#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 1.45 4.07 0.26 0.00 1.01 -1.26 -4.96 120.40 120.98 1lr5 s VAL 3 Ca 0.02 -1.28 -0.19 0.00 0.00 0.00 0.00 61.98 60.54 1lr5 s VAL 3 Cb -0.17 -3.42 -0.09 0.00 0.00 0.00 0.00 36.38 32.71 1lr5 s VAL 3 CO 0.00 -0.37 0.75 -0.13 0.00 0.00 0.00 175.10 175.35 1lr5 s ARG 4 N 1.42 4.19 -0.30 2.72 0.52 -1.26 -4.79 118.95 121.45 1lr5 s ARG 4 Ca 0.02 0.84 -0.09 0.00 -0.52 0.00 0.00 55.73 55.98 1lr5 s ARG 4 Cb -0.21 -2.72 0.17 0.00 0.52 0.00 0.00 34.95 32.71 1lr5 s ARG 4 CO 0.03 0.31 0.84 0.34 0.02 0.00 0.00 175.30 176.83 1lr5 s ASP 5 N -1.85 -0.88 -0.14 0.23 3.68 -0.36 -5.02 116.67 112.32 1lr5 s ASP 5 Ca 0.47 0.74 0.17 0.00 2.13 0.00 0.00 52.55 56.06 1lr5 s ASP 5 Cb -0.15 1.81 0.74 0.00 -1.45 0.00 0.00 42.92 43.88 1lr5 s ASP 5 CO 0.20 -0.17 1.66 -0.46 0.13 0.00 0.00 175.17 176.53 1lr5 n ASN 6 N 5.36 4.99 -4.73 -0.34 2.04 -1.26 -4.37 115.26 116.95 1lr5 n ASN 6 Ca -0.06 -2.57 -0.42 0.00 -0.44 0.00 0.00 54.58 51.09 1lr5 n ASN 6 Cb 0.52 -0.60 -0.01 0.00 -2.53 0.00 0.00 39.78 37.16 1lr5 n ASN 6 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62 1lr5 n SER 7 N 0.97 3.32 0.16 0.53 7.64 -1.26 -4.92 113.62 120.06 1lr5 n SER 7 Ca 0.26 1.20 -0.14 0.00 1.01 0.00 0.00 58.87 61.20 1lr5 n SER 7 Cb 0.97 -1.55 -0.08 0.00 -1.01 0.00 0.00 64.21 62.54 1lr5 n SER 7 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1lr5 h LEU 8 N 3.22 -0.31 -8.78 -3.43 5.85 -2.01 -3.40 115.31 106.45 1lr5 h LEU 8 Ca -0.48 -0.06 -0.64 0.00 0.84 0.00 0.00 57.88 57.54 1lr5 h LEU 8 Cb 1.26 0.08 -0.21 0.00 0.37 0.00 0.00 40.66 42.15 1lr5 h LEU 8 CO 0.67 -0.13 -0.63 -0.69 -0.34 0.00 0.00 178.44 177.32 1lr5 s VAL 9 N -5.70 4.20 0.01 1.05 1.01 -1.26 -5.09 120.40 114.63 1lr5 s VAL 9 Ca -0.15 -0.23 0.06 0.00 0.00 0.00 0.00 61.98 61.67 1lr5 s VAL 9 Cb 0.04 -2.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 1lr5 s VAL 9 CO 0.63 0.42 -0.20 -0.13 0.00 0.00 0.00 175.10 175.82 1lr5 s ARG 10 N 0.96 1.45 -0.43 2.72 0.52 -1.26 -5.10 118.95 117.81 1lr5 s ARG 10 Ca 0.02 -0.80 -0.23 0.00 -0.52 0.00 0.00 55.73 54.21 1lr5 s ARG 10 Cb -0.14 -1.48 0.02 0.00 0.52 0.00 0.00 34.95 33.87 1lr5 s ARG 10 CO 0.02 0.39 0.76 0.34 0.02 0.00 0.00 175.30 176.83 1lr5 s ASP 11 N -0.80 6.41 0.36 0.23 -1.08 -1.26 -4.92 116.67 115.61 1lr5 s ASP 11 Ca 0.07 -0.08 0.06 0.00 -0.52 0.00 0.00 52.55 52.08 1lr5 s ASP 11 Cb -0.08 -2.37 0.75 0.00 -1.46 0.00 0.00 42.92 39.76 1lr5 s ASP 11 CO 0.00 -0.86 1.96 0.40 0.52 0.00 0.00 175.17 177.19 1lr5 h ILE 12 N 5.93 1.02 0.00 4.11 2.04 -1.96 -1.99 117.51 126.65 1lr5 h ILE 12 Ca -0.25 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 1lr5 h ILE 12 Cb 1.09 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1lr5 h ILE 12 CO 0.94 0.14 -0.02 0.77 0.00 0.00 0.00 178.15 179.98 1lr5 h SER 13 N 0.74 0.00 -0.02 1.72 4.64 -2.02 -2.56 113.55 116.05 1lr5 h SER 13 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1lr5 h SER 13 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1lr5 h SER 13 CO -0.10 0.02 -0.17 0.00 -0.87 0.00 0.00 176.83 175.71 1lr5 n GLN 14 N -3.25 1.61 -2.69 4.77 1.13 -0.76 -4.99 117.38 113.20 1lr5 n GLN 14 Ca -0.02 -1.30 -0.33 0.00 -1.94 0.00 0.00 57.00 53.40 1lr5 n GLN 14 Cb 0.15 -1.36 -0.05 0.00 0.11 0.00 0.00 30.24 29.09 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 -1.82 4.04 0.04 -1.09 -1.94 -0.97 -4.97 119.30 112.60 1lr5 s MET 15 Ca 0.19 1.21 -0.36 0.00 -1.71 0.00 0.00 55.69 55.02 1lr5 s MET 15 Cb 0.15 -2.14 -0.16 0.00 2.01 0.00 0.00 34.83 34.69 1lr5 s MET 15 CO 0.34 -0.21 1.47 -2.30 -0.01 0.00 0.00 175.02 174.31 1lr5 n PRO 16 N -0.81 1.41 -5.09 2.03 -0.02 -1.26 -4.99 135.00 126.27 1lr5 n PRO 16 Ca 0.08 0.51 -0.30 0.00 -2.02 0.00 0.00 63.50 61.77 1lr5 n PRO 16 Cb 0.53 -2.20 -0.17 0.00 -0.02 0.00 0.00 33.50 31.65 1lr5 n PRO 16 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1lr5 s GLN 17 N 1.17 2.64 0.11 -0.52 0.74 -1.26 -4.58 119.66 117.96 1lr5 s GLN 17 Ca 0.86 -0.78 -0.11 0.00 0.05 0.00 0.00 55.36 55.37 1lr5 s GLN 17 Cb -0.90 -2.07 0.01 0.00 1.10 0.00 0.00 33.01 31.16 1lr5 s GLN 17 CO 0.48 0.19 0.27 0.45 -0.55 0.00 0.00 175.29 176.12 1lr5 s SER 18 N 0.30 -0.01 0.17 6.67 0.15 -0.76 -4.92 113.70 115.29 1lr5 s SER 18 Ca -0.15 -0.54 0.25 0.00 0.70 0.00 0.00 55.95 56.21 1lr5 s SER 18 Cb -0.16 0.39 0.52 0.00 -1.71 0.00 0.00 66.02 65.06 1lr5 s SER 18 CO 0.07 -0.78 1.51 0.77 1.20 0.00 0.00 173.24 176.00 1lr5 h SER 19 N 2.60 0.00 -5.45 5.45 4.64 -1.88 0.01 113.55 118.93 1lr5 h SER 19 Ca -0.34 -0.12 -0.41 0.00 -0.47 0.00 0.00 61.79 60.45 1lr5 h SER 19 Cb 1.22 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.28 1lr5 h SER 19 CO 0.52 0.06 -0.63 -1.22 -0.87 0.00 0.00 176.83 174.70 1lr5 n TYR 20 N -2.21 -2.00 -0.86 4.77 4.02 -1.26 -0.56 117.16 119.06 1lr5 n TYR 20 Ca 0.04 0.62 0.00 0.00 -0.01 0.00 0.00 57.90 58.55 1lr5 n TYR 20 Cb 0.44 -3.67 0.00 0.00 -0.02 0.00 0.00 39.34 36.09 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 -1.43 0.87 3.53 2.72 0.00 -1.26 -4.99 105.19 104.62 1lr5 n GLY 21 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.36 4.57 0.14 -0.61 1.01 0.28 -5.01 121.20 118.23 1lr5 s ILE 22 Ca 0.00 0.29 -0.35 0.00 0.00 0.00 0.00 60.65 60.60 1lr5 s ILE 22 Cb 0.00 -4.40 -0.15 0.00 0.01 0.00 0.00 42.46 37.92 1lr5 s ILE 22 CO 0.00 -0.88 1.48 -0.62 0.00 0.00 0.00 174.94 174.93 1lr5 n GLU 23 N 6.95 1.81 -0.98 2.79 -0.58 -1.26 -1.97 120.64 127.41 1lr5 n GLU 23 Ca 0.01 0.65 0.00 0.00 -0.42 0.00 0.00 57.16 57.41 1lr5 n GLU 23 Cb 0.48 -2.37 0.00 0.00 -0.57 0.00 0.00 31.44 28.98 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 3.02 0.89 3.91 0.62 0.00 -1.26 -4.90 105.19 107.47 1lr5 n GLY 24 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 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 4.30 -0.08 0.99 2.96 -0.83 -1.07 118.68 124.94 1lr5 s LEU 25 Ca 0.00 0.45 -0.01 0.00 -0.22 0.00 0.00 54.13 54.35 1lr5 s LEU 25 Cb 0.00 -3.16 0.03 0.00 0.50 0.00 0.00 46.19 43.55 1lr5 s LEU 25 CO 0.00 0.09 -0.04 -0.55 -1.32 0.00 0.00 176.35 174.53 1lr5 s SER 26 N -2.55 1.72 -0.02 3.68 0.15 -0.08 -3.78 113.70 112.81 1lr5 s SER 26 Ca 0.38 -0.18 0.04 0.00 0.70 0.00 0.00 55.95 56.90 1lr5 s SER 26 Cb -0.12 -0.60 -0.01 0.00 -1.71 0.00 0.00 66.02 63.58 1lr5 s SER 26 CO 0.26 -0.14 -0.15 -2.28 1.20 0.00 0.00 173.24 172.13 1lr5 s HIS 27 N 1.68 1.45 -0.06 3.44 2.46 -0.01 -0.51 115.29 123.74 1lr5 s HIS 27 Ca 0.02 -0.34 0.02 0.00 0.47 0.00 0.00 55.06 55.23 1lr5 s HIS 27 Cb -0.13 -0.96 0.02 0.00 -0.13 0.00 0.00 32.58 31.38 1lr5 s HIS 27 CO -0.05 -0.08 -0.09 0.42 -2.47 0.00 0.00 174.74 172.47 1lr5 s ILE 28 N -0.15 0.89 -0.50 0.89 1.01 -0.64 -1.83 121.20 120.87 1lr5 s ILE 28 Ca 0.01 -0.33 -0.27 0.00 0.00 0.00 0.00 60.65 60.07 1lr5 s ILE 28 Cb -0.08 -0.85 0.03 0.00 0.01 0.00 0.00 42.46 41.56 1lr5 s ILE 28 CO 0.00 0.31 1.06 -0.89 0.00 0.00 0.00 174.94 175.42 1lr5 s THR 29 N 0.84 4.27 0.08 2.92 2.01 -1.26 -1.02 115.64 123.49 1lr5 s THR 29 Ca -0.12 0.88 -0.16 0.00 0.31 0.00 0.00 61.69 62.60 1lr5 s THR 29 Cb -0.15 -4.57 -0.11 0.00 0.01 0.00 0.00 72.50 67.68 1lr5 s THR 29 CO 0.02 -1.04 1.37 0.58 -0.69 0.00 0.00 174.62 174.86 1lr5 h VAL 30 N 6.14 1.32 -2.00 3.82 2.07 -1.07 -3.44 116.25 123.09 1lr5 h VAL 30 Ca -0.24 -1.49 -0.21 0.00 0.82 0.00 0.00 66.70 65.58 1lr5 h VAL 30 Cb 1.07 1.74 -0.31 0.00 -1.52 0.00 0.00 31.29 32.27 1lr5 h VAL 30 CO 1.10 0.46 -0.53 0.00 0.02 0.00 0.00 177.57 178.62 1lr5 s ALA 31 N -4.23 -0.89 0.24 1.67 0.00 -0.99 -4.98 121.76 112.58 1lr5 s ALA 31 Ca -0.13 0.54 0.01 0.00 0.00 0.00 0.00 51.96 52.38 1lr5 s ALA 31 Cb 0.07 -1.69 -0.04 0.00 0.00 0.00 0.00 23.12 21.46 1lr5 s ALA 31 CO 0.81 -1.38 0.14 0.20 0.00 0.00 0.00 175.76 175.53 1lr5 s GLY 32 N 2.49 1.69 0.03 0.00 0.00 -1.26 -0.56 107.32 109.71 1lr5 s GLY 32 Ca 0.11 -1.78 -0.27 0.00 0.00 0.00 0.00 44.72 42.77 1lr5 s GLY 32 CO -0.20 -1.48 1.30 0.00 0.00 0.00 0.00 173.10 172.73 1lr5 h ALA 33 N 2.46 -1.16 -0.04 3.20 0.00 -1.84 -0.39 119.26 121.49 1lr5 h ALA 33 Ca -0.35 -0.21 -0.20 0.00 0.00 0.00 0.00 54.91 54.14 1lr5 h ALA 33 Cb 1.25 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 19.41 1lr5 h ALA 33 CO 0.53 -1.09 -0.83 -0.07 0.00 0.00 0.00 179.25 177.79 1lr5 h LEU 34 N -1.07 0.51 0.21 0.00 3.38 -1.95 -1.50 115.31 114.90 1lr5 h LEU 34 Ca -0.10 -0.37 -0.32 0.00 0.09 0.00 0.00 57.88 57.18 1lr5 h LEU 34 Cb 0.75 -0.15 0.03 0.00 0.09 0.00 0.00 40.66 41.38 1lr5 h LEU 34 CO 0.16 1.14 -1.41 0.78 0.09 0.00 0.00 178.44 179.21 1lr5 h ASN 35 N 0.26 0.75 0.00 -0.43 2.35 -1.87 -3.42 115.58 113.23 1lr5 h ASN 35 Ca -0.05 -0.79 0.00 0.00 -0.55 0.00 0.00 56.30 54.90 1lr5 h ASN 35 Cb 1.43 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 39.56 1lr5 h ASN 35 CO 0.14 1.62 0.00 1.41 -1.65 0.00 0.00 177.43 178.95 1lr5 n HIS 36 N -3.68 0.00 -0.21 1.19 8.25 -0.21 -1.23 115.22 119.33 1lr5 n HIS 36 Ca -0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 1lr5 n HIS 36 Cb 1.08 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.19 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 0.21 0.79 3.71 -1.41 0.00 -0.56 -4.56 105.19 103.36 1lr5 n GLY 37 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1lr5 n GLY 37 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1lr5 n MET 38 N -2.13 0.92 0.00 1.61 2.81 -1.01 -4.91 117.12 114.40 1lr5 n MET 38 Ca 0.00 0.37 0.00 0.00 -1.81 0.00 0.00 57.70 56.26 1lr5 n MET 38 Cb 0.00 -2.47 0.00 0.00 -0.71 0.00 0.00 33.22 30.04 1lr5 n MET 38 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1lr5 n LYS 39 N -2.03 1.33 0.00 0.03 5.02 -1.26 -4.10 118.16 117.15 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 0.48 -0.93 0.00 0.00 -0.02 0.00 0.00 35.03 34.56 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 -1.41 2.79 -4.06 1.97 1.02 -1.26 -4.43 120.64 115.27 1lr5 n GLU 40 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 1lr5 n GLU 40 Cb 0.09 -0.73 -0.11 0.00 -0.02 0.00 0.00 31.44 30.67 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 -1.06 0.35 -0.10 2.62 -7.23 -1.26 -2.90 120.40 110.82 1lr5 s VAL 41 Ca 0.00 -1.30 -0.08 0.00 -1.81 0.00 0.00 61.98 58.79 1lr5 s VAL 41 Cb 0.00 -0.84 0.03 0.00 0.56 0.00 0.00 36.38 36.13 1lr5 s VAL 41 CO 0.00 -0.62 0.25 -0.70 -0.31 0.00 0.00 175.10 173.72 1lr5 s GLU 42 N -2.35 0.27 -0.11 4.82 2.12 -0.50 -4.68 118.70 118.26 1lr5 s GLU 42 Ca -0.05 0.39 0.02 0.00 0.36 0.00 0.00 54.97 55.69 1lr5 s GLU 42 Cb -0.04 0.08 -0.01 0.00 0.26 0.00 0.00 34.13 34.43 1lr5 s GLU 42 CO -0.03 -0.06 -0.20 0.08 -0.54 0.00 0.00 175.26 174.51 1lr5 s VAL 43 N 0.38 2.44 0.14 3.70 1.01 0.28 -0.91 120.40 127.44 1lr5 s VAL 43 Ca -0.02 -0.88 0.09 0.00 0.00 0.00 0.00 61.98 61.17 1lr5 s VAL 43 Cb -0.04 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.33 1lr5 s VAL 43 CO -0.02 0.55 -0.16 0.26 0.00 0.00 0.00 175.10 175.73 1lr5 s TRP 44 N 0.37 2.56 -0.15 5.22 0.51 0.82 -0.43 118.94 127.84 1lr5 s TRP 44 Ca -0.15 -0.25 0.01 0.00 -2.12 0.00 0.00 56.10 53.59 1lr5 s TRP 44 Cb -0.17 -1.32 0.00 0.00 -0.81 0.00 0.00 33.47 31.17 1lr5 s TRP 44 CO 0.07 0.44 -0.17 -1.17 -0.51 0.00 0.00 176.95 175.60 1lr5 s LEU 45 N -2.38 2.35 -0.00 2.99 2.96 -0.18 -0.87 118.68 123.53 1lr5 s LEU 45 Ca 0.20 -0.52 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 1lr5 s LEU 45 Cb -0.10 -1.52 -0.01 0.00 0.50 0.00 0.00 46.19 45.06 1lr5 s LEU 45 CO 0.12 0.07 -0.08 -1.10 -1.32 0.00 0.00 176.35 174.04 1lr5 s GLN 46 N 0.87 0.65 -0.08 1.98 -0.21 -0.35 -1.63 119.66 120.90 1lr5 s GLN 46 Ca -0.05 -0.32 0.03 0.00 0.02 0.00 0.00 55.36 55.05 1lr5 s GLN 46 Cb -0.15 -0.62 -0.02 0.00 1.00 0.00 0.00 33.01 33.22 1lr5 s GLN 46 CO -0.02 0.17 -0.18 0.99 -2.12 0.00 0.00 175.29 174.13 1lr5 s THR 47 N -0.26 2.63 -0.18 -0.19 2.01 0.33 -1.02 115.64 118.96 1lr5 s THR 47 Ca 0.02 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.18 1lr5 s THR 47 Cb -0.04 -2.03 0.02 0.00 0.01 0.00 0.00 72.50 70.47 1lr5 s THR 47 CO -0.00 0.56 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.69 1lr5 s ILE 48 N -0.15 1.88 0.78 1.82 1.01 0.64 -0.90 121.20 126.28 1lr5 s ILE 48 Ca -0.02 -0.88 -0.11 0.00 0.00 0.00 0.00 60.65 59.63 1lr5 s ILE 48 Cb -0.14 -1.75 0.06 0.00 0.01 0.00 0.00 42.46 40.64 1lr5 s ILE 48 CO 0.04 0.46 1.09 -0.94 0.00 0.00 0.00 174.94 175.59 1lr5 s SER 49 N 1.35 4.61 0.17 3.58 1.04 -0.23 -1.57 113.70 122.64 1lr5 s SER 49 Ca 0.04 1.42 -0.33 0.00 0.48 0.00 0.00 55.95 57.55 1lr5 s SER 49 Cb -0.13 -2.18 -0.15 0.00 0.10 0.00 0.00 66.02 63.66 1lr5 s SER 49 CO -0.12 -1.91 1.33 -2.65 0.98 0.00 0.00 173.24 170.87 1lr5 n PRO 50 N -3.41 1.53 -0.54 4.02 -0.02 -1.26 -1.56 135.00 133.76 1lr5 n PRO 50 Ca 0.07 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1lr5 n PRO 50 Cb 0.55 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 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 2.39 1.43 3.86 -1.23 0.00 0.68 -5.02 105.19 107.30 1lr5 n GLY 51 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.12 3.80 0.04 1.61 -1.52 -0.60 -4.78 119.66 118.09 1lr5 s GLN 52 Ca 0.00 0.67 0.04 0.00 -1.95 0.00 0.00 55.36 54.13 1lr5 s GLN 52 Cb 0.00 -2.25 -0.02 0.00 -0.22 0.00 0.00 33.01 30.52 1lr5 s GLN 52 CO 0.00 -0.22 -0.13 1.03 -0.25 0.00 0.00 175.29 175.73 1lr5 s ARG 53 N -4.20 0.81 0.77 2.91 0.52 -1.26 -0.99 118.95 117.51 1lr5 s ARG 53 Ca 0.54 -0.77 -0.12 0.00 -0.52 0.00 0.00 55.73 54.87 1lr5 s ARG 53 Cb -0.10 -0.79 0.05 0.00 0.52 0.00 0.00 34.95 34.63 1lr5 s ARG 53 CO 0.36 0.19 1.13 0.95 0.02 0.00 0.00 175.30 177.94 1lr5 s THR 54 N -0.98 2.83 0.94 0.02 -4.23 -0.28 -5.00 115.64 108.93 1lr5 s THR 54 Ca -0.01 0.27 -0.11 0.00 -1.18 0.00 0.00 61.69 60.66 1lr5 s THR 54 Cb -0.08 -3.22 0.15 0.00 1.34 0.00 0.00 72.50 70.69 1lr5 s THR 54 CO 0.01 -0.35 1.09 -2.84 -0.54 0.00 0.00 174.62 172.00 1lr5 s PRO 55 N -5.41 0.90 -0.27 3.99 0.02 -1.26 -4.57 135.00 128.41 1lr5 s PRO 55 Ca 0.60 1.07 -0.26 0.00 0.02 0.00 0.00 61.00 62.43 1lr5 s PRO 55 Cb -0.12 -1.75 0.00 0.00 0.02 0.00 0.00 34.50 32.66 1lr5 s PRO 55 CO 0.51 -2.56 0.92 0.42 -0.33 0.00 0.00 177.00 175.96 1lr5 s ILE 56 N -2.76 4.73 0.28 2.83 1.01 -1.26 -4.56 121.20 121.47 1lr5 s ILE 56 Ca 0.65 1.62 -0.08 0.00 0.00 0.00 0.00 60.65 62.84 1lr5 s ILE 56 Cb -0.20 -4.23 -0.01 0.00 0.01 0.00 0.00 42.46 38.03 1lr5 s ILE 56 CO 0.59 -0.22 0.43 -1.38 0.00 0.00 0.00 174.94 174.36 1lr5 s HIS 57 N 3.11 0.70 0.12 3.97 -3.43 -0.10 -0.52 115.29 119.14 1lr5 s HIS 57 Ca 0.38 -1.01 -0.00 0.00 -0.80 0.00 0.00 55.06 53.63 1lr5 s HIS 57 Cb -0.14 0.01 -0.04 0.00 -1.43 0.00 0.00 32.58 30.97 1lr5 s HIS 57 CO 0.10 -1.00 0.02 -0.98 -2.00 0.00 0.00 174.74 170.87 1lr5 s ARG 58 N -3.68 0.89 -0.27 -0.38 1.70 -0.55 -0.90 118.95 115.76 1lr5 s ARG 58 Ca 0.27 -1.40 -0.23 0.00 -0.47 0.00 0.00 55.73 53.90 1lr5 s ARG 58 Cb 0.00 0.11 0.07 0.00 -0.57 0.00 0.00 34.95 34.57 1lr5 s ARG 58 CO 0.13 -0.19 0.70 -3.38 -1.08 0.00 0.00 175.30 171.48 1lr5 s HIS 59 N -3.92 -0.82 -1.29 5.89 -3.43 -1.26 -1.27 115.29 109.18 1lr5 s HIS 59 Ca 0.20 1.93 -0.15 0.00 -0.80 0.00 0.00 55.06 56.24 1lr5 s HIS 59 Cb 0.07 0.33 0.12 0.00 -1.43 0.00 0.00 32.58 31.67 1lr5 s HIS 59 CO -0.01 -0.40 1.74 0.45 -2.00 0.00 0.00 174.74 174.52 1lr5 n SER 60 N 3.01 4.90 -3.67 7.38 2.88 -1.26 -2.48 113.62 124.37 1lr5 n SER 60 Ca -0.15 -2.96 -0.05 0.00 -1.33 0.00 0.00 58.87 54.38 1lr5 n SER 60 Cb 0.56 -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 -3.26 3.80 -0.18 0.00 2.02 -1.26 -4.20 118.70 115.61 1lr5 s GLU 62 Ca 0.10 0.54 -0.07 0.00 0.02 0.00 0.00 54.97 55.56 1lr5 s GLU 62 Cb -0.01 -2.35 0.08 0.00 0.10 0.00 0.00 34.13 31.95 1lr5 s GLU 62 CO -0.01 -0.08 0.39 -2.00 0.02 0.00 0.00 175.26 173.57 1lr5 s GLU 63 N -3.92 0.32 -0.12 1.61 2.12 -1.25 -1.89 118.70 115.57 1lr5 s GLU 63 Ca 0.52 0.93 0.03 0.00 0.36 0.00 0.00 54.97 56.81 1lr5 s GLU 63 Cb -0.10 0.19 0.01 0.00 0.26 0.00 0.00 34.13 34.48 1lr5 s GLU 63 CO 0.32 -0.23 -0.22 0.08 -0.54 0.00 0.00 175.26 174.67 1lr5 s VAL 64 N 2.25 1.98 -0.11 3.70 1.01 -0.20 -0.14 120.40 128.87 1lr5 s VAL 64 Ca -0.04 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 60.94 1lr5 s VAL 64 Cb -0.11 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 1lr5 s VAL 64 CO -0.12 0.54 0.09 -0.36 0.00 0.00 0.00 175.10 175.25 1lr5 s PHE 65 N 0.61 3.45 -0.10 5.22 0.40 -0.39 -0.01 117.98 127.16 1lr5 s PHE 65 Ca -0.13 0.40 0.02 0.00 -0.60 0.00 0.00 56.93 56.62 1lr5 s PHE 65 Cb -0.17 -1.90 0.02 0.00 0.51 0.00 0.00 43.02 41.48 1lr5 s PHE 65 CO 0.03 0.62 -0.13 0.95 0.70 0.00 0.00 175.22 177.40 1lr5 s THR 66 N -0.90 1.32 -0.42 0.64 -4.23 -0.52 -2.06 115.64 109.47 1lr5 s THR 66 Ca 0.14 -0.54 -0.20 0.00 -1.18 0.00 0.00 61.69 59.90 1lr5 s THR 66 Cb -0.12 -1.22 0.02 0.00 1.34 0.00 0.00 72.50 72.52 1lr5 s THR 66 CO 0.03 0.40 0.63 -0.69 -0.54 0.00 0.00 174.62 174.46 1lr5 s VAL 67 N 1.00 4.85 0.05 2.29 1.01 -0.18 -1.04 120.40 128.38 1lr5 s VAL 67 Ca -0.07 0.22 -0.11 0.00 0.00 0.00 0.00 61.98 62.02 1lr5 s VAL 67 Cb -0.15 -4.16 -0.32 0.00 0.00 0.00 0.00 36.38 31.75 1lr5 s VAL 67 CO -0.01 -0.51 1.05 -0.07 0.00 0.00 0.00 175.10 175.55 1lr5 h LEU 68 N 9.58 0.66 -7.42 3.92 3.38 -1.08 -0.35 115.31 123.99 1lr5 h LEU 68 Ca -0.26 -0.71 -0.12 0.00 0.09 0.00 0.00 57.88 56.88 1lr5 h LEU 68 Cb 1.10 -0.21 -0.22 0.00 0.09 0.00 0.00 40.66 41.42 1lr5 h LEU 68 CO 0.87 1.56 -0.25 -0.54 0.09 0.00 0.00 178.44 180.17 1lr5 s LYS 69 N -2.62 0.59 0.94 1.13 1.02 -1.00 -4.66 119.74 115.14 1lr5 s LYS 69 Ca -0.07 0.13 0.00 0.00 0.02 0.00 0.00 55.97 56.05 1lr5 s LYS 69 Cb 0.05 0.27 0.00 0.00 -0.52 0.00 0.00 37.83 37.64 1lr5 s LYS 69 CO 0.92 -0.14 0.00 0.41 -0.92 0.00 0.00 175.35 175.62 1lr5 n GLY 70 N 1.92 -1.99 3.48 -3.33 0.00 -1.25 -0.50 105.19 103.53 1lr5 n GLY 70 Ca -0.18 -1.51 -0.09 0.00 0.00 0.00 0.00 46.02 44.23 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 1.38 0.00 1.61 3.01 -1.26 -1.23 119.74 123.25 1lr5 s LYS 71 Ca 0.00 -1.16 0.00 0.00 -1.01 0.00 0.00 55.97 53.80 1lr5 s LYS 71 Cb 0.00 0.45 0.00 0.00 -1.01 0.00 0.00 37.83 37.27 1lr5 s LYS 71 CO 0.00 -0.55 0.00 0.41 0.51 0.00 0.00 175.35 175.72 1lr5 n GLY 72 N -0.32 0.79 2.93 -3.33 0.00 -0.08 -4.31 105.19 100.87 1lr5 n GLY 72 Ca -0.05 -0.72 -0.21 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.12 0.70 -0.20 2.61 2.01 0.43 -0.94 115.64 118.12 1lr5 s THR 73 Ca 0.00 -0.23 -0.15 0.00 0.31 0.00 0.00 61.69 61.62 1lr5 s THR 73 Cb 0.00 -0.69 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 1lr5 s THR 73 CO 0.00 0.26 0.36 -0.22 -0.69 0.00 0.00 174.62 174.33 1lr5 s LEU 74 N 0.82 4.15 -0.19 4.42 2.96 0.33 -1.34 118.68 129.84 1lr5 s LEU 74 Ca -0.12 0.46 -0.06 0.00 -0.22 0.00 0.00 54.13 54.19 1lr5 s LEU 74 Cb -0.15 -2.45 -0.03 0.00 0.50 0.00 0.00 46.19 44.06 1lr5 s LEU 74 CO 0.01 -0.05 0.01 -0.76 -1.32 0.00 0.00 176.35 174.25 1lr5 s LEU 75 N 1.22 3.41 -0.03 -0.68 1.43 -0.34 0.11 118.68 123.81 1lr5 s LEU 75 Ca 0.17 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 53.17 1lr5 s LEU 75 Cb -0.14 -1.86 0.01 0.00 0.03 0.00 0.00 46.19 44.23 1lr5 s LEU 75 CO 0.07 0.10 -0.05 -0.04 0.23 0.00 0.00 176.35 176.66 1lr5 s MET 76 N 0.78 0.64 0.00 1.70 -1.94 -0.74 -0.77 119.30 118.97 1lr5 s MET 76 Ca 0.01 -0.14 0.00 0.00 -1.71 0.00 0.00 55.69 53.85 1lr5 s MET 76 Cb -0.14 -0.65 0.00 0.00 2.01 0.00 0.00 34.83 36.05 1lr5 s MET 76 CO 0.02 0.01 0.00 0.41 -0.01 0.00 0.00 175.02 175.45 1lr5 n GLY 77 N 3.56 5.10 3.73 -0.03 0.00 0.57 -0.31 105.19 117.80 1lr5 n GLY 77 Ca -0.20 -2.14 -0.30 0.00 0.00 0.00 0.00 46.02 43.38 1lr5 n GLY 77 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lr5 s SER 78 N -0.38 5.23 0.00 1.61 1.04 -0.12 -4.30 113.70 116.78 1lr5 s SER 78 Ca 0.00 -0.12 0.24 0.00 0.48 0.00 0.00 55.95 56.54 1lr5 s SER 78 Cb 0.00 -1.31 0.21 0.00 0.10 0.00 0.00 66.02 65.02 1lr5 s SER 78 CO 0.00 0.16 1.22 -1.54 0.98 0.00 0.00 173.24 174.06 1lr5 n SER 79 N 0.43 1.43 -0.05 7.02 3.41 -1.26 -4.04 113.62 120.56 1lr5 n SER 79 Ca -0.10 -1.13 -0.08 0.00 -0.26 0.00 0.00 58.87 57.30 1lr5 n SER 79 Cb 0.52 0.45 -0.15 0.00 -0.26 0.00 0.00 64.21 64.78 1lr5 n SER 79 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1lr5 n SER 80 N -0.60 0.48 -4.37 4.04 3.41 -1.26 -4.94 113.62 110.38 1lr5 n SER 80 Ca 0.09 0.23 -0.28 0.00 -0.26 0.00 0.00 58.87 58.64 1lr5 n SER 80 Cb 0.40 0.45 0.15 0.00 -0.26 0.00 0.00 64.21 64.96 1lr5 n SER 80 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1lr5 s LEU 81 N -5.78 2.76 0.53 1.04 1.43 -1.26 -4.96 118.68 112.44 1lr5 s LEU 81 Ca -0.07 0.20 0.30 0.00 -1.03 0.00 0.00 54.13 53.53 1lr5 s LEU 81 Cb 0.07 -2.39 1.49 0.00 0.03 0.00 0.00 46.19 45.39 1lr5 s LEU 81 CO 0.83 -2.40 2.06 0.11 0.23 0.00 0.00 176.35 177.19 1lr5 h LYS 82 N -1.29 0.00 -4.74 1.70 1.79 -1.94 -3.44 116.57 108.65 1lr5 h LYS 82 Ca -0.43 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 57.77 1lr5 h LYS 82 Cb 1.26 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.76 1lr5 h LYS 82 CO 0.43 0.10 -0.66 1.52 -1.08 0.00 0.00 179.45 179.76 1lr5 s TYR 83 N -4.04 1.18 0.25 -1.35 -0.85 -1.26 -1.57 117.35 109.71 1lr5 s TYR 83 Ca -0.02 -1.08 -0.04 0.00 -0.52 0.00 0.00 57.07 55.42 1lr5 s TYR 83 Cb 0.12 -0.67 0.44 0.00 0.38 0.00 0.00 41.96 42.23 1lr5 s TYR 83 CO 0.56 -0.28 1.78 -1.35 -1.52 0.00 0.00 175.55 174.74 1lr5 h PRO 84 N 2.70 0.64 0.00 -3.49 0.11 -1.70 -3.43 132.00 126.82 1lr5 h PRO 84 Ca -0.36 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1lr5 h PRO 84 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1lr5 h PRO 84 CO 0.62 0.42 0.00 0.41 -0.21 0.00 0.00 178.00 179.24 1lr5 n GLY 85 N -1.32 -0.58 3.69 -0.55 0.00 -1.02 -0.95 105.19 104.47 1lr5 n GLY 85 Ca 0.14 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.01 1lr5 n GLY 85 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1lr5 s GLN 86 N -1.61 4.17 0.56 1.61 2.00 -1.26 -4.83 119.66 120.29 1lr5 s GLN 86 Ca 0.00 2.47 -0.15 0.00 -2.00 0.00 0.00 55.36 55.69 1lr5 s GLN 86 Cb 0.00 -3.56 -0.06 0.00 0.80 0.00 0.00 33.01 30.19 1lr5 s GLN 86 CO 0.00 -0.78 1.01 -1.25 -0.50 0.00 0.00 175.29 173.77 1lr5 s PRO 87 N 2.57 3.74 0.32 1.67 0.04 -1.26 -4.93 135.00 137.15 1lr5 s PRO 87 Ca 0.77 0.91 -0.27 0.00 0.04 0.00 0.00 61.00 62.45 1lr5 s PRO 87 Cb -0.43 -2.10 -0.09 0.00 0.04 0.00 0.00 34.50 31.91 1lr5 s PRO 87 CO 0.34 -0.44 1.02 -0.65 0.04 0.00 0.00 177.00 177.31 1lr5 s GLN 88 N -4.45 4.52 -0.28 4.56 -0.21 0.58 -4.83 119.66 119.55 1lr5 s GLN 88 Ca 0.58 1.55 0.03 0.00 0.02 0.00 0.00 55.36 57.54 1lr5 s GLN 88 Cb -0.11 -2.92 0.07 0.00 1.00 0.00 0.00 33.01 31.06 1lr5 s GLN 88 CO 0.40 0.17 -0.04 -1.21 -2.12 0.00 0.00 175.29 172.49 1lr5 s GLU 89 N -1.86 1.82 -0.20 2.91 2.02 -1.26 -1.79 118.70 120.34 1lr5 s GLU 89 Ca 0.49 -1.42 -0.03 0.00 0.02 0.00 0.00 54.97 54.04 1lr5 s GLU 89 Cb -0.25 -2.88 -0.01 0.00 0.10 0.00 0.00 34.13 31.10 1lr5 s GLU 89 CO 0.31 -0.71 -0.08 0.42 0.02 0.00 0.00 175.26 175.23 1lr5 s ILE 90 N 1.13 3.15 0.56 -1.63 1.09 0.12 -4.92 121.20 120.68 1lr5 s ILE 90 Ca -0.02 -0.58 -0.21 0.00 -1.10 0.00 0.00 60.65 58.75 1lr5 s ILE 90 Cb -0.19 -2.40 -0.04 0.00 -1.06 0.00 0.00 42.46 38.76 1lr5 s ILE 90 CO -0.07 0.46 1.29 -2.84 -0.10 0.00 0.00 174.94 173.68 1lr5 s PRO 91 N 1.23 3.11 0.09 2.79 0.02 -1.26 -0.51 135.00 140.47 1lr5 s PRO 91 Ca 0.03 2.07 -0.01 0.00 0.02 0.00 0.00 61.00 63.11 1lr5 s PRO 91 Cb -0.14 -2.16 -0.04 0.00 0.02 0.00 0.00 34.50 32.18 1lr5 s PRO 91 CO -0.03 -1.16 0.01 -0.59 -0.33 0.00 0.00 177.00 174.90 1lr5 s PHE 92 N -1.40 0.71 0.35 6.54 -0.12 -0.12 -4.86 117.98 119.09 1lr5 s PHE 92 Ca 0.73 -1.14 -0.00 0.00 -0.05 0.00 0.00 56.93 56.46 1lr5 s PHE 92 Cb -0.37 -0.44 0.00 0.00 -0.63 0.00 0.00 43.02 41.58 1lr5 s PHE 92 CO 0.42 -0.44 0.47 1.97 -0.05 0.00 0.00 175.22 177.59 1lr5 n PHE 93 N 0.00 -1.38 -1.68 3.49 1.16 -1.26 -0.90 117.46 116.88 1lr5 n PHE 93 Ca -0.10 -2.46 -0.43 0.00 -1.87 0.00 0.00 57.45 52.60 1lr5 n PHE 93 Cb 0.62 0.53 -0.01 0.00 -1.61 0.00 0.00 39.48 39.01 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 -0.60 2.04 -2.43 3.97 7.27 -0.36 -2.31 117.38 124.95 1lr5 n GLN 94 Ca 0.02 0.72 -0.17 0.00 0.07 0.00 0.00 57.00 57.64 1lr5 n GLN 94 Cb 0.60 -2.28 0.00 0.00 2.41 0.00 0.00 30.24 30.97 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 0.93 -4.93 -4.87 1.69 5.15 -0.14 -5.01 115.26 108.07 1lr5 n ASN 95 Ca 0.06 -0.06 -0.21 0.00 -0.60 0.00 0.00 54.58 53.77 1lr5 n ASN 95 Cb 0.35 -3.98 -0.03 0.00 -0.53 0.00 0.00 39.78 35.59 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 -2.87 2.60 0.02 -0.44 -4.23 -0.98 -4.91 115.64 104.84 1lr5 s THR 96 Ca 0.05 -1.36 -0.01 0.00 -1.18 0.00 0.00 61.69 59.20 1lr5 s THR 96 Cb -0.02 -2.96 -0.02 0.00 1.34 0.00 0.00 72.50 70.84 1lr5 s THR 96 CO 0.06 0.00 -0.02 0.28 -0.54 0.00 0.00 174.62 174.41 1lr5 s THR 97 N -2.49 0.11 -0.13 3.99 -1.32 -1.26 -1.01 115.64 113.53 1lr5 s THR 97 Ca 0.48 -0.92 -0.13 0.00 -1.21 0.00 0.00 61.69 59.91 1lr5 s THR 97 Cb -0.03 -0.31 0.04 0.00 -1.51 0.00 0.00 72.50 70.68 1lr5 s THR 97 CO 0.28 -0.51 0.36 0.72 -2.21 0.00 0.00 174.62 173.26 1lr5 s PHE 98 N -1.54 -0.39 -0.10 9.09 -0.12 -0.88 -5.01 117.98 119.03 1lr5 s PHE 98 Ca -0.15 0.95 0.02 0.00 -0.05 0.00 0.00 56.93 57.70 1lr5 s PHE 98 Cb -0.09 0.14 -0.01 0.00 -0.63 0.00 0.00 43.02 42.42 1lr5 s PHE 98 CO -0.01 -0.20 -0.17 0.45 -0.05 0.00 0.00 175.22 175.24 1lr5 s SER 99 N 0.13 3.69 -0.33 1.98 0.15 -1.26 -1.26 113.70 116.79 1lr5 s SER 99 Ca -0.01 -0.39 -0.20 0.00 0.70 0.00 0.00 55.95 56.06 1lr5 s SER 99 Cb -0.03 -1.37 -0.00 0.00 -1.71 0.00 0.00 66.02 62.91 1lr5 s SER 99 CO 0.01 0.20 0.60 -0.63 1.20 0.00 0.00 173.24 174.61 1lr5 s ILE 100 N 0.14 4.94 0.49 6.45 -1.09 0.79 -4.99 121.20 127.94 1lr5 s ILE 100 Ca -0.09 0.62 -0.22 0.00 -2.23 0.00 0.00 60.65 58.73 1lr5 s ILE 100 Cb -0.15 -4.01 -0.09 0.00 -1.58 0.00 0.00 42.46 36.63 1lr5 s ILE 100 CO 0.06 -0.22 0.96 -2.65 -1.23 0.00 0.00 174.94 171.86 1lr5 n PRO 101 N 5.90 1.16 -1.69 2.79 -0.02 -1.26 -3.83 135.00 138.05 1lr5 n PRO 101 Ca -0.02 0.43 -0.59 0.00 -2.02 0.00 0.00 63.50 61.30 1lr5 n PRO 101 Cb 0.49 -2.07 -0.08 0.00 -0.02 0.00 0.00 33.50 31.82 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 -0.98 0.19 -0.91 -1.45 0.31 -1.26 -1.44 118.33 112.79 1lr5 n VAL 102 Ca 0.11 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1lr5 n VAL 102 Cb 0.42 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 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 4.51 -1.59 -4.72 4.52 5.03 -1.03 -4.95 115.26 117.03 1lr5 n ASN 103 Ca 0.26 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.29 1lr5 n ASN 103 Cb 0.10 -1.00 -0.03 0.00 -1.02 0.00 0.00 39.78 37.83 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 -2.42 6.91 0.02 6.41 1.11 -0.52 -4.60 116.67 123.59 1lr5 s ASP 104 Ca 0.00 2.25 -0.30 0.00 0.18 0.00 0.00 52.55 54.68 1lr5 s ASP 104 Cb 0.00 -2.59 -0.06 0.00 1.07 0.00 0.00 42.92 41.34 1lr5 s ASP 104 CO 0.00 -0.57 1.46 -2.16 1.18 0.00 0.00 175.17 175.08 1lr5 s PRO 105 N 0.86 4.26 0.19 8.23 0.04 -1.26 -4.53 135.00 142.80 1lr5 s PRO 105 Ca 0.61 2.06 -0.07 0.00 0.04 0.00 0.00 61.00 63.65 1lr5 s PRO 105 Cb -0.35 -3.56 -0.02 0.00 0.04 0.00 0.00 34.50 30.61 1lr5 s PRO 105 CO 0.31 -0.61 0.27 -3.38 0.04 0.00 0.00 177.00 173.64 1lr5 s HIS 106 N 2.39 0.63 -0.09 0.56 -3.43 -0.08 -0.31 115.29 114.96 1lr5 s HIS 106 Ca 0.66 -0.95 -0.07 0.00 -0.80 0.00 0.00 55.06 53.90 1lr5 s HIS 106 Cb -0.34 -0.16 0.03 0.00 -1.43 0.00 0.00 32.58 30.68 1lr5 s HIS 106 CO 0.28 -0.75 0.22 -1.14 -2.00 0.00 0.00 174.74 171.35 1lr5 s GLN 107 N -4.04 0.24 -0.20 -0.38 0.74 0.05 -0.93 119.66 115.15 1lr5 s GLN 107 Ca 0.25 0.35 -0.04 0.00 0.05 0.00 0.00 55.36 55.97 1lr5 s GLN 107 Cb 0.04 0.07 -0.02 0.00 1.10 0.00 0.00 33.01 34.20 1lr5 s GLN 107 CO 0.06 -0.06 -0.04 0.08 -0.55 0.00 0.00 175.29 174.78 1lr5 s VAL 108 N 0.37 3.55 -0.13 1.34 1.01 -1.26 -1.20 120.40 124.09 1lr5 s VAL 108 Ca -0.02 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.54 1lr5 s VAL 108 Cb -0.04 -2.60 0.01 0.00 0.00 0.00 0.00 36.38 33.75 1lr5 s VAL 108 CO -0.02 0.44 -0.21 0.86 0.00 0.00 0.00 175.10 176.17 1lr5 s TRP 109 N 1.12 2.66 -1.00 5.22 -0.00 -0.45 -1.12 118.94 125.37 1lr5 s TRP 109 Ca 0.02 -1.23 -0.21 0.00 -0.00 0.00 0.00 56.10 54.68 1lr5 s TRP 109 Cb -0.15 -1.80 0.08 0.00 -0.00 0.00 0.00 33.47 31.61 1lr5 s TRP 109 CO -0.00 -0.55 1.34 1.21 -0.00 0.00 0.00 176.95 178.95 1lr5 s ASN 110 N 0.70 6.57 0.00 5.86 3.04 -0.16 -0.43 114.94 130.52 1lr5 s ASN 110 Ca -0.10 -1.74 0.08 0.00 0.04 0.00 0.00 52.86 51.14 1lr5 s ASN 110 Cb -0.16 -2.50 0.42 0.00 -1.54 0.00 0.00 41.25 37.47 1lr5 s ASN 110 CO 0.01 -1.31 1.28 -1.54 -3.04 0.00 0.00 177.10 172.50 1lr5 n SER 111 N 7.91 0.20 -4.79 -4.21 3.41 -1.26 -0.23 113.62 114.65 1lr5 n SER 111 Ca 0.30 -1.79 -0.37 0.00 -0.26 0.00 0.00 58.87 56.75 1lr5 n SER 111 Cb 0.50 -0.02 -0.06 0.00 -0.26 0.00 0.00 64.21 64.37 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 -1.22 7.26 0.39 4.04 -1.08 -1.26 -4.84 116.67 119.96 1lr5 s ASP 112 Ca 0.12 1.71 0.25 0.00 -0.52 0.00 0.00 52.55 54.11 1lr5 s ASP 112 Cb 0.06 -2.53 0.57 0.00 -1.46 0.00 0.00 42.92 39.55 1lr5 s ASP 112 CO 0.09 -0.03 1.69 -0.33 0.52 0.00 0.00 175.17 177.11 1lr5 h GLU 113 N 3.28 0.00 0.00 4.34 5.08 -1.96 -3.18 114.58 122.14 1lr5 h GLU 113 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1lr5 h GLU 113 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1lr5 h GLU 113 CO 0.65 0.00 -0.12 1.58 -1.00 0.00 0.00 179.01 180.12 1lr5 n HIS 114 N -2.89 0.00 -4.14 4.33 -0.00 -1.26 -4.89 115.22 106.37 1lr5 n HIS 114 Ca 0.04 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.46 1lr5 n HIS 114 Cb 0.48 0.00 -0.08 0.00 -0.00 0.00 0.00 29.99 30.39 1lr5 n HIS 114 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.34 174.51 1lr5 s GLU 115 N -0.27 2.49 0.42 1.57 -1.05 -1.26 -4.88 118.70 115.72 1lr5 s GLU 115 Ca 0.00 -0.88 -0.25 0.00 -0.15 0.00 0.00 54.97 53.69 1lr5 s GLU 115 Cb 0.00 -2.50 -0.08 0.00 -0.44 0.00 0.00 34.13 31.11 1lr5 s GLU 115 CO 0.00 0.53 1.19 -0.51 0.95 0.00 0.00 175.26 177.42 1lr5 s ASP 116 N -2.36 6.37 -0.25 0.83 1.01 -1.26 -4.29 116.67 116.71 1lr5 s ASP 116 Ca 0.25 2.39 -0.10 0.00 0.71 0.00 0.00 52.55 55.80 1lr5 s ASP 116 Cb -0.11 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 41.15 1lr5 s ASP 116 CO 0.18 -0.79 0.16 -0.22 0.21 0.00 0.00 175.17 174.71 1lr5 s LEU 117 N -2.65 4.02 -0.15 1.23 2.96 -0.61 -3.92 118.68 119.55 1lr5 s LEU 117 Ca 0.59 0.05 0.01 0.00 -0.22 0.00 0.00 54.13 54.56 1lr5 s LEU 117 Cb -0.31 -2.09 0.00 0.00 0.50 0.00 0.00 46.19 44.29 1lr5 s LEU 117 CO 0.39 0.03 -0.18 -1.58 -1.32 0.00 0.00 176.35 173.69 1lr5 s GLN 118 N 1.27 3.12 0.08 1.98 0.74 0.35 -0.26 119.66 126.94 1lr5 s GLN 118 Ca 0.07 -0.79 0.06 0.00 0.05 0.00 0.00 55.36 54.75 1lr5 s GLN 118 Cb -0.14 -2.55 -0.03 0.00 1.10 0.00 0.00 33.01 31.38 1lr5 s GLN 118 CO 0.06 -0.02 -0.17 0.14 -0.55 0.00 0.00 175.29 174.75 1lr5 s VAL 119 N 0.87 1.37 -0.18 1.34 -7.23 -0.18 -0.43 120.40 115.95 1lr5 s VAL 119 Ca -0.05 -1.37 -0.10 0.00 -1.81 0.00 0.00 61.98 58.66 1lr5 s VAL 119 Cb -0.15 -1.27 -0.05 0.00 0.56 0.00 0.00 36.38 35.47 1lr5 s VAL 119 CO -0.02 -0.12 0.15 -0.22 -0.31 0.00 0.00 175.10 174.58 1lr5 s LEU 120 N -1.72 4.24 -0.13 1.32 2.96 -0.21 -1.21 118.68 123.92 1lr5 s LEU 120 Ca 0.02 0.29 0.02 0.00 -0.22 0.00 0.00 54.13 54.24 1lr5 s LEU 120 Cb -0.10 -2.12 -0.00 0.00 0.50 0.00 0.00 46.19 44.48 1lr5 s LEU 120 CO 0.03 0.21 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.39 1lr5 s VAL 121 N 0.16 2.41 -0.09 1.68 1.01 -0.05 -1.43 120.40 124.09 1lr5 s VAL 121 Ca 0.10 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.24 1lr5 s VAL 121 Cb -0.11 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 1lr5 s VAL 121 CO -0.01 0.54 -0.21 -0.63 0.00 0.00 0.00 175.10 174.79 1lr5 s ILE 122 N 0.63 2.40 0.14 2.22 1.01 0.99 -0.12 121.20 128.46 1lr5 s ILE 122 Ca -0.10 -0.92 0.07 0.00 0.00 0.00 0.00 60.65 59.70 1lr5 s ILE 122 Cb -0.16 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 1lr5 s ILE 122 CO 0.03 0.56 -0.17 0.27 0.00 0.00 0.00 174.94 175.63 1lr5 s ILE 123 N 0.08 1.58 0.58 2.92 -4.36 -0.08 -1.03 121.20 120.88 1lr5 s ILE 123 Ca -0.09 -1.78 0.02 0.00 -0.26 0.00 0.00 60.65 58.55 1lr5 s ILE 123 Cb -0.15 -1.66 0.06 0.00 1.25 0.00 0.00 42.46 41.95 1lr5 s ILE 123 CO 0.06 -0.33 0.80 -0.94 0.24 0.00 0.00 174.94 174.77 1lr5 s SER 124 N -2.47 5.09 -1.42 4.36 1.04 -0.79 -1.41 113.70 118.10 1lr5 s SER 124 Ca 0.11 -0.22 -0.04 0.00 0.48 0.00 0.00 55.95 56.28 1lr5 s SER 124 Cb -0.06 -0.54 0.00 0.00 0.10 0.00 0.00 66.02 65.52 1lr5 s SER 124 CO 0.05 -1.28 0.31 0.54 0.98 0.00 0.00 173.24 173.84 1lr5 n ARG 125 N -2.39 -2.06 -1.45 4.02 1.74 -1.14 -4.65 116.66 110.72 1lr5 n ARG 125 Ca 0.10 0.27 -0.31 0.00 -0.77 0.00 0.00 57.85 57.14 1lr5 n ARG 125 Cb 0.60 -4.00 0.07 0.00 -1.02 0.00 0.00 32.46 28.11 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 -6.88 2.62 0.77 5.56 0.04 -1.26 -4.55 135.00 131.29 1lr5 s PRO 126 Ca 0.07 1.02 -0.11 0.00 0.04 0.00 0.00 61.00 62.02 1lr5 s PRO 126 Cb -0.03 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.61 1lr5 s PRO 126 CO 0.93 -1.34 1.10 -1.25 0.04 0.00 0.00 177.00 176.48 1lr5 s PRO 127 N -4.99 2.32 0.29 0.56 0.04 -1.26 -4.89 135.00 127.07 1lr5 s PRO 127 Ca 0.59 0.57 -0.30 0.00 0.04 0.00 0.00 61.00 61.90 1lr5 s PRO 127 Cb -0.15 -1.95 -0.11 0.00 0.04 0.00 0.00 34.50 32.33 1lr5 s PRO 127 CO 0.55 -1.44 1.49 0.00 0.04 0.00 0.00 177.00 177.65 1lr5 s ALA 128 N -3.23 3.65 -0.71 8.56 0.00 -1.26 -4.98 121.76 123.79 1lr5 s ALA 128 Ca 0.60 1.45 -0.02 0.00 0.00 0.00 0.00 51.96 53.98 1lr5 s ALA 128 Cb -0.13 -3.59 0.18 0.00 0.00 0.00 0.00 23.12 19.58 1lr5 s ALA 128 CO 0.53 -0.87 0.54 0.15 0.00 0.00 0.00 175.76 176.12 1lr5 s LYS 129 N -0.82 2.78 -0.13 0.00 -0.14 -1.26 -4.59 119.74 115.58 1lr5 s LYS 129 Ca 0.59 -2.78 -0.15 0.00 -1.36 0.00 0.00 55.97 52.26 1lr5 s LYS 129 Cb -0.44 -3.79 -0.05 0.00 -1.68 0.00 0.00 37.83 31.87 1lr5 s LYS 129 CO 0.49 -1.21 0.37 0.42 -0.76 0.00 0.00 175.35 174.66 1lr5 s ILE 130 N -0.50 5.25 -0.19 2.17 1.01 -1.26 -4.30 121.20 123.38 1lr5 s ILE 130 Ca 0.20 0.71 -0.04 0.00 0.00 0.00 0.00 60.65 61.52 1lr5 s ILE 130 Cb -0.16 -3.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 1lr5 s ILE 130 CO -0.06 0.38 -0.02 -0.36 0.00 0.00 0.00 174.94 174.87 1lr5 s PHE 131 N 0.42 3.02 -0.13 3.97 0.40 -0.40 -1.37 117.98 123.89 1lr5 s PHE 131 Ca 0.20 -0.46 -0.09 0.00 -0.60 0.00 0.00 56.93 55.98 1lr5 s PHE 131 Cb -0.14 -2.04 -0.04 0.00 0.51 0.00 0.00 43.02 41.31 1lr5 s PHE 131 CO 0.07 -0.21 0.17 -0.51 0.70 0.00 0.00 175.22 175.44 1lr5 s LEU 132 N 0.82 4.34 -0.02 -0.37 1.43 0.11 -1.48 118.68 123.51 1lr5 s LEU 132 Ca -0.00 0.46 -0.00 0.00 -1.03 0.00 0.00 54.13 53.55 1lr5 s LEU 132 Cb -0.14 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 1lr5 s LEU 132 CO 0.02 0.32 0.04 -0.31 0.23 0.00 0.00 176.35 176.65 1lr5 s TYR 133 N -0.58 3.19 -0.30 0.29 1.51 0.32 -1.55 117.35 120.23 1lr5 s TYR 133 Ca 0.14 0.17 0.21 0.00 -1.01 0.00 0.00 57.07 56.57 1lr5 s TYR 133 Cb -0.12 -1.73 0.14 0.00 -0.11 0.00 0.00 41.96 40.14 1lr5 s TYR 133 CO 0.03 0.51 1.33 0.38 -1.11 0.00 0.00 175.55 176.69 1lr5 h ASP 134 N 4.39 0.00 -5.08 2.29 3.04 -1.94 -3.39 116.42 115.73 1lr5 h ASP 134 Ca -0.50 0.00 0.05 0.00 -3.24 0.00 0.00 57.03 53.35 1lr5 h ASP 134 Cb 1.18 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.44 1lr5 h ASP 134 CO 0.59 0.15 0.32 1.51 -2.04 0.00 0.00 179.24 179.76 1lr5 s ASP 135 N -5.95 -0.11 0.00 4.15 1.47 -1.26 -5.00 116.67 109.98 1lr5 s ASP 135 Ca 0.03 -0.83 0.15 0.00 1.18 0.00 0.00 52.55 53.08 1lr5 s ASP 135 Cb 0.07 0.73 0.67 0.00 -0.34 0.00 0.00 42.92 44.05 1lr5 s ASP 135 CO 0.73 -1.41 1.45 0.79 0.68 0.00 0.00 175.17 177.42 1lr5 n TRP 136 N -0.52 0.00 1.11 2.11 7.02 -1.26 -2.11 117.44 123.79 1lr5 n TRP 136 Ca -0.06 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.54 1lr5 n TRP 136 Cb 0.60 -0.43 0.16 0.00 -2.42 0.00 0.00 31.31 29.21 1lr5 n TRP 136 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 1lr5 n SER 137 N -1.43 1.80 -4.68 -0.99 3.41 -1.26 -2.43 113.62 108.03 1lr5 n SER 137 Ca 0.05 -1.38 -0.42 0.00 -0.26 0.00 0.00 58.87 56.86 1lr5 n SER 137 Cb 0.15 0.30 -0.03 0.00 -0.26 0.00 0.00 64.21 64.37 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 -2.41 4.28 0.50 4.33 0.00 -0.90 -4.88 119.30 120.23 1lr5 s MET 138 Ca 0.22 1.92 -0.24 0.00 0.00 0.00 0.00 55.69 57.60 1lr5 s MET 138 Cb 0.19 -3.61 -0.07 0.00 0.00 0.00 0.00 34.83 31.34 1lr5 s MET 138 CO 0.51 -0.58 1.40 -1.25 0.00 0.00 0.00 175.02 175.10 1lr5 s PRO 139 N 2.55 3.41 0.33 4.11 0.04 -1.26 -4.22 135.00 139.96 1lr5 s PRO 139 Ca 0.63 2.34 0.07 0.00 0.04 0.00 0.00 61.00 64.08 1lr5 s PRO 139 Cb -0.30 -2.46 0.75 0.00 0.04 0.00 0.00 34.50 32.53 1lr5 s PRO 139 CO 0.25 -1.01 1.84 0.45 0.04 0.00 0.00 177.00 178.58 1lr5 h HIS 140 N 1.90 0.93 0.00 0.56 3.86 -1.62 -0.33 115.15 120.45 1lr5 h HIS 140 Ca -0.51 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 1lr5 h HIS 140 Cb 1.28 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 29.46 1lr5 h HIS 140 CO 0.48 0.32 0.00 1.79 0.86 0.00 0.00 177.93 181.38 1lr5 h THR 141 N 0.77 0.00 0.00 2.45 1.35 -1.91 -2.77 112.91 112.80 1lr5 h THR 141 Ca 0.48 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 66.03 1lr5 h THR 141 Cb 0.72 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 1lr5 h THR 141 CO -0.25 0.00 -0.95 0.00 -0.25 0.00 0.00 175.52 174.07 1lr5 n ALA 142 N -1.98 2.82 -1.71 6.62 0.00 -0.15 -4.95 120.51 121.15 1lr5 n ALA 142 Ca 0.00 -0.28 -0.43 0.00 0.00 0.00 0.00 53.44 52.73 1lr5 n ALA 142 Cb 0.23 -1.08 -0.01 0.00 0.00 0.00 0.00 19.45 18.58 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 -2.02 1.61 -2.62 0.00 0.00 -1.05 -4.95 120.51 111.49 1lr5 n ALA 143 Ca 0.01 0.37 -0.40 0.00 0.00 0.00 0.00 53.44 53.42 1lr5 n ALA 143 Cb 0.50 -2.32 -0.07 0.00 0.00 0.00 0.00 19.45 17.56 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 -0.67 5.06 0.16 0.00 1.01 -0.60 -4.70 120.40 120.66 1lr5 s VAL 144 Ca 0.60 0.91 -0.31 0.00 0.00 0.00 0.00 61.98 63.17 1lr5 s VAL 144 Cb -0.56 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 31.88 1lr5 s VAL 144 CO 0.57 0.08 1.51 -0.22 0.00 0.00 0.00 175.10 177.04 1lr5 s LEU 145 N 2.31 4.37 -0.55 3.92 2.96 -1.26 0.04 118.68 130.46 1lr5 s LEU 145 Ca 0.22 2.54 0.04 0.00 -0.22 0.00 0.00 54.13 56.71 1lr5 s LEU 145 Cb -0.16 -3.59 0.15 0.00 0.50 0.00 0.00 46.19 43.09 1lr5 s LEU 145 CO 0.09 -0.77 0.34 -0.75 -1.32 0.00 0.00 176.35 173.94 1lr5 s LYS 146 N 1.03 1.91 -0.04 1.98 2.47 -0.47 -4.95 119.74 121.66 1lr5 s LYS 146 Ca 0.68 -2.69 -0.02 0.00 -1.56 0.00 0.00 55.97 52.38 1lr5 s LYS 146 Cb -0.42 -3.01 0.03 0.00 -1.46 0.00 0.00 37.83 32.98 1lr5 s LYS 146 CO 0.32 -1.20 0.08 0.12 0.16 0.00 0.00 175.35 174.83 1lr5 s PHE 147 N -0.50 -0.04 0.69 4.03 5.36 -1.26 -3.10 117.98 123.16 1lr5 s PHE 147 Ca 0.21 0.31 -0.15 0.00 -0.96 0.00 0.00 56.93 56.34 1lr5 s PHE 147 Cb -0.17 -0.25 0.02 0.00 -0.34 0.00 0.00 43.02 42.28 1lr5 s PHE 147 CO -0.07 -0.15 1.15 -1.25 -1.46 0.00 0.00 175.22 173.44 1lr5 s PRO 148 N 1.48 2.49 0.70 10.12 0.04 -1.26 -5.13 135.00 143.45 1lr5 s PRO 148 Ca -0.05 1.56 -0.11 0.00 0.04 0.00 0.00 61.00 62.45 1lr5 s PRO 148 Cb -0.12 -1.90 0.01 0.00 0.04 0.00 0.00 34.50 32.53 1lr5 s PRO 148 CO -0.04 -1.52 1.06 0.12 0.04 0.00 0.00 177.00 176.66 1lr5 s PHE 149 N -2.17 3.06 0.33 0.56 2.19 -1.18 -4.74 117.98 116.04 1lr5 s PHE 149 Ca 0.70 1.43 0.11 0.00 0.33 0.00 0.00 56.93 59.50 1lr5 s PHE 149 Cb -0.24 -2.90 0.91 0.00 -1.31 0.00 0.00 43.02 39.48 1lr5 s PHE 149 CO 0.43 -1.29 1.73 -0.39 1.83 0.00 0.00 175.22 177.54 1lr5 h VAL 150 N -0.76 0.54 0.00 3.12 -1.51 -1.95 -0.16 116.25 115.53 1lr5 h VAL 150 Ca -0.44 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 64.84 1lr5 h VAL 150 Cb 1.21 -0.07 0.00 0.00 -2.13 0.00 0.00 31.29 30.30 1lr5 h VAL 150 CO 0.56 0.10 0.00 -2.67 -1.23 0.00 0.00 177.57 174.34 1lr5 n TRP 151 N -4.85 0.00 0.50 5.19 2.14 -1.26 -2.76 117.44 116.41 1lr5 n TRP 151 Ca 0.27 0.00 0.05 0.00 2.07 0.00 0.00 57.50 59.89 1lr5 n TRP 151 Cb 0.76 -0.12 -0.01 0.00 -0.81 0.00 0.00 31.31 31.13 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 -1.12 1.17 -0.02 -0.67 8.00 -0.11 -4.79 116.55 119.02 1lr5 n ASP 152 Ca 0.18 -1.09 -0.09 0.00 0.71 0.00 0.00 54.79 54.51 1lr5 n ASP 152 Cb 0.15 0.55 -0.03 0.00 -0.02 0.00 0.00 41.12 41.78 1lr5 n ASP 152 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1lr5 h GLU 153 N 1.06 -0.14 -0.38 -1.24 5.08 -1.26 0.13 114.58 117.83 1lr5 h GLU 153 Ca 0.00 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 1lr5 h GLU 153 Cb 0.36 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1lr5 h GLU 153 CO 0.00 -0.09 0.07 -0.44 -1.00 0.00 0.00 179.01 177.55 1lr5 h ASP 154 N -0.14 0.59 0.66 1.42 3.32 -1.87 -1.06 116.42 119.35 1lr5 h ASP 154 Ca 0.10 -0.25 -0.12 0.00 0.02 0.00 0.00 57.03 56.79 1lr5 h ASP 154 Cb 0.30 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1lr5 h ASP 154 CO -0.25 0.69 -0.56 0.00 -1.72 0.00 0.00 179.24 177.40 1lr5 h PHE 156 N 0.00 0.20 -0.82 0.00 3.57 -0.50 -2.11 116.94 117.28 1lr5 h PHE 156 Ca -0.01 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.49 1lr5 h PHE 156 Cb 1.05 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.69 1lr5 h PHE 156 CO 0.00 0.28 0.54 0.93 -2.23 0.00 0.00 178.31 177.83 1lr5 h GLU 157 N 0.06 1.09 0.00 1.11 4.39 -1.16 -2.60 114.58 117.47 1lr5 h GLU 157 Ca 0.04 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1lr5 h GLU 157 Cb 0.17 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.57 1lr5 h GLU 157 CO -0.00 0.73 0.00 0.00 -1.16 0.00 0.00 179.01 178.58 1lr5 h ALA 158 N 1.47 1.00 -0.16 3.43 0.00 -1.26 -2.96 119.26 120.78 1lr5 h ALA 158 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1lr5 h ALA 158 Cb -0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1lr5 h ALA 158 CO -0.06 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1lr5 n ALA 159 N -2.06 2.50 0.16 0.00 0.00 -0.81 -5.09 120.51 115.21 1lr5 n ALA 159 Ca 0.01 -0.63 0.01 0.00 0.00 0.00 0.00 53.44 52.84 1lr5 n ALA 159 Cb 0.34 -1.02 0.08 0.00 0.00 0.00 0.00 19.45 18.84 1lr5 n ALA 159 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13