#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 3.92 -0.40 2.12 -2.85 -1.26 -5.01 119.74 116.27 1l1m s LYS 2 Ca 0.00 0.42 -0.28 0.00 -1.00 0.00 0.00 55.97 55.11 1l1m s LYS 2 Cb 0.00 -2.87 -0.02 0.00 -2.06 0.00 0.00 37.83 32.88 1l1m s LYS 2 CO 0.00 0.45 1.80 -2.14 0.10 0.00 0.00 175.35 175.56 1l1m s PRO 3 N -2.16 3.17 0.33 1.78 0.02 -1.26 -4.97 135.00 131.92 1l1m s PRO 3 Ca 0.40 1.23 -0.27 0.00 0.02 0.00 0.00 61.00 62.38 1l1m s PRO 3 Cb -0.14 -4.24 -0.09 0.00 0.02 0.00 0.00 34.50 30.05 1l1m s PRO 3 CO 0.19 -2.06 1.08 0.08 -0.33 0.00 0.00 177.00 175.97 1l1m s VAL 4 N 7.39 3.59 0.39 3.83 1.01 -1.26 -5.02 120.40 130.32 1l1m s VAL 4 Ca 0.77 1.43 0.08 0.00 0.00 0.00 0.00 61.98 64.25 1l1m s VAL 4 Cb -0.20 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 1l1m s VAL 4 CO 0.31 0.21 0.30 0.42 0.00 0.00 0.00 175.10 176.34 1l1m s THR 5 N -1.37 2.88 0.19 3.92 -4.23 -1.26 -4.15 115.64 111.61 1l1m s THR 5 Ca 0.50 -1.44 0.35 0.00 -1.18 0.00 0.00 61.69 59.92 1l1m s THR 5 Cb -0.28 -3.04 0.37 0.00 1.34 0.00 0.00 72.50 70.89 1l1m s THR 5 CO 0.35 -0.07 2.05 0.17 -0.54 0.00 0.00 174.62 176.58 1l1m h LEU 6 N 1.21 0.00 -0.19 4.79 -0.00 -1.95 -1.58 115.31 117.58 1l1m h LEU 6 Ca -0.43 0.00 -0.22 0.00 -0.00 0.00 0.00 57.88 57.24 1l1m h LEU 6 Cb 1.26 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.91 1l1m h LEU 6 CO 0.60 0.00 -0.94 1.88 -0.00 0.00 0.00 178.44 179.98 1l1m h TYR 7 N 0.00 0.43 -0.20 0.17 0.05 -1.94 -0.73 116.97 114.75 1l1m h TYR 7 Ca 0.00 -0.24 -0.15 0.00 0.05 0.00 0.00 58.73 58.38 1l1m h TYR 7 Cb 0.25 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.94 1l1m h TYR 7 CO 0.00 1.08 -0.51 0.22 -1.05 0.00 0.00 178.16 177.90 1l1m h ASP 8 N 0.15 0.62 -0.15 3.88 3.58 -1.69 -1.27 116.42 121.55 1l1m h ASP 8 Ca -0.07 -0.32 -0.10 0.00 0.42 0.00 0.00 57.03 56.96 1l1m h ASP 8 Cb 1.59 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 42.46 1l1m h ASP 8 CO 0.15 1.02 -0.31 0.58 -2.88 0.00 0.00 179.24 177.80 1l1m h VAL 9 N 0.45 1.36 -0.55 2.25 2.07 -1.44 -2.32 116.25 118.07 1l1m h VAL 9 Ca 0.02 -1.57 -0.00 0.00 0.82 0.00 0.00 66.70 65.96 1l1m h VAL 9 Cb 1.04 2.01 -0.03 0.00 -1.52 0.00 0.00 31.29 32.79 1l1m h VAL 9 CO 0.10 0.47 0.34 0.00 0.02 0.00 0.00 177.57 178.50 1l1m h ALA 10 N 0.55 0.70 -0.05 1.67 0.00 -1.08 0.55 119.26 121.61 1l1m h ALA 10 Ca 0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1l1m h ALA 10 Cb 0.91 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1l1m h ALA 10 CO 0.07 0.18 -0.31 1.49 0.00 0.00 0.00 179.25 180.68 1l1m h GLU 11 N 0.74 0.08 0.07 0.00 4.57 -1.25 0.24 114.58 119.04 1l1m h GLU 11 Ca 0.20 -0.03 -0.26 0.00 -1.18 0.00 0.00 59.36 58.09 1l1m h GLU 11 Cb -0.02 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1l1m h GLU 11 CO -0.04 0.39 -1.22 -0.92 -1.18 0.00 0.00 179.01 176.05 1l1m h TYR 12 N 0.08 0.28 0.00 0.92 3.20 -0.89 -3.28 116.97 117.29 1l1m h TYR 12 Ca 0.01 -0.21 0.00 0.00 3.14 0.00 0.00 58.73 61.67 1l1m h TYR 12 Cb 0.60 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.85 1l1m h TYR 12 CO 0.00 1.18 -0.52 0.00 -1.64 0.00 0.00 178.16 177.18 1l1m h ALA 13 N 0.74 0.73 0.00 1.82 0.00 -0.69 -3.48 119.26 118.38 1l1m h ALA 13 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1l1m h ALA 13 Cb 1.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.70 1l1m h ALA 13 CO 0.16 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.82 1l1m n GLY 14 N 1.17 0.77 0.00 0.00 0.00 0.42 -4.93 105.19 102.61 1l1m n GLY 14 Ca 0.02 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.86 0.00 -4.19 1.61 0.24 0.55 -5.01 118.33 108.67 1l1m n VAL 15 Ca 0.00 0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 62.04 1l1m n VAL 15 Cb 0.19 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.49 1l1m n VAL 15 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1l1m s SER 16 N -0.53 4.90 0.50 -1.34 0.01 -1.26 -4.20 113.70 111.79 1l1m s SER 16 Ca 0.00 -0.37 0.22 0.00 1.31 0.00 0.00 55.95 57.11 1l1m s SER 16 Cb 0.00 -1.08 1.30 0.00 0.21 0.00 0.00 66.02 66.44 1l1m s SER 16 CO 0.00 0.08 1.99 0.10 0.41 0.00 0.00 173.24 175.82 1l1m h TYR 17 N 2.56 0.12 -0.30 2.43 -0.00 -1.92 0.20 116.97 120.06 1l1m h TYR 17 Ca -0.47 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.21 1l1m h TYR 17 Cb 1.21 -0.04 -0.02 0.00 -0.00 0.00 0.00 36.73 37.88 1l1m h TYR 17 CO 0.62 0.05 -0.03 0.37 -0.00 0.00 0.00 178.16 179.17 1l1m h GLN 18 N 0.11 0.47 -0.01 0.10 5.75 -1.94 -0.89 115.11 118.69 1l1m h GLN 18 Ca 0.26 -0.10 -0.24 0.00 -0.15 0.00 0.00 58.65 58.42 1l1m h GLN 18 Cb 0.87 -0.07 0.01 0.00 1.07 0.00 0.00 27.48 29.36 1l1m h GLN 18 CO -0.03 0.52 -0.95 1.15 -2.65 0.00 0.00 178.83 176.87 1l1m h THR 19 N 0.45 1.36 0.51 2.39 2.02 -1.05 -1.86 112.91 116.72 1l1m h THR 19 Ca 0.09 -2.35 -0.02 0.00 0.77 0.00 0.00 66.41 64.90 1l1m h THR 19 Cb 0.35 2.37 0.00 0.00 -1.74 0.00 0.00 68.15 69.13 1l1m h THR 19 CO 0.01 0.71 -0.24 0.58 0.37 0.00 0.00 175.52 176.95 1l1m h VAL 20 N 0.30 0.50 0.00 3.16 2.07 -0.77 -2.15 116.25 119.36 1l1m h VAL 20 Ca -0.09 -0.07 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 1l1m h VAL 20 Cb 1.59 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1l1m h VAL 20 CO 0.17 0.01 -0.15 0.28 0.02 0.00 0.00 177.57 177.90 1l1m h SER 21 N -0.72 0.00 -0.30 0.57 0.02 -1.26 0.13 113.55 112.00 1l1m h SER 21 Ca -0.07 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1l1m h SER 21 Cb 0.54 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 1l1m h SER 21 CO 0.11 0.15 0.14 -0.09 -1.14 0.00 0.00 176.83 176.01 1l1m h ARG 22 N 0.00 0.47 0.06 3.45 9.65 -0.93 0.11 114.38 127.18 1l1m h ARG 22 Ca -0.00 -0.05 -0.21 0.00 -1.10 0.00 0.00 59.98 58.61 1l1m h ARG 22 Cb 0.29 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.76 1l1m h ARG 22 CO 0.02 0.39 -1.13 0.28 2.80 0.00 0.00 179.97 182.33 1l1m h VAL 23 N 0.48 1.11 -0.80 0.20 2.07 -0.55 -2.78 116.25 115.97 1l1m h VAL 23 Ca 0.12 -2.31 0.06 0.00 0.82 0.00 0.00 66.70 65.39 1l1m h VAL 23 Cb 0.09 2.66 -0.06 0.00 -1.52 0.00 0.00 31.29 32.45 1l1m h VAL 23 CO -0.01 0.56 0.49 0.58 0.02 0.00 0.00 177.57 179.20 1l1m h VAL 24 N -0.66 1.02 0.00 2.57 2.07 -0.62 -0.89 116.25 119.74 1l1m h VAL 24 Ca -0.27 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1l1m h VAL 24 Cb 1.48 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1l1m h VAL 24 CO -0.04 0.16 -0.04 0.78 0.02 0.00 0.00 177.57 178.45 1l1m h ASN 25 N 0.88 0.00 -5.56 0.57 -0.26 -0.96 -3.48 115.58 106.77 1l1m h ASN 25 Ca 0.36 -0.01 -0.14 0.00 -0.56 0.00 0.00 56.30 55.94 1l1m h ASN 25 Cb 0.19 0.00 0.07 0.00 -1.06 0.00 0.00 38.32 37.51 1l1m h ASN 25 CO -0.18 0.01 -0.41 0.00 -1.06 0.00 0.00 177.43 175.79 1l1m n GLN 26 N -2.42 -1.60 0.00 0.81 1.13 -0.34 -5.04 117.38 109.92 1l1m n GLN 26 Ca 0.05 1.18 0.00 0.00 -1.94 0.00 0.00 57.00 56.29 1l1m n GLN 26 Cb 0.45 -5.40 0.00 0.00 0.11 0.00 0.00 30.24 25.40 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 -2.46 0.00 -2.44 -1.58 0.00 -1.06 -5.06 120.51 107.91 1l1m n ALA 27 Ca -0.05 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.21 1l1m n ALA 27 Cb 0.56 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.11 1l1m n ALA 27 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1l1m n SER 28 N 0.00 0.95 -2.55 0.00 7.64 -1.26 -4.54 113.62 113.85 1l1m n SER 28 Ca 0.00 -1.83 -0.20 0.00 1.01 0.00 0.00 58.87 57.85 1l1m n SER 28 Cb 0.00 -0.53 0.02 0.00 -1.01 0.00 0.00 64.21 62.69 1l1m n SER 28 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1l1m n HIS 29 N -2.62 -1.46 -4.17 1.43 8.25 -1.26 -4.98 115.22 110.42 1l1m n HIS 29 Ca 0.13 0.29 -0.32 0.00 -0.26 0.00 0.00 57.72 57.56 1l1m n HIS 29 Cb 0.46 -4.04 -0.16 0.00 1.12 0.00 0.00 29.99 27.36 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 -3.06 1.84 0.16 1.59 1.01 -1.26 -5.04 120.40 115.64 1l1m s VAL 30 Ca 0.17 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.27 1l1m s VAL 30 Cb -0.07 -1.68 -0.06 0.00 0.00 0.00 0.00 36.38 34.57 1l1m s VAL 30 CO 0.21 0.50 0.43 -0.94 0.00 0.00 0.00 175.10 175.31 1l1m s SER 31 N 1.29 6.55 0.20 3.32 1.04 -1.26 -4.98 113.70 119.86 1l1m s SER 31 Ca 0.03 0.71 -0.10 0.00 0.48 0.00 0.00 55.95 57.07 1l1m s SER 31 Cb -0.13 -2.14 0.21 0.00 0.10 0.00 0.00 66.02 64.06 1l1m s SER 31 CO -0.10 0.02 1.80 0.00 0.98 0.00 0.00 173.24 175.94 1l1m h ALA 32 N 2.81 0.83 -0.48 5.32 0.00 -1.99 -0.28 119.26 125.47 1l1m h ALA 32 Ca -0.46 0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.56 1l1m h ALA 32 Cb 1.17 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.76 1l1m h ALA 32 CO 0.71 0.01 -0.10 -0.22 0.00 0.00 0.00 179.25 179.65 1l1m h LYS 33 N 0.63 0.01 0.10 0.00 3.64 -1.99 0.11 116.57 119.07 1l1m h LYS 33 Ca 0.28 -0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.40 1l1m h LYS 33 Cb 0.17 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1l1m h LYS 33 CO -0.18 0.01 -1.17 1.79 -2.27 0.00 0.00 179.45 177.63 1l1m h THR 34 N 0.01 1.52 -0.60 1.00 1.35 -1.91 -3.17 112.91 111.12 1l1m h THR 34 Ca 0.23 -3.05 -0.02 0.00 -0.55 0.00 0.00 66.41 63.02 1l1m h THR 34 Cb 0.35 2.87 -0.03 0.00 -1.73 0.00 0.00 68.15 69.62 1l1m h THR 34 CO -0.48 0.89 0.29 -0.09 -0.25 0.00 0.00 175.52 175.88 1l1m h ARG 35 N 0.08 0.84 0.00 4.72 2.43 -0.37 0.87 114.38 122.95 1l1m h ARG 35 Ca -0.11 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 58.87 1l1m h ARG 35 Cb 1.89 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 31.27 1l1m h ARG 35 CO 0.19 0.65 -0.39 0.93 -1.51 0.00 0.00 179.97 179.84 1l1m h GLU 36 N 0.84 0.00 0.00 0.20 5.08 -0.85 -2.72 114.58 117.13 1l1m h GLU 36 Ca 0.21 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.32 1l1m h GLU 36 Cb 0.09 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1l1m h GLU 36 CO -0.03 0.39 -1.69 0.36 -1.00 0.00 0.00 179.01 177.05 1l1m n LYS 37 N -3.48 0.63 -0.05 2.33 2.85 -0.76 -3.34 118.16 116.35 1l1m n LYS 37 Ca 0.00 0.22 -0.15 0.00 -1.05 0.00 0.00 58.31 57.33 1l1m n LYS 37 Cb 0.54 -1.76 -0.07 0.00 -0.65 0.00 0.00 35.03 33.09 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 1.35 0.00 0.58 2.07 -0.86 -0.70 116.25 118.69 1l1m h VAL 38 Ca -0.26 -1.68 -0.03 0.00 0.82 0.00 0.00 66.70 65.55 1l1m h VAL 38 Cb 1.86 2.02 -0.00 0.00 -1.52 0.00 0.00 31.29 33.64 1l1m h VAL 38 CO 0.06 0.51 -0.15 -0.33 0.02 0.00 0.00 177.57 177.68 1l1m h GLU 39 N 0.17 0.00 0.15 1.57 5.08 -1.65 -1.66 114.58 118.25 1l1m h GLU 39 Ca -0.01 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.08 1l1m h GLU 39 Cb 1.02 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.30 1l1m h GLU 39 CO 0.09 0.15 -1.14 0.00 -1.00 0.00 0.00 179.01 177.11 1l1m h ALA 40 N 1.85 -0.07 -0.54 3.43 0.00 -1.52 -3.14 119.26 119.26 1l1m h ALA 40 Ca -0.00 -0.76 -0.10 0.00 0.00 0.00 0.00 54.91 54.05 1l1m h ALA 40 Cb 0.57 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1l1m h ALA 40 CO 0.02 0.57 -0.05 0.00 0.00 0.00 0.00 179.25 179.79 1l1m h ALA 41 N 0.20 0.74 0.00 0.00 0.00 -0.80 -2.15 119.26 117.24 1l1m h ALA 41 Ca -0.19 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1l1m h ALA 41 Cb 1.86 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1l1m h ALA 41 CO 0.22 0.61 0.00 0.00 0.00 0.00 0.00 179.25 180.08 1l1m n MET 42 N -4.21 0.01 0.04 0.00 0.00 -0.65 -1.99 117.12 110.33 1l1m n MET 42 Ca 0.02 0.22 0.09 0.00 0.00 0.00 0.00 57.70 58.02 1l1m n MET 42 Cb 0.37 -1.53 -0.08 0.00 0.00 0.00 0.00 33.22 31.98 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 -1.52 2.51 -0.07 3.17 0.00 -0.85 -0.41 120.51 123.34 1l1m n ALA 43 Ca 0.04 -0.43 -0.14 0.00 0.00 0.00 0.00 53.44 52.91 1l1m n ALA 43 Cb 0.20 -0.91 -0.11 0.00 0.00 0.00 0.00 19.45 18.63 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 -0.95 -3.33 114.58 114.68 1l1m h GLU 44 Ca -0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1l1m h GLU 44 Cb 1.13 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 1l1m h GLU 44 CO 0.01 0.89 -0.11 1.28 -1.16 0.00 0.00 179.01 179.92 1l1m n LEU 45 N -4.60 0.17 -2.87 1.33 4.77 -0.99 -4.94 117.00 109.86 1l1m n LEU 45 Ca -0.12 0.30 -0.10 0.00 -0.03 0.00 0.00 56.01 56.06 1l1m n LEU 45 Cb 0.46 -0.37 0.05 0.00 -2.33 0.00 0.00 43.42 41.22 1l1m n LEU 45 CO 0.29 0.04 0.07 -3.20 -1.33 0.00 0.00 177.39 173.26 1l1m n ASN 46 N -1.38 -5.91 -4.71 -1.43 5.15 -1.12 -4.85 115.26 101.00 1l1m n ASN 46 Ca 0.09 -0.47 -0.42 0.00 -0.60 0.00 0.00 54.58 53.18 1l1m n ASN 46 Cb 0.31 -4.32 -0.03 0.00 -0.53 0.00 0.00 39.78 35.22 1l1m n ASN 46 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1l1m s TYR 47 N -3.25 3.53 -0.30 1.20 5.04 0.45 -4.57 117.35 119.45 1l1m s TYR 47 Ca 0.30 1.47 0.01 0.00 -2.44 0.00 0.00 57.07 56.41 1l1m s TYR 47 Cb -0.04 -3.30 0.07 0.00 0.35 0.00 0.00 41.96 39.04 1l1m s TYR 47 CO 0.59 -0.77 -0.01 0.42 -1.34 0.00 0.00 175.55 174.45 1l1m s ILE 48 N 0.89 2.61 -0.10 3.14 1.09 -1.26 -4.94 121.20 122.63 1l1m s ILE 48 Ca 0.55 -1.71 -0.36 0.00 -1.10 0.00 0.00 60.65 58.04 1l1m s ILE 48 Cb -0.27 -2.61 -0.13 0.00 -1.06 0.00 0.00 42.46 38.39 1l1m s ILE 48 CO 0.29 -0.22 1.79 -2.65 -0.10 0.00 0.00 174.94 174.05 1l1m n PRO 49 N 4.49 1.89 -2.34 2.79 -0.02 -1.26 -4.77 135.00 135.78 1l1m n PRO 49 Ca -0.09 0.69 -0.43 0.00 -2.02 0.00 0.00 63.50 61.65 1l1m n PRO 49 Cb 0.42 -2.48 -0.02 0.00 -0.02 0.00 0.00 33.50 31.40 1l1m n PRO 49 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1l1m s ASN 50 N 3.44 6.52 0.23 2.55 0.01 -1.26 -4.88 114.94 121.55 1l1m s ASN 50 Ca 0.92 1.20 0.12 0.00 -0.71 0.00 0.00 52.86 54.39 1l1m s ASN 50 Cb -0.79 -2.54 0.10 0.00 0.41 0.00 0.00 41.25 38.43 1l1m s ASN 50 CO 0.53 -1.21 1.45 0.03 -1.51 0.00 0.00 177.10 176.40 1l1m h ARG 51 N 9.97 0.00 -0.22 -0.60 2.47 -1.98 -2.41 114.38 121.61 1l1m h ARG 51 Ca -0.28 0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.24 1l1m h ARG 51 Cb 1.11 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.44 1l1m h ARG 51 CO 1.04 0.70 -0.66 0.00 0.56 0.00 0.00 179.97 181.60 1l1m h ALA 53 N 0.63 1.12 -0.23 0.00 0.00 -1.97 -2.22 119.26 116.60 1l1m h ALA 53 Ca -0.02 -0.36 -0.15 0.00 0.00 0.00 0.00 54.91 54.38 1l1m h ALA 53 Cb 1.28 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1l1m h ALA 53 CO 0.14 0.56 -0.48 0.37 0.00 0.00 0.00 179.25 179.84 1l1m h GLN 54 N 0.34 0.60 0.00 0.00 4.15 -1.21 0.36 115.11 119.35 1l1m h GLN 54 Ca 0.04 -0.34 0.00 0.00 0.77 0.00 0.00 58.65 59.12 1l1m h GLN 54 Cb 0.71 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.42 1l1m h GLN 54 CO 0.05 0.95 0.00 1.04 -1.93 0.00 0.00 178.83 178.94 1l1m n GLN 55 N -3.99 0.95 -0.02 1.69 6.02 0.17 -1.03 117.38 121.17 1l1m n GLN 55 Ca -0.03 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 56.92 1l1m n GLN 55 Cb 0.57 -1.23 -0.02 0.00 1.02 0.00 0.00 30.24 30.58 1l1m n GLN 55 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1l1m n LEU 56 N -0.73 0.76 0.04 1.08 7.94 -0.88 -2.39 117.00 122.82 1l1m n LEU 56 Ca 0.10 0.05 -0.13 0.00 -1.11 0.00 0.00 56.01 54.92 1l1m n LEU 56 Cb 0.05 -0.14 -0.09 0.00 0.53 0.00 0.00 43.42 43.77 1l1m n LEU 56 CO 0.08 0.17 0.70 0.00 -1.11 0.00 0.00 177.39 177.23 1l1m h ALA 57 N -0.15 -0.10 0.00 1.96 0.00 -0.30 -3.40 119.26 117.27 1l1m h ALA 57 Ca -0.12 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 1l1m h ALA 57 Cb 1.11 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1l1m h ALA 57 CO -0.06 -0.41 -1.46 0.41 0.00 0.00 0.00 179.25 177.73 1l1m n GLY 58 N -0.35 -0.20 0.13 0.00 0.00 -0.79 -5.06 105.19 98.93 1l1m n GLY 58 Ca -0.08 -0.08 -0.01 0.00 0.00 0.00 0.00 46.02 45.85 1l1m n GLY 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l1m n LYS 59 N -2.52 0.74 -3.78 1.61 5.02 -0.20 -5.02 118.16 114.02 1l1m n LYS 59 Ca -0.13 -0.10 -0.14 0.00 -2.02 0.00 0.00 58.31 55.92 1l1m n LYS 59 Cb 0.68 -0.02 -0.15 0.00 -0.02 0.00 0.00 35.03 35.52 1l1m n LYS 59 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1l1m s GLN 60 N -2.33 0.01 -1.28 1.97 -1.52 -1.00 -3.69 119.66 111.82 1l1m s GLN 60 Ca 0.02 0.22 -0.08 0.00 -1.95 0.00 0.00 55.36 53.58 1l1m s GLN 60 Cb -0.00 -0.18 0.17 0.00 -0.22 0.00 0.00 33.01 32.77 1l1m s GLN 60 CO 0.01 -0.14 1.98 0.43 -0.25 0.00 0.00 175.29 177.32 1l1m n SER 61 N 4.00 5.94 0.00 5.90 7.64 -1.13 -4.98 113.62 130.99 1l1m n SER 61 Ca -0.25 -3.15 0.00 0.00 1.01 0.00 0.00 58.87 56.48 1l1m n SER 61 Cb 0.52 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 1l1m n SER 61 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92