#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 3.09 -0.42 0.03 -2.85 -1.26 -5.08 119.74 113.25 1l1m s LYS 2 Ca 0.00 -0.83 -0.28 0.00 -1.00 0.00 0.00 55.97 53.86 1l1m s LYS 2 Cb 0.00 -2.47 -0.01 0.00 -2.06 0.00 0.00 37.83 33.29 1l1m s LYS 2 CO 0.00 0.03 1.74 -1.25 0.10 0.00 0.00 175.35 175.97 1l1m s PRO 3 N 0.73 3.20 0.23 1.78 0.04 -1.26 -4.93 135.00 134.78 1l1m s PRO 3 Ca -0.09 1.12 -0.30 0.00 0.04 0.00 0.00 61.00 61.78 1l1m s PRO 3 Cb -0.16 -4.21 -0.10 0.00 0.04 0.00 0.00 34.50 30.07 1l1m s PRO 3 CO 0.00 -2.03 1.39 0.08 0.04 0.00 0.00 177.00 176.48 1l1m s VAL 4 N 7.18 2.86 0.32 -0.36 1.01 -1.26 -4.92 120.40 125.23 1l1m s VAL 4 Ca 0.73 0.72 0.06 0.00 0.00 0.00 0.00 61.98 63.50 1l1m s VAL 4 Cb -0.18 -3.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.72 1l1m s VAL 4 CO 0.30 0.12 0.46 0.42 0.00 0.00 0.00 175.10 176.39 1l1m s THR 5 N -0.01 4.24 -0.03 3.92 -4.23 -1.26 -3.36 115.64 114.90 1l1m s THR 5 Ca 0.58 -0.99 0.29 0.00 -1.18 0.00 0.00 61.69 60.39 1l1m s THR 5 Cb -0.40 -3.47 0.30 0.00 1.34 0.00 0.00 72.50 70.27 1l1m s THR 5 CO 0.42 -0.18 1.89 0.17 -0.54 0.00 0.00 174.62 176.37 1l1m h LEU 6 N 0.92 0.00 -0.25 4.79 -0.00 -1.94 -0.98 115.31 117.86 1l1m h LEU 6 Ca -0.47 0.00 -0.21 0.00 -0.00 0.00 0.00 57.88 57.21 1l1m h LEU 6 Cb 1.25 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.91 1l1m h LEU 6 CO 0.54 0.00 -0.90 1.88 -0.00 0.00 0.00 178.44 179.96 1l1m h TYR 7 N 0.00 0.38 -0.28 0.17 0.05 -1.93 -1.11 116.97 114.25 1l1m h TYR 7 Ca 0.00 -0.21 -0.19 0.00 0.05 0.00 0.00 58.73 58.38 1l1m h TYR 7 Cb 0.17 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.87 1l1m h TYR 7 CO 0.00 1.02 -0.57 0.22 -1.05 0.00 0.00 178.16 177.79 1l1m h ASP 8 N 0.14 0.98 -0.48 3.88 1.82 -1.57 -1.78 116.42 119.41 1l1m h ASP 8 Ca -0.05 -0.54 -0.13 0.00 -0.39 0.00 0.00 57.03 55.92 1l1m h ASP 8 Cb 1.53 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 41.24 1l1m h ASP 8 CO 0.14 1.34 -0.22 0.58 -1.61 0.00 0.00 179.24 179.47 1l1m h VAL 9 N 0.67 1.27 -0.86 2.25 2.07 -1.48 -0.66 116.25 119.51 1l1m h VAL 9 Ca 0.01 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 66.14 1l1m h VAL 9 Cb 1.18 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.05 1l1m h VAL 9 CO 0.13 0.48 0.54 0.00 0.02 0.00 0.00 177.57 178.74 1l1m h ALA 10 N 0.86 1.34 0.00 1.67 0.00 -1.12 0.31 119.26 122.32 1l1m h ALA 10 Ca 0.11 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 1l1m h ALA 10 Cb 0.81 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1l1m h ALA 10 CO 0.07 0.59 -0.59 1.49 0.00 0.00 0.00 179.25 180.80 1l1m h GLU 11 N 1.17 0.00 0.19 0.00 4.81 -1.01 0.31 114.58 120.05 1l1m h GLU 11 Ca 0.31 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 59.23 1l1m h GLU 11 Cb -0.09 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.31 1l1m h GLU 11 CO -0.06 0.59 -1.36 -0.92 -0.73 0.00 0.00 179.01 176.53 1l1m h TYR 12 N 0.00 0.83 0.00 0.92 5.03 -0.08 -3.30 116.97 120.37 1l1m h TYR 12 Ca -0.01 -0.59 0.00 0.00 2.58 0.00 0.00 58.73 60.72 1l1m h TYR 12 Cb 1.15 -0.04 0.00 0.00 1.55 0.00 0.00 36.73 39.39 1l1m h TYR 12 CO 0.00 1.45 -0.64 0.00 -1.32 0.00 0.00 178.16 177.66 1l1m n ALA 13 N -2.65 2.94 -2.60 1.82 0.00 1.00 -4.95 120.51 116.07 1l1m n ALA 13 Ca -0.14 -0.25 -0.02 0.00 0.00 0.00 0.00 53.44 53.03 1l1m n ALA 13 Cb 1.06 -1.17 0.01 0.00 0.00 0.00 0.00 19.45 19.35 1l1m n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l1m n GLY 14 N 1.34 0.81 0.19 0.00 0.00 0.16 -4.92 105.19 102.76 1l1m n GLY 14 Ca 0.03 -0.59 -0.01 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.75 0.00 -3.74 1.61 0.24 0.85 -5.02 118.33 109.51 1l1m n VAL 15 Ca 0.00 -0.14 -0.25 0.00 -2.04 0.00 0.00 64.34 61.91 1l1m n VAL 15 Cb 0.51 0.06 -0.03 0.00 -1.47 0.00 0.00 33.84 32.91 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 -1.14 6.35 0.37 -1.34 0.01 -1.26 -4.32 113.70 112.37 1l1m s SER 16 Ca 0.02 0.31 0.06 0.00 1.31 0.00 0.00 55.95 57.64 1l1m s SER 16 Cb 0.00 -1.97 0.77 0.00 0.21 0.00 0.00 66.02 65.03 1l1m s SER 16 CO 0.01 -0.07 1.99 0.10 0.41 0.00 0.00 173.24 175.68 1l1m h TYR 17 N 1.66 0.70 -0.26 2.43 -0.00 -1.92 0.62 116.97 120.22 1l1m h TYR 17 Ca -0.49 0.02 -0.06 0.00 -0.00 0.00 0.00 58.73 58.20 1l1m h TYR 17 Cb 1.20 -0.23 -0.01 0.00 -0.00 0.00 0.00 36.73 37.69 1l1m h TYR 17 CO 0.52 0.39 -0.09 0.37 -0.00 0.00 0.00 178.16 179.36 1l1m h GLN 18 N 0.71 0.41 -0.34 0.10 5.75 -1.94 0.42 115.11 120.22 1l1m h GLN 18 Ca 0.27 -0.10 -0.09 0.00 -0.15 0.00 0.00 58.65 58.58 1l1m h GLN 18 Cb 0.17 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.66 1l1m h GLN 18 CO -0.08 0.51 -0.13 1.15 -2.65 0.00 0.00 178.83 177.63 1l1m h THR 19 N 0.39 1.29 0.39 2.39 2.02 -1.32 0.16 112.91 118.22 1l1m h THR 19 Ca 0.08 -1.22 -0.02 0.00 0.77 0.00 0.00 66.41 66.02 1l1m h THR 19 Cb 0.40 1.37 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 1l1m h THR 19 CO 0.02 0.40 -0.19 0.58 0.37 0.00 0.00 175.52 176.70 1l1m h VAL 20 N 0.46 0.61 -0.03 3.16 2.07 -0.65 -1.78 116.25 120.10 1l1m h VAL 20 Ca 0.08 -0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.58 1l1m h VAL 20 Cb 0.65 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1l1m h VAL 20 CO 0.04 0.00 -0.06 -1.28 0.02 0.00 0.00 177.57 176.30 1l1m h SER 21 N -0.53 0.04 -0.66 0.57 0.87 -0.88 0.27 113.55 113.23 1l1m h SER 21 Ca -0.05 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.47 1l1m h SER 21 Cb 0.41 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.33 1l1m h SER 21 CO 0.09 0.10 0.29 -0.09 -0.53 0.00 0.00 176.83 176.70 1l1m h ARG 22 N 0.04 0.99 0.23 2.24 9.65 -0.16 0.48 114.38 127.86 1l1m h ARG 22 Ca 0.01 -0.15 -0.32 0.00 -1.10 0.00 0.00 59.98 58.42 1l1m h ARG 22 Cb 0.13 -0.18 0.03 0.00 -1.39 0.00 0.00 29.97 28.57 1l1m h ARG 22 CO 0.01 0.79 -1.42 0.28 2.80 0.00 0.00 179.97 182.43 1l1m h VAL 23 N 0.98 1.27 -0.72 0.20 2.07 -0.27 -2.72 116.25 117.07 1l1m h VAL 23 Ca 0.23 -2.65 0.02 0.00 0.82 0.00 0.00 66.70 65.13 1l1m h VAL 23 Cb 0.15 3.03 -0.04 0.00 -1.52 0.00 0.00 31.29 32.92 1l1m h VAL 23 CO -0.02 0.80 0.46 0.58 0.02 0.00 0.00 177.57 179.41 1l1m h VAL 24 N 0.06 1.14 0.00 2.57 2.07 -0.28 -2.08 116.25 119.72 1l1m h VAL 24 Ca -0.25 -0.32 -0.11 0.00 0.82 0.00 0.00 66.70 66.84 1l1m h VAL 24 Cb 2.08 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 1l1m h VAL 24 CO 0.24 0.17 -0.53 0.78 0.02 0.00 0.00 177.57 178.25 1l1m h ASN 25 N 0.92 0.00 -5.75 0.57 2.35 -1.00 -3.47 115.58 109.19 1l1m h ASN 25 Ca 0.28 0.00 -0.38 0.00 -0.55 0.00 0.00 56.30 55.64 1l1m h ASN 25 Cb -0.04 0.00 0.14 0.00 0.05 0.00 0.00 38.32 38.47 1l1m h ASN 25 CO -0.09 0.53 -0.69 0.00 -1.65 0.00 0.00 177.43 175.54 1l1m n GLN 26 N -3.60 -7.67 0.00 0.81 1.13 -0.79 -5.00 117.38 102.27 1l1m n GLN 26 Ca -0.00 0.82 0.00 0.00 -1.94 0.00 0.00 57.00 55.88 1l1m n GLN 26 Cb 0.60 -5.84 0.00 0.00 0.11 0.00 0.00 30.24 25.11 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 -4.83 0.00 -1.93 -1.58 0.00 -1.23 -5.08 120.51 105.86 1l1m n ALA 27 Ca -0.04 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.13 1l1m n ALA 27 Cb 0.58 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.12 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 -0.72 4.45 -1.47 0.00 0.01 -1.26 -4.35 113.70 110.36 1l1m s SER 28 Ca 0.00 0.43 -0.02 0.00 1.31 0.00 0.00 55.95 57.67 1l1m s SER 28 Cb 0.00 -0.93 0.00 0.00 0.21 0.00 0.00 66.02 65.30 1l1m s SER 28 CO 0.00 -1.86 0.32 1.41 0.41 0.00 0.00 173.24 173.52 1l1m n HIS 29 N -3.13 -1.39 -4.10 2.43 8.25 -1.26 -5.00 115.22 111.02 1l1m n HIS 29 Ca 0.10 0.27 -0.33 0.00 -0.26 0.00 0.00 57.72 57.51 1l1m n HIS 29 Cb 0.60 -3.93 -0.16 0.00 1.12 0.00 0.00 29.99 27.63 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 -3.03 2.06 0.30 1.59 1.01 -1.26 -5.00 120.40 116.06 1l1m s VAL 30 Ca 0.16 -1.12 -0.12 0.00 0.00 0.00 0.00 61.98 60.90 1l1m s VAL 30 Cb -0.07 -1.96 -0.08 0.00 0.00 0.00 0.00 36.38 34.28 1l1m s VAL 30 CO 0.20 0.37 0.67 -0.94 0.00 0.00 0.00 175.10 175.40 1l1m s SER 31 N 1.25 6.68 0.49 3.32 1.04 -1.26 -4.97 113.70 120.24 1l1m s SER 31 Ca 0.01 1.11 0.22 0.00 0.48 0.00 0.00 55.95 57.77 1l1m s SER 31 Cb -0.15 -2.31 1.24 0.00 0.10 0.00 0.00 66.02 64.91 1l1m s SER 31 CO -0.11 -0.18 2.03 0.00 0.98 0.00 0.00 173.24 175.96 1l1m h ALA 32 N 2.21 1.44 0.22 5.32 0.00 -1.99 -1.12 119.26 125.34 1l1m h ALA 32 Ca -0.47 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1l1m h ALA 32 Cb 1.17 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1l1m h ALA 32 CO 0.66 0.20 -0.11 0.87 0.00 0.00 0.00 179.25 180.88 1l1m h LYS 33 N 0.00 -0.28 0.00 0.00 1.57 -2.00 -2.17 116.57 113.69 1l1m h LYS 33 Ca -0.00 0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.62 1l1m h LYS 33 Cb 0.35 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1l1m h LYS 33 CO 0.02 -0.12 -0.87 1.79 -0.57 0.00 0.00 179.45 179.71 1l1m h THR 34 N -0.39 1.56 -0.94 -0.16 1.35 -1.94 -3.22 112.91 109.17 1l1m h THR 34 Ca -0.03 -3.03 0.02 0.00 -0.55 0.00 0.00 66.41 62.82 1l1m h THR 34 Cb 0.30 2.66 -0.05 0.00 -1.73 0.00 0.00 68.15 69.33 1l1m h THR 34 CO 0.05 0.85 0.62 -0.09 -0.25 0.00 0.00 175.52 176.70 1l1m h ARG 35 N 0.00 1.20 0.00 4.72 2.43 -1.11 0.40 114.38 122.02 1l1m h ARG 35 Ca -0.01 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.05 1l1m h ARG 35 Cb 1.60 -0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 30.87 1l1m h ARG 35 CO 0.11 0.79 -0.18 0.93 -1.51 0.00 0.00 179.97 180.12 1l1m h GLU 36 N 1.24 0.00 0.00 0.20 5.08 -1.45 -2.68 114.58 116.97 1l1m h GLU 36 Ca 0.36 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.50 1l1m h GLU 36 Cb -0.09 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 1l1m h GLU 36 CO -0.09 0.18 -1.63 0.36 -1.00 0.00 0.00 179.01 176.83 1l1m n LYS 37 N -3.18 0.63 0.01 2.33 2.85 -0.83 -3.26 118.16 116.71 1l1m n LYS 37 Ca 0.02 0.20 -0.18 0.00 -1.05 0.00 0.00 58.31 57.31 1l1m n LYS 37 Cb 0.55 -1.76 -0.13 0.00 -0.65 0.00 0.00 35.03 33.05 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 1.50 0.00 0.58 2.07 -0.97 -2.07 116.25 117.36 1l1m h VAL 38 Ca -0.23 -2.24 -0.04 0.00 0.82 0.00 0.00 66.70 65.01 1l1m h VAL 38 Cb 1.75 2.90 -0.01 0.00 -1.52 0.00 0.00 31.29 34.42 1l1m h VAL 38 CO 0.05 0.64 -0.17 -0.33 0.02 0.00 0.00 177.57 177.77 1l1m h GLU 39 N -0.32 0.00 0.02 1.57 5.08 -1.65 -0.36 114.58 118.92 1l1m h GLU 39 Ca -0.09 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.04 1l1m h GLU 39 Cb 1.37 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.59 1l1m h GLU 39 CO 0.11 0.17 -1.14 0.00 -1.00 0.00 0.00 179.01 177.16 1l1m h ALA 40 N 1.83 0.38 0.05 3.43 0.00 -1.57 -3.22 119.26 120.16 1l1m h ALA 40 Ca -0.00 -0.99 -0.21 0.00 0.00 0.00 0.00 54.91 53.71 1l1m h ALA 40 Cb 0.47 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.24 1l1m h ALA 40 CO 0.02 1.26 -0.84 0.00 0.00 0.00 0.00 179.25 179.70 1l1m h ALA 41 N 0.94 0.03 0.00 0.00 0.00 -0.65 -3.18 119.26 116.39 1l1m h ALA 41 Ca -0.07 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1l1m h ALA 41 Cb 1.83 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.69 1l1m h ALA 41 CO 0.13 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.85 1l1m n MET 42 N -4.06 0.07 0.05 0.00 3.85 -0.21 -1.23 117.12 115.59 1l1m n MET 42 Ca -0.12 0.40 0.12 0.00 -1.00 0.00 0.00 57.70 57.10 1l1m n MET 42 Cb 0.80 -1.65 0.08 0.00 -1.05 0.00 0.00 33.22 31.39 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 -1.61 3.03 -0.05 3.17 0.00 -1.20 -0.70 120.51 123.16 1l1m n ALA 43 Ca 0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 53.44 53.13 1l1m n ALA 43 Cb 0.13 -1.08 -0.01 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 -3.36 114.58 114.40 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 0.79 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1l1m h GLU 44 CO 0.00 0.00 0.00 1.47 -1.16 0.00 0.00 179.01 179.32 1l1m n LEU 45 N -4.27 0.00 -3.12 1.33 -0.00 -1.14 -4.90 117.00 104.89 1l1m n LEU 45 Ca -0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.87 1l1m n LEU 45 Cb 0.12 0.00 0.05 0.00 -0.00 0.00 0.00 43.42 43.59 1l1m n LEU 45 CO 0.05 0.00 0.11 0.59 -0.00 0.00 0.00 177.39 178.13 1l1m n ASN 46 N -0.82 -6.72 -4.75 1.45 5.03 -1.20 -4.90 115.26 103.35 1l1m n ASN 46 Ca 0.14 -0.52 -0.41 0.00 0.87 0.00 0.00 54.58 54.65 1l1m n ASN 46 Cb 0.06 -5.03 -0.02 0.00 -1.02 0.00 0.00 39.78 33.77 1l1m n ASN 46 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1l1m s TYR 47 N -3.28 2.88 -0.36 3.10 5.04 0.13 -4.55 117.35 120.31 1l1m s TYR 47 Ca 0.33 0.95 -0.04 0.00 -2.44 0.00 0.00 57.07 55.86 1l1m s TYR 47 Cb -0.04 -3.93 0.07 0.00 0.35 0.00 0.00 41.96 38.41 1l1m s TYR 47 CO 0.71 -3.04 0.13 0.42 -1.34 0.00 0.00 175.55 172.43 1l1m s ILE 48 N -0.11 3.48 -0.69 3.14 -1.09 -1.21 -4.94 121.20 119.77 1l1m s ILE 48 Ca 0.60 -1.54 -0.26 0.00 -2.23 0.00 0.00 60.65 57.22 1l1m s ILE 48 Cb -0.45 -3.14 -0.06 0.00 -1.58 0.00 0.00 42.46 37.24 1l1m s ILE 48 CO 0.47 -0.38 2.12 -2.84 -1.23 0.00 0.00 174.94 173.08 1l1m s PRO 49 N 1.28 2.27 -0.28 2.79 0.02 -1.26 -4.60 135.00 135.22 1l1m s PRO 49 Ca 0.01 0.55 -0.28 0.00 0.02 0.00 0.00 61.00 61.31 1l1m s PRO 49 Cb -0.21 -4.68 -0.05 0.00 0.02 0.00 0.00 34.50 29.57 1l1m s PRO 49 CO -0.01 -3.37 2.23 -0.80 -0.33 0.00 0.00 177.00 174.72 1l1m s ASN 50 N 9.64 5.27 0.38 2.53 0.01 -1.26 -4.82 114.94 126.68 1l1m s ASN 50 Ca 0.80 1.67 0.21 0.00 -0.71 0.00 0.00 52.86 54.83 1l1m s ASN 50 Cb -0.12 -2.51 0.47 0.00 0.41 0.00 0.00 41.25 39.50 1l1m s ASN 50 CO 0.14 -2.14 1.63 0.08 -1.51 0.00 0.00 177.10 175.31 1l1m h ARG 51 N 15.84 0.00 0.01 -0.60 0.11 -1.99 -2.84 114.38 124.90 1l1m h ARG 51 Ca -0.37 0.00 -0.26 0.00 0.10 0.00 0.00 59.98 59.45 1l1m h ARG 51 Cb 1.24 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.34 1l1m h ARG 51 CO 1.01 0.28 -1.05 0.00 0.10 0.00 0.00 179.97 180.31 1l1m h ALA 53 N 0.46 1.26 -0.49 0.00 0.00 -1.95 -2.37 119.26 116.17 1l1m h ALA 53 Ca -0.13 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 1l1m h ALA 53 Cb 1.70 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.39 1l1m h ALA 53 CO 0.20 0.51 -0.10 1.96 0.00 0.00 0.00 179.25 181.82 1l1m h GLN 54 N 0.16 0.89 0.00 0.00 4.20 -1.40 0.26 115.11 119.21 1l1m h GLN 54 Ca 0.02 -0.31 -0.05 0.00 0.06 0.00 0.00 58.65 58.37 1l1m h GLN 54 Cb 0.69 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 1l1m h GLN 54 CO 0.05 0.95 -0.24 1.96 -0.67 0.00 0.00 178.83 180.89 1l1m h GLN 55 N 0.80 0.00 0.00 1.46 1.08 -0.92 0.13 115.11 117.66 1l1m h GLN 55 Ca 0.13 0.00 -0.13 0.00 -1.45 0.00 0.00 58.65 57.20 1l1m h GLN 55 Cb 0.62 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.03 1l1m h GLN 55 CO 0.04 0.24 -0.76 1.25 -0.95 0.00 0.00 178.83 178.65 1l1m h LEU 56 N 0.00 0.00 -1.59 1.46 5.85 -1.05 -3.25 115.31 116.74 1l1m h LEU 56 Ca -0.00 -0.57 -0.04 0.00 0.84 0.00 0.00 57.88 58.10 1l1m h LEU 56 Cb 0.54 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1l1m h LEU 56 CO 0.03 1.23 -0.20 0.00 -0.34 0.00 0.00 178.44 179.15 1l1m h ALA 57 N -0.43 1.66 -0.74 1.25 0.00 -0.51 -1.47 119.26 119.04 1l1m h ALA 57 Ca -0.20 -0.19 -0.29 0.00 0.00 0.00 0.00 54.91 54.23 1l1m h ALA 57 Cb 1.07 -0.03 -0.17 0.00 0.00 0.00 0.00 17.79 18.65 1l1m h ALA 57 CO -0.12 0.26 0.37 0.41 0.00 0.00 0.00 179.25 180.17 1l1m n GLY 58 N -0.95 3.68 0.94 0.00 0.00 0.45 -4.15 105.19 105.16 1l1m n GLY 58 Ca -0.02 -0.89 0.08 0.00 0.00 0.00 0.00 46.02 45.18 1l1m n GLY 58 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1l1m n LYS 59 N -0.42 2.90 -2.40 1.61 3.00 -0.55 -4.94 118.16 117.37 1l1m n LYS 59 Ca 0.42 -2.87 -0.40 0.00 -0.00 0.00 0.00 58.31 55.46 1l1m n LYS 59 Cb 1.36 -1.86 -0.03 0.00 0.00 0.00 0.00 35.03 34.50 1l1m n LYS 59 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 1l1m s GLN 60 N -2.86 3.06 0.05 1.64 -0.21 -1.26 -4.96 119.66 115.12 1l1m s GLN 60 Ca 0.43 -0.12 0.04 0.00 0.02 0.00 0.00 55.36 55.73 1l1m s GLN 60 Cb 0.35 -4.40 -0.02 0.00 1.00 0.00 0.00 33.01 29.94 1l1m s GLN 60 CO 0.09 -2.36 -0.11 -1.12 -2.12 0.00 0.00 175.29 169.66 1l1m s SER 61 N 5.17 1.29 0.00 5.90 0.01 -1.26 -5.21 113.70 119.59 1l1m s SER 61 Ca 0.46 -0.52 0.00 0.00 1.31 0.00 0.00 55.95 57.20 1l1m s SER 61 Cb -0.08 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.12 1l1m s SER 61 CO 0.13 -0.09 0.00 0.18 0.41 0.00 0.00 173.24 173.87