#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmq n ARG 3 N 0.00 0.26 0.00 0.00 0.63 -1.26 -4.75 116.66 111.54 1xmq n ARG 3 Ca 0.00 0.03 0.00 0.00 -0.92 0.00 0.00 57.85 56.96 1xmq n ARG 3 Cb 0.00 -1.62 0.00 0.00 0.45 0.00 0.00 32.46 31.29 1xmq n ARG 3 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1xmq n ARG 4 N -1.97 0.00 -3.88 -0.14 1.74 -1.26 -5.06 116.66 106.09 1xmq n ARG 4 Ca 0.03 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.79 1xmq n ARG 4 Cb 0.43 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.82 1xmq n ARG 4 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1xmq s ARG 5 N 0.00 3.47 -1.06 5.56 0.52 -1.26 -5.00 118.95 121.17 1xmq s ARG 5 Ca 0.00 -0.35 -0.24 0.00 -0.52 0.00 0.00 55.73 54.62 1xmq s ARG 5 Cb 0.00 -3.04 -0.11 0.00 0.52 0.00 0.00 34.95 32.32 1xmq s ARG 5 CO 0.00 0.62 2.02 0.50 0.02 0.00 0.00 175.30 178.45 1xmq s ARG 6 N -2.31 2.17 0.03 3.54 3.52 -1.26 -4.87 118.95 119.77 1xmq s ARG 6 Ca 0.33 -0.66 -0.12 0.00 -0.13 0.00 0.00 55.73 55.15 1xmq s ARG 6 Cb -0.13 -5.11 -0.06 0.00 -1.56 0.00 0.00 34.95 28.09 1xmq s ARG 6 CO 0.24 -4.19 0.27 0.00 -0.81 0.00 0.00 175.30 170.82 1xmq n ALA 7 N 15.74 -1.61 -2.66 6.12 0.00 -1.26 -4.92 120.51 131.91 1xmq n ALA 7 Ca 0.43 0.18 -0.35 0.00 0.00 0.00 0.00 53.44 53.70 1xmq n ALA 7 Cb 0.46 -0.58 -0.05 0.00 0.00 0.00 0.00 19.45 19.28 1xmq n ALA 7 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1xmq s GLU 8 N -0.17 3.68 0.32 0.00 4.04 -1.26 -5.06 118.70 120.25 1xmq s GLU 8 Ca 0.26 0.07 -0.29 0.00 0.04 0.00 0.00 54.97 55.06 1xmq s GLU 8 Cb -0.38 -3.06 -0.10 0.00 0.02 0.00 0.00 34.13 30.62 1xmq s GLU 8 CO 0.19 0.62 1.24 0.08 -1.84 0.00 0.00 175.26 175.55 1xmq s VAL 9 N -1.32 2.95 -0.00 1.83 1.01 -1.26 -4.98 120.40 118.63 1xmq s VAL 9 Ca 0.29 0.94 -0.30 0.00 0.00 0.00 0.00 61.98 62.91 1xmq s VAL 9 Cb -0.14 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 1xmq s VAL 9 CO 0.16 0.21 1.16 -0.13 0.00 0.00 0.00 175.10 176.51 1xmq s ARG 10 N -1.75 4.41 -0.23 2.72 0.52 -1.26 -4.99 118.95 118.37 1xmq s ARG 10 Ca 0.48 1.67 -0.22 0.00 -0.52 0.00 0.00 55.73 57.14 1xmq s ARG 10 Cb -0.37 -3.46 -0.02 0.00 0.52 0.00 0.00 34.95 31.63 1xmq s ARG 10 CO 0.49 -0.31 0.71 -0.65 0.02 0.00 0.00 175.30 175.56 1xmq s GLN 11 N 1.58 4.17 0.25 3.54 1.11 -1.26 -5.04 119.66 124.01 1xmq s GLN 11 Ca 0.56 0.74 -0.10 0.00 0.01 0.00 0.00 55.36 56.57 1xmq s GLN 11 Cb -0.26 -3.63 -0.07 0.00 -1.01 0.00 0.00 33.01 28.04 1xmq s GLN 11 CO 0.26 -0.40 0.58 -0.51 0.01 0.00 0.00 175.29 175.22 1xmq s LEU 12 N 2.46 4.14 0.51 2.90 1.02 -1.26 -5.06 118.68 123.39 1xmq s LEU 12 Ca 0.31 0.97 -0.21 0.00 0.02 0.00 0.00 54.13 55.21 1xmq s LEU 12 Cb -0.16 -3.74 -0.06 0.00 0.02 0.00 0.00 46.19 42.25 1xmq s LEU 12 CO 0.09 -0.10 1.20 -1.10 0.02 0.00 0.00 176.35 176.46 1xmq s GLN 13 N -2.89 3.44 0.74 1.70 -1.52 -1.26 -4.89 119.66 114.98 1xmq s GLN 13 Ca 0.48 1.84 -0.14 0.00 -1.95 0.00 0.00 55.36 55.60 1xmq s GLN 13 Cb -0.11 -2.23 0.05 0.00 -0.22 0.00 0.00 33.01 30.50 1xmq s GLN 13 CO 0.21 -0.84 1.16 -1.25 -0.25 0.00 0.00 175.29 174.33 1xmq s PRO 14 N -2.95 2.15 0.45 2.91 0.04 -1.26 -4.64 135.00 131.70 1xmq s PRO 14 Ca 0.69 1.58 -0.25 0.00 0.04 0.00 0.00 61.00 63.06 1xmq s PRO 14 Cb -0.30 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 1xmq s PRO 14 CO 0.35 -1.79 1.29 -3.47 0.04 0.00 0.00 177.00 173.43 1xmq n ASP 15 N -2.94 2.59 0.06 6.66 4.64 -0.63 -4.81 116.55 122.13 1xmq n ASP 15 Ca 0.12 1.08 0.09 0.00 -1.38 0.00 0.00 54.79 54.70 1xmq n ASP 15 Cb 0.51 -1.52 0.37 0.00 -1.04 0.00 0.00 41.12 39.45 1xmq n ASP 15 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 1xmq n LEU 16 N -0.01 0.30 0.00 -2.67 7.99 -1.26 -2.24 117.00 119.12 1xmq n LEU 16 Ca 0.07 0.58 0.00 0.00 -0.01 0.00 0.00 56.01 56.66 1xmq n LEU 16 Cb 0.41 -0.55 0.00 0.00 -0.11 0.00 0.00 43.42 43.16 1xmq n LEU 16 CO 0.58 -0.45 0.00 0.52 -1.51 0.00 0.00 177.39 176.53 1xmq n VAL 17 N -1.85 0.00 0.91 4.08 0.31 -1.26 -4.82 118.33 115.70 1xmq n VAL 17 Ca 0.02 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.47 1xmq n VAL 17 Cb 0.17 -0.69 0.53 0.00 -0.91 0.00 0.00 33.84 32.94 1xmq n VAL 17 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1xmq n TYR 18 N -1.65 0.00 -0.73 3.52 4.02 -1.26 -4.87 117.16 116.18 1xmq n TYR 18 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1xmq n TYR 18 Cb 0.00 -0.43 0.00 0.00 -0.02 0.00 0.00 39.34 38.89 1xmq n TYR 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1xmq n GLY 19 N 0.85 0.44 3.75 2.72 0.00 -0.95 -4.83 105.19 107.17 1xmq n GLY 19 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1xmq n GLY 19 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xmq s ASP 20 N -2.43 7.38 0.03 1.61 -1.08 -1.26 -2.75 116.67 118.16 1xmq s ASP 20 Ca 0.00 2.15 -0.18 0.00 -0.52 0.00 0.00 52.55 54.01 1xmq s ASP 20 Cb 0.00 -2.62 -0.25 0.00 -1.46 0.00 0.00 42.92 38.59 1xmq s ASP 20 CO 0.00 -0.07 1.10 -0.37 0.52 0.00 0.00 175.17 176.35 1xmq h VAL 21 N 3.20 1.37 -0.90 1.11 -1.51 -1.90 -1.66 116.25 115.95 1xmq h VAL 21 Ca -0.46 -2.25 0.24 0.00 -1.23 0.00 0.00 66.70 63.01 1xmq h VAL 21 Cb 1.21 2.63 -0.14 0.00 -2.13 0.00 0.00 31.29 32.86 1xmq h VAL 21 CO 0.68 0.67 0.33 0.25 -1.23 0.00 0.00 177.57 178.27 1xmq h LEU 22 N 0.08 0.17 -0.40 4.19 5.85 -1.93 0.15 115.31 123.42 1xmq h LEU 22 Ca -0.12 0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1xmq h LEU 22 Cb 1.57 0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.80 1xmq h LEU 22 CO 0.17 -0.11 0.18 0.58 -0.34 0.00 0.00 178.44 178.92 1xmq h VAL 23 N 0.28 1.19 -0.25 1.05 2.07 -1.98 -1.81 116.25 116.81 1xmq h VAL 23 Ca 0.58 -0.55 0.03 0.00 0.82 0.00 0.00 66.70 67.58 1xmq h VAL 23 Cb 1.19 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 1xmq h VAL 23 CO -0.61 0.20 0.04 0.74 0.02 0.00 0.00 177.57 177.96 1xmq h THR 24 N 0.51 0.87 -0.55 2.57 2.02 -0.85 0.28 112.91 117.76 1xmq h THR 24 Ca 0.14 -0.04 0.09 0.00 0.77 0.00 0.00 66.41 67.36 1xmq h THR 24 Cb 0.16 0.73 -0.11 0.00 -1.74 0.00 0.00 68.15 67.19 1xmq h THR 24 CO -0.01 0.02 -0.40 0.00 0.37 0.00 0.00 175.52 175.50 1xmq h ALA 25 N 1.18 -0.26 -1.00 6.16 0.00 -0.85 0.33 119.26 124.82 1xmq h ALA 25 Ca 0.11 0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.21 1xmq h ALA 25 Cb 0.12 0.90 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 1xmq h ALA 25 CO -0.16 -0.79 0.65 0.35 0.00 0.00 0.00 179.25 179.30 1xmq h PHE 26 N -0.22 1.20 -0.62 0.00 3.57 -0.52 -0.45 116.94 119.89 1xmq h PHE 26 Ca 0.19 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 1xmq h PHE 26 Cb 0.56 -0.39 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 1xmq h PHE 26 CO -0.67 0.60 0.28 0.82 -2.23 0.00 0.00 178.31 177.11 1xmq h ILE 27 N 1.16 1.22 -0.67 1.41 2.04 0.13 -1.40 117.51 121.40 1xmq h ILE 27 Ca 0.44 -0.65 0.01 0.00 1.00 0.00 0.00 64.86 65.67 1xmq h ILE 27 Cb 0.21 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 1xmq h ILE 27 CO -0.18 0.26 0.44 0.78 0.00 0.00 0.00 178.15 179.45 1xmq h ASN 28 N 0.85 0.76 0.64 1.72 4.21 0.11 0.43 115.58 124.30 1xmq h ASN 28 Ca 0.21 -0.02 -0.12 0.00 1.21 0.00 0.00 56.30 57.58 1xmq h ASN 28 Cb 0.15 -0.19 -0.02 0.00 -1.12 0.00 0.00 38.32 37.14 1xmq h ASN 28 CO -0.02 0.54 -0.58 0.11 -1.29 0.00 0.00 177.43 176.19 1xmq h LYS 29 N 0.89 0.00 0.07 0.81 1.79 -0.72 -3.01 116.57 116.41 1xmq h LYS 29 Ca 0.25 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.45 1xmq h LYS 29 Cb -0.08 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 30.59 1xmq h LYS 29 CO -0.06 0.58 -1.14 0.82 -1.08 0.00 0.00 179.45 178.57 1xmq h ILE 30 N 0.00 1.34 -3.67 1.86 2.04 -0.08 -3.46 117.51 115.55 1xmq h ILE 30 Ca -0.01 -2.52 -0.56 0.00 1.00 0.00 0.00 64.86 62.77 1xmq h ILE 30 Cb 1.06 2.61 0.17 0.00 -0.74 0.00 0.00 36.82 39.92 1xmq h ILE 30 CO 0.08 0.76 0.12 0.80 0.00 0.00 0.00 178.15 179.91 1xmq n MET 31 N -3.75 0.76 -3.66 2.37 1.56 0.14 -4.96 117.12 109.58 1xmq n MET 31 Ca -0.11 0.31 -0.08 0.00 -0.27 0.00 0.00 57.70 57.55 1xmq n MET 31 Cb 0.94 -2.20 -0.08 0.00 2.15 0.00 0.00 33.22 34.03 1xmq n MET 31 CO 0.00 0.00 0.00 -0.98 -0.73 0.00 0.00 175.97 174.26 1xmq s ARG 32 N -2.98 0.56 -0.44 2.12 1.70 -1.26 -4.88 118.95 113.78 1xmq s ARG 32 Ca 0.76 1.09 0.00 0.00 -0.47 0.00 0.00 55.73 57.11 1xmq s ARG 32 Cb -0.39 0.17 0.00 0.00 -0.57 0.00 0.00 34.95 34.16 1xmq s ARG 32 CO 0.47 -0.16 0.00 -0.25 -1.08 0.00 0.00 175.30 174.28 1xmq n ASP 33 N 4.49 -2.60 -0.99 -2.89 8.00 -1.26 -3.42 116.55 117.88 1xmq n ASP 33 Ca -0.20 0.04 -0.13 0.00 0.71 0.00 0.00 54.79 55.21 1xmq n ASP 33 Cb 0.56 -1.50 -0.06 0.00 -0.02 0.00 0.00 41.12 40.10 1xmq n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xmq n GLY 34 N -1.47 1.30 2.77 0.44 0.00 -1.26 -4.88 105.19 102.08 1xmq n GLY 34 Ca -0.05 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 1xmq n GLY 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xmq n LYS 35 N -1.79 3.88 0.00 1.61 5.02 -1.22 -4.75 118.16 120.91 1xmq n LYS 35 Ca -0.13 -3.53 0.03 0.00 -2.02 0.00 0.00 58.31 52.66 1xmq n LYS 35 Cb 0.53 -2.84 0.12 0.00 -0.02 0.00 0.00 35.03 32.82 1xmq n LYS 35 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1xmq n LYS 36 N 3.27 0.01 0.00 1.97 4.81 -1.26 -2.21 118.16 124.75 1xmq n LYS 36 Ca 0.45 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 58.28 1xmq n LYS 36 Cb 0.33 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.88 1xmq n LYS 36 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1xmq n ASN 37 N -1.48 0.00 -0.19 3.14 4.05 -1.26 -2.13 115.26 117.38 1xmq n ASN 37 Ca 0.01 0.44 0.20 0.00 0.45 0.00 0.00 54.58 55.69 1xmq n ASN 37 Cb 0.07 -0.39 0.56 0.00 1.23 0.00 0.00 39.78 41.25 1xmq n ASN 37 CO 0.00 0.00 0.00 0.17 -3.05 0.00 0.00 177.26 174.38 1xmq h LEU 38 N 0.00 0.29 -0.17 1.20 8.10 -1.98 0.81 115.31 123.55 1xmq h LEU 38 Ca 0.00 0.03 0.05 0.00 0.11 0.00 0.00 57.88 58.06 1xmq h LEU 38 Cb 0.00 -0.03 -0.07 0.00 -0.44 0.00 0.00 40.66 40.12 1xmq h LEU 38 CO 0.00 0.13 -0.39 0.00 -4.11 0.00 0.00 178.44 174.07 1xmq h ALA 39 N 1.62 -0.49 -0.24 0.17 0.00 -1.54 0.24 119.26 119.02 1xmq h ALA 39 Ca 0.42 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 1xmq h ALA 39 Cb 1.17 0.74 -0.01 0.00 0.00 0.00 0.00 17.79 19.69 1xmq h ALA 39 CO -0.12 -0.87 0.11 0.00 0.00 0.00 0.00 179.25 178.37 1xmq h ALA 40 N 0.27 0.32 -0.10 0.00 0.00 0.95 -2.91 119.26 117.79 1xmq h ALA 40 Ca 0.09 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1xmq h ALA 40 Cb 0.60 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1xmq h ALA 40 CO -0.41 -0.10 -0.43 0.00 0.00 0.00 0.00 179.25 178.30 1xmq h ARG 41 N 0.25 -0.50 -0.77 0.00 3.08 0.34 -1.23 114.38 115.55 1xmq h ARG 41 Ca 0.08 0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.26 1xmq h ARG 41 Cb 0.15 0.11 -0.12 0.00 0.08 0.00 0.00 29.97 30.20 1xmq h ARG 41 CO -0.01 -0.33 -0.51 0.82 -1.07 0.00 0.00 179.97 178.87 1xmq h ILE 42 N -0.52 0.03 -0.07 2.04 2.04 -0.45 0.39 117.51 120.97 1xmq h ILE 42 Ca 0.07 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.94 1xmq h ILE 42 Cb 0.64 0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1xmq h ILE 42 CO -0.38 0.00 0.05 0.15 0.00 0.00 0.00 178.15 177.97 1xmq h PHE 43 N -0.14 0.00 0.08 1.37 3.57 -1.20 0.14 116.94 120.76 1xmq h PHE 43 Ca 0.18 0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.47 1xmq h PHE 43 Cb 0.52 0.00 0.02 0.00 2.79 0.00 0.00 35.95 39.28 1xmq h PHE 43 CO -0.86 0.00 -0.89 1.88 -2.23 0.00 0.00 178.31 176.22 1xmq h TYR 44 N 0.00 0.74 0.00 0.41 0.99 0.76 -2.02 116.97 117.86 1xmq h TYR 44 Ca 0.03 -0.46 -0.01 0.00 2.00 0.00 0.00 58.73 60.29 1xmq h TYR 44 Cb 0.14 -0.06 -0.00 0.00 1.00 0.00 0.00 36.73 37.80 1xmq h TYR 44 CO 0.00 1.31 -0.04 -0.44 -0.00 0.00 0.00 178.16 178.99 1xmq h ASP 45 N -0.03 0.00 -0.18 3.88 3.32 0.14 -0.68 116.42 122.87 1xmq h ASP 45 Ca -0.13 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.76 1xmq h ASP 45 Cb 1.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.17 1xmq h ASP 45 CO 0.17 0.04 -0.49 0.00 -1.72 0.00 0.00 179.24 177.25 1xmq h ALA 46 N 1.96 0.30 -0.02 3.45 0.00 -0.51 -2.38 119.26 122.06 1xmq h ALA 46 Ca -0.00 -0.49 -0.07 0.00 0.00 0.00 0.00 54.91 54.35 1xmq h ALA 46 Cb 0.20 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1xmq h ALA 46 CO 0.01 0.47 -0.33 0.00 0.00 0.00 0.00 179.25 179.40 1xmq h LYS 48 N 0.02 0.57 0.00 0.00 1.79 -1.28 -2.38 116.57 115.29 1xmq h LYS 48 Ca 0.00 -0.31 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 1xmq h LYS 48 Cb 0.59 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 1xmq h LYS 48 CO 0.04 0.91 0.00 0.82 -1.08 0.00 0.00 179.45 180.14 1xmq h ILE 49 N 0.26 0.00 -0.00 1.86 2.04 -1.18 0.32 117.51 120.81 1xmq h ILE 49 Ca 0.03 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1xmq h ILE 49 Cb 0.81 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1xmq h ILE 49 CO 0.06 0.00 -0.66 -0.38 0.00 0.00 0.00 178.15 177.17 1xmq n ILE 50 N -2.76 0.00 0.08 -0.67 5.41 -1.05 -3.39 119.36 116.97 1xmq n ILE 50 Ca -0.01 -0.07 0.03 0.00 1.00 0.00 0.00 62.75 63.70 1xmq n ILE 50 Cb 0.15 0.79 -0.03 0.00 -0.71 0.00 0.00 39.64 39.84 1xmq n ILE 50 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 1xmq h GLN 51 N 0.70 0.00 0.00 0.38 1.08 0.13 -3.12 115.11 114.29 1xmq h GLN 51 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1xmq h GLN 51 Cb 0.56 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 1xmq h GLN 51 CO 0.00 0.27 0.00 0.39 -0.95 0.00 0.00 178.83 178.54 1xmq n GLU 52 N -2.93 0.00 0.00 1.46 1.02 -0.73 -4.25 120.64 115.21 1xmq n GLU 52 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1xmq n GLU 52 Cb 0.75 -0.27 0.00 0.00 -0.02 0.00 0.00 31.44 31.90 1xmq n GLU 52 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1xmq n LYS 53 N -0.77 0.00 -3.84 3.49 5.02 -1.22 -4.31 118.16 116.53 1xmq n LYS 53 Ca 0.00 0.24 -0.12 0.00 -2.02 0.00 0.00 58.31 56.40 1xmq n LYS 53 Cb 0.00 -1.72 -0.13 0.00 -0.02 0.00 0.00 35.03 33.15 1xmq n LYS 53 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1xmq s THR 54 N -2.43 -0.00 -2.55 -0.18 2.01 -1.18 -5.03 115.64 106.27 1xmq s THR 54 Ca 0.00 0.01 0.23 0.00 0.31 0.00 0.00 61.69 62.25 1xmq s THR 54 Cb 0.00 -0.12 0.40 0.00 0.01 0.00 0.00 72.50 72.78 1xmq s THR 54 CO 0.00 0.01 1.46 0.61 -0.69 0.00 0.00 174.62 176.01 1xmq n GLY 55 N 3.12 0.89 3.85 4.40 0.00 -1.26 -3.79 105.19 112.40 1xmq n GLY 55 Ca -0.13 -0.60 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 1xmq n GLY 55 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xmq s GLN 56 N -1.77 3.89 0.33 1.61 -0.21 -1.26 -5.00 119.66 117.24 1xmq s GLN 56 Ca 0.34 0.84 -0.29 0.00 0.02 0.00 0.00 55.36 56.28 1xmq s GLN 56 Cb 0.20 -2.18 -0.11 0.00 1.00 0.00 0.00 33.01 31.92 1xmq s GLN 56 CO 0.30 -0.25 1.56 -1.21 -2.12 0.00 0.00 175.29 173.57 1xmq s GLU 57 N -4.11 4.10 0.08 2.91 2.02 -1.26 -4.74 118.70 117.71 1xmq s GLU 57 Ca 0.57 2.60 -0.33 0.00 0.02 0.00 0.00 54.97 57.83 1xmq s GLU 57 Cb -0.10 -2.99 -0.16 0.00 0.10 0.00 0.00 34.13 30.98 1xmq s GLU 57 CO 0.33 -0.61 1.61 -1.00 0.02 0.00 0.00 175.26 175.61 1xmq h PRO 58 N 4.00 -0.84 0.00 0.39 0.13 -1.89 -2.10 132.00 131.68 1xmq h PRO 58 Ca -0.49 0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1xmq h PRO 58 Cb 1.23 0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.55 1xmq h PRO 58 CO 0.73 -0.56 0.09 1.25 -0.23 0.00 0.00 178.00 179.28 1xmq h LEU 59 N -0.88 0.00 0.14 1.56 5.85 -1.96 -0.64 115.31 119.38 1xmq h LEU 59 Ca -0.06 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.35 1xmq h LEU 59 Cb 0.73 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.76 1xmq h LEU 59 CO 0.03 0.00 -1.56 0.11 -0.34 0.00 0.00 178.44 176.68 1xmq h LYS 60 N 0.00 0.29 -0.18 1.25 1.57 -1.77 -2.98 116.57 114.75 1xmq h LYS 60 Ca 0.00 -0.49 -0.02 0.00 -1.87 0.00 0.00 60.65 58.27 1xmq h LYS 60 Cb 0.19 0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1xmq h LYS 60 CO 0.00 1.16 0.05 0.28 -0.57 0.00 0.00 179.45 180.37 1xmq h VAL 61 N 0.08 1.20 0.00 0.50 2.07 -0.68 -2.18 116.25 117.24 1xmq h VAL 61 Ca -0.26 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1xmq h VAL 61 Cb 2.04 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 33.08 1xmq h VAL 61 CO 0.17 0.19 0.00 0.33 0.02 0.00 0.00 177.57 178.29 1xmq n PHE 62 N -4.80 0.00 -0.23 1.57 7.35 -0.92 -0.92 117.46 119.52 1xmq n PHE 62 Ca -0.04 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.67 1xmq n PHE 62 Cb 0.16 -0.13 0.07 0.00 0.35 0.00 0.00 39.48 39.93 1xmq n PHE 62 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1xmq n LYS 63 N -1.14 -0.08 0.39 -4.13 4.76 -1.12 -0.44 118.16 116.40 1xmq n LYS 63 Ca 0.00 0.96 -0.19 0.00 -2.87 0.00 0.00 58.31 56.21 1xmq n LYS 63 Cb 0.00 -1.43 -0.09 0.00 -1.84 0.00 0.00 35.03 31.67 1xmq n LYS 63 CO 0.00 0.00 0.00 0.37 -1.37 0.00 0.00 177.40 176.40 1xmq h GLN 64 N 0.00 -1.05 -0.31 1.97 5.75 -1.11 -1.50 115.11 118.85 1xmq h GLN 64 Ca 0.27 0.07 0.04 0.00 -0.15 0.00 0.00 58.65 58.88 1xmq h GLN 64 Cb 0.42 0.24 -0.07 0.00 1.07 0.00 0.00 27.48 29.15 1xmq h GLN 64 CO -0.63 -0.70 -0.47 0.00 -2.65 0.00 0.00 178.83 174.38 1xmq h ALA 65 N -0.93 -0.73 -1.16 3.38 0.00 0.11 0.23 119.26 120.17 1xmq h ALA 65 Ca -0.09 -0.01 0.36 0.00 0.00 0.00 0.00 54.91 55.17 1xmq h ALA 65 Cb 0.89 1.05 -0.12 0.00 0.00 0.00 0.00 17.79 19.60 1xmq h ALA 65 CO 0.08 -0.94 0.72 0.28 0.00 0.00 0.00 179.25 179.39 1xmq h VAL 66 N -0.36 0.27 0.00 0.00 2.07 -1.24 0.68 116.25 117.67 1xmq h VAL 66 Ca 0.06 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1xmq h VAL 66 Cb 0.51 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1xmq h VAL 66 CO -0.48 0.04 0.00 -0.08 0.02 0.00 0.00 177.57 177.07 1xmq h GLU 67 N 0.23 0.00 -0.01 1.57 4.57 0.52 -2.94 114.58 118.52 1xmq h GLU 67 Ca 0.74 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.92 1xmq h GLU 67 Cb 2.05 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.64 1xmq h GLU 67 CO -0.44 0.00 -0.24 0.09 -1.18 0.00 0.00 179.01 177.24 1xmq n ASN 68 N -2.95 1.37 -0.00 1.04 3.02 0.24 -4.05 115.26 113.92 1xmq n ASN 68 Ca 0.02 -1.15 0.07 0.00 -0.03 0.00 0.00 54.58 53.49 1xmq n ASN 68 Cb 0.39 0.16 -0.08 0.00 -0.61 0.00 0.00 39.78 39.65 1xmq n ASN 68 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1xmq n VAL 69 N -0.31 0.00 -2.07 2.41 0.31 -1.07 -4.86 118.33 112.74 1xmq n VAL 69 Ca 0.13 -0.21 -0.41 0.00 -0.01 0.00 0.00 64.34 63.84 1xmq n VAL 69 Cb 0.38 0.84 -0.03 0.00 -0.91 0.00 0.00 33.84 34.13 1xmq n VAL 69 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1xmq s LYS 70 N -2.42 3.10 0.03 5.55 1.02 -1.19 -4.58 119.74 121.26 1xmq s LYS 70 Ca 0.03 1.03 -0.30 0.00 0.02 0.00 0.00 55.97 56.75 1xmq s LYS 70 Cb 0.10 -4.24 -0.07 0.00 -0.52 0.00 0.00 37.83 33.10 1xmq s LYS 70 CO 0.56 -2.15 1.49 -1.25 -0.92 0.00 0.00 175.35 173.09 1xmq s PRO 71 N 6.07 4.25 0.00 -1.68 0.04 -1.26 -4.88 135.00 137.54 1xmq s PRO 71 Ca 0.72 2.10 0.26 0.00 0.04 0.00 0.00 61.00 64.12 1xmq s PRO 71 Cb -0.17 -3.56 0.70 0.00 0.04 0.00 0.00 34.50 31.51 1xmq s PRO 71 CO 0.28 -0.62 1.54 2.89 0.04 0.00 0.00 177.00 181.13 1xmq n ARG 72 N 5.36 0.23 -3.68 4.56 1.85 -1.26 -4.69 116.66 119.04 1xmq n ARG 72 Ca 0.14 -0.12 -0.11 0.00 -1.00 0.00 0.00 57.85 56.76 1xmq n ARG 72 Cb 0.42 -1.50 -0.11 0.00 -1.05 0.00 0.00 32.46 30.22 1xmq n ARG 72 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 1xmq s MET 73 N -2.85 0.27 0.22 2.89 -1.94 -1.26 -3.36 119.30 113.27 1xmq s MET 73 Ca 0.16 0.83 0.04 0.00 -1.71 0.00 0.00 55.69 55.01 1xmq s MET 73 Cb 0.18 0.09 -0.05 0.00 2.01 0.00 0.00 34.83 37.06 1xmq s MET 73 CO 0.63 -0.23 -0.03 -1.83 -0.01 0.00 0.00 175.02 173.54 1xmq s GLU 74 N 2.13 1.33 -0.07 2.03 -1.05 -1.05 -3.83 118.70 118.18 1xmq s GLU 74 Ca -0.03 -1.65 0.01 0.00 -0.15 0.00 0.00 54.97 53.14 1xmq s GLU 74 Cb -0.11 -0.72 -0.03 0.00 -0.44 0.00 0.00 34.13 32.84 1xmq s GLU 74 CO -0.11 -0.04 -0.08 0.54 0.95 0.00 0.00 175.26 176.52 1xmq s VAL 75 N -3.33 3.57 -0.06 1.83 0.11 -1.26 -1.10 120.40 120.15 1xmq s VAL 75 Ca 0.27 -0.53 0.04 0.00 -2.93 0.00 0.00 61.98 58.83 1xmq s VAL 75 Cb 0.05 -2.45 -0.00 0.00 -1.53 0.00 0.00 36.38 32.44 1xmq s VAL 75 CO 0.08 0.59 -0.19 -0.13 -3.33 0.00 0.00 175.10 172.12 1xmq s ARG 76 N -0.71 2.22 0.35 1.54 0.52 0.05 -4.86 118.95 118.06 1xmq s ARG 76 Ca 0.11 -0.69 -0.27 0.00 -0.52 0.00 0.00 55.73 54.36 1xmq s ARG 76 Cb -0.11 -1.82 -0.09 0.00 0.52 0.00 0.00 34.95 33.45 1xmq s ARG 76 CO 0.01 0.20 1.19 0.45 0.02 0.00 0.00 175.30 177.18 1xmq s SER 77 N 0.21 6.76 -0.07 0.23 0.15 -1.26 0.65 113.70 120.38 1xmq s SER 77 Ca -0.10 2.42 -0.03 0.00 0.70 0.00 0.00 55.95 58.94 1xmq s SER 77 Cb -0.14 -2.63 0.04 0.00 -1.71 0.00 0.00 66.02 61.58 1xmq s SER 77 CO 0.05 -0.52 0.14 -0.60 1.20 0.00 0.00 173.24 173.51 1xmq s ARG 78 N -1.97 0.04 0.11 5.44 3.52 -0.36 -4.87 118.95 120.86 1xmq s ARG 78 Ca 0.52 0.45 -0.30 0.00 -0.13 0.00 0.00 55.73 56.27 1xmq s ARG 78 Cb -0.33 -0.25 -0.06 0.00 -1.56 0.00 0.00 34.95 32.74 1xmq s ARG 78 CO 0.43 -0.25 1.10 1.03 -0.81 0.00 0.00 175.30 176.80 1xmq s ARG 79 N 1.78 4.55 -0.42 5.12 1.81 -1.26 -2.32 118.95 128.21 1xmq s ARG 79 Ca -0.02 1.67 0.05 0.00 -1.72 0.00 0.00 55.73 55.71 1xmq s ARG 79 Cb -0.12 -3.33 0.19 0.00 -0.45 0.00 0.00 34.95 31.24 1xmq s ARG 79 CO -0.05 -0.03 0.45 0.28 -0.68 0.00 0.00 175.30 175.26 1xmq n VAL 80 N 3.07 -0.92 -3.60 3.52 0.31 -0.39 -4.99 118.33 115.33 1xmq n VAL 80 Ca 0.05 -3.17 -0.22 0.00 -0.01 0.00 0.00 64.34 60.98 1xmq n VAL 80 Cb 0.47 -1.27 0.01 0.00 -0.91 0.00 0.00 33.84 32.14 1xmq n VAL 80 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xmq n GLY 81 N 2.50 -1.07 1.37 2.92 0.00 -1.26 -3.60 105.19 106.05 1xmq n GLY 81 Ca 0.26 0.70 0.00 0.00 0.00 0.00 0.00 46.02 46.98 1xmq n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xmq n GLY 82 N -1.39 0.95 3.64 -0.02 0.00 -1.26 -5.07 105.19 102.04 1xmq n GLY 82 Ca -0.22 -0.62 -0.05 0.00 0.00 0.00 0.00 46.02 45.13 1xmq n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xmq s ALA 83 N -2.88 -2.11 -0.42 4.61 0.00 -1.24 -5.11 121.76 114.61 1xmq s ALA 83 Ca 0.00 2.18 -0.06 0.00 0.00 0.00 0.00 51.96 54.08 1xmq s ALA 83 Cb 0.00 -1.57 0.10 0.00 0.00 0.00 0.00 23.12 21.65 1xmq s ALA 83 CO 0.00 -0.33 0.24 -0.80 0.00 0.00 0.00 175.76 174.86 1xmq s ASN 84 N 1.13 5.43 -0.16 0.00 0.01 -1.26 -1.27 114.94 118.81 1xmq s ASN 84 Ca -0.06 -1.82 -0.02 0.00 -0.71 0.00 0.00 52.86 50.25 1xmq s ASN 84 Cb -0.04 -1.90 -0.02 0.00 0.41 0.00 0.00 41.25 39.70 1xmq s ASN 84 CO -0.13 -0.56 -0.08 -0.31 -1.51 0.00 0.00 177.10 174.51 1xmq s TYR 85 N 1.27 2.92 -0.73 2.20 4.12 -0.98 -4.89 117.35 121.27 1xmq s TYR 85 Ca 0.05 -0.63 -0.26 0.00 0.02 0.00 0.00 57.07 56.25 1xmq s TYR 85 Cb -0.23 -1.96 -0.00 0.00 -1.52 0.00 0.00 41.96 38.24 1xmq s TYR 85 CO -0.02 -0.26 1.68 -0.65 0.02 0.00 0.00 175.55 176.32 1xmq s GLN 86 N 0.69 2.85 -0.34 -0.62 -1.52 -1.26 -1.23 119.66 118.24 1xmq s GLN 86 Ca -0.04 0.09 -0.19 0.00 -1.95 0.00 0.00 55.36 53.27 1xmq s GLN 86 Cb -0.15 -4.51 -0.00 0.00 -0.22 0.00 0.00 33.01 28.12 1xmq s GLN 86 CO 0.02 -2.62 0.56 0.08 -0.25 0.00 0.00 175.29 173.08 1xmq s VAL 87 N 7.95 4.97 0.54 1.09 1.01 0.21 -4.76 120.40 131.40 1xmq s VAL 87 Ca 0.57 0.48 -0.20 0.00 0.00 0.00 0.00 61.98 62.83 1xmq s VAL 87 Cb -0.09 -4.00 -0.06 0.00 0.00 0.00 0.00 36.38 32.23 1xmq s VAL 87 CO 0.13 -0.23 1.15 -2.16 0.00 0.00 0.00 175.10 174.00 1xmq s PRO 88 N 2.51 3.36 -0.15 2.72 0.04 -1.26 -0.77 135.00 141.44 1xmq s PRO 88 Ca 0.21 1.69 -0.30 0.00 0.04 0.00 0.00 61.00 62.64 1xmq s PRO 88 Cb -0.15 -2.06 0.13 0.00 0.04 0.00 0.00 34.50 32.45 1xmq s PRO 88 CO 0.13 -0.86 1.01 0.00 0.04 0.00 0.00 177.00 177.33 1xmq s MET 89 N -3.19 0.57 0.98 4.56 0.23 -0.26 -4.90 119.30 117.30 1xmq s MET 89 Ca 0.72 0.09 -0.15 0.00 -1.03 0.00 0.00 55.69 55.32 1xmq s MET 89 Cb -0.26 0.27 -0.06 0.00 -1.53 0.00 0.00 34.83 33.25 1xmq s MET 89 CO 0.30 -0.19 -0.21 0.39 -2.03 0.00 0.00 175.02 173.28 1xmq n GLU 90 N 0.61 -0.15 -4.02 3.16 1.02 -1.26 -2.53 120.64 117.46 1xmq n GLU 90 Ca -0.09 -0.02 -0.31 0.00 -0.02 0.00 0.00 57.16 56.72 1xmq n GLU 90 Cb 0.58 -1.43 -0.16 0.00 -0.02 0.00 0.00 31.44 30.42 1xmq n GLU 90 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1xmq s VAL 91 N -2.20 1.73 0.44 2.62 1.01 -1.21 -4.67 120.40 118.11 1xmq s VAL 91 Ca 0.48 -1.02 -0.23 0.00 0.00 0.00 0.00 61.98 61.21 1xmq s VAL 91 Cb -0.19 -1.76 -0.11 0.00 0.00 0.00 0.00 36.38 34.32 1xmq s VAL 91 CO 0.75 0.22 0.78 -1.54 0.00 0.00 0.00 175.10 175.31 1xmq n SER 92 N 4.66 0.18 -0.28 3.32 3.41 -1.26 -4.62 113.62 119.04 1xmq n SER 92 Ca -0.15 0.95 0.11 0.00 -0.26 0.00 0.00 58.87 59.52 1xmq n SER 92 Cb 0.47 -1.24 0.36 0.00 -0.26 0.00 0.00 64.21 63.53 1xmq n SER 92 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1xmq h PRO 93 N 1.08 0.72 0.51 4.33 0.13 -1.98 0.33 132.00 137.13 1xmq h PRO 93 Ca -0.43 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 1xmq h PRO 93 Cb 1.37 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1xmq h PRO 93 CO 0.54 0.48 -0.35 -0.09 -0.23 0.00 0.00 178.00 178.34 1xmq h ARG 94 N 0.74 -0.79 -0.62 0.86 9.65 -2.01 -2.25 114.38 119.96 1xmq h ARG 94 Ca 0.44 0.05 -0.05 0.00 -1.10 0.00 0.00 59.98 59.33 1xmq h ARG 94 Cb 0.65 0.18 -0.03 0.00 -1.39 0.00 0.00 29.97 29.38 1xmq h ARG 94 CO -0.21 -0.53 0.20 -0.09 2.80 0.00 0.00 179.97 182.15 1xmq h ARG 95 N -0.82 0.94 -0.56 0.20 2.43 -1.83 -2.16 114.38 112.58 1xmq h ARG 95 Ca -0.07 -0.18 0.16 0.00 -0.81 0.00 0.00 59.98 59.08 1xmq h ARG 95 Cb 0.67 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1xmq h ARG 95 CO 0.05 0.81 0.50 0.37 -1.51 0.00 0.00 179.97 180.19 1xmq h GLN 96 N 0.91 0.00 0.09 0.20 4.15 -0.21 0.42 115.11 120.67 1xmq h GLN 96 Ca 0.21 0.00 -0.37 0.00 0.77 0.00 0.00 58.65 59.26 1xmq h GLN 96 Cb 0.26 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.92 1xmq h GLN 96 CO -0.01 0.00 -2.11 0.94 -1.93 0.00 0.00 178.83 175.72 1xmq n GLN 97 N -3.93 0.72 0.02 1.69 7.27 -0.86 -3.50 117.38 118.79 1xmq n GLN 97 Ca 0.11 0.24 -0.11 0.00 0.07 0.00 0.00 57.00 57.31 1xmq n GLN 97 Cb 0.72 -1.66 -0.05 0.00 2.41 0.00 0.00 30.24 31.66 1xmq n GLN 97 CO 0.00 0.00 0.00 0.77 0.07 0.00 0.00 177.06 177.90 1xmq h SER 98 N -0.00 -0.17 -0.78 1.69 0.02 -0.62 -1.99 113.55 111.71 1xmq h SER 98 Ca -0.47 0.03 0.07 0.00 -0.84 0.00 0.00 61.79 60.59 1xmq h SER 98 Cb 1.97 0.08 -0.06 0.00 0.14 0.00 0.00 62.40 64.53 1xmq h SER 98 CO 0.02 -0.08 0.45 -0.07 -1.14 0.00 0.00 176.83 176.02 1xmq h LEU 99 N -0.07 0.67 0.33 5.07 3.38 -0.41 -0.77 115.31 123.51 1xmq h LEU 99 Ca 0.04 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1xmq h LEU 99 Cb 0.13 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1xmq h LEU 99 CO -0.09 0.41 -0.17 0.00 0.09 0.00 0.00 178.44 178.67 1xmq h ALA 100 N 1.41 -1.09 -0.54 1.53 0.00 -1.49 -1.03 119.26 118.06 1xmq h ALA 100 Ca 0.36 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 55.28 1xmq h ALA 100 Cb 0.26 0.23 -0.11 0.00 0.00 0.00 0.00 17.79 18.17 1xmq h ALA 100 CO -0.21 -1.06 -0.23 -0.07 0.00 0.00 0.00 179.25 177.68 1xmq h LEU 101 N -0.46 -0.81 -0.35 0.00 3.38 -1.28 0.19 115.31 115.98 1xmq h LEU 101 Ca -0.04 0.19 0.08 0.00 0.09 0.00 0.00 57.88 58.19 1xmq h LEU 101 Cb 0.36 0.44 -0.08 0.00 0.09 0.00 0.00 40.66 41.47 1xmq h LEU 101 CO 0.06 -0.25 -0.19 -0.09 0.09 0.00 0.00 178.44 178.06 1xmq h ARG 102 N -0.10 -0.13 -0.46 1.13 2.43 -1.11 -2.15 114.38 113.99 1xmq h ARG 102 Ca 0.25 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1xmq h ARG 102 Cb 0.49 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1xmq h ARG 102 CO -0.60 -0.09 0.30 -1.49 -1.51 0.00 0.00 179.97 176.58 1xmq h TRP 103 N -0.14 0.57 -0.22 2.20 6.55 0.37 -0.25 115.95 125.03 1xmq h TRP 103 Ca 0.18 0.01 0.06 0.00 0.95 0.00 0.00 58.89 60.09 1xmq h TRP 103 Cb 0.41 -0.19 -0.07 0.00 -0.86 0.00 0.00 29.16 28.45 1xmq h TRP 103 CO -0.41 0.36 -0.24 -0.07 -1.05 0.00 0.00 178.44 177.03 1xmq h LEU 104 N 0.62 -0.78 -1.20 -4.49 3.38 -0.10 0.19 115.31 112.93 1xmq h LEU 104 Ca 0.17 0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.22 1xmq h LEU 104 Cb -0.07 0.36 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1xmq h LEU 104 CO -0.04 -0.28 -0.07 0.58 0.09 0.00 0.00 178.44 178.72 1xmq h VAL 105 N -0.26 1.21 -0.18 1.22 2.07 -1.20 0.47 116.25 119.58 1xmq h VAL 105 Ca 0.13 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 1xmq h VAL 105 Cb 0.46 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1xmq h VAL 105 CO -0.38 0.29 0.05 1.56 0.02 0.00 0.00 177.57 179.12 1xmq h GLN 106 N 0.45 0.28 -0.22 1.57 4.20 0.55 -1.29 115.11 120.65 1xmq h GLN 106 Ca 0.09 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.68 1xmq h GLN 106 Cb 0.40 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 1xmq h GLN 106 CO 0.02 0.40 -0.10 0.00 -0.67 0.00 0.00 178.83 178.48 1xmq h ALA 107 N 0.87 0.31 -0.75 3.87 0.00 -0.49 -3.02 119.26 120.05 1xmq h ALA 107 Ca 0.06 -0.29 0.16 0.00 0.00 0.00 0.00 54.91 54.83 1xmq h ALA 107 Cb 0.24 -0.08 -0.14 0.00 0.00 0.00 0.00 17.79 17.81 1xmq h ALA 107 CO -0.00 0.15 -0.14 0.00 0.00 0.00 0.00 179.25 179.26 1xmq h ALA 108 N 0.72 0.58 -0.09 0.00 0.00 0.09 0.61 119.26 121.16 1xmq h ALA 108 Ca 0.05 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1xmq h ALA 108 Cb 0.58 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1xmq h ALA 108 CO 0.03 -0.42 0.00 0.09 0.00 0.00 0.00 179.25 178.95 1xmq n ASN 109 N -5.46 0.53 -0.05 0.00 3.02 -0.50 -3.06 115.26 109.75 1xmq n ASN 109 Ca 0.11 -2.00 -0.14 0.00 -0.03 0.00 0.00 54.58 52.52 1xmq n ASN 109 Cb 0.41 -0.07 -0.14 0.00 -0.61 0.00 0.00 39.78 39.37 1xmq n ASN 109 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xmq n GLN 110 N -0.22 0.68 -0.78 3.52 1.13 0.21 -4.97 117.38 116.95 1xmq n GLN 110 Ca 0.03 0.19 -0.33 0.00 -1.94 0.00 0.00 57.00 54.95 1xmq n GLN 110 Cb 0.09 -1.66 0.13 0.00 0.11 0.00 0.00 30.24 28.90 1xmq n GLN 110 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1xmq n ARG 111 N -3.13 -0.56 -0.03 -1.09 1.74 -1.06 -5.00 116.66 107.54 1xmq n ARG 111 Ca -0.30 -0.13 -0.05 0.00 -0.77 0.00 0.00 57.85 56.60 1xmq n ARG 111 Cb 1.07 -1.76 -0.04 0.00 -1.02 0.00 0.00 32.46 30.70 1xmq n ARG 111 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1xmq h PRO 112 N -1.63 -0.05 -1.94 5.56 0.13 -1.93 -3.47 132.00 128.66 1xmq h PRO 112 Ca -0.46 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.42 1xmq h PRO 112 Cb 1.30 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 1xmq h PRO 112 CO 0.34 0.27 0.38 -0.85 -0.23 0.00 0.00 178.00 177.91 1xmq n GLU 113 N -4.77 0.00 0.10 0.86 0.00 -1.26 -4.73 120.64 110.84 1xmq n GLU 113 Ca -0.04 0.00 0.20 0.00 0.00 0.00 0.00 57.16 57.32 1xmq n GLU 113 Cb 0.17 -0.48 0.75 0.00 0.00 0.00 0.00 31.44 31.88 1xmq n GLU 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1xmq h ARG 114 N 2.64 0.00 -5.61 3.44 3.08 -2.02 -3.42 114.38 112.50 1xmq h ARG 114 Ca -0.05 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.38 1xmq h ARG 114 Cb 0.46 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.39 1xmq h ARG 114 CO 0.35 0.00 0.24 1.03 -1.07 0.00 0.00 179.97 180.52 1xmq s ARG 115 N -4.66 3.89 0.07 0.04 0.52 -1.26 -4.98 118.95 112.57 1xmq s ARG 115 Ca -0.04 0.37 -0.14 0.00 -0.52 0.00 0.00 55.73 55.40 1xmq s ARG 115 Cb 0.16 -3.74 -0.03 0.00 0.52 0.00 0.00 34.95 31.86 1xmq s ARG 115 CO 0.57 -0.64 1.15 0.00 0.02 0.00 0.00 175.30 176.39 1xmq n ALA 116 N 6.04 -0.28 -0.29 2.13 0.00 -1.26 -1.18 120.51 125.66 1xmq n ALA 116 Ca 0.01 0.37 0.11 0.00 0.00 0.00 0.00 53.44 53.93 1xmq n ALA 116 Cb 0.49 0.17 0.26 0.00 0.00 0.00 0.00 19.45 20.37 1xmq n ALA 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xmq h ALA 117 N -0.25 1.28 -0.43 0.00 0.00 -1.94 0.21 119.26 118.13 1xmq h ALA 117 Ca 0.07 0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.18 1xmq h ALA 117 Cb 0.18 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1xmq h ALA 117 CO -0.41 -0.33 0.22 0.28 0.00 0.00 0.00 179.25 179.00 1xmq h VAL 118 N 0.36 0.98 -0.55 0.00 2.07 -1.49 -1.35 116.25 116.27 1xmq h VAL 118 Ca 0.51 -0.15 0.07 0.00 0.82 0.00 0.00 66.70 67.95 1xmq h VAL 118 Cb 0.94 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 31.15 1xmq h VAL 118 CO -0.52 0.08 0.24 0.03 0.02 0.00 0.00 177.57 177.41 1xmq h ARG 119 N 0.44 0.44 -0.05 1.57 3.08 -0.35 0.31 114.38 119.82 1xmq h ARG 119 Ca 0.18 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 60.11 1xmq h ARG 119 Cb 0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 1xmq h ARG 119 CO -0.12 0.29 -0.41 0.82 -1.07 0.00 0.00 179.97 179.47 1xmq h ILE 120 N 0.45 1.31 0.39 2.04 5.03 -1.11 -0.63 117.51 124.98 1xmq h ILE 120 Ca 0.26 -1.48 -0.02 0.00 -0.12 0.00 0.00 64.86 63.50 1xmq h ILE 120 Cb 0.24 1.74 0.00 0.00 -3.03 0.00 0.00 36.82 35.77 1xmq h ILE 120 CO -0.22 0.43 -0.19 0.00 -0.68 0.00 0.00 178.15 177.49 1xmq h ALA 121 N 1.49 -0.52 -0.89 1.87 0.00 -0.08 -1.14 119.26 119.99 1xmq h ALA 121 Ca 0.01 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.77 1xmq h ALA 121 Cb 0.77 0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 1xmq h ALA 121 CO 0.06 -0.58 0.58 0.45 0.00 0.00 0.00 179.25 179.77 1xmq h HIS 122 N -0.95 1.07 -0.13 0.00 3.86 -0.41 0.18 115.15 118.77 1xmq h HIS 122 Ca -0.05 0.03 -0.11 0.00 -1.16 0.00 0.00 60.37 59.08 1xmq h HIS 122 Cb 0.54 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 1xmq h HIS 122 CO 0.03 0.61 -0.39 1.49 0.86 0.00 0.00 177.93 180.52 1xmq h GLU 123 N 1.10 0.28 0.12 2.45 4.57 -1.12 0.49 114.58 122.46 1xmq h GLU 123 Ca 0.36 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.40 1xmq h GLU 123 Cb 0.05 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 1xmq h GLU 123 CO -0.11 0.63 -0.06 -0.07 -1.18 0.00 0.00 179.01 178.23 1xmq h LEU 124 N 0.23 -0.13 0.28 1.64 3.38 -0.17 -0.07 115.31 120.46 1xmq h LEU 124 Ca 0.02 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.57 1xmq h LEU 124 Cb 0.80 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 1xmq h LEU 124 CO 0.06 0.40 -0.41 0.24 0.09 0.00 0.00 178.44 178.83 1xmq h MET 125 N -0.73 -0.69 -1.18 1.13 2.86 -0.58 0.11 114.93 115.84 1xmq h MET 125 Ca -0.02 0.05 0.34 0.00 -2.06 0.00 0.00 59.70 58.01 1xmq h MET 125 Cb 0.54 0.16 -0.05 0.00 0.06 0.00 0.00 31.60 32.31 1xmq h MET 125 CO 0.03 -0.46 0.87 -0.44 1.06 0.00 0.00 176.91 177.96 1xmq h ASP 126 N -0.71 0.00 0.09 1.22 5.19 -0.08 -0.53 116.42 121.60 1xmq h ASP 126 Ca -0.03 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.37 1xmq h ASP 126 Cb 0.65 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.16 1xmq h ASP 126 CO -0.12 0.00 -0.04 0.00 -3.12 0.00 0.00 179.24 175.96 1xmq h ALA 127 N 1.38 -0.13 0.00 3.45 0.00 0.11 -1.33 119.26 122.75 1xmq h ALA 127 Ca 0.56 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1xmq h ALA 127 Cb 2.29 0.05 0.00 0.00 0.00 0.00 0.00 17.79 20.13 1xmq h ALA 127 CO -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.00 1xmq h ALA 128 N -0.06 1.00 -0.15 0.00 0.00 0.26 -2.20 119.26 118.12 1xmq h ALA 128 Ca -0.01 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.70 1xmq h ALA 128 Cb 0.58 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.38 1xmq h ALA 128 CO 0.02 0.00 -0.68 0.93 0.00 0.00 0.00 179.25 179.52 1xmq h GLU 129 N 0.00 0.73 0.00 0.00 4.39 -1.08 -3.46 114.58 115.16 1xmq h GLU 129 Ca 0.00 -0.58 0.00 0.00 0.34 0.00 0.00 59.36 59.12 1xmq h GLU 129 Cb 0.25 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1xmq h GLU 129 CO 0.00 1.19 0.00 0.41 -1.16 0.00 0.00 179.01 179.45 1xmq n GLY 130 N 0.67 0.94 0.00 -3.84 0.00 -0.83 -5.10 105.19 97.03 1xmq n GLY 130 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1xmq n GLY 130 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1xmq n LYS 131 N 0.00 2.82 0.00 1.61 2.85 -0.52 -4.97 118.16 119.94 1xmq n LYS 131 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1xmq n LYS 131 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1xmq n LYS 131 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1xmq n GLY 132 N 5.00 -0.62 0.53 2.58 0.00 -1.25 -3.87 105.19 107.55 1xmq n GLY 132 Ca 0.00 -1.25 0.35 0.00 0.00 0.00 0.00 46.02 45.12 1xmq n GLY 132 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xmq h GLY 133 N 0.00 0.18 0.85 -0.02 0.00 -1.95 0.31 103.07 102.44 1xmq h GLY 133 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 1xmq h GLY 133 CO 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 176.54 176.56 1xmq h ALA 134 N 1.41 0.19 0.00 3.60 0.00 -1.85 -2.06 119.26 120.56 1xmq h ALA 134 Ca 0.60 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.33 1xmq h ALA 134 Cb 2.29 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 20.01 1xmq h ALA 134 CO -0.05 -0.19 -0.25 0.28 0.00 0.00 0.00 179.25 179.04 1xmq h VAL 135 N 0.06 0.97 0.76 0.00 2.07 -0.61 -2.72 116.25 116.78 1xmq h VAL 135 Ca 0.05 -0.91 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 1xmq h VAL 135 Cb 0.22 1.52 0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1xmq h VAL 135 CO -0.00 0.24 -0.36 0.50 0.02 0.00 0.00 177.57 177.97 1xmq h LYS 136 N 0.00 -0.98 -0.91 1.57 3.64 -0.82 -1.58 116.57 117.50 1xmq h LYS 136 Ca -0.00 0.07 0.21 0.00 -1.27 0.00 0.00 60.65 59.66 1xmq h LYS 136 Cb 0.50 0.22 -0.17 0.00 -0.41 0.00 0.00 32.23 32.38 1xmq h LYS 136 CO 0.03 -0.65 -0.08 0.87 -2.27 0.00 0.00 179.45 177.35 1xmq h LYS 137 N -1.08 0.03 -0.90 1.90 1.57 -1.24 2.11 116.57 118.95 1xmq h LYS 137 Ca -0.10 -0.00 0.13 0.00 -1.87 0.00 0.00 60.65 58.80 1xmq h LYS 137 Cb 0.78 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 33.01 1xmq h LYS 137 CO 0.17 0.02 0.58 -0.22 -0.57 0.00 0.00 179.45 179.43 1xmq h LYS 138 N 0.03 0.77 0.16 3.15 3.11 -1.27 0.12 116.57 122.63 1xmq h LYS 138 Ca 0.49 -0.05 -0.31 0.00 -2.81 0.00 0.00 60.65 57.98 1xmq h LYS 138 Cb 0.89 -0.17 0.01 0.00 -1.00 0.00 0.00 32.23 31.96 1xmq h LYS 138 CO -0.87 0.51 -1.44 0.93 -2.81 0.00 0.00 179.45 175.77 1xmq h GLU 139 N 0.79 0.34 -1.00 1.90 5.08 0.40 -2.45 114.58 119.65 1xmq h GLU 139 Ca 0.44 -0.58 0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1xmq h GLU 139 Cb 0.59 0.22 -0.06 0.00 0.50 0.00 0.00 28.75 30.00 1xmq h GLU 139 CO -0.21 1.25 0.66 -0.44 -1.00 0.00 0.00 179.01 179.27 1xmq h ASP 140 N 0.09 1.11 0.17 1.42 5.19 0.14 0.23 116.42 124.78 1xmq h ASP 140 Ca -0.22 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.17 1xmq h ASP 140 Cb 2.05 -0.26 0.00 0.00 0.18 0.00 0.00 39.33 41.30 1xmq h ASP 140 CO 0.21 0.77 -0.08 0.58 -3.12 0.00 0.00 179.24 177.60 1xmq h VAL 141 N 1.29 0.00 -1.32 -1.35 2.07 -0.84 -0.33 116.25 115.77 1xmq h VAL 141 Ca 0.39 -0.03 0.41 0.00 0.82 0.00 0.00 66.70 68.29 1xmq h VAL 141 Cb -0.05 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.61 1xmq h VAL 141 CO -0.11 0.00 0.88 -0.33 0.02 0.00 0.00 177.57 178.03 1xmq h GLU 142 N -0.26 0.12 -0.32 1.57 5.08 -1.26 1.42 114.58 120.93 1xmq h GLU 142 Ca -0.02 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1xmq h GLU 142 Cb 0.18 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1xmq h GLU 142 CO 0.04 0.08 0.04 0.00 -1.00 0.00 0.00 179.01 178.17 1xmq h ARG 143 N 0.12 0.54 -0.09 2.33 3.08 -0.28 -3.06 114.38 117.03 1xmq h ARG 143 Ca 0.76 -0.15 0.04 0.00 0.07 0.00 0.00 59.98 60.70 1xmq h ARG 143 Cb 2.47 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 32.40 1xmq h ARG 143 CO -0.31 0.64 -0.35 0.52 -1.07 0.00 0.00 179.97 179.40 1xmq h MET 144 N 0.36 -0.44 -7.34 0.04 2.86 0.37 -3.35 114.93 107.43 1xmq h MET 144 Ca 0.10 0.03 -0.45 0.00 -2.06 0.00 0.00 59.70 57.32 1xmq h MET 144 Cb 0.38 0.10 0.17 0.00 0.06 0.00 0.00 31.60 32.31 1xmq h MET 144 CO 0.01 -0.29 0.16 0.00 1.06 0.00 0.00 176.91 177.85 1xmq s ALA 145 N -5.96 0.71 -1.39 6.32 0.00 -0.80 -3.18 121.76 117.44 1xmq s ALA 145 Ca -0.15 -0.41 -0.00 0.00 0.00 0.00 0.00 51.96 51.39 1xmq s ALA 145 Cb 0.10 -3.11 -0.00 0.00 0.00 0.00 0.00 23.12 20.11 1xmq s ALA 145 CO 0.65 -3.06 0.46 -1.91 0.00 0.00 0.00 175.76 171.90 1xmq n GLU 146 N -4.33 -3.49 0.00 0.00 0.00 -1.26 -4.49 120.64 107.07 1xmq n GLU 146 Ca 0.05 0.43 0.00 0.00 0.00 0.00 0.00 57.16 57.65 1xmq n GLU 146 Cb 0.57 -4.61 0.00 0.00 0.00 0.00 0.00 31.44 27.40 1xmq n GLU 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1xmq n ALA 147 N -4.38 0.00 -1.71 4.31 0.00 -1.19 -4.77 120.51 112.76 1xmq n ALA 147 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1xmq n ALA 147 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.14 1xmq n ALA 147 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xmq n ASN 148 N 0.00 0.00 0.31 0.00 3.02 -1.23 -4.84 115.26 112.52 1xmq n ASN 148 Ca 0.00 -1.71 0.17 0.00 -0.03 0.00 0.00 54.58 53.01 1xmq n ASN 148 Cb 0.05 -0.14 0.91 0.00 -0.61 0.00 0.00 39.78 39.98 1xmq n ASN 148 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 1xmq h ARG 149 N 0.00 0.00 0.11 3.52 2.43 -1.88 -0.54 114.38 118.02 1xmq h ARG 149 Ca 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1xmq h ARG 149 Cb 1.28 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.83 1xmq h ARG 149 CO 0.00 0.00 -0.09 0.00 -1.51 0.00 0.00 179.97 178.37 1xmq h ALA 150 N 1.62 -0.19 0.00 2.80 0.00 -1.96 -2.52 119.26 119.01 1xmq h ALA 150 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1xmq h ALA 150 Cb 0.36 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1xmq h ALA 150 CO 0.00 -0.62 0.00 0.66 0.00 0.00 0.00 179.25 179.29 1xmq n TYR 151 N -5.20 0.00 1.04 0.00 4.02 -0.21 -4.11 117.16 112.70 1xmq n TYR 151 Ca -0.08 -0.51 0.12 0.00 -0.01 0.00 0.00 57.90 57.43 1xmq n TYR 151 Cb 0.13 -0.26 0.31 0.00 -0.02 0.00 0.00 39.34 39.49 1xmq n TYR 151 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xmq n ALA 152 N 0.65 3.36 1.23 -0.72 0.00 -0.95 -3.66 120.51 120.42 1xmq n ALA 152 Ca 0.00 -0.33 0.10 0.00 0.00 0.00 0.00 53.44 53.21 1xmq n ALA 152 Cb 0.46 -1.16 0.59 0.00 0.00 0.00 0.00 19.45 19.34 1xmq n ALA 152 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1xmq n HIS 153 N -1.38 0.00 -2.07 0.00 1.44 -1.26 -3.43 115.22 108.52 1xmq n HIS 153 Ca 0.07 0.00 -0.39 0.00 -2.01 0.00 0.00 57.72 55.39 1xmq n HIS 153 Cb 0.34 -0.06 -0.00 0.00 0.12 0.00 0.00 29.99 30.39 1xmq n HIS 153 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1xmq n TYR 154 N -1.06 2.54 -0.15 -1.40 0.53 -1.24 -4.84 117.16 111.54 1xmq n TYR 154 Ca 0.14 -2.67 0.08 0.00 -1.02 0.00 0.00 57.90 54.43 1xmq n TYR 154 Cb 0.09 -1.64 0.15 0.00 -1.03 0.00 0.00 39.34 36.90 1xmq n TYR 154 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 1xmq n ARG 155 N 1.22 -0.03 -0.80 -0.72 5.12 -1.22 -4.99 116.66 115.23 1xmq n ARG 155 Ca 0.58 0.66 0.00 0.00 -1.93 0.00 0.00 57.85 57.16 1xmq n ARG 155 Cb 0.28 -1.06 0.00 0.00 -1.16 0.00 0.00 32.46 30.52 1xmq n ARG 155 CO 0.00 0.00 0.00 1.87 -1.93 0.00 0.00 177.63 177.57