#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l1m s LYS 2 N 0.00 1.03 0.46 0.03 2.20 -1.26 -5.15 119.74 117.05 1l1m s LYS 2 Ca 0.00 -0.94 -0.22 0.00 -0.36 0.00 0.00 55.97 54.45 1l1m s LYS 2 Cb 0.00 -0.03 -0.08 0.00 -1.51 0.00 0.00 37.83 36.21 1l1m s LYS 2 CO 0.00 -1.31 1.13 -1.25 -0.36 0.00 0.00 175.35 173.56 1l1m s PRO 3 N 1.03 3.79 -0.04 4.03 0.04 -1.26 -5.02 135.00 137.57 1l1m s PRO 3 Ca 0.28 1.67 -0.18 0.00 0.04 0.00 0.00 61.00 62.81 1l1m s PRO 3 Cb -0.01 -2.36 -0.05 0.00 0.04 0.00 0.00 34.50 32.12 1l1m s PRO 3 CO -0.05 -0.50 0.51 0.08 0.04 0.00 0.00 177.00 177.08 1l1m s VAL 4 N -1.63 5.03 0.45 -0.36 1.01 -1.26 -5.03 120.40 118.61 1l1m s VAL 4 Ca 0.64 1.05 0.08 0.00 0.00 0.00 0.00 61.98 63.75 1l1m s VAL 4 Cb -0.26 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.29 1l1m s VAL 4 CO 0.31 0.42 0.49 0.42 0.00 0.00 0.00 175.10 176.74 1l1m s THR 5 N -0.08 2.62 -0.04 3.92 -4.23 -1.26 -3.58 115.64 113.00 1l1m s THR 5 Ca 0.28 -1.20 0.30 0.00 -1.18 0.00 0.00 61.69 59.88 1l1m s THR 5 Cb -0.17 -2.82 0.32 0.00 1.34 0.00 0.00 72.50 71.17 1l1m s THR 5 CO 0.14 0.00 1.90 0.17 -0.54 0.00 0.00 174.62 176.29 1l1m h LEU 6 N 0.77 0.00 -0.31 4.79 -0.00 -1.95 -1.38 115.31 117.24 1l1m h LEU 6 Ca -0.39 0.00 -0.20 0.00 -0.00 0.00 0.00 57.88 57.29 1l1m h LEU 6 Cb 1.28 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.93 1l1m h LEU 6 CO 0.51 0.00 -0.85 1.88 -0.00 0.00 0.00 178.44 179.99 1l1m h TYR 7 N 0.00 0.41 -0.46 0.17 0.05 -1.94 -1.14 116.97 114.07 1l1m h TYR 7 Ca 0.00 -0.21 -0.13 0.00 0.05 0.00 0.00 58.73 58.43 1l1m h TYR 7 Cb 0.24 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.92 1l1m h TYR 7 CO 0.00 1.01 -0.22 -0.44 -1.05 0.00 0.00 178.16 177.45 1l1m h ASP 8 N 0.17 1.00 -0.30 3.88 5.19 -1.64 -1.66 116.42 123.07 1l1m h ASP 8 Ca -0.05 -0.40 -0.07 0.00 -0.62 0.00 0.00 57.03 55.89 1l1m h ASP 8 Cb 1.46 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 40.68 1l1m h ASP 8 CO 0.14 1.18 -0.10 0.58 -3.12 0.00 0.00 179.24 177.92 1l1m h VAL 9 N 0.82 1.29 -0.91 -1.35 2.07 -1.46 -0.76 116.25 115.95 1l1m h VAL 9 Ca 0.10 -1.17 0.03 0.00 0.82 0.00 0.00 66.70 66.49 1l1m h VAL 9 Cb 0.80 1.42 -0.05 0.00 -1.52 0.00 0.00 31.29 31.94 1l1m h VAL 9 CO 0.07 0.37 0.60 0.00 0.02 0.00 0.00 177.57 178.63 1l1m h ALA 10 N 0.78 1.42 0.00 1.67 0.00 -1.10 0.21 119.26 122.23 1l1m h ALA 10 Ca 0.07 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1l1m h ALA 10 Cb 0.60 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1l1m h ALA 10 CO 0.04 0.49 -0.64 0.93 0.00 0.00 0.00 179.25 180.07 1l1m h GLU 11 N 1.14 0.00 0.07 0.00 5.08 -1.14 0.42 114.58 120.15 1l1m h GLU 11 Ca 0.36 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.46 1l1m h GLU 11 Cb 0.01 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.27 1l1m h GLU 11 CO -0.11 0.64 -1.11 -0.92 -1.00 0.00 0.00 179.01 176.51 1l1m h TYR 12 N 0.00 0.72 0.00 4.33 5.03 -0.21 -3.28 116.97 123.55 1l1m h TYR 12 Ca -0.01 -0.44 0.00 0.00 2.58 0.00 0.00 58.73 60.87 1l1m h TYR 12 Cb 1.37 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 39.59 1l1m h TYR 12 CO 0.00 1.29 -0.82 0.00 -1.32 0.00 0.00 178.16 177.31 1l1m h ALA 13 N 0.56 0.52 -1.07 1.82 0.00 -0.65 -3.48 119.26 116.96 1l1m h ALA 13 Ca -0.13 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1l1m h ALA 13 Cb 1.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1l1m h ALA 13 CO 0.20 0.00 -0.01 0.41 0.00 0.00 0.00 179.25 179.84 1l1m n GLY 14 N 1.27 0.93 0.84 0.00 0.00 0.03 -4.94 105.19 103.31 1l1m n GLY 14 Ca 0.02 -0.67 -0.06 0.00 0.00 0.00 0.00 46.02 45.31 1l1m n GLY 14 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1l1m n VAL 15 N -2.56 0.00 -3.64 1.61 0.24 0.13 -5.02 118.33 109.08 1l1m n VAL 15 Ca 0.00 -0.60 -0.24 0.00 -2.04 0.00 0.00 64.34 61.46 1l1m n VAL 15 Cb 0.50 0.22 -0.02 0.00 -1.47 0.00 0.00 33.84 33.07 1l1m n VAL 15 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1l1m s SER 16 N -1.63 6.33 0.54 -1.34 1.04 -1.26 -4.31 113.70 113.08 1l1m s SER 16 Ca 0.06 0.34 0.27 0.00 0.48 0.00 0.00 55.95 57.09 1l1m s SER 16 Cb 0.00 -1.98 1.55 0.00 0.10 0.00 0.00 66.02 65.70 1l1m s SER 16 CO 0.04 -0.15 2.14 0.10 0.98 0.00 0.00 173.24 176.35 1l1m h TYR 17 N 1.30 0.00 -0.29 5.02 -0.00 -1.91 -0.10 116.97 120.99 1l1m h TYR 17 Ca -0.50 0.00 -0.10 0.00 -0.00 0.00 0.00 58.73 58.14 1l1m h TYR 17 Cb 1.21 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.93 1l1m h TYR 17 CO 0.51 0.08 -0.23 0.37 -0.00 0.00 0.00 178.16 178.89 1l1m h GLN 18 N 0.00 0.55 -0.45 0.10 5.75 -1.93 -1.10 115.11 118.03 1l1m h GLN 18 Ca -0.00 -0.20 -0.11 0.00 -0.15 0.00 0.00 58.65 58.19 1l1m h GLN 18 Cb 0.19 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 1l1m h GLN 18 CO 0.01 0.74 -0.15 1.15 -2.65 0.00 0.00 178.83 177.93 1l1m h THR 19 N 0.49 1.27 0.37 2.39 2.02 -1.41 0.94 112.91 118.98 1l1m h THR 19 Ca 0.07 -1.29 -0.02 0.00 0.77 0.00 0.00 66.41 65.95 1l1m h THR 19 Cb 0.66 1.16 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 1l1m h THR 19 CO 0.05 0.44 -0.18 0.58 0.37 0.00 0.00 175.52 176.78 1l1m h VAL 20 N 0.73 0.64 0.00 3.16 2.07 -1.12 -2.40 116.25 119.34 1l1m h VAL 20 Ca 0.11 -0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 1l1m h VAL 20 Cb 0.71 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1l1m h VAL 20 CO 0.05 0.00 -0.10 -1.28 0.02 0.00 0.00 177.57 176.26 1l1m h SER 21 N -0.50 0.00 -0.04 0.57 0.87 -1.14 -0.50 113.55 112.81 1l1m h SER 21 Ca -0.05 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1l1m h SER 21 Cb 0.38 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1l1m h SER 21 CO 0.08 0.10 0.04 -0.09 -0.53 0.00 0.00 176.83 176.43 1l1m h ARG 22 N 0.00 0.00 0.00 2.24 9.65 -0.29 -1.97 114.38 124.02 1l1m h ARG 22 Ca -0.00 0.00 -0.40 0.00 -1.10 0.00 0.00 59.98 58.48 1l1m h ARG 22 Cb 0.18 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 28.70 1l1m h ARG 22 CO 0.01 0.00 -2.35 0.28 2.80 0.00 0.00 179.97 180.71 1l1m n VAL 23 N -4.10 1.33 -0.00 0.20 0.31 -0.63 0.49 118.33 115.93 1l1m n VAL 23 Ca -0.02 -0.36 -0.09 0.00 -0.01 0.00 0.00 64.34 63.86 1l1m n VAL 23 Cb 0.13 -1.77 -0.03 0.00 -0.91 0.00 0.00 33.84 31.26 1l1m n VAL 23 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1l1m h VAL 24 N -0.77 0.69 0.00 2.52 2.07 -1.09 -3.32 116.25 116.34 1l1m h VAL 24 Ca -0.61 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 1l1m h VAL 24 Cb 1.57 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.97 1l1m h VAL 24 CO -0.34 0.00 -0.39 0.59 0.02 0.00 0.00 177.57 177.45 1l1m n ASN 25 N -5.25 1.14 0.03 0.57 3.02 -0.77 -4.88 115.26 109.12 1l1m n ASN 25 Ca -0.03 -2.59 0.00 0.00 -0.03 0.00 0.00 54.58 51.92 1l1m n ASN 25 Cb 0.18 -0.33 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 1l1m n ASN 25 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1l1m n GLN 26 N -0.57 0.00 -3.35 3.52 6.02 -1.03 -4.99 117.38 116.98 1l1m n GLN 26 Ca 0.08 0.00 -0.21 0.00 -0.01 0.00 0.00 57.00 56.87 1l1m n GLN 26 Cb 0.74 -0.27 0.06 0.00 1.02 0.00 0.00 30.24 31.78 1l1m n GLN 26 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1l1m n ALA 27 N -3.02 -1.09 -3.16 -1.58 0.00 0.18 -4.97 120.51 106.87 1l1m n ALA 27 Ca 0.00 0.34 -0.12 0.00 0.00 0.00 0.00 53.44 53.66 1l1m n ALA 27 Cb 0.18 -4.63 -0.05 0.00 0.00 0.00 0.00 19.45 14.96 1l1m n ALA 27 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1l1m s SER 28 N -3.16 -0.34 -1.44 0.00 0.15 -1.14 -4.91 113.70 102.86 1l1m s SER 28 Ca 0.46 -0.11 0.00 0.00 0.70 0.00 0.00 55.95 57.00 1l1m s SER 28 Cb -0.20 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 1l1m s SER 28 CO 0.57 -0.81 0.00 1.41 1.20 0.00 0.00 173.24 175.61 1l1m n HIS 29 N 0.00 -0.67 -4.56 3.44 8.25 -1.26 -4.76 115.22 115.66 1l1m n HIS 29 Ca -0.17 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.01 1l1m n HIS 29 Cb 0.63 -3.26 -0.17 0.00 1.12 0.00 0.00 29.99 28.31 1l1m n HIS 29 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1l1m s VAL 30 N -2.79 1.48 0.00 1.59 1.01 -1.26 -5.03 120.40 115.40 1l1m s VAL 30 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1l1m s VAL 30 Cb 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 35.04 1l1m s VAL 30 CO 0.00 0.44 0.01 -1.54 0.00 0.00 0.00 175.10 174.01 1l1m n SER 31 N 4.05 0.00 0.20 3.32 3.41 -1.26 -4.99 113.62 118.35 1l1m n SER 31 Ca -0.20 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 1l1m n SER 31 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1l1m n SER 31 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1l1m n ALA 32 N -2.79 0.00 -0.28 7.33 0.00 -1.26 -4.89 120.51 118.62 1l1m n ALA 32 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1l1m n ALA 32 Cb 0.00 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.61 1l1m n ALA 32 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1l1m h LYS 33 N 0.00 0.73 -0.56 0.00 1.57 -1.98 0.05 116.57 116.38 1l1m h LYS 33 Ca 0.00 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 1l1m h LYS 33 Cb 0.00 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1l1m h LYS 33 CO 0.00 0.48 0.13 1.79 -0.57 0.00 0.00 179.45 181.29 1l1m h THR 34 N 0.75 1.25 -0.62 -0.16 1.35 -1.99 -1.83 112.91 111.66 1l1m h THR 34 Ca 0.39 -0.88 -0.06 0.00 -0.55 0.00 0.00 66.41 65.30 1l1m h THR 34 Cb 0.38 0.76 -0.03 0.00 -1.73 0.00 0.00 68.15 67.53 1l1m h THR 34 CO -0.25 0.33 0.14 -0.09 -0.25 0.00 0.00 175.52 175.39 1l1m h ARG 35 N 0.79 1.01 0.00 4.72 2.43 -1.62 -0.34 114.38 121.36 1l1m h ARG 35 Ca 0.17 -0.25 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 1l1m h ARG 35 Cb 0.34 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1l1m h ARG 35 CO 0.00 0.92 -0.08 0.93 -1.51 0.00 0.00 179.97 180.24 1l1m h GLU 36 N 0.92 0.00 0.00 0.20 5.08 -0.86 -2.00 114.58 117.93 1l1m h GLU 36 Ca 0.19 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.32 1l1m h GLU 36 Cb 0.38 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 1l1m h GLU 36 CO 0.00 0.08 -1.77 0.36 -1.00 0.00 0.00 179.01 176.68 1l1m n LYS 37 N -3.22 0.64 -0.02 2.33 2.85 -0.70 -3.45 118.16 116.60 1l1m n LYS 37 Ca 0.00 0.16 -0.16 0.00 -1.05 0.00 0.00 58.31 57.26 1l1m n LYS 37 Cb 0.34 -1.72 -0.11 0.00 -0.65 0.00 0.00 35.03 32.90 1l1m n LYS 37 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1l1m h VAL 38 N 0.00 1.47 0.00 0.58 2.07 -0.89 -0.47 116.25 119.01 1l1m h VAL 38 Ca -0.28 -1.96 -0.00 0.00 0.82 0.00 0.00 66.70 65.28 1l1m h VAL 38 Cb 1.82 2.61 -0.00 0.00 -1.52 0.00 0.00 31.29 34.20 1l1m h VAL 38 CO 0.05 0.56 -0.02 -0.33 0.02 0.00 0.00 177.57 177.85 1l1m h GLU 39 N -0.27 0.00 0.15 1.57 5.08 -1.55 -1.31 114.58 118.25 1l1m h GLU 39 Ca -0.05 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.02 1l1m h GLU 39 Cb 1.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.38 1l1m h GLU 39 CO 0.08 0.02 -1.49 0.00 -1.00 0.00 0.00 179.01 176.62 1l1m h ALA 40 N 1.98 0.13 -0.45 3.43 0.00 -1.57 -3.33 119.26 119.46 1l1m h ALA 40 Ca -0.00 -1.06 -0.06 0.00 0.00 0.00 0.00 54.91 53.79 1l1m h ALA 40 Cb 0.44 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1l1m h ALA 40 CO 0.00 0.85 0.06 0.00 0.00 0.00 0.00 179.25 180.16 1l1m h ALA 41 N 0.03 0.59 0.00 0.00 0.00 -0.74 -2.28 119.26 116.86 1l1m h ALA 41 Ca -0.30 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1l1m h ALA 41 Cb 1.89 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1l1m h ALA 41 CO 0.12 0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.70 1l1m n MET 42 N -4.45 0.00 0.00 0.00 3.85 -0.52 -1.17 117.12 114.83 1l1m n MET 42 Ca 0.00 0.34 0.10 0.00 -1.00 0.00 0.00 57.70 57.15 1l1m n MET 42 Cb 0.26 -1.50 -0.08 0.00 -1.05 0.00 0.00 33.22 30.84 1l1m n MET 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1l1m n ALA 43 N -1.50 4.28 -0.06 3.17 0.00 -0.87 -0.27 120.51 125.26 1l1m n ALA 43 Ca 0.02 -0.55 -0.03 0.00 0.00 0.00 0.00 53.44 52.88 1l1m n ALA 43 Cb 0.11 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 18.73 1l1m n ALA 43 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1l1m h GLU 44 N 0.00 0.00 -0.02 0.00 4.39 -0.98 -3.36 114.58 114.61 1l1m h GLU 44 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1l1m h GLU 44 Cb 0.59 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1l1m h GLU 44 CO 0.00 0.05 0.00 1.47 -1.16 0.00 0.00 179.01 179.37 1l1m n LEU 45 N -4.69 0.41 -2.78 1.33 -0.00 -1.15 -4.94 117.00 105.18 1l1m n LEU 45 Ca -0.04 -0.15 -0.00 0.00 -0.00 0.00 0.00 56.01 55.82 1l1m n LEU 45 Cb 0.15 -0.01 0.00 0.00 -0.00 0.00 0.00 43.42 43.56 1l1m n LEU 45 CO 0.06 0.07 0.27 -3.20 -0.00 0.00 0.00 177.39 174.60 1l1m n ASN 46 N -0.63 -6.81 -4.72 1.45 2.85 -1.21 -4.88 115.26 101.32 1l1m n ASN 46 Ca 0.20 -0.03 -0.42 0.00 -0.11 0.00 0.00 54.58 54.23 1l1m n ASN 46 Cb 0.16 -4.57 -0.03 0.00 1.24 0.00 0.00 39.78 36.58 1l1m n ASN 46 CO 0.00 0.00 0.00 -0.47 -2.11 0.00 0.00 177.26 174.68 1l1m s TYR 47 N -2.96 3.56 -0.37 1.20 5.04 0.63 -4.50 117.35 119.95 1l1m s TYR 47 Ca 0.01 1.52 -0.06 0.00 -2.44 0.00 0.00 57.07 56.10 1l1m s TYR 47 Cb -0.00 -3.27 0.07 0.00 0.35 0.00 0.00 41.96 39.11 1l1m s TYR 47 CO 0.62 -0.63 0.15 0.42 -1.34 0.00 0.00 175.55 174.77 1l1m s ILE 48 N 0.78 3.66 -0.09 3.14 1.09 -1.23 -4.95 121.20 123.61 1l1m s ILE 48 Ca 0.54 -1.45 -0.29 0.00 -1.10 0.00 0.00 60.65 58.35 1l1m s ILE 48 Cb -0.26 -3.22 -0.06 0.00 -1.06 0.00 0.00 42.46 37.86 1l1m s ILE 48 CO 0.30 -0.37 1.88 -2.84 -0.10 0.00 0.00 174.94 173.80 1l1m s PRO 49 N 1.33 3.87 -0.39 2.79 0.02 -1.26 -4.81 135.00 136.55 1l1m s PRO 49 Ca 0.01 2.20 -0.26 0.00 0.02 0.00 0.00 61.00 62.97 1l1m s PRO 49 Cb -0.21 -4.14 0.02 0.00 0.02 0.00 0.00 34.50 30.19 1l1m s PRO 49 CO 0.00 -1.23 0.95 -0.80 -0.33 0.00 0.00 177.00 175.59 1l1m s ASN 50 N 4.92 6.66 0.24 2.53 0.01 -1.26 -4.90 114.94 123.14 1l1m s ASN 50 Ca 0.84 0.51 0.09 0.00 -0.71 0.00 0.00 52.86 53.60 1l1m s ASN 50 Cb -0.35 -2.47 0.25 0.00 0.41 0.00 0.00 41.25 39.09 1l1m s ASN 50 CO 0.35 -0.93 1.55 0.03 -1.51 0.00 0.00 177.10 176.59 1l1m h ARG 51 N 8.63 0.02 -0.34 -0.60 3.08 -1.99 -2.48 114.38 120.70 1l1m h ARG 51 Ca -0.23 -0.02 -0.15 0.00 0.07 0.00 0.00 59.98 59.66 1l1m h ARG 51 Cb 1.08 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 1l1m h ARG 51 CO 1.01 0.70 -0.35 0.00 -1.07 0.00 0.00 179.97 180.25 1l1m h ALA 53 N 0.74 1.25 -0.68 0.00 0.00 -1.97 -2.12 119.26 116.49 1l1m h ALA 53 Ca 0.05 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 1l1m h ALA 53 Cb 0.94 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1l1m h ALA 53 CO 0.09 0.50 0.14 0.37 0.00 0.00 0.00 179.25 180.35 1l1m h GLN 54 N 0.26 1.11 -0.28 0.00 4.15 -1.12 0.23 115.11 119.46 1l1m h GLN 54 Ca 0.04 -0.28 -0.05 0.00 0.77 0.00 0.00 58.65 59.13 1l1m h GLN 54 Cb 0.63 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.17 1l1m h GLN 54 CO 0.05 1.00 -0.01 1.96 -1.93 0.00 0.00 178.83 179.89 1l1m h GLN 55 N 1.04 0.50 0.05 1.69 4.20 -0.96 0.14 115.11 121.76 1l1m h GLN 55 Ca 0.21 -0.17 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 1l1m h GLN 55 Cb 0.41 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1l1m h GLN 55 CO 0.01 0.67 -0.02 1.25 -0.67 0.00 0.00 178.83 180.06 1l1m h LEU 56 N 0.28 -0.05 -1.54 1.46 5.85 -1.19 -3.00 115.31 117.11 1l1m h LEU 56 Ca 0.08 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.54 1l1m h LEU 56 Cb 0.45 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1l1m h LEU 56 CO 0.02 0.18 -0.23 0.00 -0.34 0.00 0.00 178.44 178.07 1l1m h ALA 57 N 0.66 1.29 0.00 1.25 0.00 -0.57 -2.32 119.26 119.58 1l1m h ALA 57 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1l1m h ALA 57 Cb 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1l1m h ALA 57 CO 0.01 0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.95 1l1m n GLY 58 N -0.48 -1.16 3.94 0.00 0.00 0.03 -4.74 105.19 102.78 1l1m n GLY 58 Ca -0.02 0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1l1m n GLY 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l1m s LYS 59 N -3.15 3.42 0.20 1.61 1.02 -0.87 -5.08 119.74 116.89 1l1m s LYS 59 Ca 0.06 -0.32 -0.12 0.00 0.02 0.00 0.00 55.97 55.61 1l1m s LYS 59 Cb 0.10 -2.62 -0.00 0.00 -0.52 0.00 0.00 37.83 34.78 1l1m s LYS 59 CO 0.34 0.05 0.40 1.14 -0.92 0.00 0.00 175.35 176.36 1l1m s GLN 60 N -4.39 1.36 1.78 1.68 0.00 -1.26 -5.04 119.66 113.79 1l1m s GLN 60 Ca 0.42 -1.16 0.00 0.00 -0.00 0.00 0.00 55.36 54.62 1l1m s GLN 60 Cb -0.10 0.44 0.00 0.00 0.00 0.00 0.00 33.01 33.35 1l1m s GLN 60 CO 0.37 -0.54 0.00 0.43 0.00 0.00 0.00 175.29 175.55 1l1m n SER 61 N -0.31 -3.84 0.00 12.60 7.64 -1.26 -5.24 113.62 123.21 1l1m n SER 61 Ca -0.05 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.95 1l1m n SER 61 Cb 0.63 0.00 0.73 0.00 -1.01 0.00 0.00 64.21 64.56 1l1m n SER 61 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21