#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lr5 s VAL 3 N 2.69 3.68 0.03 0.00 1.01 -1.26 -4.97 120.40 121.58 1lr5 s VAL 3 Ca 0.47 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.43 1lr5 s VAL 3 Cb -0.17 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1lr5 s VAL 3 CO 0.12 -0.07 0.08 -0.13 0.00 0.00 0.00 175.10 175.10 1lr5 s ARG 4 N 1.41 2.99 -0.18 2.72 0.52 -1.26 -4.77 118.95 120.37 1lr5 s ARG 4 Ca -0.01 -0.56 -0.04 0.00 -0.52 0.00 0.00 55.73 54.59 1lr5 s ARG 4 Cb -0.19 -2.80 0.08 0.00 0.52 0.00 0.00 34.95 32.56 1lr5 s ARG 4 CO 0.02 0.62 0.17 0.34 0.02 0.00 0.00 175.30 176.46 1lr5 s ASP 5 N -1.96 1.69 0.00 0.23 3.68 -0.49 -5.00 116.67 114.83 1lr5 s ASP 5 Ca 0.25 -0.33 0.16 0.00 2.13 0.00 0.00 52.55 54.76 1lr5 s ASP 5 Cb -0.12 0.14 0.64 0.00 -1.45 0.00 0.00 42.92 42.13 1lr5 s ASP 5 CO 0.17 -0.33 1.46 0.59 0.13 0.00 0.00 175.17 177.18 1lr5 n ASN 6 N 5.30 1.26 -4.78 -0.34 3.02 -1.26 -4.62 115.26 113.84 1lr5 n ASN 6 Ca -0.06 -1.75 -0.36 0.00 -0.03 0.00 0.00 54.58 52.38 1lr5 n ASN 6 Cb 0.49 -0.11 -0.03 0.00 -0.61 0.00 0.00 39.78 39.52 1lr5 n ASN 6 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1lr5 s SER 7 N -1.38 6.50 -0.01 6.41 0.01 -1.26 -4.99 113.70 118.98 1lr5 s SER 7 Ca 0.26 2.08 -0.22 0.00 1.31 0.00 0.00 55.95 59.38 1lr5 s SER 7 Cb 0.14 -2.58 -0.14 0.00 0.21 0.00 0.00 66.02 63.65 1lr5 s SER 7 CO 0.20 -0.67 0.98 0.25 0.41 0.00 0.00 173.24 174.41 1lr5 h LEU 8 N 2.14 -0.50 -8.91 2.44 5.85 -2.03 -3.43 115.31 110.87 1lr5 h LEU 8 Ca -0.49 -0.08 -0.63 0.00 0.84 0.00 0.00 57.88 57.52 1lr5 h LEU 8 Cb 1.22 0.13 -0.18 0.00 0.37 0.00 0.00 40.66 42.20 1lr5 h LEU 8 CO 0.61 -0.09 -0.57 -0.69 -0.34 0.00 0.00 178.44 177.36 1lr5 s VAL 9 N -4.13 4.79 -0.01 1.05 1.01 -1.26 -5.08 120.40 116.76 1lr5 s VAL 9 Ca -0.12 -0.02 0.04 0.00 0.00 0.00 0.00 61.98 61.88 1lr5 s VAL 9 Cb 0.01 -3.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 1lr5 s VAL 9 CO 0.41 0.37 -0.15 -0.13 0.00 0.00 0.00 175.10 175.61 1lr5 s ARG 10 N 1.09 1.25 -0.37 2.72 0.52 -1.26 -5.11 118.95 117.79 1lr5 s ARG 10 Ca 0.05 -0.53 -0.27 0.00 -0.52 0.00 0.00 55.73 54.46 1lr5 s ARG 10 Cb -0.14 -1.19 0.02 0.00 0.52 0.00 0.00 34.95 34.16 1lr5 s ARG 10 CO 0.04 0.31 0.99 0.34 0.02 0.00 0.00 175.30 176.99 1lr5 s ASP 11 N -0.29 6.74 0.35 0.23 -1.08 -1.26 -4.93 116.67 116.42 1lr5 s ASP 11 Ca 0.05 0.68 0.03 0.00 -0.52 0.00 0.00 52.55 52.79 1lr5 s ASP 11 Cb -0.06 -2.49 0.65 0.00 -1.46 0.00 0.00 42.92 39.56 1lr5 s ASP 11 CO -0.00 -0.91 1.99 0.40 0.52 0.00 0.00 175.17 177.17 1lr5 h ILE 12 N 5.85 1.16 0.00 4.11 2.04 -1.97 -1.67 117.51 127.02 1lr5 h ILE 12 Ca -0.22 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1lr5 h ILE 12 Cb 1.07 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1lr5 h ILE 12 CO 1.01 0.17 0.00 -1.54 0.00 0.00 0.00 178.15 177.79 1lr5 n SER 13 N -4.42 0.51 -0.78 1.72 3.41 -1.26 -2.11 113.62 110.70 1lr5 n SER 13 Ca 0.05 0.68 0.08 0.00 -0.26 0.00 0.00 58.87 59.43 1lr5 n SER 13 Cb 0.08 -0.77 0.14 0.00 -0.26 0.00 0.00 64.21 63.39 1lr5 n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lr5 n GLN 14 N -2.13 1.96 -3.15 4.33 1.13 -0.63 -4.92 117.38 113.97 1lr5 n GLN 14 Ca 0.00 -1.84 -0.39 0.00 -1.94 0.00 0.00 57.00 52.83 1lr5 n GLN 14 Cb 0.11 -1.35 -0.06 0.00 0.11 0.00 0.00 30.24 29.06 1lr5 n GLN 14 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1lr5 s MET 15 N -1.19 4.29 0.21 -1.09 -1.94 -0.90 -5.00 119.30 113.69 1lr5 s MET 15 Ca 0.26 0.62 -0.31 0.00 -1.71 0.00 0.00 55.69 54.55 1lr5 s MET 15 Cb 0.15 -3.52 -0.10 0.00 2.01 0.00 0.00 34.83 33.38 1lr5 s MET 15 CO 0.21 -0.08 1.48 -1.25 -0.01 0.00 0.00 175.02 175.37 1lr5 s PRO 16 N 1.36 4.25 0.10 2.03 0.04 -1.26 -4.95 135.00 136.58 1lr5 s PRO 16 Ca 0.30 2.30 0.05 0.00 0.04 0.00 0.00 61.00 63.69 1lr5 s PRO 16 Cb -0.16 -3.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.20 1lr5 s PRO 16 CO 0.12 -0.48 0.02 -1.14 0.04 0.00 0.00 177.00 175.56 1lr5 s GLN 17 N 0.24 2.60 0.16 4.56 0.74 -1.26 -4.71 119.66 121.99 1lr5 s GLN 17 Ca 0.63 -0.85 -0.20 0.00 0.05 0.00 0.00 55.36 55.00 1lr5 s GLN 17 Cb -0.42 -2.55 0.05 0.00 1.10 0.00 0.00 33.01 31.19 1lr5 s GLN 17 CO 0.38 0.53 0.52 0.45 -0.55 0.00 0.00 175.29 176.62 1lr5 s SER 18 N -2.45 -0.39 0.23 6.67 0.15 -0.81 -4.92 113.70 112.17 1lr5 s SER 18 Ca 0.27 -0.21 0.24 0.00 0.70 0.00 0.00 55.95 56.95 1lr5 s SER 18 Cb -0.11 0.56 0.44 0.00 -1.71 0.00 0.00 66.02 65.19 1lr5 s SER 18 CO 0.19 -0.96 1.49 0.77 1.20 0.00 0.00 173.24 175.93 1lr5 h SER 19 N 2.16 0.00 -3.88 5.45 4.64 -1.87 0.22 113.55 120.27 1lr5 h SER 19 Ca -0.33 -0.07 -0.23 0.00 -0.47 0.00 0.00 61.79 60.69 1lr5 h SER 19 Cb 1.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 1lr5 h SER 19 CO 0.40 0.03 -0.30 -1.22 -0.87 0.00 0.00 176.83 174.88 1lr5 n TYR 20 N -2.47 -1.44 0.00 4.77 4.02 -1.26 -1.14 117.16 119.64 1lr5 n TYR 20 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 1lr5 n TYR 20 Cb 0.47 -2.67 0.00 0.00 -0.02 0.00 0.00 39.34 37.12 1lr5 n TYR 20 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1lr5 n GLY 21 N -0.79 1.59 3.47 2.72 0.00 -1.26 -4.95 105.19 105.97 1lr5 n GLY 21 Ca -0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 1lr5 n GLY 21 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lr5 s ILE 22 N -2.34 4.55 0.23 -0.61 1.01 -0.29 -5.00 121.20 118.75 1lr5 s ILE 22 Ca 0.00 -0.17 -0.32 0.00 0.00 0.00 0.00 60.65 60.16 1lr5 s ILE 22 Cb 0.00 -4.49 -0.12 0.00 0.01 0.00 0.00 42.46 37.86 1lr5 s ILE 22 CO 0.00 -1.09 1.69 -0.62 0.00 0.00 0.00 174.94 174.92 1lr5 n GLU 23 N 7.05 2.75 -0.74 2.79 -0.58 -1.26 -1.12 120.64 129.52 1lr5 n GLU 23 Ca -0.03 0.99 0.00 0.00 -0.42 0.00 0.00 57.16 57.70 1lr5 n GLU 23 Cb 0.46 -2.82 0.00 0.00 -0.57 0.00 0.00 31.44 28.51 1lr5 n GLU 23 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1lr5 n GLY 24 N 3.54 1.14 3.92 0.62 0.00 -1.26 -4.77 105.19 108.37 1lr5 n GLY 24 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1lr5 n GLY 24 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1lr5 s LEU 25 N 0.00 4.33 -0.13 0.99 2.96 -0.28 -0.62 118.68 125.92 1lr5 s LEU 25 Ca 0.00 0.35 -0.02 0.00 -0.22 0.00 0.00 54.13 54.24 1lr5 s LEU 25 Cb 0.00 -3.06 0.04 0.00 0.50 0.00 0.00 46.19 43.67 1lr5 s LEU 25 CO 0.00 0.12 0.02 -0.55 -1.32 0.00 0.00 176.35 174.62 1lr5 s SER 26 N -2.58 2.25 -0.03 3.68 0.15 -0.40 -3.55 113.70 113.21 1lr5 s SER 26 Ca 0.37 -0.46 0.06 0.00 0.70 0.00 0.00 55.95 56.62 1lr5 s SER 26 Cb -0.13 -0.51 -0.02 0.00 -1.71 0.00 0.00 66.02 63.66 1lr5 s SER 26 CO 0.27 -0.25 -0.22 -2.28 1.20 0.00 0.00 173.24 171.96 1lr5 s HIS 27 N 1.93 2.45 -0.06 3.44 2.46 0.07 -0.99 115.29 124.59 1lr5 s HIS 27 Ca 0.02 -0.39 0.02 0.00 0.47 0.00 0.00 55.06 55.18 1lr5 s HIS 27 Cb -0.15 -1.55 0.02 0.00 -0.13 0.00 0.00 32.58 30.77 1lr5 s HIS 27 CO -0.07 0.00 -0.09 0.42 -2.47 0.00 0.00 174.74 172.53 1lr5 s ILE 28 N -0.58 0.91 -0.58 0.89 1.01 -0.49 -1.93 121.20 120.42 1lr5 s ILE 28 Ca 0.09 -0.34 -0.23 0.00 0.00 0.00 0.00 60.65 60.16 1lr5 s ILE 28 Cb -0.11 -0.86 0.05 0.00 0.01 0.00 0.00 42.46 41.56 1lr5 s ILE 28 CO 0.00 0.30 0.91 -0.89 0.00 0.00 0.00 174.94 175.27 1lr5 s THR 29 N 0.76 4.42 0.10 2.92 2.01 -1.26 -0.81 115.64 123.78 1lr5 s THR 29 Ca -0.13 0.03 -0.14 0.00 0.31 0.00 0.00 61.69 61.75 1lr5 s THR 29 Cb -0.15 -4.55 -0.09 0.00 0.01 0.00 0.00 72.50 67.71 1lr5 s THR 29 CO 0.02 -1.17 1.40 0.58 -0.69 0.00 0.00 174.62 174.76 1lr5 h VAL 30 N 5.99 1.30 -1.31 3.82 2.07 -1.20 -3.43 116.25 123.48 1lr5 h VAL 30 Ca -0.27 -1.56 -0.02 0.00 0.82 0.00 0.00 66.70 65.66 1lr5 h VAL 30 Cb 1.07 1.64 -0.24 0.00 -1.52 0.00 0.00 31.29 32.24 1lr5 h VAL 30 CO 1.10 0.50 -0.39 0.00 0.02 0.00 0.00 177.57 178.80 1lr5 s ALA 31 N -4.24 -1.87 0.32 1.67 0.00 -1.04 -4.98 121.76 111.63 1lr5 s ALA 31 Ca -0.12 1.18 0.03 0.00 0.00 0.00 0.00 51.96 53.05 1lr5 s ALA 31 Cb 0.09 -2.14 -0.04 0.00 0.00 0.00 0.00 23.12 21.03 1lr5 s ALA 31 CO 0.85 -1.51 0.14 0.20 0.00 0.00 0.00 175.76 175.43 1lr5 s GLY 32 N 2.73 2.11 0.02 0.00 0.00 -1.26 -0.36 107.32 110.55 1lr5 s GLY 32 Ca 0.15 -1.72 -0.10 0.00 0.00 0.00 0.00 44.72 43.04 1lr5 s GLY 32 CO -0.23 -1.65 1.12 0.00 0.00 0.00 0.00 173.10 172.34 1lr5 h ALA 33 N 2.16 -1.06 -0.05 3.20 0.00 -1.85 -1.01 119.26 120.64 1lr5 h ALA 33 Ca -0.35 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 1lr5 h ALA 33 Cb 1.25 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1lr5 h ALA 33 CO 0.56 -1.03 -0.60 -0.07 0.00 0.00 0.00 179.25 178.10 1lr5 h LEU 34 N -0.39 0.21 0.03 0.00 3.38 -1.95 0.46 115.31 117.05 1lr5 h LEU 34 Ca -0.04 -0.12 -0.24 0.00 0.09 0.00 0.00 57.88 57.58 1lr5 h LEU 34 Cb 0.29 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1lr5 h LEU 34 CO 0.06 0.76 -1.15 0.78 0.09 0.00 0.00 178.44 178.98 1lr5 h ASN 35 N 0.14 0.11 0.00 -0.43 2.35 -1.86 -3.40 115.58 112.48 1lr5 h ASN 35 Ca -0.01 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 1lr5 h ASN 35 Cb 1.10 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.43 1lr5 h ASN 35 CO 0.09 1.10 0.00 1.41 -1.65 0.00 0.00 177.43 178.38 1lr5 n HIS 36 N -3.36 0.00 -0.80 1.19 8.25 -0.54 -1.40 115.22 118.56 1lr5 n HIS 36 Ca -0.04 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 1lr5 n HIS 36 Cb 0.97 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.08 1lr5 n HIS 36 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lr5 n GLY 37 N -0.04 0.59 3.74 -1.41 0.00 0.15 -4.90 105.19 103.31 1lr5 n GLY 37 Ca 0.00 -0.10 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 1lr5 n GLY 37 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1lr5 s MET 38 N -0.37 2.59 0.00 1.61 -1.94 -0.50 -4.87 119.30 115.83 1lr5 s MET 38 Ca 0.00 1.97 0.00 0.00 -1.71 0.00 0.00 55.69 55.95 1lr5 s MET 38 Cb 0.00 -1.86 0.00 0.00 2.01 0.00 0.00 34.83 34.98 1lr5 s MET 38 CO 0.00 -1.54 0.00 1.63 -0.01 0.00 0.00 175.02 175.10 1lr5 n LYS 39 N -1.94 1.29 0.00 2.03 5.02 -1.26 -3.78 118.16 119.51 1lr5 n LYS 39 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 1lr5 n LYS 39 Cb 0.49 -0.92 0.00 0.00 -0.02 0.00 0.00 35.03 34.58 1lr5 n LYS 39 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1lr5 n GLU 40 N -1.33 2.68 -4.03 1.97 1.02 -1.26 -4.39 120.64 115.30 1lr5 n GLU 40 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.05 1lr5 n GLU 40 Cb 0.06 -0.97 -0.11 0.00 -0.02 0.00 0.00 31.44 30.40 1lr5 n GLU 40 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1lr5 s VAL 41 N -1.91 0.20 -0.06 2.62 -7.23 -1.26 -2.24 120.40 110.52 1lr5 s VAL 41 Ca 0.00 -1.25 -0.05 0.00 -1.81 0.00 0.00 61.98 58.87 1lr5 s VAL 41 Cb 0.00 -0.74 0.02 0.00 0.56 0.00 0.00 36.38 36.22 1lr5 s VAL 41 CO 0.00 -0.66 0.15 -0.70 -0.31 0.00 0.00 175.10 173.58 1lr5 s GLU 42 N -2.33 0.17 -0.09 4.82 2.12 -0.79 -4.74 118.70 117.86 1lr5 s GLU 42 Ca -0.07 0.24 0.04 0.00 0.36 0.00 0.00 54.97 55.53 1lr5 s GLU 42 Cb -0.04 0.05 0.00 0.00 0.26 0.00 0.00 34.13 34.40 1lr5 s GLU 42 CO -0.04 -0.04 -0.22 0.08 -0.54 0.00 0.00 175.26 174.50 1lr5 s VAL 43 N 0.24 1.87 0.20 3.70 1.01 0.51 -0.77 120.40 127.17 1lr5 s VAL 43 Ca -0.01 -0.91 0.10 0.00 0.00 0.00 0.00 61.98 61.16 1lr5 s VAL 43 Cb -0.03 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1lr5 s VAL 43 CO -0.01 0.52 -0.17 0.26 0.00 0.00 0.00 175.10 175.70 1lr5 s TRP 44 N 0.40 2.44 -0.14 5.22 0.51 0.69 -0.63 118.94 127.43 1lr5 s TRP 44 Ca -0.18 -0.30 0.01 0.00 -2.12 0.00 0.00 56.10 53.51 1lr5 s TRP 44 Cb -0.17 -1.18 0.02 0.00 -0.81 0.00 0.00 33.47 31.33 1lr5 s TRP 44 CO 0.08 0.54 -0.16 -1.17 -0.51 0.00 0.00 176.95 175.73 1lr5 s LEU 45 N -2.89 1.77 0.01 2.99 2.96 0.01 -0.21 118.68 123.32 1lr5 s LEU 45 Ca 0.24 -0.50 0.04 0.00 -0.22 0.00 0.00 54.13 53.69 1lr5 s LEU 45 Cb -0.08 -1.21 -0.01 0.00 0.50 0.00 0.00 46.19 45.39 1lr5 s LEU 45 CO 0.13 -0.02 -0.13 -1.10 -1.32 0.00 0.00 176.35 173.91 1lr5 s GLN 46 N 1.31 0.93 -0.07 1.98 -0.21 0.10 -1.40 119.66 122.29 1lr5 s GLN 46 Ca 0.02 -0.58 0.04 0.00 0.02 0.00 0.00 55.36 54.86 1lr5 s GLN 46 Cb -0.13 -0.90 -0.01 0.00 1.00 0.00 0.00 33.01 32.96 1lr5 s GLN 46 CO -0.08 0.24 -0.21 0.99 -2.12 0.00 0.00 175.29 174.10 1lr5 s THR 47 N -0.57 2.43 -0.12 -0.19 2.01 -0.16 -0.76 115.64 118.27 1lr5 s THR 47 Ca 0.03 -0.93 0.03 0.00 0.31 0.00 0.00 61.69 61.13 1lr5 s THR 47 Cb -0.06 -1.92 0.01 0.00 0.01 0.00 0.00 72.50 70.53 1lr5 s THR 47 CO 0.00 0.57 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.66 1lr5 s ILE 48 N -0.17 1.96 0.69 1.82 1.01 0.13 -1.28 121.20 125.35 1lr5 s ILE 48 Ca -0.02 -0.93 -0.13 0.00 0.00 0.00 0.00 60.65 59.56 1lr5 s ILE 48 Cb -0.14 -1.72 0.01 0.00 0.01 0.00 0.00 42.46 40.62 1lr5 s ILE 48 CO 0.04 0.53 1.09 -0.94 0.00 0.00 0.00 174.94 175.66 1lr5 s SER 49 N 0.70 5.03 0.08 3.58 1.04 0.20 -1.70 113.70 122.63 1lr5 s SER 49 Ca -0.11 1.90 -0.37 0.00 0.48 0.00 0.00 55.95 57.85 1lr5 s SER 49 Cb -0.16 -2.54 -0.17 0.00 0.10 0.00 0.00 66.02 63.26 1lr5 s SER 49 CO 0.01 -1.68 1.37 -2.65 0.98 0.00 0.00 173.24 171.27 1lr5 n PRO 50 N -2.75 1.19 -0.44 4.02 -0.02 -1.26 -1.56 135.00 134.18 1lr5 n PRO 50 Ca 0.10 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1lr5 n PRO 50 Cb 0.52 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1lr5 n PRO 50 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lr5 n GLY 51 N 2.63 1.97 3.94 -1.23 0.00 0.65 -4.97 105.19 108.17 1lr5 n GLY 51 Ca 0.19 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 1lr5 n GLY 51 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1lr5 s GLN 52 N -0.03 3.23 0.05 1.61 -1.52 -0.60 -4.73 119.66 117.67 1lr5 s GLN 52 Ca 0.00 -0.35 0.00 0.00 -1.95 0.00 0.00 55.36 53.06 1lr5 s GLN 52 Cb 0.00 -2.56 -0.03 0.00 -0.22 0.00 0.00 33.01 30.20 1lr5 s GLN 52 CO 0.00 -0.16 -0.04 1.03 -0.25 0.00 0.00 175.29 175.87 1lr5 s ARG 53 N -4.52 0.53 0.57 2.91 0.52 -1.26 0.22 118.95 117.92 1lr5 s ARG 53 Ca 0.46 -0.97 -0.14 0.00 -0.52 0.00 0.00 55.73 54.56 1lr5 s ARG 53 Cb -0.10 0.04 -0.06 0.00 0.52 0.00 0.00 34.95 35.35 1lr5 s ARG 53 CO 0.38 -0.05 1.01 0.95 0.02 0.00 0.00 175.30 177.61 1lr5 s THR 54 N -2.69 4.55 1.07 0.02 -4.23 -0.56 -4.98 115.64 108.81 1lr5 s THR 54 Ca -0.02 1.04 -0.12 0.00 -1.18 0.00 0.00 61.69 61.40 1lr5 s THR 54 Cb -0.01 -3.75 0.21 0.00 1.34 0.00 0.00 72.50 70.28 1lr5 s THR 54 CO -0.05 -0.88 0.93 -2.65 -0.54 0.00 0.00 174.62 171.43 1lr5 n PRO 55 N -2.16 -1.53 -2.63 3.99 -0.02 -1.26 -4.54 135.00 126.84 1lr5 n PRO 55 Ca 0.06 -0.40 -0.42 0.00 -2.02 0.00 0.00 63.50 60.72 1lr5 n PRO 55 Cb 0.54 -2.18 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 1lr5 n PRO 55 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1lr5 s ILE 56 N -2.47 4.65 0.31 4.25 1.01 -1.26 -4.56 121.20 123.13 1lr5 s ILE 56 Ca 0.66 1.93 -0.14 0.00 0.00 0.00 0.00 60.65 63.10 1lr5 s ILE 56 Cb -0.23 -4.24 0.02 0.00 0.01 0.00 0.00 42.46 38.02 1lr5 s ILE 56 CO 0.63 0.01 0.63 -1.38 0.00 0.00 0.00 174.94 174.83 1lr5 s HIS 57 N 1.99 0.26 0.18 3.97 -3.43 -0.16 -1.06 115.29 117.03 1lr5 s HIS 57 Ca 0.50 -0.71 0.01 0.00 -0.80 0.00 0.00 55.06 54.06 1lr5 s HIS 57 Cb -0.20 0.46 -0.04 0.00 -1.43 0.00 0.00 32.58 31.37 1lr5 s HIS 57 CO 0.20 -1.24 0.04 -0.98 -2.00 0.00 0.00 174.74 170.76 1lr5 s ARG 58 N -3.39 1.11 -0.23 -0.38 1.70 -0.46 -1.18 118.95 116.11 1lr5 s ARG 58 Ca 0.19 -1.55 -0.24 0.00 -0.47 0.00 0.00 55.73 53.66 1lr5 s ARG 58 Cb -0.03 -0.10 0.07 0.00 -0.57 0.00 0.00 34.95 34.31 1lr5 s ARG 58 CO 0.11 -0.21 0.67 -3.38 -1.08 0.00 0.00 175.30 171.41 1lr5 s HIS 59 N -3.81 -0.72 -1.41 5.89 -3.43 -1.26 -1.18 115.29 109.37 1lr5 s HIS 59 Ca 0.27 1.73 -0.13 0.00 -0.80 0.00 0.00 55.06 56.13 1lr5 s HIS 59 Cb 0.07 0.26 0.07 0.00 -1.43 0.00 0.00 32.58 31.55 1lr5 s HIS 59 CO 0.05 -0.37 2.12 0.45 -2.00 0.00 0.00 174.74 174.99 1lr5 n SER 60 N 2.58 4.20 -3.62 7.38 2.88 -1.26 -1.70 113.62 124.07 1lr5 n SER 60 Ca -0.14 -2.90 -0.07 0.00 -1.33 0.00 0.00 58.87 54.43 1lr5 n SER 60 Cb 0.55 -1.63 -0.02 0.00 -0.75 0.00 0.00 64.21 62.37 1lr5 n SER 60 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1lr5 s GLU 62 N -3.31 3.86 -0.13 0.00 2.02 -1.26 -4.31 118.70 115.56 1lr5 s GLU 62 Ca 0.08 0.69 -0.05 0.00 0.02 0.00 0.00 54.97 55.71 1lr5 s GLU 62 Cb -0.02 -2.28 0.06 0.00 0.10 0.00 0.00 34.13 32.00 1lr5 s GLU 62 CO -0.04 -0.14 0.27 -2.00 0.02 0.00 0.00 175.26 173.38 1lr5 s GLU 63 N -3.94 0.19 -0.09 1.61 2.12 -1.26 -1.71 118.70 115.62 1lr5 s GLU 63 Ca 0.55 0.69 0.03 0.00 0.36 0.00 0.00 54.97 56.60 1lr5 s GLU 63 Cb -0.10 -0.05 0.00 0.00 0.26 0.00 0.00 34.13 34.25 1lr5 s GLU 63 CO 0.31 -0.23 -0.21 0.08 -0.54 0.00 0.00 175.26 174.67 1lr5 s VAL 64 N 1.94 1.81 -0.08 3.70 1.01 0.07 -0.09 120.40 128.76 1lr5 s VAL 64 Ca -0.04 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.08 1lr5 s VAL 64 Cb -0.11 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 1lr5 s VAL 64 CO -0.09 0.51 -0.08 -0.36 0.00 0.00 0.00 175.10 175.08 1lr5 s PHE 65 N 0.45 2.91 -0.12 5.22 0.40 -0.11 -0.28 117.98 126.46 1lr5 s PHE 65 Ca -0.17 -0.07 0.00 0.00 -0.60 0.00 0.00 56.93 56.10 1lr5 s PHE 65 Cb -0.17 -1.73 0.02 0.00 0.51 0.00 0.00 43.02 41.65 1lr5 s PHE 65 CO 0.07 0.25 -0.12 0.95 0.70 0.00 0.00 175.22 177.07 1lr5 s THR 66 N -0.62 1.31 -0.37 0.64 -4.23 0.29 -1.63 115.64 111.03 1lr5 s THR 66 Ca 0.09 -0.48 -0.26 0.00 -1.18 0.00 0.00 61.69 59.86 1lr5 s THR 66 Cb -0.12 -1.25 0.01 0.00 1.34 0.00 0.00 72.50 72.49 1lr5 s THR 66 CO 0.02 0.41 0.92 -0.69 -0.54 0.00 0.00 174.62 174.74 1lr5 s VAL 67 N 1.42 4.59 -0.04 2.29 1.01 -0.10 -1.13 120.40 128.44 1lr5 s VAL 67 Ca 0.01 1.18 -0.03 0.00 0.00 0.00 0.00 61.98 63.14 1lr5 s VAL 67 Cb -0.13 -4.33 -0.27 0.00 0.00 0.00 0.00 36.38 31.65 1lr5 s VAL 67 CO -0.07 -0.53 0.67 -0.07 0.00 0.00 0.00 175.10 175.11 1lr5 h LEU 68 N 10.05 0.39 -7.64 3.92 3.38 -0.98 0.33 115.31 124.76 1lr5 h LEU 68 Ca -0.23 -0.64 -0.12 0.00 0.09 0.00 0.00 57.88 56.97 1lr5 h LEU 68 Cb 1.08 -0.13 -0.19 0.00 0.09 0.00 0.00 40.66 41.51 1lr5 h LEU 68 CO 0.98 1.55 -0.36 -0.54 0.09 0.00 0.00 178.44 180.16 1lr5 s LYS 69 N -2.59 0.64 1.47 1.13 1.02 -1.05 -4.71 119.74 115.65 1lr5 s LYS 69 Ca -0.13 -0.40 0.00 0.00 0.02 0.00 0.00 55.97 55.46 1lr5 s LYS 69 Cb 0.07 0.27 0.00 0.00 -0.52 0.00 0.00 37.83 37.65 1lr5 s LYS 69 CO 0.83 -0.18 0.00 0.41 -0.92 0.00 0.00 175.35 175.49 1lr5 n GLY 70 N 1.09 -1.70 3.51 -3.33 0.00 -1.25 -0.87 105.19 102.64 1lr5 n GLY 70 Ca -0.21 -1.33 -0.12 0.00 0.00 0.00 0.00 46.02 44.36 1lr5 n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lr5 s LYS 71 N 0.00 1.69 0.00 1.61 1.02 -1.26 -1.60 119.74 121.19 1lr5 s LYS 71 Ca 0.00 -1.51 0.00 0.00 0.02 0.00 0.00 55.97 54.48 1lr5 s LYS 71 Cb 0.00 0.44 0.00 0.00 -0.52 0.00 0.00 37.83 37.75 1lr5 s LYS 71 CO 0.00 -0.69 0.00 0.41 -0.92 0.00 0.00 175.35 174.15 1lr5 n GLY 72 N -0.45 -1.01 2.89 -3.33 0.00 -0.85 -4.37 105.19 98.08 1lr5 n GLY 72 Ca -0.00 -0.80 -0.22 0.00 0.00 0.00 0.00 46.02 45.00 1lr5 n GLY 72 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lr5 s THR 73 N -3.00 0.67 -0.20 2.61 2.01 -0.68 -0.82 115.64 116.23 1lr5 s THR 73 Ca 0.00 -0.16 -0.17 0.00 0.31 0.00 0.00 61.69 61.67 1lr5 s THR 73 Cb 0.00 -0.70 -0.04 0.00 0.01 0.00 0.00 72.50 71.77 1lr5 s THR 73 CO 0.00 0.27 0.44 -0.22 -0.69 0.00 0.00 174.62 174.42 1lr5 s LEU 74 N 1.17 4.16 -0.23 4.42 2.96 -0.36 -1.20 118.68 129.60 1lr5 s LEU 74 Ca -0.07 0.58 -0.07 0.00 -0.22 0.00 0.00 54.13 54.36 1lr5 s LEU 74 Cb -0.14 -2.58 -0.03 0.00 0.50 0.00 0.00 46.19 43.94 1lr5 s LEU 74 CO -0.01 -0.10 0.05 -0.76 -1.32 0.00 0.00 176.35 174.20 1lr5 s LEU 75 N 1.36 3.39 -0.10 -0.68 1.43 -0.16 -0.67 118.68 123.26 1lr5 s LEU 75 Ca 0.21 -0.20 0.04 0.00 -1.03 0.00 0.00 54.13 53.15 1lr5 s LEU 75 Cb -0.15 -1.89 0.00 0.00 0.03 0.00 0.00 46.19 44.18 1lr5 s LEU 75 CO 0.09 0.00 -0.24 -0.04 0.23 0.00 0.00 176.35 176.39 1lr5 s MET 76 N 1.39 3.00 0.06 1.70 -1.94 -0.71 -1.25 119.30 121.55 1lr5 s MET 76 Ca 0.05 -0.87 0.01 0.00 -1.71 0.00 0.00 55.69 53.17 1lr5 s MET 76 Cb -0.15 -2.27 0.01 0.00 2.01 0.00 0.00 34.83 34.42 1lr5 s MET 76 CO 0.03 0.18 0.05 0.41 -0.01 0.00 0.00 175.02 175.67 1lr5 n GLY 77 N 3.51 3.07 3.81 -0.03 0.00 0.72 -0.87 105.19 115.40 1lr5 n GLY 77 Ca -0.19 -2.19 -0.38 0.00 0.00 0.00 0.00 46.02 43.26 1lr5 n GLY 77 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1lr5 s SER 78 N -1.38 7.05 -0.00 1.61 0.15 0.12 -4.48 113.70 116.77 1lr5 s SER 78 Ca 0.03 1.28 0.20 0.00 0.70 0.00 0.00 55.95 58.17 1lr5 s SER 78 Cb -0.00 -2.36 -0.23 0.00 -1.71 0.00 0.00 66.02 61.72 1lr5 s SER 78 CO 0.02 0.22 0.86 -1.54 1.20 0.00 0.00 173.24 174.01 1lr5 n SER 79 N 1.48 0.95 0.01 5.45 3.41 -1.26 -4.21 113.62 119.45 1lr5 n SER 79 Ca -0.09 -0.96 -0.12 0.00 -0.26 0.00 0.00 58.87 57.44 1lr5 n SER 79 Cb 0.51 1.03 -0.14 0.00 -0.26 0.00 0.00 64.21 65.35 1lr5 n SER 79 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1lr5 h SER 80 N 0.00 0.16 -3.80 4.04 4.64 -1.92 -3.46 113.55 113.20 1lr5 h SER 80 Ca 0.00 -0.29 -0.44 0.00 -0.47 0.00 0.00 61.79 60.60 1lr5 h SER 80 Cb 0.50 -0.05 0.17 0.00 -0.31 0.00 0.00 62.40 62.71 1lr5 h SER 80 CO 0.00 1.25 0.20 -0.76 -0.87 0.00 0.00 176.83 176.65 1lr5 s LEU 81 N -6.53 1.38 0.00 5.97 1.43 -1.26 -4.94 118.68 114.74 1lr5 s LEU 81 Ca -0.08 0.87 0.29 0.00 -1.03 0.00 0.00 54.13 54.19 1lr5 s LEU 81 Cb 0.08 -2.90 1.34 0.00 0.03 0.00 0.00 46.19 44.74 1lr5 s LEU 81 CO 0.82 -3.40 1.93 0.29 0.23 0.00 0.00 176.35 176.22 1lr5 n LYS 82 N -4.31 0.75 -4.00 1.70 4.76 -1.26 -4.81 118.16 110.99 1lr5 n LYS 82 Ca 0.09 -0.21 -0.08 0.00 -2.87 0.00 0.00 58.31 55.24 1lr5 n LYS 82 Cb 0.59 -1.50 -0.09 0.00 -1.84 0.00 0.00 35.03 32.19 1lr5 n LYS 82 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 1lr5 s TYR 83 N -2.40 0.38 0.12 2.13 -0.85 -1.26 -0.65 117.35 114.81 1lr5 s TYR 83 Ca 0.32 -0.87 -0.19 0.00 -0.52 0.00 0.00 57.07 55.81 1lr5 s TYR 83 Cb 0.20 -0.25 -0.06 0.00 0.38 0.00 0.00 41.96 42.23 1lr5 s TYR 83 CO 0.45 -0.46 1.73 -1.35 -1.52 0.00 0.00 175.55 174.40 1lr5 h PRO 84 N 2.97 0.34 0.00 -3.49 0.11 -1.69 -3.41 132.00 126.83 1lr5 h PRO 84 Ca -0.34 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1lr5 h PRO 84 Cb 1.17 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1lr5 h PRO 84 CO 0.61 0.29 0.00 0.41 -0.21 0.00 0.00 178.00 179.10 1lr5 n GLY 85 N -0.99 -0.60 3.66 -0.55 0.00 -0.16 0.13 105.19 106.67 1lr5 n GLY 85 Ca -0.03 -1.72 -0.45 0.00 0.00 0.00 0.00 46.02 43.82 1lr5 n GLY 85 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1lr5 n GLN 86 N -0.65 1.91 -3.01 1.61 -0.06 -1.26 -4.74 117.38 111.17 1lr5 n GLN 86 Ca 0.00 0.68 -0.30 0.00 -2.00 0.00 0.00 57.00 55.38 1lr5 n GLN 86 Cb 0.00 -2.32 -0.03 0.00 -4.06 0.00 0.00 30.24 23.83 1lr5 n GLN 86 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 1lr5 s PRO 87 N -0.35 3.76 0.35 3.69 0.04 -1.26 -4.88 135.00 136.35 1lr5 s PRO 87 Ca 0.69 0.36 -0.26 0.00 0.04 0.00 0.00 61.00 61.84 1lr5 s PRO 87 Cb -0.68 -2.46 -0.09 0.00 0.04 0.00 0.00 34.50 31.30 1lr5 s PRO 87 CO 0.50 0.05 1.04 -0.65 0.04 0.00 0.00 177.00 177.98 1lr5 s GLN 88 N -3.68 4.39 -0.25 4.56 -0.21 -0.05 -4.84 119.66 119.58 1lr5 s GLN 88 Ca 0.50 1.57 -0.01 0.00 0.02 0.00 0.00 55.36 57.43 1lr5 s GLN 88 Cb -0.10 -2.80 0.03 0.00 1.00 0.00 0.00 33.01 31.14 1lr5 s GLN 88 CO 0.30 0.05 -0.07 -1.21 -2.12 0.00 0.00 175.29 172.24 1lr5 s GLU 89 N -2.07 2.76 -0.28 2.91 2.02 -1.26 -1.73 118.70 121.04 1lr5 s GLU 89 Ca 0.52 -1.03 0.01 0.00 0.02 0.00 0.00 54.97 54.50 1lr5 s GLU 89 Cb -0.25 -2.96 0.06 0.00 0.10 0.00 0.00 34.13 31.08 1lr5 s GLU 89 CO 0.31 -0.42 -0.05 0.42 0.02 0.00 0.00 175.26 175.54 1lr5 s ILE 90 N 1.30 2.46 0.56 -1.63 1.09 0.16 -4.96 121.20 120.18 1lr5 s ILE 90 Ca -0.01 -1.64 -0.21 0.00 -1.10 0.00 0.00 60.65 57.69 1lr5 s ILE 90 Cb -0.17 -2.48 -0.04 0.00 -1.06 0.00 0.00 42.46 38.70 1lr5 s ILE 90 CO -0.05 -0.13 1.35 -0.81 -0.10 0.00 0.00 174.94 175.21 1lr5 n PRO 91 N 4.48 1.61 -4.17 2.79 -0.04 -1.26 -1.23 135.00 137.18 1lr5 n PRO 91 Ca -0.12 0.60 -0.10 0.00 -0.04 0.00 0.00 63.50 63.84 1lr5 n PRO 91 Cb 0.42 -2.57 -0.10 0.00 -0.04 0.00 0.00 33.50 31.21 1lr5 n PRO 91 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1lr5 s PHE 92 N -1.30 0.89 0.26 0.54 -0.12 -0.00 -4.85 117.98 113.39 1lr5 s PHE 92 Ca 0.73 -1.10 -0.01 0.00 -0.05 0.00 0.00 56.93 56.51 1lr5 s PHE 92 Cb -0.41 -0.53 0.00 0.00 -0.63 0.00 0.00 43.02 41.46 1lr5 s PHE 92 CO 0.48 -0.36 0.35 1.97 -0.05 0.00 0.00 175.22 177.61 1lr5 n PHE 93 N -0.09 -1.12 -1.74 3.49 1.16 -1.26 -2.00 117.46 115.90 1lr5 n PHE 93 Ca -0.08 -1.79 -0.42 0.00 -1.87 0.00 0.00 57.45 53.28 1lr5 n PHE 93 Cb 0.63 0.39 -0.01 0.00 -1.61 0.00 0.00 39.48 38.87 1lr5 n PHE 93 CO 0.00 0.00 0.00 0.94 -1.87 0.00 0.00 176.76 175.83 1lr5 n GLN 94 N -0.44 2.51 -2.39 3.97 7.27 -0.63 -2.17 117.38 125.51 1lr5 n GLN 94 Ca 0.01 0.89 -0.10 0.00 0.07 0.00 0.00 57.00 57.86 1lr5 n GLN 94 Cb 0.44 -2.61 0.01 0.00 2.41 0.00 0.00 30.24 30.49 1lr5 n GLN 94 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 1lr5 n ASN 95 N 1.48 -3.56 -4.80 1.69 5.15 0.11 -5.02 115.26 110.31 1lr5 n ASN 95 Ca 0.06 -0.07 -0.23 0.00 -0.60 0.00 0.00 54.58 53.75 1lr5 n ASN 95 Cb 0.36 -2.66 -0.06 0.00 -0.53 0.00 0.00 39.78 36.90 1lr5 n ASN 95 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1lr5 s THR 96 N -2.66 2.48 0.03 -0.44 -4.23 -0.92 -4.93 115.64 104.97 1lr5 s THR 96 Ca 0.07 -1.55 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 1lr5 s THR 96 Cb -0.03 -3.00 -0.02 0.00 1.34 0.00 0.00 72.50 70.79 1lr5 s THR 96 CO 0.08 -0.01 -0.04 0.28 -0.54 0.00 0.00 174.62 174.40 1lr5 s THR 97 N -2.54 0.20 -0.17 3.99 -1.32 -1.26 -0.93 115.64 113.62 1lr5 s THR 97 Ca 0.44 -1.10 -0.17 0.00 -1.21 0.00 0.00 61.69 59.65 1lr5 s THR 97 Cb 0.01 -0.54 0.05 0.00 -1.51 0.00 0.00 72.50 70.50 1lr5 s THR 97 CO 0.25 -0.57 0.48 0.72 -2.21 0.00 0.00 174.62 173.29 1lr5 s PHE 98 N -1.89 -0.52 -0.12 9.09 -0.12 -0.65 -5.00 117.98 118.78 1lr5 s PHE 98 Ca -0.11 1.23 -0.00 0.00 -0.05 0.00 0.00 56.93 58.00 1lr5 s PHE 98 Cb -0.07 0.18 -0.02 0.00 -0.63 0.00 0.00 43.02 42.48 1lr5 s PHE 98 CO -0.02 -0.28 -0.09 0.45 -0.05 0.00 0.00 175.22 175.23 1lr5 s SER 99 N 0.11 4.36 -0.24 1.98 0.15 -1.26 -0.94 113.70 117.86 1lr5 s SER 99 Ca -0.01 -0.20 -0.15 0.00 0.70 0.00 0.00 55.95 56.29 1lr5 s SER 99 Cb -0.03 -1.48 -0.04 0.00 -1.71 0.00 0.00 66.02 62.76 1lr5 s SER 99 CO 0.01 0.23 0.39 -0.63 1.20 0.00 0.00 173.24 174.44 1lr5 s ILE 100 N -0.00 5.18 0.39 6.45 -1.09 0.87 -4.99 121.20 128.00 1lr5 s ILE 100 Ca -0.02 0.65 -0.26 0.00 -2.23 0.00 0.00 60.65 58.79 1lr5 s ILE 100 Cb -0.14 -3.72 -0.11 0.00 -1.58 0.00 0.00 42.46 36.91 1lr5 s ILE 100 CO 0.03 0.20 1.20 -2.65 -1.23 0.00 0.00 174.94 172.49 1lr5 n PRO 101 N 4.95 1.83 -1.63 2.79 -0.02 -1.26 -4.00 135.00 137.67 1lr5 n PRO 101 Ca -0.08 0.65 -0.51 0.00 -2.02 0.00 0.00 63.50 61.54 1lr5 n PRO 101 Cb 0.51 -2.26 -0.06 0.00 -0.02 0.00 0.00 33.50 31.67 1lr5 n PRO 101 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1lr5 n VAL 102 N -0.07 0.06 -0.74 -1.45 0.31 -1.26 -1.47 118.33 113.71 1lr5 n VAL 102 Ca 0.07 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1lr5 n VAL 102 Cb 0.38 -1.09 0.00 0.00 -0.91 0.00 0.00 33.84 32.22 1lr5 n VAL 102 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1lr5 n ASN 103 N 3.24 0.00 -4.76 4.52 5.03 -0.69 -4.96 115.26 117.64 1lr5 n ASN 103 Ca 0.19 0.00 -0.40 0.00 0.87 0.00 0.00 54.58 55.24 1lr5 n ASN 103 Cb 0.21 -0.89 -0.04 0.00 -1.02 0.00 0.00 39.78 38.04 1lr5 n ASN 103 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1lr5 s ASP 104 N -2.69 7.14 0.15 6.41 1.11 -0.54 -4.64 116.67 123.61 1lr5 s ASP 104 Ca 0.00 2.38 -0.30 0.00 0.18 0.00 0.00 52.55 54.81 1lr5 s ASP 104 Cb 0.00 -2.63 -0.08 0.00 1.07 0.00 0.00 42.92 41.28 1lr5 s ASP 104 CO 0.00 -0.25 1.27 -2.16 1.18 0.00 0.00 175.17 175.22 1lr5 s PRO 105 N -1.52 4.41 0.22 8.23 0.04 -1.26 -4.52 135.00 140.60 1lr5 s PRO 105 Ca 0.46 1.95 -0.17 0.00 0.04 0.00 0.00 61.00 63.28 1lr5 s PRO 105 Cb -0.34 -3.25 0.02 0.00 0.04 0.00 0.00 34.50 30.97 1lr5 s PRO 105 CO 0.44 -0.25 0.55 -3.38 0.04 0.00 0.00 177.00 174.41 1lr5 s HIS 106 N 0.47 -0.02 -0.11 0.56 -3.43 -0.33 -0.20 115.29 112.23 1lr5 s HIS 106 Ca 0.58 -0.35 -0.10 0.00 -0.80 0.00 0.00 55.06 54.38 1lr5 s HIS 106 Cb -0.34 0.41 0.03 0.00 -1.43 0.00 0.00 32.58 31.25 1lr5 s HIS 106 CO 0.34 -1.00 0.30 -1.14 -2.00 0.00 0.00 174.74 171.24 1lr5 s GLN 107 N -3.92 0.34 -0.17 -0.38 0.74 -0.38 -0.99 119.66 114.90 1lr5 s GLN 107 Ca 0.13 0.44 -0.06 0.00 0.05 0.00 0.00 55.36 55.92 1lr5 s GLN 107 Cb -0.02 0.14 -0.03 0.00 1.10 0.00 0.00 33.01 34.19 1lr5 s GLN 107 CO 0.02 -0.06 0.01 0.08 -0.55 0.00 0.00 175.29 174.80 1lr5 s VAL 108 N 0.30 4.31 -0.11 1.34 1.01 -1.26 -0.98 120.40 125.01 1lr5 s VAL 108 Ca -0.01 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 61.79 1lr5 s VAL 108 Cb -0.03 -2.92 0.01 0.00 0.00 0.00 0.00 36.38 33.43 1lr5 s VAL 108 CO -0.01 0.47 -0.20 0.86 0.00 0.00 0.00 175.10 176.22 1lr5 s TRP 109 N 0.44 2.36 -0.89 5.22 -0.00 -0.34 -1.50 118.94 124.23 1lr5 s TRP 109 Ca -0.00 -1.08 -0.25 0.00 -0.00 0.00 0.00 56.10 54.77 1lr5 s TRP 109 Cb -0.13 -1.62 0.04 0.00 -0.00 0.00 0.00 33.47 31.75 1lr5 s TRP 109 CO 0.02 -0.49 1.40 1.21 -0.00 0.00 0.00 176.95 179.09 1lr5 s ASN 110 N 0.69 6.30 0.00 5.86 3.04 0.13 -1.69 114.94 129.28 1lr5 s ASN 110 Ca -0.11 -0.99 0.31 0.00 0.04 0.00 0.00 52.86 52.11 1lr5 s ASN 110 Cb -0.16 -2.56 1.77 0.00 -1.54 0.00 0.00 41.25 38.75 1lr5 s ASN 110 CO 0.02 -1.69 2.16 -1.54 -3.04 0.00 0.00 177.10 173.01 1lr5 n SER 111 N 9.30 0.00 -4.76 -4.21 3.41 -1.26 -0.26 113.62 115.85 1lr5 n SER 111 Ca 0.21 -0.70 -0.39 0.00 -0.26 0.00 0.00 58.87 57.72 1lr5 n SER 111 Cb 0.50 -0.10 -0.06 0.00 -0.26 0.00 0.00 64.21 64.30 1lr5 n SER 111 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1lr5 s ASP 112 N -2.20 7.48 0.04 4.04 -1.08 -1.26 -4.81 116.67 118.88 1lr5 s ASP 112 Ca 0.41 2.01 0.22 0.00 -0.52 0.00 0.00 52.55 54.68 1lr5 s ASP 112 Cb 0.21 -2.61 -0.19 0.00 -1.46 0.00 0.00 42.92 38.87 1lr5 s ASP 112 CO 0.40 0.03 0.73 -0.62 0.52 0.00 0.00 175.17 176.23 1lr5 n GLU 113 N 1.22 0.55 -0.05 4.34 1.02 -1.26 -2.25 120.64 124.21 1lr5 n GLU 113 Ca -0.01 -0.08 -0.16 0.00 -0.02 0.00 0.00 57.16 56.89 1lr5 n GLU 113 Cb 0.47 -1.60 -0.14 0.00 -0.02 0.00 0.00 31.44 30.15 1lr5 n GLU 113 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 1lr5 n HIS 114 N -2.26 0.70 -3.93 -0.32 -0.00 -1.26 -4.89 115.22 103.26 1lr5 n HIS 114 Ca -0.02 0.18 -0.09 0.00 0.46 0.00 0.00 57.72 58.26 1lr5 n HIS 114 Cb 0.53 -1.10 -0.08 0.00 -0.12 0.00 0.00 29.99 29.22 1lr5 n HIS 114 CO 0.00 0.00 0.00 -1.83 0.46 0.00 0.00 176.34 174.97 1lr5 s GLU 115 N -2.55 0.85 0.63 1.57 -1.05 -1.26 -5.04 118.70 111.85 1lr5 s GLU 115 Ca -0.20 -1.06 -0.18 0.00 -0.15 0.00 0.00 54.97 53.38 1lr5 s GLU 115 Cb 0.07 0.32 -0.02 0.00 -0.44 0.00 0.00 34.13 34.06 1lr5 s GLU 115 CO 0.75 -0.26 1.21 -0.51 0.95 0.00 0.00 175.26 177.40 1lr5 s ASP 116 N -2.90 4.96 -0.22 0.83 1.01 -1.26 -4.44 116.67 114.65 1lr5 s ASP 116 Ca 0.08 2.38 -0.06 0.00 0.71 0.00 0.00 52.55 55.66 1lr5 s ASP 116 Cb 0.05 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.36 1lr5 s ASP 116 CO -0.09 -1.75 0.04 -0.22 0.21 0.00 0.00 175.17 173.36 1lr5 s LEU 117 N -4.34 3.44 -0.13 1.23 2.96 -0.69 -3.90 118.68 117.25 1lr5 s LEU 117 Ca 0.77 -0.15 0.02 0.00 -0.22 0.00 0.00 54.13 54.55 1lr5 s LEU 117 Cb -0.30 -1.89 0.01 0.00 0.50 0.00 0.00 46.19 44.51 1lr5 s LEU 117 CO 0.36 0.05 -0.20 -1.58 -1.32 0.00 0.00 176.35 173.67 1lr5 s GLN 118 N 1.11 2.72 0.04 1.98 0.74 -0.05 0.20 119.66 126.40 1lr5 s GLN 118 Ca 0.03 -0.74 0.06 0.00 0.05 0.00 0.00 55.36 54.76 1lr5 s GLN 118 Cb -0.14 -2.22 -0.02 0.00 1.10 0.00 0.00 33.01 31.72 1lr5 s GLN 118 CO 0.03 -0.03 -0.17 0.14 -0.55 0.00 0.00 175.29 174.71 1lr5 s VAL 119 N 0.86 1.38 -0.18 1.34 -7.23 0.06 -0.28 120.40 116.35 1lr5 s VAL 119 Ca -0.07 -1.07 -0.13 0.00 -1.81 0.00 0.00 61.98 58.90 1lr5 s VAL 119 Cb -0.15 -1.21 -0.05 0.00 0.56 0.00 0.00 36.38 35.53 1lr5 s VAL 119 CO -0.01 0.12 0.25 -0.22 -0.31 0.00 0.00 175.10 174.93 1lr5 s LEU 120 N -1.10 4.22 -0.05 1.32 2.96 -0.28 -0.72 118.68 125.03 1lr5 s LEU 120 Ca 0.05 0.41 0.06 0.00 -0.22 0.00 0.00 54.13 54.42 1lr5 s LEU 120 Cb -0.08 -2.29 -0.01 0.00 0.50 0.00 0.00 46.19 44.31 1lr5 s LEU 120 CO 0.01 0.11 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.24 1lr5 s VAL 121 N 0.52 1.80 -0.07 1.68 1.01 0.71 -0.55 120.40 125.50 1lr5 s VAL 121 Ca 0.14 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.23 1lr5 s VAL 121 Cb -0.13 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.73 1lr5 s VAL 121 CO 0.02 0.51 -0.19 -0.63 0.00 0.00 0.00 175.10 174.81 1lr5 s ILE 122 N -0.12 1.62 0.24 2.22 1.01 0.62 -0.22 121.20 126.57 1lr5 s ILE 122 Ca -0.03 -0.78 0.11 0.00 0.00 0.00 0.00 60.65 59.96 1lr5 s ILE 122 Cb -0.12 -1.41 -0.05 0.00 0.01 0.00 0.00 42.46 40.88 1lr5 s ILE 122 CO 0.03 0.46 -0.21 0.27 0.00 0.00 0.00 174.94 175.49 1lr5 s ILE 123 N 0.36 2.35 0.53 2.92 -4.36 0.05 -0.75 121.20 122.30 1lr5 s ILE 123 Ca -0.13 -2.25 0.03 0.00 -0.26 0.00 0.00 60.65 58.04 1lr5 s ILE 123 Cb -0.16 -2.20 0.04 0.00 1.25 0.00 0.00 42.46 41.39 1lr5 s ILE 123 CO 0.05 -0.32 0.74 -0.94 0.24 0.00 0.00 174.94 174.71 1lr5 s SER 124 N -3.19 5.30 -1.21 4.36 1.04 -0.70 -1.88 113.70 117.43 1lr5 s SER 124 Ca 0.26 -0.17 -0.32 0.00 0.48 0.00 0.00 55.95 56.19 1lr5 s SER 124 Cb -0.06 -0.71 0.04 0.00 0.10 0.00 0.00 66.02 65.39 1lr5 s SER 124 CO 0.12 -1.10 0.69 0.54 0.98 0.00 0.00 173.24 174.47 1lr5 n ARG 125 N -2.25 -0.41 -1.85 4.02 1.74 -0.95 -4.63 116.66 112.33 1lr5 n ARG 125 Ca 0.09 0.14 -0.31 0.00 -0.77 0.00 0.00 57.85 57.00 1lr5 n ARG 125 Cb 0.60 -2.80 0.03 0.00 -1.02 0.00 0.00 32.46 29.27 1lr5 n ARG 125 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1lr5 s PRO 126 N -7.21 3.17 0.75 5.56 0.04 -1.26 -4.61 135.00 131.43 1lr5 s PRO 126 Ca 0.49 0.62 -0.12 0.00 0.04 0.00 0.00 61.00 62.04 1lr5 s PRO 126 Cb -0.25 -2.04 0.04 0.00 0.04 0.00 0.00 34.50 32.28 1lr5 s PRO 126 CO 0.96 -0.85 1.11 -1.25 0.04 0.00 0.00 177.00 177.01 1lr5 s PRO 127 N -5.25 2.52 0.32 0.56 0.04 -1.26 -4.87 135.00 127.05 1lr5 s PRO 127 Ca 0.57 0.42 -0.29 0.00 0.04 0.00 0.00 61.00 61.74 1lr5 s PRO 127 Cb -0.11 -1.99 -0.11 0.00 0.04 0.00 0.00 34.50 32.33 1lr5 s PRO 127 CO 0.53 -1.27 1.45 0.00 0.04 0.00 0.00 177.00 177.75 1lr5 s ALA 128 N -3.36 3.59 -0.57 8.56 0.00 -1.26 -4.99 121.76 123.74 1lr5 s ALA 128 Ca 0.59 1.43 0.02 0.00 0.00 0.00 0.00 51.96 54.01 1lr5 s ALA 128 Cb -0.12 -3.57 0.14 0.00 0.00 0.00 0.00 23.12 19.58 1lr5 s ALA 128 CO 0.52 -0.86 0.33 0.15 0.00 0.00 0.00 175.76 175.90 1lr5 s LYS 129 N -1.36 2.21 -0.14 0.00 -0.14 -1.26 -4.57 119.74 114.47 1lr5 s LYS 129 Ca 0.55 -2.63 -0.13 0.00 -1.36 0.00 0.00 55.97 52.40 1lr5 s LYS 129 Cb -0.44 -3.47 -0.05 0.00 -1.68 0.00 0.00 37.83 32.20 1lr5 s LYS 129 CO 0.53 -1.14 0.27 0.42 -0.76 0.00 0.00 175.35 174.67 1lr5 s ILE 130 N -0.28 5.31 -0.17 2.17 1.01 -1.26 -4.17 121.20 123.80 1lr5 s ILE 130 Ca 0.17 0.49 -0.06 0.00 0.00 0.00 0.00 60.65 61.26 1lr5 s ILE 130 Cb -0.23 -3.59 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 1lr5 s ILE 130 CO -0.02 0.45 0.01 -0.36 0.00 0.00 0.00 174.94 175.03 1lr5 s PHE 131 N 0.05 3.13 -0.13 3.97 0.40 -0.33 -0.70 117.98 124.36 1lr5 s PHE 131 Ca 0.16 -0.15 -0.07 0.00 -0.60 0.00 0.00 56.93 56.27 1lr5 s PHE 131 Cb -0.13 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.33 1lr5 s PHE 131 CO 0.04 0.02 0.12 -0.51 0.70 0.00 0.00 175.22 175.59 1lr5 s LEU 132 N 0.45 4.23 -0.08 -0.37 1.43 0.12 -1.35 118.68 123.11 1lr5 s LEU 132 Ca -0.00 0.37 -0.02 0.00 -1.03 0.00 0.00 54.13 53.44 1lr5 s LEU 132 Cb -0.13 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 1lr5 s LEU 132 CO 0.02 0.36 0.03 -0.31 0.23 0.00 0.00 176.35 176.67 1lr5 s TYR 133 N -0.71 3.23 -0.25 0.29 1.51 -0.23 -0.95 117.35 120.23 1lr5 s TYR 133 Ca 0.13 0.24 0.22 0.00 -1.01 0.00 0.00 57.07 56.65 1lr5 s TYR 133 Cb -0.12 -1.80 0.43 0.00 -0.11 0.00 0.00 41.96 40.36 1lr5 s TYR 133 CO 0.03 0.51 1.63 0.38 -1.11 0.00 0.00 175.55 176.99 1lr5 h ASP 134 N 5.06 0.00 -4.98 2.29 3.04 -1.94 -3.38 116.42 116.50 1lr5 h ASP 134 Ca -0.51 0.00 0.12 0.00 -3.24 0.00 0.00 57.03 53.40 1lr5 h ASP 134 Cb 1.20 0.00 -0.11 0.00 -1.04 0.00 0.00 39.33 39.37 1lr5 h ASP 134 CO 0.55 0.15 0.44 -0.62 -2.04 0.00 0.00 179.24 177.72 1lr5 s ASP 135 N -6.22 -0.31 0.62 4.15 2.15 -1.26 -5.02 116.67 110.79 1lr5 s ASP 135 Ca 0.05 -0.21 0.36 0.00 0.43 0.00 0.00 52.55 53.18 1lr5 s ASP 135 Cb 0.07 0.48 2.03 0.00 -0.30 0.00 0.00 42.92 45.19 1lr5 s ASP 135 CO 0.67 -0.83 2.29 -0.50 -0.17 0.00 0.00 175.17 176.63 1lr5 h TRP 136 N 2.00 0.00 0.00 -5.34 4.06 -1.91 -1.76 115.95 113.00 1lr5 h TRP 136 Ca -0.24 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.71 1lr5 h TRP 136 Cb 1.25 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.41 1lr5 h TRP 136 CO 0.32 0.01 0.00 -1.13 -3.56 0.00 0.00 178.44 174.07 1lr5 n SER 137 N -3.52 0.76 -4.73 -3.49 3.41 -1.26 -0.99 113.62 103.80 1lr5 n SER 137 Ca -0.03 0.61 -0.42 0.00 -0.26 0.00 0.00 58.87 58.78 1lr5 n SER 137 Cb 0.09 -0.80 -0.03 0.00 -0.26 0.00 0.00 64.21 63.21 1lr5 n SER 137 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 1lr5 s MET 138 N -3.19 4.38 0.57 4.33 0.00 -0.67 -4.84 119.30 119.88 1lr5 s MET 138 Ca 0.08 2.02 -0.21 0.00 0.00 0.00 0.00 55.69 57.58 1lr5 s MET 138 Cb 0.11 -3.23 -0.04 0.00 0.00 0.00 0.00 34.83 31.67 1lr5 s MET 138 CO 0.52 -0.30 1.32 -2.14 0.00 0.00 0.00 175.02 174.41 1lr5 s PRO 139 N 0.40 3.03 0.35 4.11 0.02 -1.26 -4.13 135.00 137.52 1lr5 s PRO 139 Ca 0.59 2.12 0.06 0.00 0.02 0.00 0.00 61.00 63.79 1lr5 s PRO 139 Cb -0.36 -2.14 0.73 0.00 0.02 0.00 0.00 34.50 32.75 1lr5 s PRO 139 CO 0.34 -1.25 1.94 0.45 -0.33 0.00 0.00 177.00 178.16 1lr5 h HIS 140 N 1.23 0.80 0.00 6.54 3.86 -1.25 -0.96 115.15 125.37 1lr5 h HIS 140 Ca -0.51 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 58.72 1lr5 h HIS 140 Cb 1.31 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 29.51 1lr5 h HIS 140 CO 0.45 0.41 0.00 1.79 0.86 0.00 0.00 177.93 181.44 1lr5 h THR 141 N 0.78 0.00 0.00 2.45 1.35 -1.89 -2.78 112.91 112.82 1lr5 h THR 141 Ca 0.33 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 1lr5 h THR 141 Cb 0.30 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 67.65 1lr5 h THR 141 CO -0.12 0.00 -1.39 0.00 -0.25 0.00 0.00 175.52 173.76 1lr5 n ALA 142 N -1.85 3.89 -1.69 6.62 0.00 -0.38 -4.99 120.51 122.12 1lr5 n ALA 142 Ca 0.01 -0.55 -0.39 0.00 0.00 0.00 0.00 53.44 52.51 1lr5 n ALA 142 Cb 0.18 -0.78 0.04 0.00 0.00 0.00 0.00 19.45 18.89 1lr5 n ALA 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lr5 n ALA 143 N -1.82 1.04 -2.85 0.00 0.00 -1.05 -4.94 120.51 110.89 1lr5 n ALA 143 Ca 0.01 0.10 -0.34 0.00 0.00 0.00 0.00 53.44 53.21 1lr5 n ALA 143 Cb 0.43 -2.26 -0.11 0.00 0.00 0.00 0.00 19.45 17.51 1lr5 n ALA 143 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1lr5 s VAL 144 N -1.35 4.04 0.12 0.00 1.01 -0.13 -4.78 120.40 119.32 1lr5 s VAL 144 Ca 0.72 -0.32 -0.30 0.00 0.00 0.00 0.00 61.98 62.08 1lr5 s VAL 144 Cb -0.43 -2.75 -0.07 0.00 0.00 0.00 0.00 36.38 33.13 1lr5 s VAL 144 CO 0.49 0.52 1.25 -0.22 0.00 0.00 0.00 175.10 177.15 1lr5 s LEU 145 N -0.01 4.40 -0.51 3.92 2.96 -1.26 0.11 118.68 128.29 1lr5 s LEU 145 Ca 0.02 2.19 0.03 0.00 -0.22 0.00 0.00 54.13 56.15 1lr5 s LEU 145 Cb -0.13 -3.59 0.14 0.00 0.50 0.00 0.00 46.19 43.10 1lr5 s LEU 145 CO 0.02 -0.49 0.27 -0.75 -1.32 0.00 0.00 176.35 174.09 1lr5 s LYS 146 N 0.59 1.79 -0.06 1.98 2.47 0.12 -4.95 119.74 121.69 1lr5 s LYS 146 Ca 0.58 -2.49 -0.00 0.00 -1.56 0.00 0.00 55.97 52.50 1lr5 s LYS 146 Cb -0.33 -3.00 0.02 0.00 -1.46 0.00 0.00 37.83 33.07 1lr5 s LYS 146 CO 0.32 -1.14 -0.02 0.12 0.16 0.00 0.00 175.35 174.79 1lr5 s PHE 147 N -0.19 0.72 0.62 4.03 5.36 -1.26 -3.04 117.98 124.22 1lr5 s PHE 147 Ca 0.18 -0.20 -0.17 0.00 -0.96 0.00 0.00 56.93 55.78 1lr5 s PHE 147 Cb -0.23 -0.73 -0.02 0.00 -0.34 0.00 0.00 43.02 41.69 1lr5 s PHE 147 CO -0.02 -0.26 1.17 -1.25 -1.46 0.00 0.00 175.22 173.40 1lr5 s PRO 148 N 1.42 2.89 0.87 10.12 0.04 -1.26 -5.14 135.00 143.94 1lr5 s PRO 148 Ca -0.03 1.66 -0.12 0.00 0.04 0.00 0.00 61.00 62.55 1lr5 s PRO 148 Cb -0.13 -1.94 0.11 0.00 0.04 0.00 0.00 34.50 32.58 1lr5 s PRO 148 CO -0.03 -1.23 1.10 0.12 0.04 0.00 0.00 177.00 177.00 1lr5 s PHE 149 N -1.87 2.54 0.29 0.56 2.19 -1.17 -4.68 117.98 115.84 1lr5 s PHE 149 Ca 0.73 1.11 0.03 0.00 0.33 0.00 0.00 56.93 59.13 1lr5 s PHE 149 Cb -0.26 -3.20 0.64 0.00 -1.31 0.00 0.00 43.02 38.89 1lr5 s PHE 149 CO 0.35 -2.19 1.80 -0.39 1.83 0.00 0.00 175.22 176.62 1lr5 h VAL 150 N -1.39 0.79 0.00 3.12 -1.51 -1.93 -0.38 116.25 114.96 1lr5 h VAL 150 Ca -0.49 -0.29 0.00 0.00 -1.23 0.00 0.00 66.70 64.69 1lr5 h VAL 150 Cb 1.29 -0.12 0.00 0.00 -2.13 0.00 0.00 31.29 30.34 1lr5 h VAL 150 CO 0.58 0.15 0.00 -2.67 -1.23 0.00 0.00 177.57 174.40 1lr5 n TRP 151 N -4.73 0.00 0.43 5.19 2.14 -1.26 -3.33 117.44 115.88 1lr5 n TRP 151 Ca 0.21 0.00 0.04 0.00 2.07 0.00 0.00 57.50 59.82 1lr5 n TRP 151 Cb 0.47 -0.07 -0.04 0.00 -0.81 0.00 0.00 31.31 30.87 1lr5 n TRP 151 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 1lr5 n ASP 152 N -1.07 0.63 -0.27 -0.67 8.00 -0.21 -4.73 116.55 118.23 1lr5 n ASP 152 Ca 0.21 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.90 1lr5 n ASP 152 Cb 0.13 0.86 0.13 0.00 -0.02 0.00 0.00 41.12 42.23 1lr5 n ASP 152 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1lr5 h GLU 153 N 0.28 0.78 -0.16 -1.24 4.81 -1.39 -0.60 114.58 117.06 1lr5 h GLU 153 Ca 0.00 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1lr5 h GLU 153 Cb 0.24 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1lr5 h GLU 153 CO 0.00 0.51 0.04 -0.44 -0.73 0.00 0.00 179.01 178.39 1lr5 h ASP 154 N 0.80 0.23 0.17 1.04 5.19 -1.85 -1.35 116.42 120.66 1lr5 h ASP 154 Ca 0.35 -0.22 -0.14 0.00 -0.62 0.00 0.00 57.03 56.40 1lr5 h ASP 154 Cb 0.24 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 1lr5 h ASP 154 CO -0.20 0.39 -0.50 0.00 -3.12 0.00 0.00 179.24 175.82 1lr5 h PHE 156 N 0.30 0.65 -0.34 0.00 3.57 -0.95 0.14 116.94 120.30 1lr5 h PHE 156 Ca 0.01 -0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.39 1lr5 h PHE 156 Cb 0.98 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 1lr5 h PHE 156 CO 0.03 0.54 -0.11 0.93 -2.23 0.00 0.00 178.31 177.47 1lr5 h GLU 157 N 0.56 0.67 -0.69 1.11 4.39 -1.13 -3.06 114.58 116.44 1lr5 h GLU 157 Ca 0.15 -0.27 0.09 0.00 0.34 0.00 0.00 59.36 59.67 1lr5 h GLU 157 Cb 0.15 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 1lr5 h GLU 157 CO -0.02 0.85 0.45 0.00 -1.16 0.00 0.00 179.01 179.14 1lr5 h ALA 158 N 0.80 1.86 0.00 3.43 0.00 -0.74 -1.51 119.26 123.10 1lr5 h ALA 158 Ca 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1lr5 h ALA 158 Cb 0.62 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1lr5 h ALA 158 CO 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 179.25 179.26 1lr5 h ALA 159 N 1.65 1.07 0.00 0.00 0.00 -0.62 -3.51 119.26 117.85 1lr5 h ALA 159 Ca 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1lr5 h ALA 159 Cb 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1lr5 h ALA 159 CO -0.10 0.04 0.00 1.63 0.00 0.00 0.00 179.25 180.82