#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nsn n VAL 2 N 0.00-10.88 -3.64 5.18 0.31 -1.26 -4.90 118.33 103.14 1nsn n VAL 2 Ca 0.00 2.59 -0.15 0.00 -0.01 0.00 0.00 64.34 66.77 1nsn n VAL 2 Cb 0.00 -4.86 -0.08 0.00 -0.91 0.00 0.00 33.84 28.00 1nsn n VAL 2 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1nsn s GLN 3 N -1.15 0.81 -0.45 5.55 0.74 -1.20 -4.85 119.66 119.11 1nsn s GLN 3 Ca 0.00 0.31 0.02 0.00 0.05 0.00 0.00 55.36 55.75 1nsn s GLN 3 Cb 0.00 0.38 0.13 0.00 1.10 0.00 0.00 33.01 34.62 1nsn s GLN 3 CO 0.00 -0.20 0.24 -0.51 -0.55 0.00 0.00 175.29 174.26 1nsn s LEU 4 N -0.72 3.00 -0.06 3.68 1.43 -1.26 -2.25 118.68 122.51 1nsn s LEU 4 Ca -0.08 -2.67 -0.24 0.00 -1.03 0.00 0.00 54.13 50.11 1nsn s LEU 4 Cb -0.03 -1.15 -0.04 0.00 0.03 0.00 0.00 46.19 45.00 1nsn s LEU 4 CO 0.05 -0.26 0.72 -1.10 0.23 0.00 0.00 176.35 175.99 1nsn s GLN 5 N 0.27 4.45 0.30 1.70 1.11 -0.88 -4.09 119.66 122.52 1nsn s GLN 5 Ca 0.17 0.93 0.10 0.00 0.01 0.00 0.00 55.36 56.57 1nsn s GLN 5 Cb -0.25 -3.45 -0.06 0.00 -1.01 0.00 0.00 33.01 28.25 1nsn s GLN 5 CO -0.00 0.06 -0.13 -1.21 0.01 0.00 0.00 175.29 174.02 1nsn s GLU 6 N 0.80 1.70 0.78 2.91 2.02 -1.26 -0.90 118.70 124.75 1nsn s GLU 6 Ca 0.39 -1.84 -0.14 0.00 0.02 0.00 0.00 54.97 53.40 1nsn s GLU 6 Cb -0.18 -1.62 0.07 0.00 0.10 0.00 0.00 34.13 32.50 1nsn s GLU 6 CO 0.19 0.20 1.20 0.45 0.02 0.00 0.00 175.26 177.32 1nsn s SER 7 N -3.53 3.86 0.60 -0.19 0.15 -1.25 -4.97 113.70 108.36 1nsn s SER 7 Ca 0.31 2.34 0.00 0.00 0.70 0.00 0.00 55.95 59.29 1nsn s SER 7 Cb -0.00 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1nsn s SER 7 CO 0.15 -2.49 0.00 0.61 1.20 0.00 0.00 173.24 172.71 1nsn n GLY 8 N 0.38 -1.47 3.74 9.45 0.00 -1.26 -4.67 105.19 111.36 1nsn n GLY 8 Ca 0.13 -1.57 -0.31 0.00 0.00 0.00 0.00 46.02 44.27 1nsn n GLY 8 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1nsn s PRO 9 N -1.80 1.80 -0.25 1.61 0.02 -1.26 -4.59 135.00 130.53 1nsn s PRO 9 Ca 0.00 1.18 -0.06 0.00 0.02 0.00 0.00 61.00 62.14 1nsn s PRO 9 Cb 0.00 -1.84 0.13 0.00 0.02 0.00 0.00 34.50 32.80 1nsn s PRO 9 CO 0.00 -1.97 0.50 0.20 -0.33 0.00 0.00 177.00 175.40 1nsn s GLY 10 N -3.25 -0.58 0.18 0.52 0.00 -1.09 -4.81 107.32 98.29 1nsn s GLY 10 Ca 0.63 1.66 -0.22 0.00 0.00 0.00 0.00 44.72 46.78 1nsn s GLY 10 CO 0.57 2.80 0.74 -2.27 0.00 0.00 0.00 173.10 174.94 1nsn s LEU 11 N 2.72 4.48 -0.05 0.66 0.20 -1.26 -2.71 118.68 122.72 1nsn s LEU 11 Ca 0.04 1.52 -0.06 0.00 0.69 0.00 0.00 54.13 56.32 1nsn s LEU 11 Cb -0.13 -3.38 0.01 0.00 -0.43 0.00 0.00 46.19 42.26 1nsn s LEU 11 CO -0.16 0.14 0.16 0.68 -0.29 0.00 0.00 176.35 176.88 1nsn s VAL 12 N -1.30 0.02 0.47 1.68 -7.23 -1.04 -4.96 120.40 108.03 1nsn s VAL 12 Ca 0.38 -0.13 -0.21 0.00 -1.81 0.00 0.00 61.98 60.21 1nsn s VAL 12 Cb -0.20 -0.28 -0.08 0.00 0.56 0.00 0.00 36.38 36.38 1nsn s VAL 12 CO 0.23 -0.07 1.06 -0.54 -0.31 0.00 0.00 175.10 175.47 1nsn s LYS 13 N -0.18 3.86 -0.55 4.82 1.02 -1.26 -3.96 119.74 123.48 1nsn s LYS 13 Ca -0.03 1.45 -0.26 0.00 0.02 0.00 0.00 55.97 57.15 1nsn s LYS 13 Cb -0.02 -2.23 -0.05 0.00 -0.52 0.00 0.00 37.83 35.00 1nsn s LYS 13 CO 0.00 -0.40 2.20 -2.14 -0.92 0.00 0.00 175.35 174.10 1nsn s PRO 14 N -3.00 2.27 0.00 -1.68 0.02 -1.26 -3.03 135.00 128.32 1nsn s PRO 14 Ca 0.65 1.06 0.00 0.00 0.02 0.00 0.00 61.00 62.73 1nsn s PRO 14 Cb -0.19 -4.53 0.00 0.00 0.02 0.00 0.00 34.50 29.80 1nsn s PRO 14 CO 0.24 -3.13 0.00 0.43 -0.33 0.00 0.00 177.00 174.21 1nsn n SER 15 N 14.85 0.00 -2.67 2.53 7.64 -0.62 -4.87 113.62 130.49 1nsn n SER 15 Ca 0.31 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 60.08 1nsn n SER 15 Cb 0.53 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.76 1nsn n SER 15 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1nsn n GLN 16 N 0.00 1.37 -0.30 1.43 0.00 -1.17 -4.67 117.38 114.05 1nsn n GLN 16 Ca 0.00 -3.39 0.00 0.00 -0.00 0.00 0.00 57.00 53.61 1nsn n GLN 16 Cb 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 30.24 28.87 1nsn n GLN 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1nsn n SER 17 N -0.08 0.00 -3.61 1.69 3.41 -1.26 -4.98 113.62 108.79 1nsn n SER 17 Ca 0.13 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.67 1nsn n SER 17 Cb 0.79 -0.46 -0.02 0.00 -0.26 0.00 0.00 64.21 64.26 1nsn n SER 17 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 1nsn s LEU 18 N -1.26 -0.32 -0.07 1.04 2.34 -1.26 -5.04 118.68 114.11 1nsn s LEU 18 Ca 0.00 -0.19 -0.01 0.00 0.06 0.00 0.00 54.13 53.99 1nsn s LEU 18 Cb 0.00 2.21 0.03 0.00 -0.56 0.00 0.00 46.19 47.87 1nsn s LEU 18 CO 0.00 -0.83 -0.01 -0.44 -1.06 0.00 0.00 176.35 174.01 1nsn s SER 19 N -2.72 1.61 0.99 1.48 0.01 -1.26 -3.56 113.70 110.25 1nsn s SER 19 Ca 0.07 -0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.22 1nsn s SER 19 Cb -0.02 -0.49 0.00 0.00 0.21 0.00 0.00 66.02 65.73 1nsn s SER 19 CO -0.04 -0.17 0.00 0.18 0.41 0.00 0.00 173.24 173.61 1nsn n LEU 20 N 5.04 0.00 -3.70 2.44 4.77 -0.25 -4.86 117.00 120.44 1nsn n LEU 20 Ca -0.09 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.87 1nsn n LEU 20 Cb 0.50 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1nsn n LEU 20 CO 0.12 -0.62 0.85 -0.89 -1.33 0.00 0.00 177.39 175.52 1nsn s THR 21 N -0.99 0.00 -0.38 -5.08 2.01 -1.26 -3.62 115.64 106.31 1nsn s THR 21 Ca 0.00 -0.49 0.07 0.00 0.31 0.00 0.00 61.69 61.57 1nsn s THR 21 Cb 0.00 -1.99 0.18 0.00 0.01 0.00 0.00 72.50 70.70 1nsn s THR 21 CO 0.00 0.00 0.58 0.00 -0.69 0.00 0.00 174.62 174.51 1nsn s THR 23 N 1.93 3.68 -0.41 0.00 2.01 -0.08 -3.56 115.64 119.21 1nsn s THR 23 Ca 0.15 1.56 0.02 0.00 0.31 0.00 0.00 61.69 63.73 1nsn s THR 23 Cb -0.07 -3.94 0.12 0.00 0.01 0.00 0.00 72.50 68.62 1nsn s THR 23 CO -0.10 0.27 0.18 0.68 -0.69 0.00 0.00 174.62 174.97 1nsn s VAL 24 N -1.32 1.56 1.33 3.82 -7.23 -1.11 -2.07 120.40 115.38 1nsn s VAL 24 Ca 0.48 -2.36 -0.18 0.00 -1.81 0.00 0.00 61.98 58.10 1nsn s VAL 24 Cb -0.28 -2.11 0.34 0.00 0.56 0.00 0.00 36.38 34.89 1nsn s VAL 24 CO 0.35 -0.79 0.96 -0.89 -0.31 0.00 0.00 175.10 174.42 1nsn s THR 25 N 0.63 1.56 0.00 5.32 2.01 -0.95 -3.10 115.64 121.11 1nsn s THR 25 Ca 0.15 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.15 1nsn s THR 25 Cb -0.22 -2.02 0.00 0.00 0.01 0.00 0.00 72.50 70.27 1nsn s THR 25 CO -0.07 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.47 1nsn n GLY 26 N 1.35 0.15 0.00 4.40 0.00 -1.26 -3.22 105.19 106.61 1nsn n GLY 26 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1nsn n GLY 26 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1nsn n TYR 27 N -2.29 -0.07 0.00 1.61 9.36 -1.18 -4.37 117.16 120.22 1nsn n TYR 27 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1nsn n TYR 27 Cb 0.35 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.06 1nsn n TYR 27 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1nsn n SER 28 N -0.07 0.48 -0.97 2.98 7.64 -1.26 -4.92 113.62 117.49 1nsn n SER 28 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1nsn n SER 28 Cb 0.00 0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 1nsn n SER 28 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1nsn n ILE 29 N -0.38 -3.37 0.00 0.44 5.41 -1.26 -4.66 119.36 115.54 1nsn n ILE 29 Ca 0.00 0.39 0.00 0.00 1.00 0.00 0.00 62.75 64.14 1nsn n ILE 29 Cb 0.02 -2.99 0.00 0.00 -0.71 0.00 0.00 39.64 35.97 1nsn n ILE 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1nsn n THR 30 N 0.22 0.00 0.00 1.39 -1.04 -1.26 -4.85 114.28 108.74 1nsn n THR 30 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1nsn n THR 30 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1nsn n THR 30 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1nsn n SER 31 N 0.00 0.00 0.00 8.00 7.64 -1.26 -4.55 113.62 123.45 1nsn n SER 31 Ca 0.00 0.35 0.00 0.00 1.01 0.00 0.00 58.87 60.23 1nsn n SER 31 Cb 0.00 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 1nsn n SER 31 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1nsn n ASP 32 N -1.34 -0.22 -2.80 6.43 2.03 -1.26 -4.91 116.55 114.48 1nsn n ASP 32 Ca 0.00 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.29 1nsn n ASP 32 Cb 0.03 0.37 0.05 0.00 -0.72 0.00 0.00 41.12 40.84 1nsn n ASP 32 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nsn n TYR 33 N 0.83 1.28 -0.55 -0.67 9.36 -1.26 -4.91 117.16 121.24 1nsn n TYR 33 Ca 0.00 -2.22 -0.21 0.00 3.32 0.00 0.00 57.90 58.79 1nsn n TYR 33 Cb 0.00 -0.25 -0.05 0.00 -0.63 0.00 0.00 39.34 38.41 1nsn n TYR 33 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1nsn n ALA 34 N -0.54 0.10 -1.09 2.98 0.00 -1.26 -4.05 120.51 116.65 1nsn n ALA 34 Ca 0.08 -0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.18 1nsn n ALA 34 Cb 0.81 -0.88 0.13 0.00 0.00 0.00 0.00 19.45 19.50 1nsn n ALA 34 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1nsn n TRP 35 N 3.58 1.23 -3.24 0.00 5.03 -1.18 0.14 117.44 123.01 1nsn n TRP 35 Ca 0.24 0.41 -0.03 0.00 3.03 0.00 0.00 57.50 61.15 1nsn n TRP 35 Cb -0.00 -2.10 -0.03 0.00 -1.03 0.00 0.00 31.31 28.15 1nsn n TRP 35 CO 0.00 0.00 0.00 -0.80 -0.03 0.00 0.00 177.69 176.86 1nsn s ASN 35 N -2.13 -0.77 0.29 -0.99 0.01 -0.78 -3.25 114.94 107.32 1nsn s ASN 35 Ca 0.73 -0.71 -0.29 0.00 -0.71 0.00 0.00 52.86 51.88 1nsn s ASN 35 Cb -0.29 1.59 -0.10 0.00 0.41 0.00 0.00 41.25 42.86 1nsn s ASN 35 CO 0.51 -0.24 1.34 0.26 -1.51 0.00 0.00 177.10 177.46 1nsn s TRP 36 N 2.04 3.07 0.05 2.20 0.52 -0.29 -2.91 118.94 123.62 1nsn s TRP 36 Ca 0.14 1.30 0.04 0.00 0.02 0.00 0.00 56.10 57.60 1nsn s TRP 36 Cb -0.08 -3.70 -0.02 0.00 -1.15 0.00 0.00 33.47 28.51 1nsn s TRP 36 CO -0.13 -2.06 -0.12 0.42 0.02 0.00 0.00 176.95 175.08 1nsn s ILE 37 N -0.70 0.95 0.18 2.03 -1.09 0.11 -0.26 121.20 122.42 1nsn s ILE 37 Ca 0.52 -1.05 0.10 0.00 -2.23 0.00 0.00 60.65 58.00 1nsn s ILE 37 Cb -0.40 -0.90 -0.04 0.00 -1.58 0.00 0.00 42.46 39.53 1nsn s ILE 37 CO 0.49 -0.13 -0.18 -0.60 -1.23 0.00 0.00 174.94 173.29 1nsn s ARG 38 N -1.32 1.74 -0.35 2.79 3.52 -0.29 -1.09 118.95 123.94 1nsn s ARG 38 Ca -0.02 -1.40 0.03 0.00 -0.13 0.00 0.00 55.73 54.22 1nsn s ARG 38 Cb -0.08 -1.98 0.16 0.00 -1.56 0.00 0.00 34.95 31.48 1nsn s ARG 38 CO 0.01 0.42 0.40 -1.14 -0.81 0.00 0.00 175.30 174.18 1nsn s GLN 39 N -2.67 0.58 0.59 5.12 0.74 0.17 -1.36 119.66 122.85 1nsn s GLN 39 Ca 0.22 -0.54 -0.18 0.00 0.05 0.00 0.00 55.36 54.91 1nsn s GLN 39 Cb -0.08 -0.55 -0.06 0.00 1.10 0.00 0.00 33.01 33.42 1nsn s GLN 39 CO 0.12 -1.15 0.88 0.34 -0.55 0.00 0.00 175.29 174.93 1nsn n PHE 40 N 4.58 0.53 -1.92 1.67 -0.00 -1.25 -1.77 117.46 119.30 1nsn n PHE 40 Ca 0.08 0.44 -0.42 0.00 -0.00 0.00 0.00 57.45 57.54 1nsn n PHE 40 Cb 0.47 -2.10 -0.03 0.00 -0.00 0.00 0.00 39.48 37.82 1nsn n PHE 40 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.76 174.62 1nsn s PRO 41 N -2.63 4.17 0.00 -7.13 0.02 -1.26 -3.58 135.00 124.60 1nsn s PRO 41 Ca 0.74 2.31 0.00 0.00 0.02 0.00 0.00 61.00 64.07 1nsn s PRO 41 Cb -0.42 -4.02 0.00 0.00 0.02 0.00 0.00 34.50 30.07 1nsn s PRO 41 CO 0.48 -0.87 0.00 0.41 -0.33 0.00 0.00 177.00 176.69 1nsn n GLY 42 N 4.24 1.98 0.00 0.52 0.00 -1.26 -4.98 105.19 105.69 1nsn n GLY 42 Ca 0.18 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1nsn n GLY 42 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1nsn n ASN 43 N 0.00 0.00 -3.11 1.61 2.85 -1.23 -5.15 115.26 110.23 1nsn n ASN 43 Ca 0.00 0.00 -0.09 0.00 -0.11 0.00 0.00 54.58 54.38 1nsn n ASN 43 Cb 0.00 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 40.99 1nsn n ASN 43 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1nsn s LYS 44 N 0.00 0.89 -0.40 1.20 2.20 -1.26 -4.99 119.74 117.38 1nsn s LYS 44 Ca 0.00 -0.97 -0.28 0.00 -0.36 0.00 0.00 55.97 54.36 1nsn s LYS 44 Cb 0.00 -0.36 -0.00 0.00 -1.51 0.00 0.00 37.83 35.96 1nsn s LYS 44 CO 0.00 -1.27 1.57 -0.51 -0.36 0.00 0.00 175.35 174.78 1nsn s LEU 45 N 1.13 3.53 -0.19 5.43 1.43 -1.26 -3.75 118.68 125.01 1nsn s LEU 45 Ca 0.24 0.95 -0.02 0.00 -1.03 0.00 0.00 54.13 54.27 1nsn s LEU 45 Cb -0.04 -3.46 -0.00 0.00 0.03 0.00 0.00 46.19 42.71 1nsn s LEU 45 CO -0.07 -1.59 -0.10 -1.61 0.23 0.00 0.00 176.35 173.21 1nsn s GLU 46 N 5.32 3.29 -0.05 1.70 2.02 -0.46 -4.97 118.70 125.54 1nsn s GLU 46 Ca 0.68 -0.69 -0.30 0.00 0.02 0.00 0.00 54.97 54.68 1nsn s GLU 46 Cb -0.17 -2.80 -0.05 0.00 0.10 0.00 0.00 34.13 31.21 1nsn s GLU 46 CO 0.32 -0.09 1.53 -0.46 0.02 0.00 0.00 175.26 176.59 1nsn s TRP 47 N 1.12 2.35 -0.09 1.61 -0.00 -1.26 -1.13 118.94 121.53 1nsn s TRP 47 Ca 0.01 0.48 -0.23 0.00 -0.00 0.00 0.00 56.10 56.36 1nsn s TRP 47 Cb -0.14 -3.80 -0.28 0.00 -0.00 0.00 0.00 33.47 29.25 1nsn s TRP 47 CO -0.03 -3.19 0.75 0.52 -0.00 0.00 0.00 176.95 175.00 1nsn h MET 48 N 8.83 0.19 0.00 5.86 2.86 -0.97 -3.44 114.93 128.25 1nsn h MET 48 Ca -0.37 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 56.95 1nsn h MET 48 Cb 1.17 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.95 1nsn h MET 48 CO 0.94 1.15 0.00 0.41 1.06 0.00 0.00 176.91 180.48 1nsn n GLY 49 N 1.65 -0.94 2.66 8.32 0.00 -1.19 -1.66 105.19 114.02 1nsn n GLY 49 Ca -0.16 -1.60 -0.19 0.00 0.00 0.00 0.00 46.02 44.07 1nsn n GLY 49 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1nsn n TYR 50 N 0.84 -0.11 -3.67 1.61 0.18 -0.23 -1.13 117.16 114.64 1nsn n TYR 50 Ca 0.00 -2.15 -0.11 0.00 1.88 0.00 0.00 57.90 57.52 1nsn n TYR 50 Cb 0.00 0.07 -0.09 0.00 -0.38 0.00 0.00 39.34 38.94 1nsn n TYR 50 CO 0.00 0.00 0.00 -1.50 -2.08 0.00 0.00 176.86 173.28 1nsn s ILE 51 N -2.87 -0.01 0.52 -3.48 2.07 -1.20 -2.03 121.20 114.20 1nsn s ILE 51 Ca 0.21 0.02 0.02 0.00 -1.41 0.00 0.00 60.65 59.50 1nsn s ILE 51 Cb 0.01 -0.81 0.00 0.00 0.13 0.00 0.00 42.46 41.79 1nsn s ILE 51 CO 0.15 0.01 0.12 0.28 -1.91 0.00 0.00 174.94 173.59 1nsn s THR 52 N 0.87 1.30 0.51 4.00 -1.32 -1.22 -3.08 115.64 116.69 1nsn s THR 52 Ca -0.05 -1.85 0.23 0.00 -1.21 0.00 0.00 61.69 58.82 1nsn s THR 52 Cb -0.05 -2.15 0.39 0.00 -1.51 0.00 0.00 72.50 69.18 1nsn s THR 52 CO -0.07 0.00 1.98 0.22 -2.21 0.00 0.00 174.62 174.53 1nsn h TYR 53 N 1.17 0.11 -0.15 9.09 5.03 -1.91 -2.06 116.97 128.25 1nsn h TYR 53 Ca -0.42 0.00 -0.08 0.00 2.58 0.00 0.00 58.73 60.81 1nsn h TYR 53 Cb 1.31 -0.03 -0.01 0.00 1.55 0.00 0.00 36.73 39.55 1nsn h TYR 53 CO 1.37 0.04 -0.27 0.66 -1.32 0.00 0.00 178.16 178.64 1nsn h SER 54 N 0.09 0.27 0.00 -2.11 4.64 -1.96 -3.48 113.55 111.01 1nsn h SER 54 Ca 0.28 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1nsn h SER 54 Cb 1.00 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 1nsn h SER 54 CO -0.03 0.55 0.00 0.61 -0.87 0.00 0.00 176.83 177.09 1nsn n GLY 55 N -0.49 3.40 3.65 -0.77 0.00 -0.78 -5.08 105.19 105.12 1nsn n GLY 55 Ca -0.01 -0.99 -0.31 0.00 0.00 0.00 0.00 46.02 44.72 1nsn n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nsn s THR 56 N -0.01 2.02 0.00 2.61 2.01 -1.26 -4.72 115.64 116.30 1nsn s THR 56 Ca 0.00 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.01 1nsn s THR 56 Cb 0.00 -2.02 0.00 0.00 0.01 0.00 0.00 72.50 70.49 1nsn s THR 56 CO 0.00 -0.01 0.00 0.35 -0.69 0.00 0.00 174.62 174.27 1nsn n THR 57 N -4.33 0.00 -3.15 -0.82 -2.24 -1.26 -3.46 114.28 99.03 1nsn n THR 57 Ca 0.11 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.94 1nsn n THR 57 Cb 0.52 -0.02 -0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1nsn n THR 57 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1nsn s SER 58 N -0.34 -1.10 0.04 3.42 0.15 -0.86 -4.96 113.70 110.04 1nsn s SER 58 Ca 0.00 0.21 -0.20 0.00 0.70 0.00 0.00 55.95 56.66 1nsn s SER 58 Cb 0.00 1.73 -0.06 0.00 -1.71 0.00 0.00 66.02 65.98 1nsn s SER 58 CO 0.00 -0.20 0.59 -0.31 1.20 0.00 0.00 173.24 174.52 1nsn s TYR 59 N 2.89 3.75 0.28 3.44 1.51 -1.26 -1.07 117.35 126.88 1nsn s TYR 59 Ca 0.16 1.25 -0.29 0.00 -1.01 0.00 0.00 57.07 57.18 1nsn s TYR 59 Cb -0.08 -2.56 -0.14 0.00 -0.11 0.00 0.00 41.96 39.07 1nsn s TYR 59 CO -0.23 0.47 1.10 -1.71 -1.11 0.00 0.00 175.55 174.07 1nsn n ASN 60 N 2.22 1.62 -0.08 2.29 2.85 -0.67 -4.87 115.26 118.62 1nsn n ASN 60 Ca -0.08 1.17 -0.13 0.00 -0.11 0.00 0.00 54.58 55.43 1nsn n ASN 60 Cb 0.51 -1.32 -0.09 0.00 1.24 0.00 0.00 39.78 40.12 1nsn n ASN 60 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1nsn h PRO 61 N 2.44 -0.40 0.00 1.20 0.11 -1.94 -3.28 132.00 130.12 1nsn h PRO 61 Ca -0.41 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1nsn h PRO 61 Cb 1.33 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.53 1nsn h PRO 61 CO 0.63 -0.27 0.00 0.45 -0.21 0.00 0.00 178.00 178.61 1nsn n SER 62 N -5.08 0.00 -4.17 -2.05 2.88 -1.26 -3.52 113.62 100.42 1nsn n SER 62 Ca -0.04 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.11 1nsn n SER 62 Cb 0.31 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.68 1nsn n SER 62 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1nsn s LEU 63 N 0.00 5.55 0.00 2.46 1.43 -1.24 -4.96 118.68 121.93 1nsn s LEU 63 Ca 0.00 -2.16 0.00 0.00 -1.03 0.00 0.00 54.13 50.94 1nsn s LEU 63 Cb 0.00 -1.94 0.00 0.00 0.03 0.00 0.00 46.19 44.28 1nsn s LEU 63 CO 0.00 -0.59 0.00 1.17 0.23 0.00 0.00 176.35 177.16 1nsn n LYS 64 N 4.52 0.00 -1.74 1.70 4.81 -1.23 -4.62 118.16 121.60 1nsn n LYS 64 Ca -0.02 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.01 1nsn n LYS 64 Cb 0.41 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.47 1nsn n LYS 64 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1nsn n SER 65 N 0.00 3.10 0.00 3.14 7.64 -1.26 -3.21 113.62 123.03 1nsn n SER 65 Ca 0.00 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.03 1nsn n SER 65 Cb 0.00 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 61.64 1nsn n SER 65 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1nsn n ARG 66 N 0.12 0.00 -4.39 1.43 1.85 -1.26 -5.04 116.66 109.37 1nsn n ARG 66 Ca 0.05 0.00 -0.21 0.00 -1.00 0.00 0.00 57.85 56.69 1nsn n ARG 66 Cb 0.39 -0.72 -0.16 0.00 -1.05 0.00 0.00 32.46 30.93 1nsn n ARG 66 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 1nsn s ILE 67 N -2.43 0.79 0.30 8.89 1.01 -1.20 0.78 121.20 129.35 1nsn s ILE 67 Ca 0.00 -0.36 0.03 0.00 0.00 0.00 0.00 60.65 60.32 1nsn s ILE 67 Cb 0.00 -0.71 -0.03 0.00 0.01 0.00 0.00 42.46 41.73 1nsn s ILE 67 CO 0.00 0.25 0.29 -0.94 0.00 0.00 0.00 174.94 174.54 1nsn s SER 68 N 0.24 1.14 -0.16 3.58 1.04 -0.49 -4.93 113.70 114.12 1nsn s SER 68 Ca -0.04 -1.60 -0.04 0.00 0.48 0.00 0.00 55.95 54.75 1nsn s SER 68 Cb -0.09 0.54 0.07 0.00 0.10 0.00 0.00 66.02 66.64 1nsn s SER 68 CO 0.01 -1.06 0.19 0.27 0.98 0.00 0.00 173.24 173.63 1nsn s ILE 69 N -3.55 -0.29 0.55 -1.02 -4.36 -1.26 -2.28 121.20 108.99 1nsn s ILE 69 Ca 0.38 0.04 0.08 0.00 -0.26 0.00 0.00 60.65 60.88 1nsn s ILE 69 Cb 0.03 -0.55 0.06 0.00 1.25 0.00 0.00 42.46 43.25 1nsn s ILE 69 CO 0.22 -0.09 0.61 -0.44 0.24 0.00 0.00 174.94 175.47 1nsn s SER 70 N 2.30 4.90 -0.41 4.36 0.01 -0.83 -4.87 113.70 119.16 1nsn s SER 70 Ca 0.05 -1.02 0.04 0.00 1.31 0.00 0.00 55.95 56.33 1nsn s SER 70 Cb -0.14 0.32 0.17 0.00 0.21 0.00 0.00 66.02 66.57 1nsn s SER 70 CO -0.10 -1.21 0.35 0.00 0.41 0.00 0.00 173.24 172.69 1nsn s ARG 71 N -4.48 0.89 -1.27 12.44 1.70 -1.26 -1.13 118.95 125.84 1nsn s ARG 71 Ca 0.49 -2.00 -0.08 0.00 -0.47 0.00 0.00 55.73 53.67 1nsn s ARG 71 Cb -0.04 -1.32 0.17 0.00 -0.57 0.00 0.00 34.95 33.19 1nsn s ARG 71 CO 0.31 -1.37 1.94 -3.47 -1.08 0.00 0.00 175.30 171.62 1nsn n ASP 72 N 2.93 5.78 -0.14 -2.89 -0.08 0.71 -4.84 116.55 118.02 1nsn n ASP 72 Ca 0.28 -3.15 -0.03 0.00 -1.51 0.00 0.00 54.79 50.37 1nsn n ASP 72 Cb 0.48 -1.43 0.04 0.00 2.34 0.00 0.00 41.12 42.54 1nsn n ASP 72 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1nsn h THR 73 N 3.48 0.62 -0.72 5.18 1.35 -1.91 -0.92 112.91 119.98 1nsn h THR 73 Ca 0.44 -0.03 0.12 0.00 -0.55 0.00 0.00 66.41 66.39 1nsn h THR 73 Cb 0.56 0.54 -0.08 0.00 -1.73 0.00 0.00 68.15 67.43 1nsn h THR 73 CO 1.57 0.01 0.31 0.77 -0.25 0.00 0.00 175.52 177.94 1nsn h SER 74 N 0.08 0.34 -1.33 5.36 4.64 -1.88 0.65 113.55 121.40 1nsn h SER 74 Ca 0.22 0.09 -0.61 0.00 -0.47 0.00 0.00 61.79 61.02 1nsn h SER 74 Cb 0.33 0.05 -0.23 0.00 -0.31 0.00 0.00 62.40 62.25 1nsn h SER 74 CO -0.40 0.16 0.74 0.29 -0.87 0.00 0.00 176.83 176.74 1nsn n LYS 75 N -4.95 2.51 -1.45 4.77 4.76 -0.62 -4.92 118.16 118.25 1nsn n LYS 75 Ca 0.13 -2.86 0.00 0.00 -2.87 0.00 0.00 58.31 52.71 1nsn n LYS 75 Cb 0.35 -2.15 0.00 0.00 -1.84 0.00 0.00 35.03 31.39 1nsn n LYS 75 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1nsn n ASN 76 N -0.04 0.00 -3.69 4.39 4.05 0.23 -4.82 115.26 115.37 1nsn n ASN 76 Ca 0.51 0.00 -0.13 0.00 0.45 0.00 0.00 54.58 55.41 1nsn n ASN 76 Cb 0.45 0.00 -0.07 0.00 1.23 0.00 0.00 39.78 41.39 1nsn n ASN 76 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 1nsn s GLN 77 N -1.46 0.84 0.05 1.20 -0.21 -0.45 -2.73 119.66 116.90 1nsn s GLN 77 Ca 0.00 -0.25 0.07 0.00 0.02 0.00 0.00 55.36 55.20 1nsn s GLN 77 Cb 0.00 0.37 -0.03 0.00 1.00 0.00 0.00 33.01 34.36 1nsn s GLN 77 CO 0.00 -0.26 -0.20 -0.06 -2.12 0.00 0.00 175.29 172.64 1nsn s PHE 78 N -1.95 1.76 0.47 0.91 0.08 -1.23 -0.21 117.98 117.81 1nsn s PHE 78 Ca -0.09 -0.38 0.03 0.00 0.12 0.00 0.00 56.93 56.61 1nsn s PHE 78 Cb -0.02 -1.04 -0.03 0.00 -0.57 0.00 0.00 43.02 41.36 1nsn s PHE 78 CO 0.01 0.11 0.02 -0.06 -0.10 0.00 0.00 175.22 175.20 1nsn s PHE 79 N -0.87 2.00 -0.18 0.36 0.40 -0.28 -2.64 117.98 116.78 1nsn s PHE 79 Ca 0.07 -0.94 -0.13 0.00 -0.60 0.00 0.00 56.93 55.34 1nsn s PHE 79 Cb -0.09 -1.57 0.06 0.00 0.51 0.00 0.00 43.02 41.92 1nsn s PHE 79 CO 0.02 0.20 0.46 0.00 0.70 0.00 0.00 175.22 176.60 1nsn s MET 80 N -3.82 0.48 0.09 0.44 0.23 -1.24 -1.96 119.30 113.52 1nsn s MET 80 Ca 0.16 0.77 0.10 0.00 -1.03 0.00 0.00 55.69 55.69 1nsn s MET 80 Cb 0.04 0.11 -0.04 0.00 -1.53 0.00 0.00 34.83 33.41 1nsn s MET 80 CO 0.08 -0.12 -0.25 -0.65 -2.03 0.00 0.00 175.02 172.06 1nsn s GLN 81 N 0.95 1.64 -0.50 3.16 -0.21 -0.97 -1.09 119.66 122.65 1nsn s GLN 81 Ca -0.06 -1.22 0.03 0.00 0.02 0.00 0.00 55.36 54.14 1nsn s GLN 81 Cb -0.06 -1.98 0.14 0.00 1.00 0.00 0.00 33.01 32.10 1nsn s GLN 81 CO -0.08 0.48 0.27 -0.51 -2.12 0.00 0.00 175.29 173.33 1nsn s LEU 82 N -1.76 3.67 0.88 2.90 2.01 -1.23 -1.39 118.68 123.75 1nsn s LEU 82 Ca 0.14 -2.93 -0.11 0.00 0.01 0.00 0.00 54.13 51.24 1nsn s LEU 82 Cb -0.10 -1.38 0.12 0.00 0.01 0.00 0.00 46.19 44.84 1nsn s LEU 82 CO 0.05 -0.23 1.10 0.20 1.01 0.00 0.00 176.35 178.48 1nsn s ASN 82 N -0.12 3.49 -1.33 2.29 -0.87 0.23 -3.87 114.94 114.76 1nsn s ASN 82 Ca 0.18 1.80 -0.24 0.00 -1.57 0.00 0.00 52.86 53.03 1nsn s ASN 82 Cb -0.23 -2.42 0.03 0.00 -0.02 0.00 0.00 41.25 38.61 1nsn s ASN 82 CO -0.01 -2.68 0.45 -0.24 -2.57 0.00 0.00 177.10 172.05 1nsn n SER 82 N -3.93 -2.39 -4.68 -1.22 2.88 -1.26 -4.83 113.62 98.19 1nsn n SER 82 Ca 0.09 -1.31 -0.41 0.00 -1.33 0.00 0.00 58.87 55.92 1nsn n SER 82 Cb 0.53 -1.59 0.02 0.00 -0.75 0.00 0.00 64.21 62.42 1nsn n SER 82 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1nsn n VAL 82 N -4.94 2.71 -4.28 2.46 0.31 -1.25 -4.73 118.33 108.61 1nsn n VAL 82 Ca -0.18 -0.50 -0.16 0.00 -0.01 0.00 0.00 64.34 63.49 1nsn n VAL 82 Cb 0.61 -1.44 -0.10 0.00 -0.91 0.00 0.00 33.84 32.00 1nsn n VAL 82 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1nsn s THR 83 N -1.25 1.35 0.55 2.52 -4.23 -1.26 -1.59 115.64 111.73 1nsn s THR 83 Ca 0.63 -2.11 0.23 0.00 -1.18 0.00 0.00 61.69 59.27 1nsn s THR 83 Cb -0.51 -1.92 0.34 0.00 1.34 0.00 0.00 72.50 71.75 1nsn s THR 83 CO 0.56 -0.69 2.09 0.74 -0.54 0.00 0.00 174.62 176.78 1nsn h THR 84 N 2.70 0.74 0.00 3.99 2.02 -1.96 0.29 112.91 120.69 1nsn h THR 84 Ca -0.37 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.81 1nsn h THR 84 Cb 1.20 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 1nsn h THR 84 CO 0.63 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.90 1nsn n GLU 85 N -4.25 0.78 0.00 6.66 1.02 -1.26 -2.75 120.64 120.84 1nsn n GLU 85 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1nsn n GLU 85 Cb 0.32 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 1nsn n GLU 85 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1nsn n ASP 86 N 0.44 0.55 -4.70 1.62 8.00 0.10 -5.04 116.55 117.51 1nsn n ASP 86 Ca 0.00 -0.88 -0.42 0.00 0.71 0.00 0.00 54.79 54.19 1nsn n ASP 86 Cb 0.32 0.11 -0.03 0.00 -0.02 0.00 0.00 41.12 41.51 1nsn n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1nsn s THR 87 N -0.11 3.75 -2.61 -3.53 2.01 -1.11 -4.90 115.64 109.13 1nsn s THR 87 Ca 0.00 1.19 0.00 0.00 0.31 0.00 0.00 61.69 63.19 1nsn s THR 87 Cb 0.00 -3.76 0.00 0.00 0.01 0.00 0.00 72.50 68.75 1nsn s THR 87 CO 0.00 0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.58 1nsn n GLY 88 N 3.50 -1.81 3.86 4.40 0.00 -0.98 -4.21 105.19 109.95 1nsn n GLY 88 Ca 0.12 -1.13 -0.31 0.00 0.00 0.00 0.00 46.02 44.70 1nsn n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nsn s THR 89 N -2.33 5.07 -0.18 2.61 -4.23 -0.73 -1.70 115.64 114.15 1nsn s THR 89 Ca 0.00 -0.50 0.01 0.00 -1.18 0.00 0.00 61.69 60.02 1nsn s THR 89 Cb 0.00 -3.45 0.02 0.00 1.34 0.00 0.00 72.50 70.42 1nsn s THR 89 CO 0.00 0.16 -0.17 -0.36 -0.54 0.00 0.00 174.62 173.71 1nsn s PHE 90 N -1.44 2.63 -0.12 3.99 0.08 0.16 -0.65 117.98 122.63 1nsn s PHE 90 Ca 0.32 -1.58 -0.02 0.00 0.12 0.00 0.00 56.93 55.77 1nsn s PHE 90 Cb -0.13 -1.82 -0.03 0.00 -0.57 0.00 0.00 43.02 40.48 1nsn s PHE 90 CO 0.24 -0.77 -0.05 0.71 -0.10 0.00 0.00 175.22 175.25 1nsn s TYR 91 N 1.34 3.00 0.30 0.36 1.51 -0.25 -0.96 117.35 122.64 1nsn s TYR 91 Ca 0.04 -0.17 -0.03 0.00 -1.01 0.00 0.00 57.07 55.90 1nsn s TYR 91 Cb -0.14 -1.85 -0.04 0.00 -0.11 0.00 0.00 41.96 39.82 1nsn s TYR 91 CO -0.12 0.12 0.54 0.00 -1.11 0.00 0.00 175.55 174.99 1nsn s THR 93 N -2.14 0.07 0.23 0.00 2.01 -1.14 -1.66 115.64 113.00 1nsn s THR 93 Ca 0.42 -0.59 -0.14 0.00 0.31 0.00 0.00 61.69 61.69 1nsn s THR 93 Cb -0.10 -0.45 -0.08 0.00 0.01 0.00 0.00 72.50 71.88 1nsn s THR 93 CO 0.32 -0.32 0.63 -0.60 -0.69 0.00 0.00 174.62 173.95 1nsn s ARG 94 N -1.24 3.98 0.00 4.92 3.00 -0.50 -1.87 118.95 127.25 1nsn s ARG 94 Ca -0.13 0.54 -0.00 0.00 -1.00 0.00 0.00 55.73 55.14 1nsn s ARG 94 Cb -0.07 -2.72 -0.00 0.00 0.00 0.00 0.00 34.95 32.16 1nsn s ARG 94 CO 0.02 0.34 1.32 0.41 0.00 0.00 0.00 175.30 177.39 1nsn n GLY 95 N 0.24 1.81 0.00 8.12 0.00 0.37 -3.26 105.19 112.48 1nsn n GLY 95 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1nsn n GLY 95 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nsn n ASN 96 N 1.69 0.00 0.00 1.61 4.13 -1.26 -4.87 115.26 116.55 1nsn n ASN 96 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1nsn n ASN 96 Cb 0.33 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.57 1nsn n ASN 96 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1nsn n GLY 97 N 0.00 -0.36 0.00 7.41 0.00 -1.20 -5.16 105.19 105.88 1nsn n GLY 97 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1nsn n GLY 97 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1nsn n ASP 98 N 1.59 0.00 -4.47 1.61 5.75 -1.26 -3.21 116.55 116.55 1nsn n ASP 98 Ca 0.00 0.00 -0.24 0.00 -0.01 0.00 0.00 54.79 54.54 1nsn n ASP 98 Cb 0.00 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 39.99 1nsn n ASP 98 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 1nsn s TRP 103 N 0.00 2.26 0.29 2.11 0.52 -1.26 -1.41 118.94 121.45 1nsn s TRP 103 Ca 0.00 -0.37 0.02 0.00 0.02 0.00 0.00 56.10 55.78 1nsn s TRP 103 Cb 0.00 -1.02 -0.03 0.00 -1.15 0.00 0.00 33.47 31.27 1nsn s TRP 103 CO 0.00 0.68 0.45 0.20 0.02 0.00 0.00 176.95 178.30 1nsn s GLY 104 N -3.51 1.31 0.00 0.98 0.00 -0.66 -4.68 107.32 100.76 1nsn s GLY 104 Ca 0.30 -1.05 0.05 0.00 0.00 0.00 0.00 44.72 44.02 1nsn s GLY 104 CO 0.15 -1.03 0.69 -1.06 0.00 0.00 0.00 173.10 171.85 1nsn n GLN 105 N -1.54 0.38 -0.65 2.90 3.00 -1.26 -4.74 117.38 115.48 1nsn n GLN 105 Ca -0.07 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 56.94 1nsn n GLN 105 Cb 0.56 -1.20 -0.01 0.00 0.00 0.00 0.00 30.24 29.60 1nsn n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1nsn n GLY 106 N -0.16 -3.23 3.33 1.08 0.00 -1.26 -4.98 105.19 99.96 1nsn n GLY 106 Ca 0.04 -1.16 -0.32 0.00 0.00 0.00 0.00 46.02 44.58 1nsn n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nsn s THR 107 N -4.33 2.65 -0.14 2.61 2.01 -0.13 -4.88 115.64 113.43 1nsn s THR 107 Ca 0.00 -0.82 -0.10 0.00 0.31 0.00 0.00 61.69 61.08 1nsn s THR 107 Cb 0.00 -2.06 -0.05 0.00 0.01 0.00 0.00 72.50 70.40 1nsn s THR 107 CO 0.00 0.55 0.19 -0.89 -0.69 0.00 0.00 174.62 173.78 1nsn s THR 108 N 0.13 5.39 0.05 -0.82 2.01 -1.26 0.37 115.64 121.51 1nsn s THR 108 Ca -0.09 0.33 0.05 0.00 0.31 0.00 0.00 61.69 62.29 1nsn s THR 108 Cb -0.15 -3.49 -0.02 0.00 0.01 0.00 0.00 72.50 68.84 1nsn s THR 108 CO 0.06 0.52 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.59 1nsn s LEU 109 N -0.36 2.20 0.20 4.42 2.01 -0.69 -2.67 118.68 123.79 1nsn s LEU 109 Ca 0.14 -0.51 0.04 0.00 0.01 0.00 0.00 54.13 53.81 1nsn s LEU 109 Cb -0.12 -0.65 -0.05 0.00 0.01 0.00 0.00 46.19 45.38 1nsn s LEU 109 CO 0.03 0.03 -0.04 -0.89 1.01 0.00 0.00 176.35 176.49 1nsn s THR 110 N -0.95 1.09 -0.39 5.49 2.01 -1.10 -2.32 115.64 119.48 1nsn s THR 110 Ca 0.02 -2.05 0.06 0.00 0.31 0.00 0.00 61.69 60.03 1nsn s THR 110 Cb -0.09 -2.15 0.17 0.00 0.01 0.00 0.00 72.50 70.44 1nsn s THR 110 CO 0.02 -0.49 0.54 -0.69 -0.69 0.00 0.00 174.62 173.32 1nsn s VAL 111 N -3.38 -0.79 0.00 3.82 1.01 -1.26 -2.51 120.40 117.30 1nsn s VAL 111 Ca 0.24 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.91 1nsn s VAL 111 Cb 0.04 -0.30 0.00 0.00 0.00 0.00 0.00 36.38 36.13 1nsn s VAL 111 CO 0.06 -0.19 0.00 -1.20 0.00 0.00 0.00 175.10 173.77 1nsn n SER 112 N 4.46 0.57 0.00 3.32 7.64 -1.25 -4.51 113.62 123.84 1nsn n SER 112 Ca 0.10 -0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1nsn n SER 112 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 1nsn n SER 112 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1nsn n SER 113 N -0.29 0.00 -0.02 6.43 3.41 -1.26 -4.53 113.62 117.37 1nsn n SER 113 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1nsn n SER 113 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1nsn n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nsn n ALA 114 N -0.76 0.00 -1.71 7.33 0.00 -1.26 -5.05 120.51 119.06 1nsn n ALA 114 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1nsn n ALA 114 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1nsn n ALA 114 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nsn n LYS 115 N -0.03 -1.63 -2.89 0.00 4.76 -1.26 -5.03 118.16 112.07 1nsn n LYS 115 Ca 0.00 1.54 -0.37 0.00 -2.87 0.00 0.00 58.31 56.61 1nsn n LYS 115 Cb 0.00 -2.20 -0.06 0.00 -1.84 0.00 0.00 35.03 30.93 1nsn n LYS 115 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1nsn s THR 116 N -0.21 4.33 -0.05 -0.18 -1.32 -1.26 -4.72 115.64 112.23 1nsn s THR 116 Ca -0.06 1.65 -0.02 0.00 -1.21 0.00 0.00 61.69 62.05 1nsn s THR 116 Cb 0.00 -3.98 0.03 0.00 -1.51 0.00 0.00 72.50 67.05 1nsn s THR 116 CO 0.16 0.19 0.08 -0.89 -2.21 0.00 0.00 174.62 171.95 1nsn s THR 117 N -1.55 -0.12 0.39 5.08 2.01 0.14 -4.96 115.64 116.63 1nsn s THR 117 Ca 0.47 0.34 -0.25 0.00 0.31 0.00 0.00 61.69 62.56 1nsn s THR 117 Cb -0.18 -0.17 -0.09 0.00 0.01 0.00 0.00 72.50 72.07 1nsn s THR 117 CO 0.23 0.14 1.07 -2.84 -0.69 0.00 0.00 174.62 172.53 1nsn s PRO 118 N 1.81 4.20 0.55 4.92 0.02 -1.26 -1.75 135.00 143.49 1nsn s PRO 118 Ca -0.00 1.58 -0.18 0.00 0.02 0.00 0.00 61.00 62.42 1nsn s PRO 118 Cb -0.12 -2.63 -0.06 0.00 0.02 0.00 0.00 34.50 31.71 1nsn s PRO 118 CO -0.04 -0.12 1.07 -1.25 -0.33 0.00 0.00 177.00 176.32 1nsn s PRO 119 N -2.35 3.47 -0.32 5.54 0.04 -1.26 -4.52 135.00 135.60 1nsn s PRO 119 Ca 0.56 1.35 -0.16 0.00 0.04 0.00 0.00 61.00 62.79 1nsn s PRO 119 Cb -0.24 -2.05 -0.02 0.00 0.04 0.00 0.00 34.50 32.23 1nsn s PRO 119 CO 0.30 -0.70 0.41 -1.12 0.04 0.00 0.00 177.00 175.93 1nsn s SER 120 N -2.29 6.25 -0.36 6.66 0.01 0.42 -4.91 113.70 119.49 1nsn s SER 120 Ca 0.67 0.02 -0.13 0.00 1.31 0.00 0.00 55.95 57.82 1nsn s SER 120 Cb -0.18 -2.22 -0.01 0.00 0.21 0.00 0.00 66.02 63.82 1nsn s SER 120 CO 0.29 -0.32 0.25 -0.69 0.41 0.00 0.00 173.24 173.18 1nsn s VAL 121 N 2.14 5.22 -0.17 3.43 1.01 -1.26 -0.92 120.40 129.85 1nsn s VAL 121 Ca 0.15 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1nsn s VAL 121 Cb -0.16 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.48 1nsn s VAL 121 CO 0.11 -0.09 -0.16 -0.31 0.00 0.00 0.00 175.10 174.65 1nsn s TYR 122 N 1.70 2.78 0.52 5.22 2.02 -0.65 -4.98 117.35 123.96 1nsn s TYR 122 Ca 0.06 -1.24 -0.21 0.00 -0.37 0.00 0.00 57.07 55.31 1nsn s TYR 122 Cb -0.18 -1.91 -0.06 0.00 -0.40 0.00 0.00 41.96 39.41 1nsn s TYR 122 CO 0.10 -0.59 1.17 -1.25 -1.57 0.00 0.00 175.55 173.41 1nsn s PRO 123 N 1.01 3.44 -0.34 -1.71 0.04 -1.26 -1.17 135.00 135.00 1nsn s PRO 123 Ca -0.02 1.75 -0.01 0.00 0.04 0.00 0.00 61.00 62.76 1nsn s PRO 123 Cb -0.15 -2.16 0.11 0.00 0.04 0.00 0.00 34.50 32.34 1nsn s PRO 123 CO -0.04 -0.81 0.15 -0.51 0.04 0.00 0.00 177.00 175.83 1nsn s LEU 124 N -3.53 1.84 0.02 -3.56 1.43 0.57 -4.87 118.68 110.58 1nsn s LEU 124 Ca 0.70 -1.87 -0.01 0.00 -1.03 0.00 0.00 54.13 51.92 1nsn s LEU 124 Cb -0.28 -0.74 -0.04 0.00 0.03 0.00 0.00 46.19 45.17 1nsn s LEU 124 CO 0.32 -0.37 0.18 0.00 0.23 0.00 0.00 176.35 176.71 1nsn s ALA 125 N 1.36 3.94 -0.42 4.21 0.00 -1.26 -2.00 121.76 127.59 1nsn s ALA 125 Ca 0.13 -0.80 -0.39 0.00 0.00 0.00 0.00 51.96 50.90 1nsn s ALA 125 Cb -0.19 -1.83 -0.16 0.00 0.00 0.00 0.00 23.12 20.93 1nsn s ALA 125 CO -0.18 0.77 1.47 -2.30 0.00 0.00 0.00 175.76 175.53 1nsn n PRO 126 N 0.71 0.00 0.15 0.00 -0.02 -1.26 -4.71 135.00 129.87 1nsn n PRO 126 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 1nsn n PRO 126 Cb 0.52 -1.25 0.02 0.00 -0.02 0.00 0.00 33.50 32.77 1nsn n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nsn n GLY 127 N 4.21 -0.25 3.08 -1.23 0.00 -1.26 -3.57 105.19 106.17 1nsn n GLY 127 Ca 0.32 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1nsn n GLY 127 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nsn s SER 128 N -2.51 -0.96 0.21 1.61 0.01 -1.26 -5.06 113.70 105.74 1nsn s SER 128 Ca -0.00 0.32 0.16 0.00 1.31 0.00 0.00 55.95 57.74 1nsn s SER 128 Cb 0.00 1.80 0.69 0.00 0.21 0.00 0.00 66.02 68.72 1nsn s SER 128 CO 0.01 -0.30 0.69 0.00 0.41 0.00 0.00 173.24 174.05 1nsn n ALA 129 N 5.40 0.66 0.00 1.44 0.00 -1.23 -4.16 120.51 122.63 1nsn n ALA 129 Ca 0.01 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1nsn n ALA 129 Cb 0.52 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.49 1nsn n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nsn n ALA 130 N -2.53 0.00 0.00 0.00 0.00 -1.26 -4.66 120.51 112.06 1nsn n ALA 130 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1nsn n ALA 130 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.19 1nsn n ALA 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nsn n GLN 133 N -1.21 0.00 -1.02 0.00 10.64 -1.26 -4.88 117.38 119.65 1nsn n GLN 133 Ca 0.00 0.00 -0.01 0.00 -1.83 0.00 0.00 57.00 55.16 1nsn n GLN 133 Cb 0.00 0.00 -0.00 0.00 -0.86 0.00 0.00 30.24 29.38 1nsn n GLN 133 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 1nsn n THR 134 N 0.00 0.00 -4.44 -0.39 -1.04 -1.26 -5.02 114.28 102.12 1nsn n THR 134 Ca 0.00 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.68 1nsn n THR 134 Cb 0.00 -0.32 -0.10 0.00 -1.82 0.00 0.00 70.33 68.09 1nsn n THR 134 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1nsn s ASN 135 N -2.16 4.91 0.00 8.00 3.84 -1.26 -4.99 114.94 123.29 1nsn s ASN 135 Ca 0.00 0.00 0.00 0.00 0.21 0.00 0.00 52.86 53.07 1nsn s ASN 135 Cb 0.00 -1.27 0.00 0.00 -0.55 0.00 0.00 41.25 39.43 1nsn s ASN 135 CO 0.00 0.33 0.00 -1.54 -2.79 0.00 0.00 177.10 173.10 1nsn n SER 136 N 1.86 0.00 -3.75 -4.21 3.41 -1.26 -4.41 113.62 105.25 1nsn n SER 136 Ca -0.17 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.34 1nsn n SER 136 Cb 0.53 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.42 1nsn n SER 136 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nsn s MET 137 N -2.65 0.91 0.23 4.33 0.23 -1.26 0.11 119.30 121.20 1nsn s MET 137 Ca 0.00 -0.75 0.08 0.00 -1.03 0.00 0.00 55.69 53.99 1nsn s MET 137 Cb 0.00 0.39 -0.04 0.00 -1.53 0.00 0.00 34.83 33.65 1nsn s MET 137 CO 0.00 -0.31 0.06 0.54 -2.03 0.00 0.00 175.02 173.27 1nsn s VAL 138 N -3.47 3.84 -0.24 5.16 0.11 -0.52 -4.60 120.40 120.68 1nsn s VAL 138 Ca 0.01 -1.60 0.01 0.00 -2.93 0.00 0.00 61.98 57.47 1nsn s VAL 138 Cb 0.02 -3.02 0.06 0.00 -1.53 0.00 0.00 36.38 31.91 1nsn s VAL 138 CO -0.09 -0.28 -0.06 -0.89 -3.33 0.00 0.00 175.10 170.45 1nsn s THR 139 N -2.08 1.60 0.42 5.04 2.01 -1.26 -2.74 115.64 118.64 1nsn s THR 139 Ca 0.31 -1.28 0.08 0.00 0.31 0.00 0.00 61.69 61.10 1nsn s THR 139 Cb -0.08 -1.86 -0.00 0.00 0.01 0.00 0.00 72.50 70.57 1nsn s THR 139 CO 0.21 -0.10 0.48 -0.76 -0.69 0.00 0.00 174.62 173.76 1nsn s LEU 140 N 1.36 3.51 0.07 4.42 1.43 0.64 -4.47 118.68 125.64 1nsn s LEU 140 Ca -0.06 -0.59 -0.27 0.00 -1.03 0.00 0.00 54.13 52.18 1nsn s LEU 140 Cb -0.19 -2.34 0.08 0.00 0.03 0.00 0.00 46.19 43.78 1nsn s LEU 140 CO -0.06 -0.73 0.98 -0.83 0.23 0.00 0.00 176.35 175.94 1nsn s GLY 141 N -4.26 -0.33 -0.15 -3.19 0.00 -0.85 -1.17 107.32 97.38 1nsn s GLY 141 Ca 0.52 0.51 -0.10 0.00 0.00 0.00 0.00 44.72 45.65 1nsn s GLY 141 CO 0.31 0.14 0.37 0.00 0.00 0.00 0.00 173.10 173.91 1nsn s LEU 143 N 1.01 4.15 -0.91 0.00 2.96 -0.32 -2.52 118.68 123.04 1nsn s LEU 143 Ca -0.07 0.25 -0.06 0.00 -0.22 0.00 0.00 54.13 54.03 1nsn s LEU 143 Cb -0.07 -2.05 0.23 0.00 0.50 0.00 0.00 46.19 44.80 1nsn s LEU 143 CO -0.08 0.23 0.83 -0.69 -1.32 0.00 0.00 176.35 175.32 1nsn s VAL 144 N 0.05 5.00 0.24 1.68 1.01 0.10 -1.64 120.40 126.83 1nsn s VAL 144 Ca 0.09 -3.35 -0.19 0.00 0.00 0.00 0.00 61.98 58.53 1nsn s VAL 144 Cb -0.11 -4.08 -0.08 0.00 0.00 0.00 0.00 36.38 32.10 1nsn s VAL 144 CO -0.00 -1.08 0.73 -0.75 0.00 0.00 0.00 175.10 174.00 1nsn s LYS 145 N -0.86 4.23 -0.65 2.72 2.20 -0.10 -0.27 119.74 127.00 1nsn s LYS 145 Ca 0.25 0.85 -0.17 0.00 -0.36 0.00 0.00 55.97 56.55 1nsn s LYS 145 Cb -0.11 -2.82 0.03 0.00 -1.51 0.00 0.00 37.83 33.42 1nsn s LYS 145 CO -0.09 0.36 0.61 0.41 -0.36 0.00 0.00 175.35 176.28 1nsn n GLY 146 N 0.59 -0.64 3.18 5.54 0.00 0.12 -0.43 105.19 113.54 1nsn n GLY 146 Ca -0.02 0.83 -0.27 0.00 0.00 0.00 0.00 46.02 46.56 1nsn n GLY 146 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1nsn n TYR 147 N -1.54 0.68 0.00 1.61 0.18 -0.74 -4.52 117.16 112.83 1nsn n TYR 147 Ca -0.22 -2.30 0.00 0.00 1.88 0.00 0.00 57.90 57.26 1nsn n TYR 147 Cb 0.67 -0.18 0.00 0.00 -0.38 0.00 0.00 39.34 39.45 1nsn n TYR 147 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 1nsn n PHE 148 N -1.01 0.00 -0.47 -3.48 7.35 -0.72 -0.35 117.46 118.78 1nsn n PHE 148 Ca -0.13 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.56 1nsn n PHE 148 Cb 0.57 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.40 1nsn n PHE 148 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1nsn n PRO 149 N -0.01 3.57 -3.92 -7.13 -0.04 -1.26 0.25 135.00 126.46 1nsn n PRO 149 Ca 0.00 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.24 1nsn n PRO 149 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 1nsn n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1nsn s GLU 150 N 2.92 2.67 0.00 0.54 2.02 -1.26 -4.83 118.70 120.76 1nsn s GLU 150 Ca 0.00 -1.32 0.00 0.00 0.02 0.00 0.00 54.97 53.67 1nsn s GLU 150 Cb 0.00 -2.42 0.00 0.00 0.10 0.00 0.00 34.13 31.81 1nsn s GLU 150 CO 0.00 0.14 0.00 -0.35 0.02 0.00 0.00 175.26 175.07 1nsn n PRO 151 N -1.30 1.38 -4.20 0.39 -0.04 -1.26 -4.83 135.00 125.15 1nsn n PRO 151 Ca -0.03 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.19 1nsn n PRO 151 Cb 0.60 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.98 1nsn n PRO 151 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1nsn s VAL 152 N 0.24 2.75 -0.34 0.52 1.01 -1.26 -4.26 120.40 119.06 1nsn s VAL 152 Ca 0.00 -1.80 0.01 0.00 0.00 0.00 0.00 61.98 60.18 1nsn s VAL 152 Cb 0.00 -2.91 0.14 0.00 0.00 0.00 0.00 36.38 33.61 1nsn s VAL 152 CO 0.00 -0.16 0.27 -0.89 0.00 0.00 0.00 175.10 174.32 1nsn s THR 153 N -2.49 -0.12 -0.27 3.92 2.01 -0.20 -4.99 115.64 113.51 1nsn s THR 153 Ca 0.37 -1.20 -0.11 0.00 0.31 0.00 0.00 61.69 61.06 1nsn s THR 153 Cb -0.00 -0.92 -0.05 0.00 0.01 0.00 0.00 72.50 71.53 1nsn s THR 153 CO 0.21 -0.75 0.20 0.68 -0.69 0.00 0.00 174.62 174.27 1nsn s VAL 154 N 1.46 5.31 0.36 3.82 -7.23 -1.26 -2.06 120.40 120.80 1nsn s VAL 154 Ca 0.16 0.21 0.08 0.00 -1.81 0.00 0.00 61.98 60.62 1nsn s VAL 154 Cb -0.18 -3.54 -0.07 0.00 0.56 0.00 0.00 36.38 33.15 1nsn s VAL 154 CO -0.09 0.27 -0.06 0.42 -0.31 0.00 0.00 175.10 175.34 1nsn s THR 155 N 1.59 2.07 -0.15 5.32 -4.23 -0.09 -4.98 115.64 115.16 1nsn s THR 155 Ca 0.08 -2.13 -0.00 0.00 -1.18 0.00 0.00 61.69 58.46 1nsn s THR 155 Cb -0.15 -2.73 -0.00 0.00 1.34 0.00 0.00 72.50 70.95 1nsn s THR 155 CO 0.09 -0.15 -0.14 0.26 -0.54 0.00 0.00 174.62 174.14 1nsn s TRP 156 N -2.71 2.80 -1.26 3.99 0.52 -1.26 -0.78 118.94 120.24 1nsn s TRP 156 Ca 0.33 -0.95 -0.10 0.00 0.02 0.00 0.00 56.10 55.40 1nsn s TRP 156 Cb 0.05 -1.89 -0.00 0.00 -1.15 0.00 0.00 33.47 30.47 1nsn s TRP 156 CO 0.16 -0.42 0.64 0.09 0.02 0.00 0.00 176.95 177.44 1nsn n ASN 161 N 3.99 -2.84 0.00 2.95 4.13 -0.47 -0.07 115.26 122.95 1nsn n ASN 161 Ca -0.19 -0.99 0.00 0.00 1.68 0.00 0.00 54.58 55.08 1nsn n ASN 161 Cb 0.52 -3.34 0.00 0.00 -1.54 0.00 0.00 39.78 35.42 1nsn n ASN 161 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1nsn n SER 162 N -2.84 -2.49 0.00 6.41 7.64 -1.26 -0.90 113.62 120.17 1nsn n SER 162 Ca -0.20 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.68 1nsn n SER 162 Cb 0.64 -2.67 0.00 0.00 -1.01 0.00 0.00 64.21 61.17 1nsn n SER 162 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nsn n GLY 163 N -0.48 2.01 0.38 0.23 0.00 0.90 -4.97 105.19 103.27 1nsn n GLY 163 Ca 0.00 0.00 0.27 0.00 0.00 0.00 0.00 46.02 46.29 1nsn n GLY 163 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1nsn h SER 164 N 0.00 0.44 -3.12 1.61 0.02 -0.88 -3.31 113.55 108.31 1nsn h SER 164 Ca 0.00 0.16 -0.73 0.00 -0.84 0.00 0.00 61.79 60.37 1nsn h SER 164 Cb 0.00 0.11 -0.22 0.00 0.14 0.00 0.00 62.40 62.43 1nsn h SER 164 CO 0.00 -0.11 0.23 -0.76 -1.14 0.00 0.00 176.83 175.06 1nsn s LEU 165 N -10.05 5.85 -0.60 5.07 1.43 -1.15 -4.94 118.68 114.29 1nsn s LEU 165 Ca -0.09 -2.02 0.05 0.00 -1.03 0.00 0.00 54.13 51.04 1nsn s LEU 165 Cb 0.29 -2.28 0.34 0.00 0.03 0.00 0.00 46.19 44.57 1nsn s LEU 165 CO 0.80 -0.90 1.01 -1.54 0.23 0.00 0.00 176.35 175.95 1nsn n SER 166 N 5.50 4.67 -3.67 2.29 3.41 -1.25 -4.57 113.62 120.01 1nsn n SER 166 Ca 0.05 -3.69 -0.09 0.00 -0.26 0.00 0.00 58.87 54.88 1nsn n SER 166 Cb 0.45 -0.59 -0.09 0.00 -0.26 0.00 0.00 64.21 63.72 1nsn n SER 166 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1nsn s SER 167 N -3.36 -0.73 0.00 4.04 0.01 -1.26 -4.81 113.70 107.58 1nsn s SER 167 Ca 0.48 1.21 0.00 0.00 1.31 0.00 0.00 55.95 58.95 1nsn s SER 167 Cb 0.28 1.09 0.00 0.00 0.21 0.00 0.00 66.02 67.60 1nsn s SER 167 CO -0.14 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 173.90 1nsn n GLY 168 N 4.21 0.76 3.55 3.44 0.00 -1.26 -4.13 105.19 111.75 1nsn n GLY 168 Ca -0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 1nsn n GLY 168 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nsn s VAL 171 N -3.20 3.87 -0.31 1.61 1.01 -1.24 -3.74 120.40 118.40 1nsn s VAL 171 Ca 0.00 0.51 -0.06 0.00 0.00 0.00 0.00 61.98 62.43 1nsn s VAL 171 Cb 0.00 -4.84 0.03 0.00 0.00 0.00 0.00 36.38 31.57 1nsn s VAL 171 CO 0.00 -1.66 0.07 -1.00 0.00 0.00 0.00 175.10 172.52 1nsn s HIS 172 N 5.34 3.19 -0.29 5.22 3.76 -0.47 -4.95 115.29 127.09 1nsn s HIS 172 Ca 0.36 -1.27 -0.08 0.00 -0.15 0.00 0.00 55.06 53.92 1nsn s HIS 172 Cb -0.09 -2.24 -0.01 0.00 1.11 0.00 0.00 32.58 31.36 1nsn s HIS 172 CO 0.18 -0.67 0.11 0.99 -0.85 0.00 0.00 174.74 174.50 1nsn s THR 173 N 1.43 4.32 0.24 1.30 2.01 -1.26 -0.50 115.64 123.18 1nsn s THR 173 Ca 0.00 -0.44 -0.25 0.00 0.31 0.00 0.00 61.69 61.32 1nsn s THR 173 Cb -0.18 -3.16 -0.09 0.00 0.01 0.00 0.00 72.50 69.08 1nsn s THR 173 CO 0.02 0.14 0.84 -0.36 -0.69 0.00 0.00 174.62 174.57 1nsn s PHE 174 N 1.58 3.78 0.70 4.92 0.40 0.17 -4.97 117.98 124.56 1nsn s PHE 174 Ca 0.04 1.65 -0.16 0.00 -0.60 0.00 0.00 56.93 57.87 1nsn s PHE 174 Cb -0.17 -2.81 -0.01 0.00 0.51 0.00 0.00 43.02 40.55 1nsn s PHE 174 CO 0.04 0.37 0.90 -2.30 0.70 0.00 0.00 175.22 174.93 1nsn n PRO 175 N 1.02 0.54 -2.88 0.24 -0.02 -1.26 -3.78 135.00 128.85 1nsn n PRO 175 Ca -0.02 0.24 -0.37 0.00 -2.02 0.00 0.00 63.50 61.33 1nsn n PRO 175 Cb 0.49 -2.15 -0.06 0.00 -0.02 0.00 0.00 33.50 31.76 1nsn n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nsn s ALA 176 N -1.78 3.28 -0.13 3.55 0.00 -1.26 -4.66 121.76 120.75 1nsn s ALA 176 Ca 0.73 0.41 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1nsn s ALA 176 Cb -0.36 -3.07 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 1nsn s ALA 176 CO 0.51 0.22 -0.14 0.08 0.00 0.00 0.00 175.76 176.44 1nsn s VAL 177 N -1.59 2.97 -1.04 0.00 1.01 -0.90 -4.91 120.40 115.94 1nsn s VAL 177 Ca 0.48 -0.69 -0.24 0.00 0.00 0.00 0.00 61.98 61.53 1nsn s VAL 177 Cb -0.18 -2.24 -0.16 0.00 0.00 0.00 0.00 36.38 33.80 1nsn s VAL 177 CO 0.23 0.52 1.96 -0.11 0.00 0.00 0.00 175.10 177.70 1nsn n LEU 178 N 3.61 2.58 -4.50 3.92 7.94 -1.26 -2.66 117.00 126.63 1nsn n LEU 178 Ca -0.18 -2.86 -0.42 0.00 -1.11 0.00 0.00 56.01 51.44 1nsn n LEU 178 Cb 0.53 -1.59 -0.03 0.00 0.53 0.00 0.00 43.42 42.85 1nsn n LEU 178 CO 0.30 -2.18 0.97 -1.58 -1.11 0.00 0.00 177.39 173.79 1nsn s GLN 179 N 6.90 3.18 -1.00 1.96 -0.44 0.17 -4.43 119.66 126.01 1nsn s GLN 179 Ca 0.71 -0.62 -0.07 0.00 -2.50 0.00 0.00 55.36 52.87 1nsn s GLN 179 Cb 0.01 -4.28 -0.04 0.00 -1.64 0.00 0.00 33.01 27.06 1nsn s GLN 179 CO 0.16 -1.98 0.85 -1.13 0.50 0.00 0.00 175.29 173.69 1nsn n SER 180 N 8.44 -6.62 0.00 6.67 3.41 -1.26 -2.20 113.62 122.06 1nsn n SER 180 Ca 0.02 -0.64 0.00 0.00 -0.26 0.00 0.00 58.87 57.99 1nsn n SER 180 Cb 0.47 -4.82 0.00 0.00 -0.26 0.00 0.00 64.21 59.60 1nsn n SER 180 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1nsn n ASP 183 N -2.82 -1.50 -3.95 4.04 2.03 -1.26 -4.92 116.55 108.17 1nsn n ASP 183 Ca -0.07 0.00 -0.15 0.00 0.52 0.00 0.00 54.79 55.09 1nsn n ASP 183 Cb 0.59 -2.23 -0.14 0.00 -0.72 0.00 0.00 41.12 38.62 1nsn n ASP 183 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1nsn s LEU 184 N 0.00 2.01 0.54 -2.67 1.43 -0.93 -4.91 118.68 114.15 1nsn s LEU 184 Ca 0.00 -0.08 -0.08 0.00 -1.03 0.00 0.00 54.13 52.94 1nsn s LEU 184 Cb 0.00 -0.23 -0.04 0.00 0.03 0.00 0.00 46.19 45.95 1nsn s LEU 184 CO 0.00 0.05 0.89 -0.31 0.23 0.00 0.00 176.35 177.21 1nsn s TYR 185 N -0.11 3.59 -0.18 0.29 2.02 0.53 0.43 117.35 123.91 1nsn s TYR 185 Ca 0.02 1.01 -0.15 0.00 -0.37 0.00 0.00 57.07 57.58 1nsn s TYR 185 Cb -0.02 -2.48 0.05 0.00 -0.40 0.00 0.00 41.96 39.12 1nsn s TYR 185 CO -0.00 -0.45 0.47 0.99 -1.57 0.00 0.00 175.55 174.98 1nsn s THR 186 N -2.92 -0.01 0.28 -0.71 2.01 -1.09 -0.71 115.64 112.50 1nsn s THR 186 Ca 0.51 0.02 0.02 0.00 0.31 0.00 0.00 61.69 62.55 1nsn s THR 186 Cb -0.11 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.70 1nsn s THR 186 CO 0.49 0.01 0.13 -0.22 -0.69 0.00 0.00 174.62 174.34 1nsn s LEU 187 N 0.54 1.61 0.01 4.42 0.20 0.62 -2.11 118.68 123.98 1nsn s LEU 187 Ca -0.02 -1.48 -0.10 0.00 0.69 0.00 0.00 54.13 53.22 1nsn s LEU 187 Cb -0.04 0.15 0.01 0.00 -0.43 0.00 0.00 46.19 45.87 1nsn s LEU 187 CO -0.03 -0.83 0.19 -0.44 -0.29 0.00 0.00 176.35 174.96 1nsn s SER 188 N -3.33 -0.01 -0.09 3.68 0.01 -1.25 -0.72 113.70 111.98 1nsn s SER 188 Ca 0.37 -0.21 -0.04 0.00 1.31 0.00 0.00 55.95 57.38 1nsn s SER 188 Cb 0.06 0.26 0.04 0.00 0.21 0.00 0.00 66.02 66.59 1nsn s SER 188 CO 0.16 -0.46 0.20 -0.55 0.41 0.00 0.00 173.24 173.00 1nsn s SER 189 N -1.64 -0.17 -0.01 2.44 0.15 -1.05 0.45 113.70 113.87 1nsn s SER 189 Ca -0.11 0.42 0.06 0.00 0.70 0.00 0.00 55.95 57.02 1nsn s SER 189 Cb -0.05 0.31 -0.02 0.00 -1.71 0.00 0.00 66.02 64.55 1nsn s SER 189 CO 0.00 -0.16 -0.21 -0.94 1.20 0.00 0.00 173.24 173.13 1nsn s SER 190 N 1.25 3.52 -0.13 5.45 1.04 0.34 -2.48 113.70 122.70 1nsn s SER 190 Ca -0.09 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1nsn s SER 190 Cb -0.11 -0.55 0.02 0.00 0.10 0.00 0.00 66.02 65.48 1nsn s SER 190 CO -0.07 0.31 -0.12 0.54 0.98 0.00 0.00 173.24 174.88 1nsn s VAL 191 N -0.72 1.37 -0.98 5.02 0.11 -0.32 -1.37 120.40 123.50 1nsn s VAL 191 Ca 0.11 -0.52 -0.06 0.00 -2.93 0.00 0.00 61.98 58.59 1nsn s VAL 191 Cb -0.10 -1.30 0.24 0.00 -1.53 0.00 0.00 36.38 33.69 1nsn s VAL 191 CO 0.01 0.42 0.92 0.42 -3.33 0.00 0.00 175.10 173.54 1nsn s THR 192 N 1.43 5.15 0.30 5.04 -4.23 -1.25 -0.26 115.64 121.82 1nsn s THR 192 Ca 0.02 -3.56 -0.11 0.00 -1.18 0.00 0.00 61.69 56.86 1nsn s THR 192 Cb -0.13 -4.14 -0.07 0.00 1.34 0.00 0.00 72.50 69.49 1nsn s THR 192 CO -0.08 -1.12 0.65 0.54 -0.54 0.00 0.00 174.62 174.07 1nsn s VAL 193 N -1.18 4.83 0.28 2.29 0.11 -1.11 -4.73 120.40 120.89 1nsn s VAL 193 Ca 0.28 0.61 -0.28 0.00 -2.93 0.00 0.00 61.98 59.66 1nsn s VAL 193 Cb -0.09 -3.65 -0.14 0.00 -1.53 0.00 0.00 36.38 30.97 1nsn s VAL 193 CO -0.10 -0.22 0.95 -2.65 -3.33 0.00 0.00 175.10 169.75 1nsn n PRO 194 N -0.51 1.18 0.33 1.54 -0.02 -1.26 -1.44 135.00 134.82 1nsn n PRO 194 Ca 0.02 0.41 0.20 0.00 -2.02 0.00 0.00 63.50 62.11 1nsn n PRO 194 Cb 0.53 -1.74 1.09 0.00 -0.02 0.00 0.00 33.50 33.36 1nsn n PRO 194 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1nsn h SER 195 N 1.86 0.00 0.40 2.55 0.87 0.55 -2.95 113.55 116.82 1nsn h SER 195 Ca -0.38 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.16 1nsn h SER 195 Cb 1.35 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.32 1nsn h SER 195 CO 0.60 0.00 -0.19 0.28 -0.53 0.00 0.00 176.83 176.99 1nsn h SER 196 N 0.00 -0.45 0.00 6.23 0.02 -1.88 -3.39 113.55 114.08 1nsn h SER 196 Ca 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1nsn h SER 196 Cb 0.21 0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1nsn h SER 196 CO -0.00 -0.17 0.00 -0.81 -1.14 0.00 0.00 176.83 174.71 1nsn n PRO 199 N -5.24 0.00 -1.67 3.45 -0.04 -1.11 -4.70 135.00 125.69 1nsn n PRO 199 Ca -0.11 0.53 -0.43 0.00 -0.04 0.00 0.00 63.50 63.45 1nsn n PRO 199 Cb 0.27 -1.47 -0.01 0.00 -0.04 0.00 0.00 33.50 32.25 1nsn n PRO 199 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1nsn n ARG 200 N -2.02 1.92 0.08 0.54 5.12 -1.26 -1.08 116.66 119.96 1nsn n ARG 200 Ca 0.00 0.67 0.10 0.00 -1.93 0.00 0.00 57.85 56.70 1nsn n ARG 200 Cb 0.00 -2.22 -0.04 0.00 -1.16 0.00 0.00 32.46 29.04 1nsn n ARG 200 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1nsn n PRO 202 N 0.53 0.62 -0.28 5.56 -0.02 -1.26 -4.81 135.00 135.34 1nsn n PRO 202 Ca 0.06 0.06 -0.06 0.00 -2.02 0.00 0.00 63.50 61.54 1nsn n PRO 202 Cb 0.36 -1.76 -0.02 0.00 -0.02 0.00 0.00 33.50 32.06 1nsn n PRO 202 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1nsn h SER 203 N 0.00 -1.50 -3.39 2.55 0.02 -1.77 -3.37 113.55 106.09 1nsn h SER 203 Ca -0.02 0.27 -0.53 0.00 -0.84 0.00 0.00 61.79 60.67 1nsn h SER 203 Cb 1.05 0.72 -0.01 0.00 0.14 0.00 0.00 62.40 64.30 1nsn h SER 203 CO 0.00 -0.31 0.45 -1.61 -1.14 0.00 0.00 176.83 174.23 1nsn s GLU 204 N -5.85 4.54 0.39 3.45 0.41 -0.24 -5.03 118.70 116.37 1nsn s GLU 204 Ca -0.14 1.60 -0.25 0.00 -0.41 0.00 0.00 54.97 55.78 1nsn s GLU 204 Cb 0.15 -3.37 -0.09 0.00 -1.78 0.00 0.00 34.13 29.04 1nsn s GLU 204 CO 0.68 -0.06 1.09 0.99 -0.49 0.00 0.00 175.26 177.46 1nsn s THR 205 N 0.64 3.54 -0.03 3.63 2.01 -1.26 -4.22 115.64 119.95 1nsn s THR 205 Ca 0.53 1.23 0.00 0.00 0.31 0.00 0.00 61.69 63.76 1nsn s THR 205 Cb -0.26 -3.66 0.03 0.00 0.01 0.00 0.00 72.50 68.61 1nsn s THR 205 CO 0.30 0.06 0.00 -0.69 -0.69 0.00 0.00 174.62 173.61 1nsn s VAL 206 N -1.55 0.18 -0.20 3.82 1.01 -1.26 -5.02 120.40 117.37 1nsn s VAL 206 Ca 0.57 0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.64 1nsn s VAL 206 Cb -0.25 -0.29 0.06 0.00 0.00 0.00 0.00 36.38 35.90 1nsn s VAL 206 CO 0.32 0.16 0.01 -0.89 0.00 0.00 0.00 175.10 174.69 1nsn s THR 207 N 1.20 0.82 -0.28 3.92 2.01 -1.26 -2.41 115.64 119.64 1nsn s THR 207 Ca -0.07 -0.74 -0.29 0.00 0.31 0.00 0.00 61.69 60.89 1nsn s THR 207 Cb -0.13 -1.25 0.00 0.00 0.01 0.00 0.00 72.50 71.13 1nsn s THR 207 CO -0.02 -0.16 1.20 0.00 -0.69 0.00 0.00 174.62 174.94 1nsn s ASN 209 N 2.14 6.14 -0.15 0.00 0.01 0.04 -2.24 114.94 120.88 1nsn s ASN 209 Ca 0.51 0.14 0.01 0.00 -0.71 0.00 0.00 52.86 52.81 1nsn s ASN 209 Cb -0.16 -2.16 0.00 0.00 0.41 0.00 0.00 41.25 39.34 1nsn s ASN 209 CO 0.18 -0.11 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.80 1nsn s VAL 210 N 1.89 2.49 -0.05 1.60 1.01 -0.34 -0.92 120.40 126.08 1nsn s VAL 210 Ca 0.11 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.30 1nsn s VAL 210 Cb -0.16 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 1nsn s VAL 210 CO 0.10 0.52 -0.18 0.00 0.00 0.00 0.00 175.10 175.55 1nsn s ALA 211 N 0.84 2.50 -0.52 5.51 0.00 -0.88 -0.86 121.76 128.35 1nsn s ALA 211 Ca -0.05 -1.01 0.04 0.00 0.00 0.00 0.00 51.96 50.93 1nsn s ALA 211 Cb -0.15 -0.86 0.16 0.00 0.00 0.00 0.00 23.12 22.27 1nsn s ALA 211 CO -0.01 0.52 0.37 -1.58 0.00 0.00 0.00 175.76 175.06 1nsn s HIS 212 N -0.58 2.17 0.01 0.00 2.46 0.35 -1.03 115.29 118.68 1nsn s HIS 212 Ca 0.08 -2.70 -0.02 0.00 0.47 0.00 0.00 55.06 52.89 1nsn s HIS 212 Cb -0.11 -1.78 -0.00 0.00 -0.13 0.00 0.00 32.58 30.56 1nsn s HIS 212 CO 0.01 -0.72 0.59 -0.35 -2.47 0.00 0.00 174.74 171.81 1nsn n PRO 213 N 2.71 -0.03 0.20 2.88 -0.04 -1.26 -1.68 135.00 137.79 1nsn n PRO 213 Ca 0.21 0.59 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 1nsn n PRO 213 Cb 0.40 -0.89 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 1nsn n PRO 213 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nsn n ALA 214 N -2.67 0.00 -1.50 0.55 0.00 -1.26 -0.50 120.51 115.13 1nsn n ALA 214 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1nsn n ALA 214 Cb 0.02 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.50 1nsn n ALA 214 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1nsn n SER 215 N -1.83 0.68 0.00 0.00 3.41 -0.68 -4.90 113.62 110.31 1nsn n SER 215 Ca 0.00 -2.11 0.00 0.00 -0.26 0.00 0.00 58.87 56.50 1nsn n SER 215 Cb 0.74 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1nsn n SER 215 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1nsn n SER 216 N -0.37 -1.14 -4.72 4.04 2.88 0.35 -4.93 113.62 109.74 1nsn n SER 216 Ca 0.04 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.16 1nsn n SER 216 Cb 0.63 -2.38 -0.03 0.00 -0.75 0.00 0.00 64.21 61.67 1nsn n SER 216 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1nsn s THR 217 N -1.32 4.21 -0.05 2.46 2.01 -1.24 -4.96 115.64 116.74 1nsn s THR 217 Ca 0.00 1.66 -0.02 0.00 0.31 0.00 0.00 61.69 63.64 1nsn s THR 217 Cb 0.00 -4.06 0.04 0.00 0.01 0.00 0.00 72.50 68.48 1nsn s THR 217 CO 0.00 0.17 0.10 -0.75 -0.69 0.00 0.00 174.62 173.45 1nsn s LYS 218 N 0.65 0.02 -0.00 4.92 2.36 -1.26 -0.49 119.74 125.94 1nsn s LYS 218 Ca 0.54 0.33 -0.01 0.00 -2.55 0.00 0.00 55.97 54.28 1nsn s LYS 218 Cb -0.27 -0.25 -0.00 0.00 -1.05 0.00 0.00 37.83 36.26 1nsn s LYS 218 CO 0.30 -0.20 0.02 0.08 1.55 0.00 0.00 175.35 177.11 1nsn s VAL 219 N 1.35 0.04 -0.07 4.02 1.01 -0.04 -5.02 120.40 121.70 1nsn s VAL 219 Ca -0.06 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.62 1nsn s VAL 219 Cb -0.12 -0.14 0.02 0.00 0.00 0.00 0.00 36.38 36.14 1nsn s VAL 219 CO -0.05 -0.17 -0.08 -1.81 0.00 0.00 0.00 175.10 172.99 1nsn s ASP 220 N -0.50 1.59 -0.05 3.32 1.01 -1.26 -1.20 116.67 119.57 1nsn s ASP 220 Ca -0.06 -0.23 0.04 0.00 0.71 0.00 0.00 52.55 53.01 1nsn s ASP 220 Cb -0.04 -0.69 -0.00 0.00 1.01 0.00 0.00 42.92 43.21 1nsn s ASP 220 CO -0.00 -0.04 -0.18 -0.54 0.21 0.00 0.00 175.17 174.62 1nsn s LYS 221 N 1.04 1.96 -0.12 8.23 3.01 -0.95 -4.99 119.74 127.92 1nsn s LYS 221 Ca -0.08 -0.62 -0.04 0.00 -1.01 0.00 0.00 55.97 54.21 1nsn s LYS 221 Cb -0.14 -1.65 -0.04 0.00 -1.01 0.00 0.00 37.83 34.99 1nsn s LYS 221 CO -0.00 0.21 0.05 -1.59 0.51 0.00 0.00 175.35 174.52 1nsn s LYS 222 N 0.17 3.33 0.00 1.68 -2.85 -1.26 -0.74 119.74 120.06 1nsn s LYS 222 Ca -0.07 -0.32 0.29 0.00 -1.00 0.00 0.00 55.97 54.87 1nsn s LYS 222 Cb -0.13 -2.99 1.37 0.00 -2.06 0.00 0.00 37.83 34.02 1nsn s LYS 222 CO 0.03 0.63 1.92 -0.89 0.10 0.00 0.00 175.35 177.14