 166 Ca 0.62 2.19 0.21 0.00 0.43 0.00 0.00 52.55 56.00 3bpc s ASP 166 Cb -0.45 -2.58 0.86 0.00 -0.30 0.00 0.00 42.92 40.44 3bpc s ASP 166 CO 0.57 -0.55 1.64 -1.20 -0.17 0.00 0.00 175.17 175.46 3bpc n SER 167 N 3.82 0.42 -0.11 -0.34 7.64 -1.26 -1.75 113.62 122.04 3bpc n SER 167 Ca 0.10 0.59 -0.21 0.00 1.01 0.00 0.00 58.87 60.36 3bpc n SER 167 Cb 0.44 -0.69 -0.07 0.00 -1.01 0.00 0.00 64.21 62.88 3bpc n SER 167 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3bpc n LYS 168 N -1.96 0.49 -0.05 1.43 4.81 -1.26 -2.68 118.16 118.94 3bpc n LYS 168 Ca 0.03 0.21 0.08 0.00 -0.87 0.00 0.00 58.31 57.76 3bpc n LYS 168 Cb 0.23 -1.32 0.09 0.00 0.02 0.00 0.00 35.03 34.05 3bpc n LYS 168 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 3bpc n ASP 169 N -4.11 2.47 -1.61 3.14 3.85 -1.26 -4.90 116.55 114.13 3bpc n ASP 169 Ca -0.39 -1.71 -0.19 0.00 -0.71 0.00 0.00 54.79 51.80 3bpc n ASP 169 Cb 0.74 -0.06 -0.07 0.00 -1.35 0.00 0.00 41.12 40.38 3bpc n ASP 169 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 3bpc n SER 170 N 0.87 -5.34 -4.94 -1.12 7.64 -0.72 -4.98 113.62 105.03 3bpc n SER 170 Ca 0.10 0.37 -0.24 0.00 1.01 0.00 0.00 58.87 60.12 3bpc n SER 170 Cb 0.40 -4.49 0.01 0.00 -1.01 0.00 0.00 64.21 59.13 3bpc n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3bpc s THR 171 N -2.76 4.14 0.16 0.44 -4.23 -1.26 -4.64 115.64 107.48 3bpc s THR 171 Ca 0.00 -0.39 0.06 0.00 -1.18 0.00 0.00 61.69 60.19 3bpc s THR 171 Cb 0.00 -3.54 -0.04 0.00 1.34 0.00 0.00 72.50 70.26 3bpc s THR 171 CO 0.00 -0.41 0.04 -0.31 -0.54 0.00 0.00 174.62 173.40 3bpc s TYR 172 N -2.59 2.96 0.16 3.99 1.51 -0.12 0.09 117.35 123.35 3bpc s TYR 172 Ca 0.48 -0.08 0.06 0.00 -1.01 0.00 0.00 57.07 56.52 3bpc s TYR 172 Cb -0.10 -1.45 -0.04 0.00 -0.11 0.00 0.00 41.96 40.26 3bpc s TYR 172 CO 0.39 0.51 -0.12 -1.12 -1.11 0.00 0.00 175.55 174.10 3bpc s SER 173 N -2.87 2.08 -0.03 2.29 0.01 -1.26 -0.49 113.70 113.43 3bpc s SER 173 Ca 0.28 -0.99 -0.03 0.00 1.31 0.00 0.00 55.95 56.52 3bpc s SER 173 Cb -0.10 -0.06 0.01 0.00 0.21 0.00 0.00 66.02 66.08 3bpc s SER 173 CO 0.20 -0.25 0.09 -0.32 0.41 0.00 0.00 173.24 173.36 3bpc s MET 174 N -3.58 0.15 -0.04 12.44 0.00 0.16 -0.80 119.30 127.63 3bpc s MET 174 Ca 0.18 0.03 0.02 0.00 0.00 0.00 0.00 55.69 55.91 3bpc s MET 174 Cb 0.01 0.07 -0.03 0.00 0.00 0.00 0.00 34.83 34.87 3bpc s MET 174 CO 0.03 -0.02 -0.07 0.45 0.00 0.00 0.00 175.02 175.41 3bpc s SER 175 N -0.17 4.66 -0.09 1.11 0.15 0.18 -0.38 113.70 119.15 3bpc s SER 175 Ca -0.02 -0.06 0.02 0.00 0.70 0.00 0.00 55.95 56.58 3bpc s SER 175 Cb -0.02 -1.15 0.02 0.00 -1.71 0.00 0.00 66.02 63.16 3bpc s SER 175 CO 0.00 0.33 -0.13 -0.55 1.20 0.00 0.00 173.24 174.10 3bpc s SER 176 N -1.03 2.17 -0.15 5.45 0.15 0.53 -1.36 113.70 119.46 3bpc s SER 176 Ca 0.14 -0.36 0.02 0.00 0.70 0.00 0.00 55.95 56.45 3bpc s SER 176 Cb -0.11 -0.96 0.01 0.00 -1.71 0.00 0.00 66.02 63.25 3bpc s SER 176 CO 0.04 0.00 -0.21 -0.89 1.20 0.00 0.00 173.24 173.38 3bpc s THR 177 N 0.98 2.01 -0.25 6.45 2.01 -0.39 -0.11 115.64 126.34 3bpc s THR 177 Ca -0.08 -0.93 -0.07 0.00 0.31 0.00 0.00 61.69 60.92 3bpc s THR 177 Cb -0.15 -1.79 -0.03 0.00 0.01 0.00 0.00 72.50 70.54 3bpc s THR 177 CO -0.01 0.54 0.07 -0.22 -0.69 0.00 0.00 174.62 174.31 3bpc s LEU 178 N 0.99 3.43 -0.15 4.42 2.96 0.98 -0.88 118.68 130.43 3bpc s LEU 178 Ca -0.03 -0.20 -0.02 0.00 -0.22 0.00 0.00 54.13 53.65 3bpc s LEU 178 Cb -0.15 -1.92 -0.02 0.00 0.50 0.00 0.00 46.19 44.60 3bpc s LEU 178 CO -0.05 -0.03 -0.08 -0.89 -1.32 0.00 0.00 176.35 173.98 3bpc s THR 179 N 1.59 3.43 0.35 3.68 2.01 0.29 -0.05 115.64 126.95 3bpc s THR 179 Ca 0.06 -0.52 0.08 0.00 0.31 0.00 0.00 61.69 61.63 3bpc s THR 179 Cb -0.15 -2.49 -0.07 0.00 0.01 0.00 0.00 72.50 69.80 3bpc s THR 179 CO 0.03 0.50 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.66 3bpc s LEU 180 N 0.54 2.70 0.67 4.42 1.43 0.91 -4.64 118.68 124.71 3bpc s LEU 180 Ca -0.06 -1.27 -0.11 0.00 -1.03 0.00 0.00 54.13 51.67 3bpc s LEU 180 Cb -0.15 -0.87 -0.01 0.00 0.03 0.00 0.00 46.19 45.20 3bpc s LEU 180 CO 0.03 -0.34 1.06 0.42 0.23 0.00 0.00 176.35 177.76 3bpc s THR 181 N -2.75 4.06 0.11 5.49 -4.23 -1.26 -1.34 115.64 115.72 3bpc s THR 181 Ca 0.33 0.67 -0.19 0.00 -1.18 0.00 0.00 61.69 61.32 3bpc s THR 181 Cb 0.06 -3.63 -0.06 0.00 1.34 0.00 0.00 72.50 70.21 3bpc s THR 181 CO 0.16 -0.88 1.69 0.50 -0.54 0.00 0.00 174.62 175.56 3bpc h LYS 182 N -0.53 0.36 -0.56 3.99 3.64 -1.29 -1.70 116.57 120.48 3bpc h LYS 182 Ca -0.45 -0.05 0.11 0.00 -1.27 0.00 0.00 60.65 59.00 3bpc h LYS 182 Cb 1.22 -0.07 -0.09 0.00 -0.41 0.00 0.00 32.23 32.88 3bpc h LYS 182 CO 0.62 0.35 -0.02 -0.44 -2.27 0.00 0.00 179.45 177.69 3bpc h ASP 183 N 0.28 -0.28 -0.21 4.20 5.19 -1.94 -0.67 116.42 122.98 3bpc h ASP 183 Ca 0.09 0.14 -0.02 0.00 -0.62 0.00 0.00 57.03 56.62 3bpc h ASP 183 Cb 0.10 0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.86 3bpc h ASP 183 CO -0.01 -0.10 0.05 -0.08 -3.12 0.00 0.00 179.24 175.97 3bpc h GLU 184 N 0.10 0.34 -1.00 3.56 4.57 -1.93 -3.11 114.58 117.11 3bpc h GLU 184 Ca 0.28 -0.08 0.16 0.00 -1.18 0.00 0.00 59.36 58.54 3bpc h GLU 184 Cb 0.45 -0.04 -0.10 0.00 -0.16 0.00 0.00 28.75 28.89 3bpc h GLU 184 CO -0.49 0.46 0.62 -0.92 -1.18 0.00 0.00 179.01 177.51 3bpc h TYR 185 N 0.16 1.10 0.00 0.92 3.20 -0.88 -2.11 116.97 119.37 3bpc h TYR 185 Ca 0.07 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.97 3bpc h TYR 185 Cb 0.28 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.21 3bpc h TYR 185 CO 0.01 0.33 0.00 0.39 -1.64 0.00 0.00 178.16 177.25 3bpc n GLU 186 N -4.70 0.01 0.07 1.82 1.02 -0.30 -3.13 120.64 115.43 3bpc n GLU 186 Ca 0.21 0.16 0.13 0.00 -0.02 0.00 0.00 57.16 57.64 3bpc n GLU 186 Cb 0.48 -1.50 0.33 0.00 -0.02 0.00 0.00 31.44 30.73 3bpc n GLU 186 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3bpc n ARG 187 N -1.49 0.23 -4.23 3.49 1.74 -0.79 -4.92 116.66 110.69 3bpc n ARG 187 Ca 0.05 0.13 -0.14 0.00 -0.77 0.00 0.00 57.85 57.13 3bpc n ARG 187 Cb 0.23 -1.71 -0.10 0.00 -1.02 0.00 0.00 32.46 29.86 3bpc n ARG 187 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3bpc s HIS 188 N -3.11 1.19 -0.17 -1.55 3.76 -1.18 -5.09 115.29 109.14 3bpc s HIS 188 Ca 0.09 -0.76 -0.09 0.00 -0.15 0.00 0.00 55.06 54.15 3bpc s HIS 188 Cb 0.14 -0.62 -0.07 0.00 1.11 0.00 0.00 32.58 33.14 3bpc s HIS 188 CO 0.64 0.04 -0.22 -1.71 -0.85 0.00 0.00 174.74 172.64 3bpc n ASN 189 N -0.06 1.22 -4.69 1.40 4.05 -1.26 -4.81 115.26 111.10 3bpc n ASN 189 Ca -0.11 0.21 -0.39 0.00 0.45 0.00 0.00 54.58 54.74 3bpc n ASN 189 Cb 0.60 -0.51 -0.06 0.00 1.23 0.00 0.00 39.78 41.04 3bpc n ASN 189 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 3bpc s SER 190 N -6.52 6.64 -0.12 1.20 0.15 -1.26 -0.86 113.70 112.92 3bpc s SER 190 Ca -0.24 0.76 0.02 0.00 0.70 0.00 0.00 55.95 57.20 3bpc s SER 190 Cb 0.09 -2.30 0.01 0.00 -1.71 0.00 0.00 66.02 62.11 3bpc s SER 190 CO 0.30 -0.10 -0.20 -0.31 1.20 0.00 0.00 173.24 174.13 3bpc s TYR 191 N 1.16 2.42 -0.02 3.44 2.02 -0.50 -0.28 117.35 125.59 3bpc s TYR 191 Ca 0.25 -1.17 0.01 0.00 -0.37 0.00 0.00 57.07 55.79 3bpc s TYR 191 Cb -0.15 -1.67 0.02 0.00 -0.40 0.00 0.00 41.96 39.76 3bpc s TYR 191 CO 0.10 -0.54 -0.00 0.99 -1.57 0.00 0.00 175.55 174.52 3bpc s THR 192 N 0.81 0.17 -0.06 -0.71 2.01 0.04 -1.56 115.64 116.33 3bpc s THR 192 Ca -0.08 0.05 0.04 0.00 0.31 0.00 0.00 61.69 62.00 3bpc s THR 192 Cb -0.16 -0.24 -0.02 0.00 0.01 0.00 0.00 72.50 72.10 3bpc s THR 192 CO -0.00 0.12 -0.17 0.00 -0.69 0.00 0.00 174.62 173.87 3bpc s GLU 194 N -0.41 2.13 -0.23 0.00 2.02 0.10 -1.89 118.70 120.43 3bpc s GLU 194 Ca 0.04 -0.49 -0.08 0.00 0.02 0.00 0.00 54.97 54.46 3bpc s GLU 194 Cb -0.12 -2.00 -0.04 0.00 0.10 0.00 0.00 34.13 32.07 3bpc s GLU 194 CO 0.02 -0.24 0.09 0.00 0.02 0.00 0.00 175.26 175.14 3bpc s ALA 195 N 1.53 3.32 -0.22 5.21 0.00 0.16 -1.10 121.76 130.67 3bpc s ALA 195 Ca 0.05 -0.97 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 3bpc s ALA 195 Cb -0.13 -2.08 -0.01 0.00 0.00 0.00 0.00 23.12 20.90 3bpc s ALA 195 CO -0.10 -0.24 -0.03 0.99 0.00 0.00 0.00 175.76 176.38 3bpc s THR 196 N 1.16 3.51 0.09 0.00 2.01 0.14 -1.11 115.64 121.43 3bpc s THR 196 Ca 0.05 -0.45 0.05 0.00 0.31 0.00 0.00 61.69 61.65 3bpc s THR 196 Cb -0.14 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 3bpc s THR 196 CO 0.04 0.42 -0.13 -2.28 -0.69 0.00 0.00 174.62 171.98 3bpc s HIS 197 N 1.41 1.18 0.28 4.92 2.46 -1.26 -1.37 115.29 122.90 3bpc s HIS 197 Ca 0.05 -0.54 0.36 0.00 0.47 0.00 0.00 55.06 55.40 3bpc s HIS 197 Cb -0.14 -0.65 1.85 0.00 -0.13 0.00 0.00 32.58 33.51 3bpc s HIS 197 CO -0.02 0.05 2.09 1.57 -2.47 0.00 0.00 174.74 175.97 3bpc h LYS 198 N 3.92 0.00 0.00 2.88 2.10 -1.95 -2.11 116.57 121.42 3bpc h LYS 198 Ca -0.39 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.26 3bpc h LYS 198 Cb 1.19 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.52 3bpc h LYS 198 CO 0.46 0.00 -0.00 1.79 -2.00 0.00 0.00 179.45 179.70 3bpc h THR 199 N 0.00 0.15 -2.95 0.07 1.35 -1.91 -3.43 112.91 106.19 3bpc h THR 199 Ca 0.00 -0.02 -0.13 0.00 -0.55 0.00 0.00 66.41 65.72 3bpc h THR 199 Cb 0.12 1.01 -0.23 0.00 -1.73 0.00 0.00 68.15 67.32 3bpc h THR 199 CO 0.00 0.00 -0.29 -0.55 -0.25 0.00 0.00 175.52 174.43 3bpc s SER 200 N -5.45 -0.29 0.26 5.36 0.15 -0.79 -4.98 113.70 107.96 3bpc s SER 200 Ca -0.05 0.43 0.25 0.00 0.70 0.00 0.00 55.95 57.29 3bpc s SER 200 Cb 0.14 0.53 0.88 0.00 -1.71 0.00 0.00 66.02 65.86 3bpc s SER 200 CO 0.45 -0.27 1.75 0.71 1.20 0.00 0.00 173.24 177.09 3bpc h THR 201 N 4.27 0.00 -3.49 6.45 1.35 -1.84 -3.40 112.91 116.24 3bpc h THR 201 Ca -0.28 -0.42 -0.61 0.00 -0.55 0.00 0.00 66.41 64.55 3bpc h THR 201 Cb 1.18 1.31 -0.12 0.00 -1.73 0.00 0.00 68.15 68.80 3bpc h THR 201 CO 0.34 0.00 0.20 -0.44 -0.25 0.00 0.00 175.52 175.37 3bpc s SER 202 N -4.59 6.56 0.61 5.36 0.01 -1.26 -5.06 113.70 115.32 3bpc s SER 202 Ca 0.07 0.57 -0.19 0.00 1.31 0.00 0.00 55.95 57.71 3bpc s SER 202 Cb 0.10 -2.35 -0.03 0.00 0.21 0.00 0.00 66.02 63.96 3bpc s SER 202 CO 0.52 -0.47 1.27 -2.65 0.41 0.00 0.00 173.24 172.32 3bpc n PRO 203 N 5.88 1.29 -3.10 12.44 -0.02 -1.26 -4.86 135.00 145.36 3bpc n PRO 203 Ca 0.00 0.49 -0.40 0.00 -2.02 0.00 0.00 63.50 61.57 3bpc n PRO 203 Cb 0.49 -2.50 -0.06 0.00 -0.02 0.00 0.00 33.50 31.41 3bpc n PRO 203 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3bpc s ILE 204 N -1.36 5.00 -0.16 4.25 1.09 -0.26 -4.89 121.20 124.86 3bpc s ILE 204 Ca 0.78 1.19 -0.00 0.00 -1.10 0.00 0.00 60.65 61.52 3bpc s ILE 204 Cb -0.40 -3.95 -0.00 0.00 -1.06 0.00 0.00 42.46 37.05 3bpc s ILE 204 CO 0.44 0.07 -0.15 -0.69 -0.10 0.00 0.00 174.94 174.52 3bpc s VAL 205 N 2.16 2.67 -0.03 2.92 1.01 -1.26 -0.66 120.40 127.21 3bpc s VAL 205 Ca 0.28 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.56 3bpc s VAL 205 Cb -0.16 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 3bpc s VAL 205 CO 0.10 0.51 -0.20 -0.54 0.00 0.00 0.00 175.10 174.97 3bpc s LYS 206 N 0.90 1.76 0.04 2.72 -0.14 -0.79 -5.04 119.74 119.19 3bpc s LYS 206 Ca -0.04 -0.71 -0.07 0.00 -1.36 0.00 0.00 55.97 53.79 3bpc s LYS 206 Cb -0.15 -1.63 -0.00 0.00 -1.68 0.00 0.00 37.83 34.36 3bpc s LYS 206 CO -0.01 0.38 0.14 0.45 -0.76 0.00 0.00 175.35 175.55 3bpc s SER 207 N -0.32 0.11 0.05 2.83 0.15 -1.26 -1.16 113.70 114.10 3bpc s SER 207 Ca 0.04 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.23 3bpc s SER 207 Cb -0.09 0.26 -0.03 0.00 -1.71 0.00 0.00 66.02 64.44 3bpc s SER 207 CO 0.00 -0.54 -0.04 0.72 1.20 0.00 0.00 173.24 174.58 3bpc s PHE 208 N -2.62 0.53 -0.12 3.44 -0.71 -0.60 -5.02 117.98 112.87 3bpc s PHE 208 Ca -0.05 -0.80 0.00 0.00 -1.04 0.00 0.00 56.93 55.04 3bpc s PHE 208 Cb -0.01 -0.35 -0.02 0.00 -1.21 0.00 0.00 43.02 41.43 3bpc s PHE 208 CO -0.04 -0.24 -0.12 -0.80 -1.34 0.00 0.00 175.22 172.67 3bpc s ASN 209 N -2.32 4.12 0.43 1.98 0.01 -1.26 -1.41 114.94 116.49 3bpc s ASN 209 Ca -0.01 -0.28 0.16 0.00 -0.71 0.00 0.00 52.86 52.02 3bpc s ASN 209 Cb -0.00 -1.51 1.05 0.00 0.41 0.00 0.00 41.25 41.20 3bpc s ASN 209 CO -0.05 0.20 1.92 0.03 -1.51 0.00 0.00 177.10 177.69 3bpc h ARG 210 N 6.47 0.40 0.00 -0.60 3.08 -1.31 -0.91 114.38 121.50 3bpc h ARG 210 Ca -0.30 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.73 3bpc h ARG 210 Cb 1.20 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.16 3bpc h ARG 210 CO 0.56 0.27 0.00 -2.95 -1.07 0.00 0.00 179.97 176.77 3bpc h ASN 211 N 0.41 0.00 0.02 7.04 7.08 -1.95 -2.61 115.58 125.58 3bpc h ASN 211 Ca 0.37 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.59 3bpc h ASN 211 Cb 0.84 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.08 3bpc h ASN 211 CO -0.12 0.00 -0.37 -0.62 -2.08 0.00 0.00 177.43 174.25 3bpc n GLU 212 N -2.63 1.31 0.00 4.14 1.02 -0.35 -5.28 120.64 118.85 3bpc n GLU 212 Ca 0.00 -1.04 0.05 0.00 -0.02 0.00 0.00 57.16 56.15 3bpc n GLU 212 Cb 0.19 -1.48 0.32 0.00 -0.02 0.00 0.00 31.44 30.45 3bpc n GLU 212 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31