#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r2k s VAL 3 N 0.00 1.95 0.63 1.69 1.01 -1.26 -4.66 120.40 119.76 1r2k s VAL 3 Ca 0.00 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 60.96 1r2k s VAL 3 Cb 0.00 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1r2k s VAL 3 CO 0.00 0.53 1.03 -0.55 0.00 0.00 0.00 175.10 176.10 1r2k s SER 4 N 0.82 6.07 0.10 3.32 0.15 -0.92 -4.97 113.70 118.27 1r2k s SER 4 Ca -0.08 1.32 0.23 0.00 0.70 0.00 0.00 55.95 58.12 1r2k s SER 4 Cb -0.16 -2.34 0.03 0.00 -1.71 0.00 0.00 66.02 61.85 1r2k s SER 4 CO -0.01 -0.95 1.01 0.35 1.20 0.00 0.00 173.24 174.84 1r2k n THR 5 N -2.77 0.32 -4.40 6.45 -2.24 -1.26 -4.19 114.28 106.19 1r2k n THR 5 Ca 0.06 -0.37 -0.27 0.00 -2.27 0.00 0.00 64.05 61.20 1r2k n THR 5 Cb 0.55 -0.03 -0.09 0.00 -2.10 0.00 0.00 70.33 68.65 1r2k n THR 5 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1r2k s GLU 6 N -3.28 2.09 0.13 -0.78 0.41 -1.26 -5.00 118.70 111.01 1r2k s GLU 6 Ca 0.01 -2.00 -0.26 0.00 -0.41 0.00 0.00 54.97 52.32 1r2k s GLU 6 Cb 0.13 -1.79 -0.07 0.00 -1.78 0.00 0.00 34.13 30.61 1r2k s GLU 6 CO 0.80 -0.09 0.79 0.12 -0.49 0.00 0.00 175.26 176.39 1r2k s PHE 7 N -2.67 3.86 -0.11 1.61 5.36 -1.26 -4.39 117.98 120.38 1r2k s PHE 7 Ca 0.37 1.62 0.02 0.00 -0.96 0.00 0.00 56.93 57.97 1r2k s PHE 7 Cb 0.07 -2.81 0.01 0.00 -0.34 0.00 0.00 43.02 39.95 1r2k s PHE 7 CO 0.20 0.43 -0.15 0.42 -1.46 0.00 0.00 175.22 174.65 1r2k s ILE 8 N -0.77 1.52 0.47 3.12 1.01 -1.26 -5.05 121.20 120.24 1r2k s ILE 8 Ca 0.38 -0.65 -0.21 0.00 0.00 0.00 0.00 60.65 60.16 1r2k s ILE 8 Cb -0.23 -1.39 -0.08 0.00 0.01 0.00 0.00 42.46 40.77 1r2k s ILE 8 CO 0.26 0.45 1.07 -2.84 0.00 0.00 0.00 174.94 173.88 1r2k s PRO 9 N 1.01 3.82 0.14 2.79 0.02 -1.26 -4.66 135.00 136.85 1r2k s PRO 9 Ca -0.06 1.49 0.10 0.00 0.02 0.00 0.00 61.00 62.55 1r2k s PRO 9 Cb -0.15 -2.23 -0.04 0.00 0.02 0.00 0.00 34.50 32.10 1r2k s PRO 9 CO -0.02 -0.44 -0.19 0.95 -0.33 0.00 0.00 177.00 176.97 1r2k s THR 10 N -1.81 2.74 -0.45 0.99 -4.23 -1.26 -4.91 115.64 106.71 1r2k s THR 10 Ca 0.65 -1.63 -0.21 0.00 -1.18 0.00 0.00 61.69 59.32 1r2k s THR 10 Cb -0.20 -2.27 0.03 0.00 1.34 0.00 0.00 72.50 71.39 1r2k s THR 10 CO 0.25 0.04 0.70 -0.13 -0.54 0.00 0.00 174.62 174.94 1r2k s ARG 11 N -2.29 3.31 -0.02 3.99 3.00 -1.26 -1.54 118.95 124.13 1r2k s ARG 11 Ca 0.19 -0.32 0.02 0.00 0.00 0.00 0.00 55.73 55.62 1r2k s ARG 11 Cb -0.10 -3.96 -0.03 0.00 0.00 0.00 0.00 34.95 30.86 1r2k s ARG 11 CO 0.10 -1.08 -0.07 0.42 0.00 0.00 0.00 175.30 174.68 1r2k s ILE 12 N 3.00 3.68 -0.07 1.52 1.01 0.68 -1.22 121.20 129.80 1r2k s ILE 12 Ca 0.25 -0.66 0.05 0.00 0.00 0.00 0.00 60.65 60.29 1r2k s ILE 12 Cb -0.14 -2.56 -0.01 0.00 0.01 0.00 0.00 42.46 39.76 1r2k s ILE 12 CO 0.20 0.47 -0.24 0.00 0.00 0.00 0.00 174.94 175.37 1r2k s ALA 13 N -0.92 2.21 0.04 9.38 0.00 0.32 -0.48 121.76 132.30 1r2k s ALA 13 Ca 0.15 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 51.13 1r2k s ALA 13 Cb -0.11 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 1r2k s ALA 13 CO 0.05 0.39 -0.06 0.42 0.00 0.00 0.00 175.76 176.56 1r2k s ILE 14 N -0.06 3.70 -0.02 0.00 1.01 -0.04 -0.79 121.20 125.00 1r2k s ILE 14 Ca -0.06 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 59.70 1r2k s ILE 14 Cb -0.15 -2.66 0.03 0.00 0.01 0.00 0.00 42.46 39.69 1r2k s ILE 14 CO 0.05 0.29 0.02 -0.22 0.00 0.00 0.00 174.94 175.08 1r2k s LEU 15 N -1.73 1.15 -0.13 2.97 2.96 0.14 -1.92 118.68 122.13 1r2k s LEU 15 Ca 0.20 0.02 -0.02 0.00 -0.22 0.00 0.00 54.13 54.11 1r2k s LEU 15 Cb -0.11 -0.10 -0.02 0.00 0.50 0.00 0.00 46.19 46.45 1r2k s LEU 15 CO 0.11 -0.11 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.07 1r2k s THR 16 N 0.99 3.63 -0.32 3.68 2.01 -0.18 -1.34 115.64 124.12 1r2k s THR 16 Ca -0.09 -0.46 -0.09 0.00 0.31 0.00 0.00 61.69 61.36 1r2k s THR 16 Cb -0.12 -2.55 0.01 0.00 0.01 0.00 0.00 72.50 69.84 1r2k s THR 16 CO -0.02 0.52 0.14 -0.69 -0.69 0.00 0.00 174.62 173.88 1r2k s VAL 17 N 0.12 4.37 -0.28 3.82 1.01 -0.65 -0.70 120.40 128.08 1r2k s VAL 17 Ca -0.03 -0.63 -0.25 0.00 0.00 0.00 0.00 61.98 61.07 1r2k s VAL 17 Cb -0.14 -3.29 0.13 0.00 0.00 0.00 0.00 36.38 33.08 1r2k s VAL 17 CO 0.03 -0.01 1.06 -0.55 0.00 0.00 0.00 175.10 175.64 1r2k s SER 18 N 1.56 -0.41 0.02 3.32 0.15 0.53 -4.36 113.70 114.50 1r2k s SER 18 Ca 0.03 0.79 -0.01 0.00 0.70 0.00 0.00 55.95 57.46 1r2k s SER 18 Cb -0.18 0.79 -0.27 0.00 -1.71 0.00 0.00 66.02 64.66 1r2k s SER 18 CO 0.05 -0.15 0.92 0.78 1.20 0.00 0.00 173.24 176.04 1r2k h ASN 19 N 4.03 0.31 0.00 5.45 -0.26 -1.90 -3.31 115.58 119.90 1r2k h ASN 19 Ca -0.28 -0.42 -0.26 0.00 -0.56 0.00 0.00 56.30 54.78 1r2k h ASN 19 Cb 1.18 -0.10 -0.04 0.00 -1.06 0.00 0.00 38.32 38.30 1r2k h ASN 19 CO 0.12 1.35 -1.61 0.54 -1.06 0.00 0.00 177.43 176.77 1r2k n ARG 20 N -3.41 0.55 -1.35 0.81 1.74 -1.26 -4.97 116.66 108.77 1r2k n ARG 20 Ca -0.14 0.41 -0.48 0.00 -0.77 0.00 0.00 57.85 56.88 1r2k n ARG 20 Cb 1.03 -1.61 -0.04 0.00 -1.02 0.00 0.00 32.46 30.83 1r2k n ARG 20 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1r2k n ARG 21 N -4.39 0.00 -4.68 5.56 3.00 -1.26 -5.02 116.66 109.86 1r2k n ARG 21 Ca -0.35 0.00 -0.31 0.00 -0.01 0.00 0.00 57.85 57.18 1r2k n ARG 21 Cb 0.68 -1.03 -0.07 0.00 0.00 0.00 0.00 32.46 32.04 1r2k n ARG 21 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1r2k s GLY 22 N -0.79 2.97 0.39 -0.13 0.00 -1.26 -4.94 107.32 103.55 1r2k s GLY 22 Ca 0.65 -0.47 0.06 0.00 0.00 0.00 0.00 44.72 44.96 1r2k s GLY 22 CO 0.54 -2.06 2.02 0.83 0.00 0.00 0.00 173.10 174.42 1r2k h GLU 23 N 1.45 0.64 -0.27 2.90 4.39 -1.96 -2.92 114.58 118.82 1r2k h GLU 23 Ca -0.40 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.21 1r2k h GLU 23 Cb 1.31 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.80 1r2k h GLU 23 CO 0.65 0.43 -0.06 1.05 -1.16 0.00 0.00 179.01 179.92 1r2k h GLU 24 N 0.66 0.51 -0.93 2.33 4.11 -2.02 -3.24 114.58 116.01 1r2k h GLU 24 Ca 0.22 -0.19 -0.63 0.00 0.07 0.00 0.00 59.36 58.83 1r2k h GLU 24 Cb 0.05 -0.03 -0.31 0.00 0.50 0.00 0.00 28.75 28.95 1r2k h GLU 24 CO -0.05 0.72 0.49 -0.40 0.07 0.00 0.00 179.01 179.83 1r2k n ASP 25 N -4.54 6.74 -3.94 3.06 5.75 -1.17 -4.77 116.55 117.69 1r2k n ASP 25 Ca -0.03 -3.77 -0.37 0.00 -0.01 0.00 0.00 54.79 50.60 1r2k n ASP 25 Cb 0.30 -0.83 -0.03 0.00 -1.03 0.00 0.00 41.12 39.53 1r2k n ASP 25 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1r2k n ASP 26 N -0.90 5.04 -0.35 -1.12 4.64 -1.11 -4.64 116.55 118.11 1r2k n ASP 26 Ca 0.58 -3.30 0.01 0.00 -1.38 0.00 0.00 54.79 50.70 1r2k n ASP 26 Cb 0.80 -1.08 0.15 0.00 -1.04 0.00 0.00 41.12 39.96 1r2k n ASP 26 CO 0.00 0.00 0.00 0.74 -0.82 0.00 0.00 177.20 177.12 1r2k h THR 27 N 3.57 1.11 -0.23 5.18 2.02 -1.89 -2.38 112.91 120.29 1r2k h THR 27 Ca 0.19 -0.40 -0.18 0.00 0.77 0.00 0.00 66.41 66.79 1r2k h THR 27 Cb 0.71 -0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1r2k h THR 27 CO 1.04 0.21 -0.56 0.28 0.37 0.00 0.00 175.52 176.86 1r2k h SER 28 N 1.15 0.89 -0.11 4.18 0.02 -1.90 -2.01 113.55 115.76 1r2k h SER 28 Ca 0.41 -0.57 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1r2k h SER 28 Cb 0.11 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1r2k h SER 28 CO -0.16 1.29 0.08 1.23 -1.14 0.00 0.00 176.83 178.13 1r2k h GLY 29 N 0.52 0.16 0.83 -3.77 0.00 -1.92 -2.36 103.07 96.53 1r2k h GLY 29 Ca -0.01 -0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.29 1r2k h GLY 29 CO 0.12 0.06 0.19 0.45 0.00 0.00 0.00 176.54 177.36 1r2k h HIS 30 N 0.15 0.34 -0.60 5.60 3.86 -1.44 -1.71 115.15 121.35 1r2k h HIS 30 Ca 0.04 0.01 0.08 0.00 -1.16 0.00 0.00 60.37 59.34 1r2k h HIS 30 Cb -0.02 -0.10 -0.06 0.00 1.06 0.00 0.00 27.41 28.29 1r2k h HIS 30 CO -0.07 0.18 0.27 -0.92 0.86 0.00 0.00 177.93 178.25 1r2k h TYR 31 N 0.38 0.49 -0.35 2.45 3.20 -1.21 0.18 116.97 122.11 1r2k h TYR 31 Ca 0.16 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.97 1r2k h TYR 31 Cb 0.06 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 1r2k h TYR 31 CO -0.10 0.18 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.43 1r2k h LEU 32 N 0.49 0.69 -0.12 2.82 3.38 -1.13 0.40 115.31 121.84 1r2k h LEU 32 Ca 0.29 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1r2k h LEU 32 Cb 0.29 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1r2k h LEU 32 CO -0.25 0.91 0.04 -0.09 0.09 0.00 0.00 178.44 179.14 1r2k h ARG 33 N 0.47 0.19 0.25 1.13 2.43 -0.95 0.25 114.38 118.14 1r2k h ARG 33 Ca 0.09 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1r2k h ARG 33 Cb 0.62 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1r2k h ARG 33 CO 0.04 0.31 -0.14 -0.44 -1.51 0.00 0.00 179.97 178.23 1r2k h ASP 34 N 0.02 -0.33 -0.36 -3.80 3.45 -0.58 -0.66 116.42 114.16 1r2k h ASP 34 Ca 0.04 0.02 0.01 0.00 0.43 0.00 0.00 57.03 57.53 1r2k h ASP 34 Cb 0.20 0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 39.04 1r2k h ASP 34 CO -0.00 -0.23 0.22 0.28 -1.57 0.00 0.00 179.24 177.94 1r2k h SER 35 N -0.36 0.36 -0.51 6.45 0.02 -0.16 0.21 113.55 119.56 1r2k h SER 35 Ca -0.03 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 61.01 1r2k h SER 35 Cb 0.29 -0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.68 1r2k h SER 35 CO 0.04 0.26 0.10 0.00 -1.14 0.00 0.00 176.83 176.09 1r2k h ALA 36 N 1.16 0.57 -0.04 3.77 0.00 -0.30 -2.53 119.26 121.88 1r2k h ALA 36 Ca 0.14 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1r2k h ALA 36 Cb -0.01 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1r2k h ALA 36 CO -0.06 -0.31 -0.10 1.96 0.00 0.00 0.00 179.25 180.74 1r2k h GLN 37 N 0.24 0.15 0.00 0.00 4.20 -0.74 -2.38 115.11 116.58 1r2k h GLN 37 Ca 0.25 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1r2k h GLN 37 Cb 0.34 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1r2k h GLN 37 CO -0.33 0.70 0.06 0.39 -0.67 0.00 0.00 178.83 178.98 1r2k n GLU 38 N -4.67 0.00 0.00 1.46 1.02 0.71 0.11 120.64 119.27 1r2k n GLU 38 Ca -0.08 0.21 0.06 0.00 -0.02 0.00 0.00 57.16 57.33 1r2k n GLU 38 Cb 0.36 -1.56 -0.03 0.00 -0.02 0.00 0.00 31.44 30.19 1r2k n GLU 38 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1r2k n ALA 39 N -1.16 3.28 0.00 0.62 0.00 -0.98 -5.00 120.51 117.27 1r2k n ALA 39 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1r2k n ALA 39 Cb 0.06 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1r2k n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r2k n GLY 40 N 1.14 0.83 3.93 0.00 0.00 0.29 -5.06 105.19 106.33 1r2k n GLY 40 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 1r2k n GLY 40 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1r2k s HIS 41 N -2.00 3.48 -0.23 1.61 3.76 -0.91 -4.51 115.29 116.48 1r2k s HIS 41 Ca 0.00 0.45 -0.09 0.00 -0.15 0.00 0.00 55.06 55.26 1r2k s HIS 41 Cb 0.00 -2.05 -0.04 0.00 1.11 0.00 0.00 32.58 31.60 1r2k s HIS 41 CO 0.00 -0.04 0.12 -1.01 -0.85 0.00 0.00 174.74 172.96 1r2k s HIS 42 N -2.45 3.24 -0.73 1.40 0.09 -0.59 -4.20 115.29 112.05 1r2k s HIS 42 Ca 0.43 0.04 -0.18 0.00 -0.00 0.00 0.00 55.06 55.34 1r2k s HIS 42 Cb -0.10 -2.23 0.13 0.00 -0.00 0.00 0.00 32.58 30.38 1r2k s HIS 42 CO 0.38 -0.03 0.85 0.08 -0.00 0.00 0.00 174.74 176.02 1r2k s VAL 43 N 1.08 4.90 -1.03 -0.90 1.01 -1.26 -0.23 120.40 123.97 1r2k s VAL 43 Ca 0.06 -1.36 0.24 0.00 0.00 0.00 0.00 61.98 60.92 1r2k s VAL 43 Cb -0.14 -4.58 0.22 0.00 0.00 0.00 0.00 36.38 31.88 1r2k s VAL 43 CO 0.04 -1.24 1.77 1.33 0.00 0.00 0.00 175.10 177.01 1r2k n VAL 44 N 5.28 0.34 -3.60 2.92 0.24 0.36 -4.90 118.33 118.97 1r2k n VAL 44 Ca 0.04 0.08 -0.06 0.00 -2.04 0.00 0.00 64.34 62.36 1r2k n VAL 44 Cb 0.45 -0.67 -0.03 0.00 -1.47 0.00 0.00 33.84 32.12 1r2k n VAL 44 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1r2k s ASP 45 N -2.97 -0.19 -0.03 -1.34 3.68 -1.23 -5.00 116.67 109.59 1r2k s ASP 45 Ca 0.13 0.12 -0.20 0.00 2.13 0.00 0.00 52.55 54.72 1r2k s ASP 45 Cb 0.16 0.17 0.04 0.00 -1.45 0.00 0.00 42.92 41.84 1r2k s ASP 45 CO 0.43 -0.24 0.44 -0.75 0.13 0.00 0.00 175.17 175.19 1r2k s LYS 46 N -1.75 0.79 0.13 4.34 2.20 -1.26 -0.86 119.74 123.33 1r2k s LYS 46 Ca 0.06 0.00 -0.25 0.00 -0.36 0.00 0.00 55.97 55.43 1r2k s LYS 46 Cb -0.01 0.36 0.07 0.00 -1.51 0.00 0.00 37.83 36.74 1r2k s LYS 46 CO -0.04 -0.23 0.79 0.00 -0.36 0.00 0.00 175.35 175.51 1r2k s ALA 47 N -1.20 -1.61 -0.03 3.13 0.00 -0.81 -4.96 121.76 116.29 1r2k s ALA 47 Ca -0.12 0.41 0.04 0.00 0.00 0.00 0.00 51.96 52.30 1r2k s ALA 47 Cb -0.03 0.69 -0.00 0.00 0.00 0.00 0.00 23.12 23.77 1r2k s ALA 47 CO 0.06 -0.86 -0.15 0.42 0.00 0.00 0.00 175.76 175.23 1r2k s ILE 48 N -3.49 1.28 0.11 0.00 1.01 -1.26 -1.01 121.20 117.84 1r2k s ILE 48 Ca 0.07 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 60.10 1r2k s ILE 48 Cb -0.02 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 1r2k s ILE 48 CO -0.05 0.37 -0.10 0.68 0.00 0.00 0.00 174.94 175.84 1r2k s VAL 49 N -0.03 0.99 0.76 2.92 -7.23 0.12 -4.94 120.40 112.98 1r2k s VAL 49 Ca -0.01 -1.77 -0.11 0.00 -1.81 0.00 0.00 61.98 58.27 1r2k s VAL 49 Cb -0.10 -1.52 0.05 0.00 0.56 0.00 0.00 36.38 35.38 1r2k s VAL 49 CO 0.01 -0.63 1.10 -0.54 -0.31 0.00 0.00 175.10 174.73 1r2k s LYS 50 N -3.12 2.31 -1.13 4.82 -0.14 -1.25 -0.35 119.74 120.88 1r2k s LYS 50 Ca 0.09 1.21 -0.20 0.00 -1.36 0.00 0.00 55.97 55.72 1r2k s LYS 50 Cb -0.01 -1.90 -0.05 0.00 -1.68 0.00 0.00 37.83 34.19 1r2k s LYS 50 CO -0.00 -1.61 1.95 0.39 -0.76 0.00 0.00 175.35 175.32 1r2k n GLU 51 N -3.37 2.16 -3.86 1.68 1.02 -1.26 -4.60 120.64 112.41 1r2k n GLU 51 Ca 0.09 -2.47 -0.21 0.00 -0.02 0.00 0.00 57.16 54.55 1r2k n GLU 51 Cb 0.53 -3.34 -0.17 0.00 -0.02 0.00 0.00 31.44 28.44 1r2k n GLU 51 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1r2k s ASN 52 N 4.87 1.24 0.26 1.62 2.47 -1.26 -4.85 114.94 119.30 1r2k s ASN 52 Ca 0.58 -0.07 -0.01 0.00 0.42 0.00 0.00 52.86 53.77 1r2k s ASN 52 Cb 0.08 -0.38 0.49 0.00 -1.45 0.00 0.00 41.25 39.99 1r2k s ASN 52 CO 0.07 -0.16 1.80 -0.09 -3.72 0.00 0.00 177.10 175.01 1r2k h ARG 53 N 7.96 0.79 -0.12 0.43 2.43 -1.87 -1.83 114.38 122.17 1r2k h ARG 53 Ca -0.26 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 58.67 1r2k h ARG 53 Cb 1.13 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.50 1r2k h ARG 53 CO 0.32 0.52 -0.72 1.88 -1.51 0.00 0.00 179.97 180.47 1r2k h TYR 54 N 0.81 0.72 -0.35 2.20 -1.99 -1.96 -2.04 116.97 114.36 1r2k h TYR 54 Ca 0.45 -0.31 -0.03 0.00 2.00 0.00 0.00 58.73 60.85 1r2k h TYR 54 Cb 0.49 -0.11 -0.01 0.00 2.00 0.00 0.00 36.73 39.09 1r2k h TYR 54 CO -0.05 1.08 0.11 0.00 -0.00 0.00 0.00 178.16 179.30 1r2k h ALA 55 N 0.84 0.46 -0.18 3.88 0.00 -1.81 -0.94 119.26 121.50 1r2k h ALA 55 Ca -0.03 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1r2k h ALA 55 Cb 1.30 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1r2k h ALA 55 CO 0.13 0.09 0.10 0.82 0.00 0.00 0.00 179.25 180.39 1r2k h ILE 56 N 0.41 1.00 -0.91 0.00 2.04 -1.34 -2.50 117.51 116.21 1r2k h ILE 56 Ca 0.11 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.90 1r2k h ILE 56 Cb 0.25 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1r2k h ILE 56 CO -0.00 0.04 0.56 0.03 0.00 0.00 0.00 178.15 178.77 1r2k h ARG 57 N 0.20 1.22 -0.11 2.37 3.08 -1.16 -1.08 114.38 118.90 1r2k h ARG 57 Ca 0.07 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1r2k h ARG 57 Cb 0.01 -0.26 -0.00 0.00 0.08 0.00 0.00 29.97 29.79 1r2k h ARG 57 CO -0.05 0.84 0.01 0.00 -1.07 0.00 0.00 179.97 179.71 1r2k h ALA 58 N 1.37 0.15 -0.13 0.04 0.00 -1.00 -1.00 119.26 118.69 1r2k h ALA 58 Ca 0.33 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1r2k h ALA 58 Cb -0.08 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1r2k h ALA 58 CO -0.06 -0.18 0.00 0.37 0.00 0.00 0.00 179.25 179.38 1r2k h GLN 59 N -0.06 0.23 -0.14 0.00 5.75 -1.27 -2.84 115.11 116.78 1r2k h GLN 59 Ca 0.03 -0.07 -0.09 0.00 -0.15 0.00 0.00 58.65 58.37 1r2k h GLN 59 Cb 0.32 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.84 1r2k h GLN 59 CO 0.00 0.46 -0.31 0.28 -2.65 0.00 0.00 178.83 176.61 1r2k h VAL 60 N -0.03 1.27 -0.14 2.39 2.07 -1.25 -2.68 116.25 117.87 1r2k h VAL 60 Ca 0.04 -1.27 -0.12 0.00 0.82 0.00 0.00 66.70 66.16 1r2k h VAL 60 Cb 0.35 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1r2k h VAL 60 CO 0.01 0.39 -0.44 0.28 0.02 0.00 0.00 177.57 177.82 1r2k h SER 61 N 0.24 0.36 -0.10 0.57 0.02 -1.15 -0.77 113.55 112.71 1r2k h SER 61 Ca 0.03 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1r2k h SER 61 Cb 0.67 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.10 1r2k h SER 61 CO 0.05 0.76 0.03 0.00 -1.14 0.00 0.00 176.83 176.53 1r2k h ALA 62 N 1.26 0.13 -0.49 3.77 0.00 -1.31 -1.65 119.26 120.97 1r2k h ALA 62 Ca 0.02 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1r2k h ALA 62 Cb 0.89 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1r2k h ALA 62 CO 0.07 -0.26 0.14 -1.49 0.00 0.00 0.00 179.25 177.71 1r2k h TRP 63 N -0.01 0.75 -0.54 0.00 6.55 -1.26 -0.88 115.95 120.55 1r2k h TRP 63 Ca 0.03 -0.06 -0.02 0.00 0.95 0.00 0.00 58.89 59.79 1r2k h TRP 63 Cb 0.21 -0.23 -0.02 0.00 -0.86 0.00 0.00 29.16 28.26 1r2k h TRP 63 CO -0.01 0.63 0.24 0.82 -1.05 0.00 0.00 178.44 179.07 1r2k h ILE 64 N 0.72 1.21 0.00 1.49 2.04 -0.95 -2.60 117.51 119.42 1r2k h ILE 64 Ca 0.16 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1r2k h ILE 64 Cb 0.24 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1r2k h ILE 64 CO -0.01 0.24 0.00 0.00 0.00 0.00 0.00 178.15 178.39 1r2k n ALA 65 N -2.33 2.38 -1.44 1.87 0.00 -0.64 -4.82 120.51 115.53 1r2k n ALA 65 Ca 0.03 -0.12 -0.31 0.00 0.00 0.00 0.00 53.44 53.04 1r2k n ALA 65 Cb 0.14 -1.47 0.07 0.00 0.00 0.00 0.00 19.45 18.19 1r2k n ALA 65 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1r2k s SER 66 N -2.81 4.84 0.05 0.00 1.04 -0.37 -4.98 113.70 111.47 1r2k s SER 66 Ca 0.20 1.63 0.15 0.00 0.48 0.00 0.00 55.95 58.41 1r2k s SER 66 Cb 0.19 -2.41 -0.15 0.00 0.10 0.00 0.00 66.02 63.75 1r2k s SER 66 CO 0.49 -1.79 0.85 0.44 0.98 0.00 0.00 173.24 174.21 1r2k h ASP 67 N -0.96 0.00 0.21 7.02 3.45 -1.90 -3.41 116.42 120.84 1r2k h ASP 67 Ca -0.45 0.00 -0.34 0.00 0.43 0.00 0.00 57.03 56.67 1r2k h ASP 67 Cb 1.23 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 39.94 1r2k h ASP 67 CO 0.55 0.72 -2.08 -0.90 -1.57 0.00 0.00 179.24 175.96 1r2k n ASP 68 N -2.98 0.83 -4.67 6.45 5.75 -1.26 -4.89 116.55 115.77 1r2k n ASP 68 Ca -0.10 0.18 -0.43 0.00 -0.01 0.00 0.00 54.79 54.43 1r2k n ASP 68 Cb 0.90 0.19 -0.02 0.00 -1.03 0.00 0.00 41.12 41.16 1r2k n ASP 68 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1r2k s VAL 69 N -2.55 4.49 -0.16 2.12 1.01 -1.26 -4.65 120.40 119.40 1r2k s VAL 69 Ca -0.12 1.79 0.14 0.00 0.00 0.00 0.00 61.98 63.79 1r2k s VAL 69 Cb 0.07 -4.16 -0.20 0.00 0.00 0.00 0.00 36.38 32.10 1r2k s VAL 69 CO 0.80 -0.11 0.05 0.00 0.00 0.00 0.00 175.10 175.83 1r2k n GLN 70 N 6.07 1.33 -4.27 2.72 6.02 -0.36 -4.84 117.38 124.06 1r2k n GLN 70 Ca 0.12 -0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.93 1r2k n GLN 70 Cb 0.46 -1.41 -0.14 0.00 1.02 0.00 0.00 30.24 30.16 1r2k n GLN 70 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1r2k s VAL 71 N -2.39 0.58 -0.06 5.09 1.01 -0.95 -1.07 120.40 122.62 1r2k s VAL 71 Ca -0.09 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.57 1r2k s VAL 71 Cb 0.05 -0.50 0.00 0.00 0.00 0.00 0.00 36.38 35.93 1r2k s VAL 71 CO 0.66 0.14 -0.17 -0.69 0.00 0.00 0.00 175.10 175.03 1r2k s VAL 72 N -0.24 1.49 -0.11 2.92 1.01 0.58 -0.52 120.40 125.54 1r2k s VAL 72 Ca 0.02 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.31 1r2k s VAL 72 Cb -0.03 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 35.06 1r2k s VAL 72 CO -0.00 0.43 -0.22 -0.76 0.00 0.00 0.00 175.10 174.54 1r2k s LEU 73 N 0.21 2.05 -0.07 3.92 1.43 0.03 -1.76 118.68 124.48 1r2k s LEU 73 Ca -0.08 -0.55 0.03 0.00 -1.03 0.00 0.00 54.13 52.50 1r2k s LEU 73 Cb -0.14 -1.36 0.01 0.00 0.03 0.00 0.00 46.19 44.73 1r2k s LEU 73 CO 0.04 0.13 -0.16 -0.63 0.23 0.00 0.00 176.35 175.96 1r2k s ILE 74 N 0.49 1.40 -0.16 -0.59 1.01 0.12 0.28 121.20 123.76 1r2k s ILE 74 Ca -0.16 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 59.86 1r2k s ILE 74 Cb -0.17 -1.24 0.02 0.00 0.01 0.00 0.00 42.46 41.07 1r2k s ILE 74 CO 0.06 0.41 -0.18 0.28 0.00 0.00 0.00 174.94 175.51 1r2k s THR 75 N 0.51 1.83 0.00 2.92 -1.32 -0.45 -4.33 115.64 114.80 1r2k s THR 75 Ca -0.15 -0.80 0.00 0.00 -1.21 0.00 0.00 61.69 59.53 1r2k s THR 75 Cb -0.16 -1.67 0.00 0.00 -1.51 0.00 0.00 72.50 69.16 1r2k s THR 75 CO 0.05 0.50 0.00 0.61 -2.21 0.00 0.00 174.62 173.57 1r2k n GLY 76 N 4.60 2.93 1.84 6.08 0.00 -1.25 -1.64 105.19 117.74 1r2k n GLY 76 Ca -0.19 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.01 1r2k n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r2k n GLY 77 N 0.10 0.59 0.91 -0.02 0.00 -1.26 -4.64 105.19 100.87 1r2k n GLY 77 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1r2k n GLY 77 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r2k n THR 78 N -2.81 0.51 -1.18 2.61 -2.24 -1.26 -2.11 114.28 107.80 1r2k n THR 78 Ca 0.00 -0.62 -0.30 0.00 -2.27 0.00 0.00 64.05 60.86 1r2k n THR 78 Cb 0.00 0.53 0.25 0.00 -2.10 0.00 0.00 70.33 69.01 1r2k n THR 78 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1r2k s GLY 79 N -1.29 1.62 0.00 3.38 0.00 -1.26 -1.65 107.32 108.12 1r2k s GLY 79 Ca 0.35 -1.12 0.22 0.00 0.00 0.00 0.00 44.72 44.17 1r2k s GLY 79 CO 0.27 -0.19 1.44 1.04 0.00 0.00 0.00 173.10 175.66 1r2k n LEU 80 N -4.76 2.92 -4.84 0.66 4.77 -1.26 -4.65 117.00 109.85 1r2k n LEU 80 Ca 0.15 -1.27 -0.29 0.00 -0.03 0.00 0.00 56.01 54.57 1r2k n LEU 80 Cb 0.60 -0.22 0.10 0.00 -2.33 0.00 0.00 43.42 41.57 1r2k n LEU 80 CO 0.42 0.63 0.74 0.42 -1.33 0.00 0.00 177.39 178.27 1r2k s THR 81 N -1.56 2.52 0.45 -5.08 -4.23 -1.26 -4.95 115.64 101.53 1r2k s THR 81 Ca 0.37 0.17 0.20 0.00 -1.18 0.00 0.00 61.69 61.25 1r2k s THR 81 Cb 0.21 -3.02 0.23 0.00 1.34 0.00 0.00 72.50 71.26 1r2k s THR 81 CO 0.30 -0.22 2.04 -0.08 -0.54 0.00 0.00 174.62 176.11 1r2k h GLU 82 N -1.14 0.00 0.00 3.99 4.57 -2.03 -2.72 114.58 117.24 1r2k h GLU 82 Ca -0.48 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 1r2k h GLU 82 Cb 1.30 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 1r2k h GLU 82 CO 0.63 0.15 -0.39 0.41 -1.18 0.00 0.00 179.01 178.62 1r2k n GLY 83 N -0.92 -1.36 3.60 1.92 0.00 -1.26 -4.77 105.19 102.40 1r2k n GLY 83 Ca -0.02 -0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 1r2k n GLY 83 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1r2k s ASP 84 N -3.32 6.41 0.00 1.61 1.01 -1.03 -4.67 116.67 116.68 1r2k s ASP 84 Ca 0.11 0.69 0.00 0.00 0.71 0.00 0.00 52.55 54.06 1r2k s ASP 84 Cb 0.17 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.55 1r2k s ASP 84 CO 0.66 -1.39 0.69 0.00 0.21 0.00 0.00 175.17 175.33 1r2k n GLN 85 N 8.04 1.04 -0.01 8.23 1.13 -1.09 -4.83 117.38 129.89 1r2k n GLN 85 Ca 0.15 -0.92 -0.09 0.00 -1.94 0.00 0.00 57.00 54.20 1r2k n GLN 85 Cb 0.48 -0.90 -0.03 0.00 0.11 0.00 0.00 30.24 29.91 1r2k n GLN 85 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1r2k h ALA 86 N 0.00 -0.17 -0.48 -1.58 0.00 -1.71 0.15 119.26 115.47 1r2k h ALA 86 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1r2k h ALA 86 Cb 0.39 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1r2k h ALA 86 CO 0.00 -0.67 0.31 -1.35 0.00 0.00 0.00 179.25 177.54 1r2k h PRO 87 N -0.27 0.64 -0.85 0.00 0.11 -1.89 -1.07 132.00 128.67 1r2k h PRO 87 Ca 0.11 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.21 1r2k h PRO 87 Cb 0.43 -0.14 -0.05 0.00 0.11 0.00 0.00 31.00 31.34 1r2k h PRO 87 CO -0.31 0.43 0.54 0.93 -0.21 0.00 0.00 178.00 179.39 1r2k h GLU 88 N 0.65 1.01 -0.29 1.05 3.07 -1.82 -0.74 114.58 117.52 1r2k h GLU 88 Ca 0.18 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 58.94 1r2k h GLU 88 Cb -0.06 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 27.61 1r2k h GLU 88 CO -0.04 0.67 0.05 0.00 -1.40 0.00 0.00 179.01 178.30 1r2k h ALA 89 N 1.36 0.38 0.17 3.43 0.00 -0.28 -3.38 119.26 120.94 1r2k h ALA 89 Ca 0.34 -0.19 -0.34 0.00 0.00 0.00 0.00 54.91 54.73 1r2k h ALA 89 Cb 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1r2k h ALA 89 CO -0.13 0.07 -1.71 -0.07 0.00 0.00 0.00 179.25 177.41 1r2k h LEU 90 N 0.30 0.56 -0.81 0.00 3.38 -0.99 -3.39 115.31 114.35 1r2k h LEU 90 Ca 0.09 -0.93 0.20 0.00 0.09 0.00 0.00 57.88 57.33 1r2k h LEU 90 Cb 0.33 -0.18 -0.14 0.00 0.09 0.00 0.00 40.66 40.76 1r2k h LEU 90 CO 0.00 1.77 0.11 -0.07 0.09 0.00 0.00 178.44 180.34 1r2k h LEU 91 N 0.02 -0.18 0.00 1.67 3.38 -1.32 0.39 115.31 119.28 1r2k h LEU 91 Ca -0.34 0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1r2k h LEU 91 Cb 2.03 0.31 0.00 0.00 0.09 0.00 0.00 40.66 43.08 1r2k h LEU 91 CO 0.15 -0.16 0.00 -0.81 0.09 0.00 0.00 178.44 177.70 1r2k n PRO 92 N -5.29 0.14 0.02 1.13 -0.04 -1.26 -2.34 135.00 127.36 1r2k n PRO 92 Ca 0.17 0.15 0.12 0.00 -0.04 0.00 0.00 63.50 63.90 1r2k n PRO 92 Cb 0.56 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.69 1r2k n PRO 92 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1r2k n LEU 93 N -1.39 0.60 -4.76 1.53 4.77 0.14 -4.94 117.00 112.94 1r2k n LEU 93 Ca 0.07 0.01 -0.40 0.00 -0.03 0.00 0.00 56.01 55.66 1r2k n LEU 93 Cb 0.18 -0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 1r2k n LEU 93 CO 0.15 0.08 0.79 -0.36 -1.33 0.00 0.00 177.39 176.72 1r2k s PHE 94 N -3.07 3.51 -0.01 -1.77 0.08 -0.99 -4.75 117.98 110.98 1r2k s PHE 94 Ca 0.08 1.68 -0.10 0.00 0.12 0.00 0.00 56.93 58.72 1r2k s PHE 94 Cb 0.16 -3.28 -0.31 0.00 -0.57 0.00 0.00 43.02 39.02 1r2k s PHE 94 CO 0.74 -0.61 0.84 -0.44 -0.10 0.00 0.00 175.22 175.64 1r2k h ASP 95 N 3.60 0.63 -4.98 1.36 3.45 -0.36 -3.47 116.42 116.64 1r2k h ASP 95 Ca -0.47 -0.81 -0.13 0.00 0.43 0.00 0.00 57.03 56.05 1r2k h ASP 95 Cb 1.21 -0.20 -0.20 0.00 -0.56 0.00 0.00 39.33 39.58 1r2k h ASP 95 CO 0.66 1.67 -0.36 -0.13 -1.57 0.00 0.00 179.24 179.50 1r2k s ARG 96 N -2.60 0.59 -0.02 3.56 0.52 -0.99 -5.01 118.95 115.01 1r2k s ARG 96 Ca -0.12 -0.28 -0.04 0.00 -0.52 0.00 0.00 55.73 54.77 1r2k s ARG 96 Cb 0.05 0.26 -0.04 0.00 0.52 0.00 0.00 34.95 35.74 1r2k s ARG 96 CO 0.88 -0.16 0.20 -2.00 0.02 0.00 0.00 175.30 174.25 1r2k s GLU 97 N -1.35 3.48 -0.87 3.54 2.12 -1.26 0.01 118.70 124.36 1r2k s GLU 97 Ca -0.14 -0.24 -0.06 0.00 0.36 0.00 0.00 54.97 54.90 1r2k s GLU 97 Cb -0.06 -3.10 0.22 0.00 0.26 0.00 0.00 34.13 31.45 1r2k s GLU 97 CO 0.03 0.68 0.77 0.08 -0.54 0.00 0.00 175.26 176.28 1r2k s VAL 98 N -1.29 4.79 0.35 3.70 1.01 0.23 -4.89 120.40 124.29 1r2k s VAL 98 Ca 0.26 -3.34 0.11 0.00 0.00 0.00 0.00 61.98 59.01 1r2k s VAL 98 Cb -0.13 -3.97 0.34 0.00 0.00 0.00 0.00 36.38 32.62 1r2k s VAL 98 CO 0.17 -1.05 1.80 -0.33 0.00 0.00 0.00 175.10 175.68 1r2k h GLU 99 N 6.67 0.60 -1.00 2.72 3.07 -1.97 -2.26 114.58 122.41 1r2k h GLU 99 Ca 0.12 -0.04 0.25 0.00 -0.50 0.00 0.00 59.36 59.19 1r2k h GLU 99 Cb 0.90 -0.13 -0.08 0.00 -0.84 0.00 0.00 28.75 28.59 1r2k h GLU 99 CO 0.84 0.39 0.65 0.78 -1.40 0.00 0.00 179.01 180.27 1r2k h GLY 100 N 0.61 1.10 0.89 -3.84 0.00 -1.96 -2.83 103.07 97.05 1r2k h GLY 100 Ca 0.55 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.63 1r2k h GLY 100 CO -0.31 -0.09 -0.43 -2.75 0.00 0.00 0.00 176.54 172.97 1r2k h PHE 101 N 0.41 -1.11 -0.43 5.60 3.57 -1.79 -1.30 116.94 121.89 1r2k h PHE 101 Ca 0.55 -0.03 0.05 0.00 3.53 0.00 0.00 57.97 62.08 1r2k h PHE 101 Cb 1.39 0.37 -0.05 0.00 2.79 0.00 0.00 35.95 40.45 1r2k h PHE 101 CO -0.00 -0.69 0.15 0.78 -2.23 0.00 0.00 178.31 176.31 1r2k h GLY 102 N -1.25 0.56 0.94 2.40 0.00 -1.67 0.16 103.07 104.20 1r2k h GLY 102 Ca -0.12 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1r2k h GLY 102 CO 0.20 0.02 0.15 0.83 0.00 0.00 0.00 176.54 177.74 1r2k h GLU 103 N 0.31 0.45 -0.12 4.80 5.08 -1.55 -0.70 114.58 122.86 1r2k h GLU 103 Ca 0.20 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1r2k h GLU 103 Cb 0.20 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1r2k h GLU 103 CO -0.21 0.41 -0.01 0.28 -1.00 0.00 0.00 179.01 178.48 1r2k h VAL 104 N 0.37 1.27 -0.82 3.13 2.07 -0.99 -3.08 116.25 118.20 1r2k h VAL 104 Ca 0.11 -0.87 0.06 0.00 0.82 0.00 0.00 66.70 66.82 1r2k h VAL 104 Cb 0.11 1.61 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 1r2k h VAL 104 CO -0.01 0.25 0.54 0.15 0.02 0.00 0.00 177.57 178.51 1r2k h PHE 105 N -0.07 0.92 0.00 1.57 3.57 -0.61 -1.14 116.94 121.18 1r2k h PHE 105 Ca 0.03 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1r2k h PHE 105 Cb 0.39 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.83 1r2k h PHE 105 CO 0.04 0.49 0.00 0.54 -2.23 0.00 0.00 178.31 177.15 1r2k n ARG 106 N -4.48 0.81 0.00 1.11 1.74 -0.28 -1.85 116.66 113.71 1r2k n ARG 106 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 1r2k n ARG 106 Cb 0.20 -1.10 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 1r2k n ARG 106 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1r2k n LEU 108 N 0.92 0.00 0.08 0.55 4.77 -0.43 -1.68 117.00 121.20 1r2k n LEU 108 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.88 1r2k n LEU 108 Cb 0.40 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.48 1r2k n LEU 108 CO 0.00 0.00 0.24 -1.28 -1.33 0.00 0.00 177.39 175.02 1r2k h SER 109 N 0.00 0.34 -0.89 -1.43 0.87 -1.60 -3.15 113.55 107.69 1r2k h SER 109 Ca 0.00 -0.27 0.01 0.00 -1.23 0.00 0.00 61.79 60.30 1r2k h SER 109 Cb 0.00 -0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 61.81 1r2k h SER 109 CO 0.00 1.06 0.58 0.15 -0.53 0.00 0.00 176.83 178.09 1r2k h PHE 110 N 0.15 1.13 0.00 2.24 3.57 -1.53 0.32 116.94 122.81 1r2k h PHE 110 Ca -0.05 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1r2k h PHE 110 Cb 1.51 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 39.87 1r2k h PHE 110 CO 0.04 0.72 0.00 0.39 -2.23 0.00 0.00 178.31 177.23 1r2k n GLU 111 N -4.45 0.25 0.00 1.11 1.02 -1.19 -0.52 120.64 116.86 1r2k n GLU 111 Ca 0.10 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 1r2k n GLU 111 Cb 0.02 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.94 1r2k n GLU 111 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1r2k n GLU 112 N -1.18 1.63 0.00 3.49 2.13 -0.36 -4.86 120.64 121.49 1r2k n GLU 112 Ca 0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.89 1r2k n GLU 112 Cb 0.08 -0.84 0.00 0.00 0.27 0.00 0.00 31.44 30.95 1r2k n GLU 112 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 1r2k n ILE 113 N -1.77 0.06 -4.28 6.31 -5.35 0.99 -5.11 119.36 110.20 1r2k n ILE 113 Ca 0.00 -0.46 0.00 0.00 -0.27 0.00 0.00 62.75 62.02 1r2k n ILE 113 Cb 0.34 1.09 0.00 0.00 -1.74 0.00 0.00 39.64 39.33 1r2k n ILE 113 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1r2k n GLY 114 N -0.03 0.43 0.00 3.28 0.00 0.32 -3.55 105.19 105.64 1r2k n GLY 114 Ca 0.00 -0.90 0.06 0.00 0.00 0.00 0.00 46.02 45.19 1r2k n GLY 114 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r2k n THR 115 N 0.00 0.93 0.82 2.61 -2.24 -1.26 -2.27 114.28 112.86 1r2k n THR 115 Ca 0.00 0.23 0.06 0.00 -2.27 0.00 0.00 64.05 62.07 1r2k n THR 115 Cb 0.00 -1.01 0.36 0.00 -2.10 0.00 0.00 70.33 67.58 1r2k n THR 115 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1r2k n SER 116 N -1.42 0.00 0.22 3.42 7.64 -1.23 -1.75 113.62 120.50 1r2k n SER 116 Ca 0.04 -0.44 0.10 0.00 1.01 0.00 0.00 58.87 59.58 1r2k n SER 116 Cb 0.13 0.00 0.43 0.00 -1.01 0.00 0.00 64.21 63.76 1r2k n SER 116 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1r2k h THR 117 N 0.00 0.54 0.00 0.44 1.03 -1.71 -2.78 112.91 110.44 1r2k h THR 117 Ca 0.00 -1.18 0.00 0.00 -0.01 0.00 0.00 66.41 65.22 1r2k h THR 117 Cb 0.00 1.81 0.00 0.00 -1.07 0.00 0.00 68.15 68.89 1r2k h THR 117 CO 0.00 0.23 0.00 0.18 -0.01 0.00 0.00 175.52 175.92 1r2k n LEU 118 N -3.36 0.00 -0.39 0.00 4.77 -0.71 -2.77 117.00 114.54 1r2k n LEU 118 Ca 0.00 0.38 0.10 0.00 -0.03 0.00 0.00 56.01 56.47 1r2k n LEU 118 Cb 0.45 -0.38 0.44 0.00 -2.33 0.00 0.00 43.42 41.59 1r2k n LEU 118 CO 0.34 -0.19 0.80 0.00 -1.33 0.00 0.00 177.39 177.01 1r2k n GLN 119 N -1.38 1.51 -4.33 3.23 1.13 -1.05 -4.84 117.38 111.64 1r2k n GLN 119 Ca 0.05 -0.77 -0.20 0.00 -1.94 0.00 0.00 57.00 54.15 1r2k n GLN 119 Cb 0.14 -1.37 -0.13 0.00 0.11 0.00 0.00 30.24 28.99 1r2k n GLN 119 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 1r2k s SER 120 N -1.60 1.62 -0.54 1.08 0.01 -1.11 -4.12 113.70 109.04 1r2k s SER 120 Ca 0.31 -0.46 0.05 0.00 1.31 0.00 0.00 55.95 57.16 1r2k s SER 120 Cb 0.16 -0.10 0.38 0.00 0.21 0.00 0.00 66.02 66.67 1r2k s SER 120 CO 0.25 0.02 1.10 0.54 0.41 0.00 0.00 173.24 175.56 1r2k n ARG 121 N 1.87 3.40 -1.67 12.44 1.74 -0.66 -5.02 116.66 128.76 1r2k n ARG 121 Ca -0.18 -4.65 -0.38 0.00 -0.77 0.00 0.00 57.85 51.86 1r2k n ARG 121 Cb 0.55 -2.25 0.05 0.00 -1.02 0.00 0.00 32.46 29.78 1r2k n ARG 121 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1r2k n ALA 122 N -0.36 0.76 -3.47 7.54 0.00 -1.26 -4.86 120.51 118.86 1r2k n ALA 122 Ca 0.36 0.07 -0.12 0.00 0.00 0.00 0.00 53.44 53.76 1r2k n ALA 122 Cb 0.50 -2.21 -0.03 0.00 0.00 0.00 0.00 19.45 17.71 1r2k n ALA 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1r2k s VAL 123 N -1.39 0.00 0.07 0.00 0.11 -0.76 -4.50 120.40 113.92 1r2k s VAL 123 Ca 0.74 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 59.71 1r2k s VAL 123 Cb -0.43 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.41 1r2k s VAL 123 CO 0.48 0.00 0.15 0.00 -3.33 0.00 0.00 175.10 172.40 1r2k s ALA 124 N -3.01 -0.14 0.35 1.54 0.00 -1.26 -0.39 121.76 118.85 1r2k s ALA 124 Ca 0.01 -0.61 -0.15 0.00 0.00 0.00 0.00 51.96 51.20 1r2k s ALA 124 Cb -0.01 0.38 0.06 0.00 0.00 0.00 0.00 23.12 23.55 1r2k s ALA 124 CO -0.08 -0.43 0.80 0.41 0.00 0.00 0.00 175.76 176.47 1r2k n GLY 125 N 0.25 0.95 3.18 0.00 0.00 -0.17 -0.60 105.19 108.79 1r2k n GLY 125 Ca -0.16 -1.23 -0.26 0.00 0.00 0.00 0.00 46.02 44.37 1r2k n GLY 125 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r2k s VAL 126 N -2.12 1.47 -0.14 1.61 1.01 0.10 -0.48 120.40 121.85 1r2k s VAL 126 Ca 0.16 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.31 1r2k s VAL 126 Cb -0.04 -1.23 0.07 0.00 0.00 0.00 0.00 36.38 35.17 1r2k s VAL 126 CO 0.10 0.42 0.26 0.00 0.00 0.00 0.00 175.10 175.88 1r2k s ALA 127 N -0.36 -0.52 -1.43 5.51 0.00 -0.45 0.43 121.76 124.94 1r2k s ALA 127 Ca 0.05 0.82 -0.08 0.00 0.00 0.00 0.00 51.96 52.75 1r2k s ALA 127 Cb -0.08 -1.07 0.04 0.00 0.00 0.00 0.00 23.12 22.01 1r2k s ALA 127 CO -0.00 -0.74 0.65 -1.71 0.00 0.00 0.00 175.76 173.96 1r2k n ASN 128 N 5.35 -4.98 -0.38 0.00 4.05 -1.26 -0.37 115.26 117.67 1r2k n ASN 128 Ca -0.06 -0.41 -0.05 0.00 0.45 0.00 0.00 54.58 54.51 1r2k n ASN 128 Cb 0.50 -4.04 -0.02 0.00 1.23 0.00 0.00 39.78 37.45 1r2k n ASN 128 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 1r2k n LYS 129 N -4.06 -0.82 -3.45 1.20 5.02 -1.26 -4.83 118.16 109.96 1r2k n LYS 129 Ca -0.04 0.54 -0.37 0.00 -2.02 0.00 0.00 58.31 56.41 1r2k n LYS 129 Cb 0.57 -4.35 -0.07 0.00 -0.02 0.00 0.00 35.03 31.15 1r2k n LYS 129 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1r2k s THR 130 N -1.94 5.24 -0.16 -0.18 2.01 0.50 -3.13 115.64 117.98 1r2k s THR 130 Ca 0.00 0.64 -0.23 0.00 0.31 0.00 0.00 61.69 62.41 1r2k s THR 130 Cb 0.00 -3.69 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 1r2k s THR 130 CO 0.00 0.31 0.72 -0.22 -0.69 0.00 0.00 174.62 174.73 1r2k s LEU 131 N 0.99 4.19 -0.16 4.42 0.20 -0.23 -1.34 118.68 126.74 1r2k s LEU 131 Ca 0.18 1.03 0.01 0.00 0.69 0.00 0.00 54.13 56.04 1r2k s LEU 131 Cb -0.14 -3.05 0.02 0.00 -0.43 0.00 0.00 46.19 42.59 1r2k s LEU 131 CO 0.07 -0.29 -0.17 -0.63 -0.29 0.00 0.00 176.35 175.04 1r2k s ILE 132 N 1.77 1.81 -0.17 6.68 1.01 0.36 -0.31 121.20 132.36 1r2k s ILE 132 Ca 0.34 -0.79 -0.00 0.00 0.00 0.00 0.00 60.65 60.20 1r2k s ILE 132 Cb -0.16 -1.67 -0.00 0.00 0.01 0.00 0.00 42.46 40.64 1r2k s ILE 132 CO 0.13 0.49 -0.14 -0.36 0.00 0.00 0.00 174.94 175.06 1r2k s PHE 133 N 1.39 2.81 0.07 3.97 0.40 -0.72 -1.00 117.98 124.90 1r2k s PHE 133 Ca 0.05 -1.07 0.09 0.00 -0.60 0.00 0.00 56.93 55.39 1r2k s PHE 133 Cb -0.13 -1.92 -0.03 0.00 0.51 0.00 0.00 43.02 41.44 1r2k s PHE 133 CO -0.12 -0.51 -0.22 0.00 0.70 0.00 0.00 175.22 175.07 1r2k s ALA 134 N 0.95 2.49 0.41 5.36 0.00 0.47 -0.70 121.76 130.74 1r2k s ALA 134 Ca -0.03 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 50.62 1r2k s ALA 134 Cb -0.15 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.34 1r2k s ALA 134 CO -0.02 0.56 0.67 -1.25 0.00 0.00 0.00 175.76 175.72 1r2k s PRO 136 N -1.64 3.52 0.52 0.00 0.04 -1.26 -1.83 135.00 134.35 1r2k s PRO 136 Ca 0.14 -0.05 0.30 0.00 0.04 0.00 0.00 61.00 61.44 1r2k s PRO 136 Cb -0.10 -2.52 1.24 0.00 0.04 0.00 0.00 34.50 33.16 1r2k s PRO 136 CO 0.06 -0.02 1.95 0.78 0.04 0.00 0.00 177.00 179.80 1r2k h GLY 137 N 0.56 0.00 -4.92 0.56 0.00 -1.88 -3.32 103.07 94.07 1r2k h GLY 137 Ca -0.48 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.32 1r2k h GLY 137 CO 0.62 0.00 1.06 -0.45 0.00 0.00 0.00 176.54 177.77 1r2k s SER 138 N -5.88 6.48 0.44 0.19 0.15 -1.26 -4.71 113.70 109.10 1r2k s SER 138 Ca 0.01 2.69 0.09 0.00 0.70 0.00 0.00 55.95 59.44 1r2k s SER 138 Cb 0.10 -2.57 0.95 0.00 -1.71 0.00 0.00 66.02 62.79 1r2k s SER 138 CO 0.57 -0.96 2.07 0.74 1.20 0.00 0.00 173.24 176.87 1r2k h THR 139 N 4.59 1.08 -0.38 6.45 2.02 -1.94 -0.43 112.91 124.31 1r2k h THR 139 Ca -0.45 -0.18 -0.08 0.00 0.77 0.00 0.00 66.41 66.48 1r2k h THR 139 Cb 1.21 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 1r2k h THR 139 CO 0.94 0.09 -0.08 0.50 0.37 0.00 0.00 175.52 177.33 1r2k h LYS 140 N 0.40 0.64 -0.24 6.66 3.64 -1.96 -0.26 116.57 125.44 1r2k h LYS 140 Ca 0.11 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 1r2k h LYS 140 Cb -0.02 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1r2k h LYS 140 CO -0.02 0.72 -0.13 0.00 -2.27 0.00 0.00 179.45 177.75 1r2k h ALA 141 N 1.32 0.34 -0.99 5.00 0.00 -1.48 -1.95 119.26 121.50 1r2k h ALA 141 Ca 0.11 -0.31 0.08 0.00 0.00 0.00 0.00 54.91 54.79 1r2k h ALA 141 Cb 0.50 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.14 1r2k h ALA 141 CO 0.03 0.21 0.64 0.00 0.00 0.00 0.00 179.25 180.12 1r2k h ARG 143 N 1.10 0.01 -0.93 0.00 3.08 -0.84 0.30 114.38 117.11 1r2k h ARG 143 Ca 0.44 -0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.52 1r2k h ARG 143 Cb 0.26 -0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.26 1r2k h ARG 143 CO -0.19 0.14 0.61 1.15 -1.07 0.00 0.00 179.97 180.61 1r2k h THR 144 N -0.12 1.19 0.01 2.04 2.02 -0.64 -0.66 112.91 116.75 1r2k h THR 144 Ca 0.00 -0.41 -0.00 0.00 0.77 0.00 0.00 66.41 66.77 1r2k h THR 144 Cb 0.13 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.42 1r2k h THR 144 CO -0.00 0.22 -0.01 0.00 0.37 0.00 0.00 175.52 176.10 1r2k h ALA 145 N 1.44 -0.02 0.81 6.16 0.00 -0.85 -2.38 119.26 124.44 1r2k h ALA 145 Ca 0.36 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1r2k h ALA 145 Cb -0.04 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.76 1r2k h ALA 145 CO -0.10 -0.25 -0.39 2.35 0.00 0.00 0.00 179.25 180.86 1r2k h TRP 146 N -0.55 -1.01 -0.30 0.00 2.91 -0.80 0.36 115.95 116.56 1r2k h TRP 146 Ca -0.00 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 59.99 1r2k h TRP 146 Cb 0.53 0.34 -0.01 0.00 -0.51 0.00 0.00 29.16 29.50 1r2k h TRP 146 CO 0.11 -0.62 0.17 0.93 -1.03 0.00 0.00 178.44 177.99 1r2k h GLU 147 N -1.25 0.41 -0.00 2.65 5.08 -1.27 0.14 114.58 120.33 1r2k h GLU 147 Ca -0.11 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1r2k h GLU 147 Cb 0.85 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1r2k h GLU 147 CO 0.18 0.35 -0.42 0.09 -1.00 0.00 0.00 179.01 178.21 1r2k n ASN 148 N -4.82 0.92 0.09 1.42 4.13 -0.89 -4.66 115.26 111.44 1r2k n ASN 148 Ca -0.02 -0.72 0.00 0.00 1.68 0.00 0.00 54.58 55.52 1r2k n ASN 148 Cb 0.07 0.28 0.00 0.00 -1.54 0.00 0.00 39.78 38.59 1r2k n ASN 148 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1r2k n ILE 149 N -0.98 0.04 -0.03 2.41 5.41 -0.69 -4.97 119.36 120.55 1r2k n ILE 149 Ca 0.09 0.01 -0.13 0.00 1.00 0.00 0.00 62.75 63.72 1r2k n ILE 149 Cb 0.35 -0.56 -0.11 0.00 -0.71 0.00 0.00 39.64 38.62 1r2k n ILE 149 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1r2k h ILE 150 N 0.00 1.54 -0.59 1.39 2.04 -0.89 -3.19 117.51 117.80 1r2k h ILE 150 Ca 0.00 -1.59 0.11 0.00 1.00 0.00 0.00 64.86 64.38 1r2k h ILE 150 Cb 0.02 2.62 -0.12 0.00 -0.74 0.00 0.00 36.82 38.60 1r2k h ILE 150 CO 0.00 0.41 -0.25 0.00 0.00 0.00 0.00 178.15 178.31 1r2k h ALA 151 N 0.33 0.16 -0.29 1.87 0.00 -0.94 0.18 119.26 120.56 1r2k h ALA 151 Ca -0.00 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1r2k h ALA 151 Cb 0.68 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1r2k h ALA 151 CO 0.00 -0.56 0.17 -1.35 0.00 0.00 0.00 179.25 177.51 1r2k h PRO 152 N -0.10 0.41 0.00 0.00 0.11 -1.78 -2.00 132.00 128.63 1r2k h PRO 152 Ca 0.26 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.32 1r2k h PRO 152 Cb 0.52 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.54 1r2k h PRO 152 CO -0.66 0.33 -0.05 1.96 -0.21 0.00 0.00 178.00 179.38 1r2k h GLN 153 N 0.36 0.00 -0.00 1.05 1.08 -1.29 -0.31 115.11 116.00 1r2k h GLN 153 Ca 0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 1r2k h GLN 153 Cb 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.47 1r2k h GLN 153 CO -0.02 0.05 -0.49 1.28 -0.95 0.00 0.00 178.83 178.70 1r2k n LEU 154 N -3.39 0.82 -4.59 1.46 4.77 -0.04 -2.24 117.00 113.79 1r2k n LEU 154 Ca -0.02 -0.19 -0.43 0.00 -0.03 0.00 0.00 56.01 55.34 1r2k n LEU 154 Cb 0.18 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.07 1r2k n LEU 154 CO 0.26 0.18 0.75 -0.62 -1.33 0.00 0.00 177.39 176.63 1r2k s ASP 155 N -2.82 6.63 0.50 -1.43 3.68 -0.13 -4.86 116.67 118.24 1r2k s ASP 155 Ca 0.15 0.46 0.33 0.00 2.13 0.00 0.00 52.55 55.62 1r2k s ASP 155 Cb 0.18 -2.46 1.80 0.00 -1.45 0.00 0.00 42.92 40.99 1r2k s ASP 155 CO 0.66 -0.90 2.02 0.00 0.13 0.00 0.00 175.17 177.09 1r2k h ALA 156 N 8.62 1.00 -0.00 3.66 0.00 -1.83 -1.62 119.26 129.09 1r2k h ALA 156 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1r2k h ALA 156 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1r2k h ALA 156 CO 0.99 0.00 -0.27 0.54 0.00 0.00 0.00 179.25 180.51 1r2k n ARG 157 N -2.68 0.10 -1.90 0.00 1.74 -1.26 -2.17 116.66 110.50 1r2k n ARG 157 Ca -0.02 -0.04 -0.41 0.00 -0.77 0.00 0.00 57.85 56.60 1r2k n ARG 157 Cb 0.07 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 29.99 1r2k n ARG 157 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1r2k s THR 158 N -2.92 2.38 0.22 0.55 2.01 -0.61 -4.85 115.64 112.42 1r2k s THR 158 Ca 0.15 0.32 0.11 0.00 0.31 0.00 0.00 61.69 62.57 1r2k s THR 158 Cb 0.18 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.45 1r2k s THR 158 CO 0.61 0.05 -0.16 -0.13 -0.69 0.00 0.00 174.62 174.30 1r2k s ARG 159 N -0.36 1.80 0.43 4.92 0.52 -1.26 -3.65 118.95 121.36 1r2k s ARG 159 Ca 0.62 -1.51 0.21 0.00 -0.52 0.00 0.00 55.73 54.53 1r2k s ARG 159 Cb -0.45 -1.95 0.98 0.00 0.52 0.00 0.00 34.95 34.05 1r2k s ARG 159 CO 0.45 0.39 1.88 -1.00 0.02 0.00 0.00 175.30 177.03 1r2k h PRO 160 N 2.72 0.00 -3.40 3.54 0.13 -2.04 -3.49 132.00 129.46 1r2k h PRO 160 Ca -0.45 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1r2k h PRO 160 Cb 1.23 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.29 1r2k h PRO 160 CO 0.54 0.27 0.02 0.00 -0.23 0.00 0.00 178.00 178.60 1r2k n ASN 162 N -0.51 -0.07 0.13 0.00 6.94 -1.26 -4.87 115.26 115.61 1r2k n ASN 162 Ca -0.03 -1.06 0.12 0.00 -0.02 0.00 0.00 54.58 53.59 1r2k n ASN 162 Cb 0.61 0.12 0.17 0.00 -2.36 0.00 0.00 39.78 38.32 1r2k n ASN 162 CO 0.00 0.00 0.00 -0.26 -1.03 0.00 0.00 177.26 175.97 1r2k h PHE 163 N 1.04 0.00 -0.54 -2.53 0.04 -1.79 -3.41 116.94 109.74 1r2k h PHE 163 Ca -0.01 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.81 1r2k h PHE 163 Cb 0.04 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.13 1r2k h PHE 163 CO 0.00 0.00 -0.32 1.58 -0.60 0.00 0.00 178.31 178.97 1r2k n HIS 164 N -2.57 -0.24 0.23 -0.55 -0.00 -1.26 -0.24 115.22 110.60 1r2k n HIS 164 Ca 0.03 0.68 0.08 0.00 -0.00 0.00 0.00 57.72 58.51 1r2k n HIS 164 Cb 0.49 -0.51 0.38 0.00 -0.00 0.00 0.00 29.99 30.35 1r2k n HIS 164 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1r2k n PRO 165 N -4.43 0.10 -0.03 1.57 -0.04 -1.26 -2.88 135.00 128.03 1r2k n PRO 165 Ca 0.01 0.49 0.09 0.00 -0.04 0.00 0.00 63.50 64.06 1r2k n PRO 165 Cb 0.14 -1.75 0.09 0.00 -0.04 0.00 0.00 33.50 31.94 1r2k n PRO 165 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1r2k n HIS 166 N -1.95 0.08 -2.42 0.54 8.25 0.67 -4.99 115.22 115.40 1r2k n HIS 166 Ca 0.01 -0.05 -0.34 0.00 -0.26 0.00 0.00 57.72 57.08 1r2k n HIS 166 Cb 0.09 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.18 1r2k n HIS 166 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1r2k s LEU 167 N -1.49 3.76 0.18 2.41 1.43 -1.14 -4.85 118.68 118.99 1r2k s LEU 167 Ca 0.23 1.92 -0.31 0.00 -1.03 0.00 0.00 54.13 54.94 1r2k s LEU 167 Cb 0.16 -4.56 -0.09 0.00 0.03 0.00 0.00 46.19 41.73 1r2k s LEU 167 CO 0.23 -0.89 1.42 -1.59 0.23 0.00 0.00 176.35 175.75 1r2k s LYS 168 N -3.42 4.30 0.00 1.70 -2.85 -1.18 -5.08 119.74 113.20 1r2k s LYS 168 Ca 0.67 2.18 0.04 0.00 -1.00 0.00 0.00 55.97 57.86 1r2k s LYS 168 Cb -0.17 -3.18 0.23 0.00 -2.06 0.00 0.00 37.83 32.65 1r2k s LYS 168 CO 0.24 -0.42 0.71 1.63 0.10 0.00 0.00 175.35 177.61