#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 3.93 -0.24 0.03 -2.85 -1.26 -4.95 119.74 114.40 1l1m s LYS 2 Ca 0.00 1.33 -0.28 0.00 -1.00 0.00 0.00 55.97 56.02 1l1m s LYS 2 Cb 0.00 -2.17 -0.04 0.00 -2.06 0.00 0.00 37.83 33.57 1l1m s LYS 2 CO 0.00 -0.32 2.00 -1.25 0.10 0.00 0.00 175.35 175.88 1l1m s PRO 3 N -3.13 3.33 -0.07 1.78 0.04 -1.26 -4.88 135.00 130.81 1l1m s PRO 3 Ca 0.65 1.82 -0.14 0.00 0.04 0.00 0.00 61.00 63.38 1l1m s PRO 3 Cb -0.16 -4.27 -0.05 0.00 0.04 0.00 0.00 34.50 30.07 1l1m s PRO 3 CO 0.19 -1.87 0.35 0.08 0.04 0.00 0.00 177.00 175.79 1l1m s VAL 4 N 7.27 5.18 0.42 -0.36 1.01 -1.26 -4.95 120.40 127.72 1l1m s VAL 4 Ca 0.90 0.69 0.08 0.00 0.00 0.00 0.00 61.98 63.65 1l1m s VAL 4 Cb -0.29 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.44 1l1m s VAL 4 CO 0.35 0.51 0.54 0.42 0.00 0.00 0.00 175.10 176.92 1l1m s THR 5 N -0.52 2.91 -0.15 3.92 -4.23 -1.26 -2.15 115.64 114.16 1l1m s THR 5 Ca 0.21 -1.06 0.28 0.00 -1.18 0.00 0.00 61.69 59.94 1l1m s THR 5 Cb -0.15 -2.98 0.30 0.00 1.34 0.00 0.00 72.50 71.01 1l1m s THR 5 CO 0.09 0.00 1.85 0.17 -0.54 0.00 0.00 174.62 176.19 1l1m h LEU 6 N 0.70 0.00 -0.10 4.79 -0.00 -1.94 -2.00 115.31 116.76 1l1m h LEU 6 Ca -0.40 0.00 -0.24 0.00 -0.00 0.00 0.00 57.88 57.24 1l1m h LEU 6 Cb 1.28 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.95 1l1m h LEU 6 CO 0.47 0.00 -0.90 1.88 -0.00 0.00 0.00 178.44 179.90 1l1m h TYR 7 N 0.00 1.04 -0.45 0.17 0.05 -1.94 -1.70 116.97 114.13 1l1m h TYR 7 Ca 0.00 -0.51 -0.11 0.00 0.05 0.00 0.00 58.73 58.17 1l1m h TYR 7 Cb 0.28 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.86 1l1m h TYR 7 CO 0.00 1.34 -0.14 0.22 -1.05 0.00 0.00 178.16 178.53 1l1m h ASP 8 N 0.47 0.85 -0.45 3.88 3.58 -1.76 -1.77 116.42 121.23 1l1m h ASP 8 Ca -0.09 -0.28 -0.12 0.00 0.42 0.00 0.00 57.03 56.97 1l1m h ASP 8 Cb 1.53 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 42.34 1l1m h ASP 8 CO 0.18 1.00 -0.19 0.58 -2.88 0.00 0.00 179.24 177.93 1l1m h VAL 9 N 0.76 1.27 -0.90 2.25 2.07 -1.50 -1.86 116.25 118.34 1l1m h VAL 9 Ca 0.12 -1.34 0.02 0.00 0.82 0.00 0.00 66.70 66.32 1l1m h VAL 9 Cb 0.66 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 31.57 1l1m h VAL 9 CO 0.05 0.46 0.59 0.00 0.02 0.00 0.00 177.57 178.69 1l1m h ALA 10 N 0.85 1.39 0.00 1.67 0.00 -1.03 0.51 119.26 122.65 1l1m h ALA 10 Ca 0.10 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1l1m h ALA 10 Cb 0.76 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1l1m h ALA 10 CO 0.06 0.54 -0.57 0.93 0.00 0.00 0.00 179.25 180.21 1l1m h GLU 11 N 1.18 0.00 0.04 0.00 5.08 -1.10 0.36 114.58 120.13 1l1m h GLU 11 Ca 0.34 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.43 1l1m h GLU 11 Cb -0.07 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.20 1l1m h GLU 11 CO -0.09 0.57 -1.10 -0.92 -1.00 0.00 0.00 179.01 176.47 1l1m h TYR 12 N 0.00 0.98 0.00 4.33 5.03 -0.45 -3.28 116.97 123.58 1l1m h TYR 12 Ca -0.01 -0.56 0.00 0.00 2.58 0.00 0.00 58.73 60.74 1l1m h TYR 12 Cb 1.08 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 39.26 1l1m h TYR 12 CO 0.00 1.40 -0.57 0.00 -1.32 0.00 0.00 178.16 177.67 1l1m h ALA 13 N 0.41 0.70 -1.13 1.82 0.00 -0.90 -3.48 119.26 116.68 1l1m h ALA 13 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1l1m h ALA 13 Cb 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.55 1l1m h ALA 13 CO 0.21 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.87 1l1m n GLY 14 N 1.18 0.88 0.00 0.00 0.00 0.33 -4.97 105.19 102.61 1l1m n GLY 14 Ca 0.02 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.21 0.00 -3.98 1.61 0.24 0.98 -5.02 118.33 109.95 1l1m n VAL 15 Ca 0.00 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.08 1l1m n VAL 15 Cb 0.49 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.83 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 -0.39 6.25 0.44 -1.34 1.04 -1.26 -4.38 113.70 114.05 1l1m s SER 16 Ca 0.00 0.07 0.19 0.00 0.48 0.00 0.00 55.95 56.69 1l1m s SER 16 Cb 0.00 -1.83 1.04 0.00 0.10 0.00 0.00 66.02 65.33 1l1m s SER 16 CO 0.00 -0.03 1.95 0.10 0.98 0.00 0.00 173.24 176.23 1l1m h TYR 17 N 1.46 0.00 -0.29 5.02 -0.00 -1.91 -1.13 116.97 120.12 1l1m h TYR 17 Ca -0.51 0.00 -0.10 0.00 -0.00 0.00 0.00 58.73 58.12 1l1m h TYR 17 Cb 1.22 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.94 1l1m h TYR 17 CO 0.48 0.23 -0.24 0.37 -0.00 0.00 0.00 178.16 179.00 1l1m h GLN 18 N 0.00 0.56 -0.37 0.10 5.75 -1.94 -0.42 115.11 118.78 1l1m h GLN 18 Ca -0.00 -0.21 -0.05 0.00 -0.15 0.00 0.00 58.65 58.23 1l1m h GLN 18 Cb 0.48 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.99 1l1m h GLN 18 CO 0.03 0.76 0.02 1.15 -2.65 0.00 0.00 178.83 178.14 1l1m h THR 19 N 0.49 1.25 0.01 2.39 2.02 -1.63 0.11 112.91 117.56 1l1m h THR 19 Ca 0.07 -0.93 0.01 0.00 0.77 0.00 0.00 66.41 66.33 1l1m h THR 19 Cb 0.69 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 1l1m h THR 19 CO 0.05 0.31 -0.06 0.58 0.37 0.00 0.00 175.52 176.78 1l1m h VAL 20 N 0.46 0.85 -0.15 3.16 2.07 -1.02 -1.76 116.25 119.86 1l1m h VAL 20 Ca 0.11 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.60 1l1m h VAL 20 Cb 0.42 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1l1m h VAL 20 CO 0.01 0.00 -0.04 -1.28 0.02 0.00 0.00 177.57 176.28 1l1m h SER 21 N -0.11 0.20 -0.39 0.57 0.87 -0.96 0.10 113.55 113.84 1l1m h SER 21 Ca 0.02 -0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.50 1l1m h SER 21 Cb 0.13 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.02 1l1m h SER 21 CO -0.05 0.28 0.07 -0.09 -0.53 0.00 0.00 176.83 176.51 1l1m h ARG 22 N 0.22 0.72 0.09 2.24 9.65 -0.09 -1.04 114.38 126.18 1l1m h ARG 22 Ca 0.05 -0.16 -0.13 0.00 -1.10 0.00 0.00 59.98 58.65 1l1m h ARG 22 Cb 0.22 -0.10 0.01 0.00 -1.39 0.00 0.00 29.97 28.71 1l1m h ARG 22 CO 0.01 0.69 -0.56 0.28 2.80 0.00 0.00 179.97 183.18 1l1m h VAL 23 N 0.69 1.59 -0.89 0.20 2.07 -0.47 -2.73 116.25 116.71 1l1m h VAL 23 Ca 0.15 -2.47 0.03 0.00 0.82 0.00 0.00 66.70 65.23 1l1m h VAL 23 Cb 0.33 3.24 -0.05 0.00 -1.52 0.00 0.00 31.29 33.29 1l1m h VAL 23 CO 0.01 0.68 0.58 0.58 0.02 0.00 0.00 177.57 179.43 1l1m h VAL 24 N -0.59 1.16 0.00 2.57 2.07 -0.95 -2.09 116.25 118.41 1l1m h VAL 24 Ca -0.10 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1l1m h VAL 24 Cb 1.42 -0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1l1m h VAL 24 CO 0.09 0.21 -0.03 0.78 0.02 0.00 0.00 177.57 178.63 1l1m h ASN 25 N 1.13 0.00 -5.43 0.57 2.35 -1.31 -3.48 115.58 109.41 1l1m h ASN 25 Ca 0.35 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.75 1l1m h ASN 25 Cb -0.01 0.00 0.14 0.00 0.05 0.00 0.00 38.32 38.49 1l1m h ASN 25 CO -0.11 0.03 -0.65 0.00 -1.65 0.00 0.00 177.43 175.05 1l1m n GLN 26 N -3.11 -7.00 0.00 0.81 1.13 -0.79 -5.01 117.38 103.41 1l1m n GLN 26 Ca 0.03 0.77 0.00 0.00 -1.94 0.00 0.00 57.00 55.86 1l1m n GLN 26 Cb 0.52 -5.61 0.00 0.00 0.11 0.00 0.00 30.24 25.26 1l1m n GLN 26 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1l1m n ALA 27 N -4.55 0.00 -2.00 -1.58 0.00 -1.14 -5.07 120.51 106.17 1l1m n ALA 27 Ca -0.07 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.16 1l1m n ALA 27 Cb 0.58 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.09 1l1m n ALA 27 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1l1m s SER 28 N -1.00 5.01 -1.42 0.00 0.01 -1.26 -4.54 113.70 110.50 1l1m s SER 28 Ca 0.00 -0.36 -0.05 0.00 1.31 0.00 0.00 55.95 56.85 1l1m s SER 28 Cb 0.00 -0.34 0.01 0.00 0.21 0.00 0.00 66.02 65.90 1l1m s SER 28 CO 0.00 -1.35 0.72 1.41 0.41 0.00 0.00 173.24 174.44 1l1m n HIS 29 N -2.40 -2.09 -4.03 2.43 8.25 -1.26 -4.97 115.22 111.15 1l1m n HIS 29 Ca 0.12 0.62 -0.33 0.00 -0.26 0.00 0.00 57.72 57.87 1l1m n HIS 29 Cb 0.60 -4.46 -0.15 0.00 1.12 0.00 0.00 29.99 27.11 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 -3.19 2.38 0.57 1.59 1.01 -1.26 -5.01 120.40 116.49 1l1m s VAL 30 Ca 0.36 -1.50 -0.09 0.00 0.00 0.00 0.00 61.98 60.74 1l1m s VAL 30 Cb -0.16 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1l1m s VAL 30 CO 0.44 0.01 0.95 -0.94 0.00 0.00 0.00 175.10 175.56 1l1m s SER 31 N 1.16 6.25 0.39 3.32 1.04 -1.26 -4.95 113.70 119.65 1l1m s SER 31 Ca -0.07 1.27 0.16 0.00 0.48 0.00 0.00 55.95 57.79 1l1m s SER 31 Cb -0.19 -2.40 0.79 0.00 0.10 0.00 0.00 66.02 64.32 1l1m s SER 31 CO -0.05 -0.77 1.82 0.00 0.98 0.00 0.00 173.24 175.23 1l1m h ALA 32 N -0.11 1.24 0.54 5.32 0.00 -1.99 -1.56 119.26 122.71 1l1m h ALA 32 Ca -0.45 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.11 1l1m h ALA 32 Cb 1.19 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.93 1l1m h ALA 32 CO 0.62 0.44 -0.26 0.87 0.00 0.00 0.00 179.25 180.92 1l1m h LYS 33 N 0.00 -0.70 0.00 0.00 1.79 -2.01 -2.83 116.57 112.83 1l1m h LYS 33 Ca -0.00 0.05 -0.14 0.00 -2.18 0.00 0.00 60.65 58.37 1l1m h LYS 33 Cb 0.70 0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 31.49 1l1m h LYS 33 CO 0.05 -0.41 -0.68 1.79 -1.08 0.00 0.00 179.45 179.12 1l1m h THR 34 N -0.87 1.46 -0.73 -0.16 1.35 -1.96 -2.83 112.91 109.17 1l1m h THR 34 Ca -0.07 -2.34 0.04 0.00 -0.55 0.00 0.00 66.41 63.49 1l1m h THR 34 Cb 0.61 2.27 -0.04 0.00 -1.73 0.00 0.00 68.15 69.26 1l1m h THR 34 CO 0.12 0.66 0.48 -0.09 -0.25 0.00 0.00 175.52 176.45 1l1m h ARG 35 N 0.00 0.83 0.11 4.72 2.43 -1.25 0.67 114.38 121.89 1l1m h ARG 35 Ca -0.01 -0.05 -0.30 0.00 -0.81 0.00 0.00 59.98 58.81 1l1m h ARG 35 Cb 1.22 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 1l1m h ARG 35 CO 0.09 0.55 -1.54 0.93 -1.51 0.00 0.00 179.97 178.48 1l1m h GLU 36 N 0.85 0.23 -0.01 0.20 5.08 -1.45 -3.16 114.58 116.32 1l1m h GLU 36 Ca 0.30 -0.40 -0.18 0.00 -1.00 0.00 0.00 59.36 58.08 1l1m h GLU 36 Cb 0.11 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1l1m h GLU 36 CO -0.09 1.09 -0.82 1.57 -1.00 0.00 0.00 179.01 179.76 1l1m h LYS 37 N 0.06 0.15 -0.06 2.33 2.10 -1.21 -1.84 116.57 118.10 1l1m h LYS 37 Ca -0.25 -0.15 -0.13 0.00 -2.00 0.00 0.00 60.65 58.13 1l1m h LYS 37 Cb 2.01 0.04 0.01 0.00 -0.90 0.00 0.00 32.23 33.39 1l1m h LYS 37 CO 0.15 0.88 -0.47 0.28 -2.00 0.00 0.00 179.45 178.30 1l1m h VAL 38 N 0.09 1.41 0.00 0.07 2.07 -1.02 -1.19 116.25 117.68 1l1m h VAL 38 Ca -0.03 -1.87 -0.06 0.00 0.82 0.00 0.00 66.70 65.56 1l1m h VAL 38 Cb 1.42 2.36 -0.01 0.00 -1.52 0.00 0.00 31.29 33.54 1l1m h VAL 38 CO 0.12 0.55 -0.28 -0.33 0.02 0.00 0.00 177.57 177.65 1l1m h GLU 39 N -0.04 0.00 0.04 1.57 5.08 -1.57 -0.36 114.58 119.30 1l1m h GLU 39 Ca -0.04 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.09 1l1m h GLU 39 Cb 1.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1l1m h GLU 39 CO 0.09 0.28 -1.05 0.00 -1.00 0.00 0.00 179.01 177.34 1l1m h ALA 40 N 1.72 0.31 -0.00 3.43 0.00 -1.27 -3.21 119.26 120.24 1l1m h ALA 40 Ca -0.00 -0.85 -0.19 0.00 0.00 0.00 0.00 54.91 53.86 1l1m h ALA 40 Cb 0.60 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.32 1l1m h ALA 40 CO 0.04 1.07 -0.76 0.00 0.00 0.00 0.00 179.25 179.60 1l1m h ALA 41 N 0.86 0.09 0.00 0.00 0.00 -0.70 -3.17 119.26 116.34 1l1m h ALA 41 Ca -0.06 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.23 1l1m h ALA 41 Cb 1.77 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1l1m h ALA 41 CO 0.15 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.88 1l1m n MET 42 N -4.09 0.10 0.08 0.00 3.85 -0.19 -1.26 117.12 115.61 1l1m n MET 42 Ca -0.11 0.46 0.11 0.00 -1.00 0.00 0.00 57.70 57.17 1l1m n MET 42 Cb 0.75 -1.75 -0.01 0.00 -1.05 0.00 0.00 33.22 31.16 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 -1.67 2.63 -0.05 3.17 0.00 -1.20 -0.59 120.51 122.80 1l1m n ALA 43 Ca 0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 53.44 53.16 1l1m n ALA 43 Cb 0.12 -1.06 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 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 -0.00 0.00 4.39 -1.21 -3.35 114.58 114.42 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 0.97 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 1l1m h GLU 44 CO 0.00 0.12 -0.01 1.47 -1.16 0.00 0.00 179.01 179.43 1l1m n LEU 45 N -4.75 0.10 -2.60 1.33 -0.00 -1.15 -4.94 117.00 105.00 1l1m n LEU 45 Ca -0.02 0.08 -0.01 0.00 -0.00 0.00 0.00 56.01 56.07 1l1m n LEU 45 Cb 0.07 -0.11 0.00 0.00 -0.00 0.00 0.00 43.42 43.38 1l1m n LEU 45 CO 0.05 0.02 0.23 0.59 -0.00 0.00 0.00 177.39 178.28 1l1m n ASN 46 N -1.05 -6.02 -4.74 1.45 3.02 -1.17 -4.76 115.26 102.00 1l1m n ASN 46 Ca 0.20 -0.07 -0.42 0.00 -0.03 0.00 0.00 54.58 54.26 1l1m n ASN 46 Cb 0.18 -4.01 -0.03 0.00 -0.61 0.00 0.00 39.78 35.32 1l1m n ASN 46 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1l1m s TYR 47 N -3.01 3.07 -0.45 3.10 5.04 0.24 -4.30 117.35 121.04 1l1m s TYR 47 Ca 0.02 0.98 -0.07 0.00 -2.44 0.00 0.00 57.07 55.55 1l1m s TYR 47 Cb -0.00 -3.80 0.11 0.00 0.35 0.00 0.00 41.96 38.62 1l1m s TYR 47 CO 0.52 -2.68 0.30 0.42 -1.34 0.00 0.00 175.55 172.77 1l1m s ILE 48 N 0.28 3.93 0.14 3.14 -1.09 -0.91 -4.92 121.20 121.77 1l1m s ILE 48 Ca 0.61 -1.84 -0.31 0.00 -2.23 0.00 0.00 60.65 56.88 1l1m s ILE 48 Cb -0.41 -3.60 -0.09 0.00 -1.58 0.00 0.00 42.46 36.78 1l1m s ILE 48 CO 0.40 -0.73 1.45 -2.84 -1.23 0.00 0.00 174.94 171.99 1l1m s PRO 49 N 1.30 4.28 -0.32 2.79 0.02 -1.26 -4.71 135.00 137.11 1l1m s PRO 49 Ca 0.06 2.19 -0.08 0.00 0.02 0.00 0.00 61.00 63.19 1l1m s PRO 49 Cb -0.25 -3.20 0.01 0.00 0.02 0.00 0.00 34.50 31.08 1l1m s PRO 49 CO -0.02 -0.48 0.12 -0.80 -0.33 0.00 0.00 177.00 175.49 1l1m s ASN 50 N 1.03 5.34 0.38 2.53 0.01 -1.26 -4.94 114.94 118.03 1l1m s ASN 50 Ca 0.66 -0.76 0.20 0.00 -0.71 0.00 0.00 52.86 52.25 1l1m s ASN 50 Cb -0.39 -1.93 0.37 0.00 0.41 0.00 0.00 41.25 39.70 1l1m s ASN 50 CO 0.32 -0.24 1.59 0.08 -1.51 0.00 0.00 177.10 177.34 1l1m h ARG 51 N 8.29 0.00 -0.26 -0.60 -0.00 -1.98 -2.58 114.38 117.25 1l1m h ARG 51 Ca -0.30 0.00 -0.11 0.00 -0.00 0.00 0.00 59.98 59.57 1l1m h ARG 51 Cb 1.12 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.09 1l1m h ARG 51 CO 0.62 0.25 -0.26 0.00 -0.00 0.00 0.00 179.97 180.57 1l1m h ALA 53 N 0.69 1.22 -0.38 0.00 0.00 -1.98 -1.84 119.26 116.97 1l1m h ALA 53 Ca 0.04 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.42 1l1m h ALA 53 Cb 0.83 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1l1m h ALA 53 CO 0.07 0.59 -0.15 0.37 0.00 0.00 0.00 179.25 180.13 1l1m h GLN 54 N 0.00 0.77 -0.17 0.00 4.15 -1.13 0.41 115.11 119.14 1l1m h GLN 54 Ca -0.00 -0.32 -0.07 0.00 0.77 0.00 0.00 58.65 59.02 1l1m h GLN 54 Cb 0.83 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.48 1l1m h GLN 54 CO 0.06 0.93 -0.21 1.96 -1.93 0.00 0.00 178.83 179.65 1l1m h GLN 55 N 0.57 0.29 0.07 1.69 4.20 -0.77 0.16 115.11 121.32 1l1m h GLN 55 Ca 0.09 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1l1m h GLN 55 Cb 0.69 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1l1m h GLN 55 CO 0.05 0.50 -0.03 1.25 -0.67 0.00 0.00 178.83 179.92 1l1m h LEU 56 N 0.27 -0.08 -1.18 1.46 5.85 -1.06 -2.38 115.31 118.20 1l1m h LEU 56 Ca 0.05 -0.54 -0.03 0.00 0.84 0.00 0.00 57.88 58.20 1l1m h LEU 56 Cb 0.53 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 1l1m h LEU 56 CO 0.04 0.60 0.22 0.00 -0.34 0.00 0.00 178.44 178.95 1l1m h ALA 57 N -0.15 1.35 -0.19 1.25 0.00 -0.14 -0.63 119.26 120.75 1l1m h ALA 57 Ca -0.01 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1l1m h ALA 57 Cb 0.61 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1l1m h ALA 57 CO 0.02 0.49 0.00 0.41 0.00 0.00 0.00 179.25 180.16 1l1m n GLY 58 N -1.07 0.14 4.98 0.00 0.00 0.56 -4.95 105.19 104.85 1l1m n GLY 58 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1l1m n GLY 58 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1l1m n LYS 59 N 0.18 0.00 -4.22 1.61 2.85 -0.25 -4.25 118.16 114.08 1l1m n LYS 59 Ca 0.13 0.00 -0.23 0.00 -1.05 0.00 0.00 58.31 57.16 1l1m n LYS 59 Cb 0.26 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.58 1l1m n LYS 59 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 1l1m s GLN 60 N 0.00 2.50 3.15 -1.58 1.11 -1.26 -4.76 119.66 118.82 1l1m s GLN 60 Ca 0.00 -1.25 0.00 0.00 0.01 0.00 0.00 55.36 54.12 1l1m s GLN 60 Cb 0.00 -2.32 0.00 0.00 -1.01 0.00 0.00 33.01 29.68 1l1m s GLN 60 CO 0.00 0.39 0.00 0.43 0.01 0.00 0.00 175.29 176.12 1l1m n SER 61 N -0.82 0.00 0.00 5.90 7.64 -1.26 -5.20 113.62 119.88 1l1m n SER 61 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.81 1l1m n SER 61 Cb 0.58 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.78 1l1m n SER 61 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03