#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rcq s ARG -2 N 0.00 0.07 0.19 3.17 3.52 -1.26 -4.98 118.95 119.66 2rcq s ARG -2 Ca 0.00 0.35 -0.22 0.00 -0.13 0.00 0.00 55.73 55.73 2rcq s ARG -2 Cb 0.00 -0.20 -0.08 0.00 -1.56 0.00 0.00 34.95 33.11 2rcq s ARG -2 CO 0.00 -0.17 0.74 0.20 -0.81 0.00 0.00 175.30 175.25 2rcq s GLY -1 N 1.22 2.75 0.17 8.12 0.00 -1.25 -4.66 107.32 113.67 2rcq s GLY -1 Ca -0.08 0.24 0.24 0.00 0.00 0.00 0.00 44.72 45.12 2rcq s GLY -1 CO -0.05 0.67 1.30 1.48 0.00 0.00 0.00 173.10 176.50 2rcq h SER 0 N 3.86 0.00 -5.01 1.64 4.64 -1.05 -3.42 113.55 114.21 2rcq h SER 0 Ca -0.48 -0.13 -0.05 0.00 -0.47 0.00 0.00 61.79 60.66 2rcq h SER 0 Cb 1.20 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.13 2rcq h SER 0 CO 0.65 0.06 0.11 0.28 -0.87 0.00 0.00 176.83 177.07 2rcq s THR 1 N -3.22 0.02 -0.78 2.95 -1.32 -1.26 -5.01 115.64 107.03 2rcq s THR 1 Ca 0.05 -0.13 0.26 0.00 -1.21 0.00 0.00 61.69 60.65 2rcq s THR 1 Cb 0.12 -0.99 0.17 0.00 -1.51 0.00 0.00 72.50 70.29 2rcq s THR 1 CO 0.73 -0.07 1.62 0.54 -2.21 0.00 0.00 174.62 175.22 2rcq n ARG 2 N 0.31 0.20 -2.33 7.08 1.74 -1.26 -4.46 116.66 117.94 2rcq n ARG 2 Ca -0.18 0.11 -0.41 0.00 -0.77 0.00 0.00 57.85 56.61 2rcq n ARG 2 Cb 0.61 -1.68 -0.03 0.00 -1.02 0.00 0.00 32.46 30.34 2rcq n ARG 2 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2rcq s ASP 3 N -4.01 5.90 0.00 0.55 2.15 -1.26 -4.81 116.67 115.18 2rcq s ASP 3 Ca 0.10 0.13 0.19 0.00 0.43 0.00 0.00 52.55 53.40 2rcq s ASP 3 Cb 0.14 -2.54 0.28 0.00 -0.30 0.00 0.00 42.92 40.50 2rcq s ASP 3 CO 0.64 -1.93 1.22 0.00 -0.17 0.00 0.00 175.17 174.93 2rcq n GLN 4 N 8.99 2.05 -1.58 4.34 6.02 -1.26 -4.99 117.38 130.96 2rcq n GLN 4 Ca 0.12 -1.93 -0.46 0.00 -0.01 0.00 0.00 57.00 54.72 2rcq n GLN 4 Cb 0.50 -1.40 -0.03 0.00 1.02 0.00 0.00 30.24 30.33 2rcq n GLN 4 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2rcq n ASN 5 N 1.14 1.28 0.00 1.08 4.13 -1.26 -4.66 115.26 116.96 2rcq n ASN 5 Ca 0.14 1.16 0.00 0.00 1.68 0.00 0.00 54.58 57.56 2rcq n ASN 5 Cb 0.51 -1.25 0.00 0.00 -1.54 0.00 0.00 39.78 37.49 2rcq n ASN 5 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2rcq n GLY 6 N 1.61 0.96 3.31 7.41 0.00 -0.56 -4.50 105.19 113.41 2rcq n GLY 6 Ca 0.12 -1.94 -0.32 0.00 0.00 0.00 0.00 46.02 43.88 2rcq n GLY 6 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rcq s THR 7 N -1.84 2.56 -0.03 2.61 2.01 0.34 -0.67 115.64 120.63 2rcq s THR 7 Ca 0.00 -0.84 0.02 0.00 0.31 0.00 0.00 61.69 61.18 2rcq s THR 7 Cb 0.00 -2.03 0.01 0.00 0.01 0.00 0.00 72.50 70.49 2rcq s THR 7 CO 0.00 0.55 -0.09 0.26 -0.69 0.00 0.00 174.62 174.64 2rcq s TRP 8 N 0.25 1.01 -0.13 4.92 0.52 0.40 -0.65 118.94 125.25 2rcq s TRP 8 Ca -0.13 -0.27 -0.00 0.00 0.02 0.00 0.00 56.10 55.72 2rcq s TRP 8 Cb -0.16 -0.73 -0.01 0.00 -1.15 0.00 0.00 33.47 31.41 2rcq s TRP 8 CO 0.07 -0.13 -0.13 -2.00 0.02 0.00 0.00 176.95 174.78 2rcq s GLU 9 N 0.30 3.38 0.17 4.98 2.12 0.36 -0.34 118.70 129.66 2rcq s GLU 9 Ca -0.05 -0.69 -0.33 0.00 0.36 0.00 0.00 54.97 54.27 2rcq s GLU 9 Cb -0.10 -2.63 -0.12 0.00 0.26 0.00 0.00 34.13 31.54 2rcq s GLU 9 CO 0.01 0.21 1.70 -0.12 -0.54 0.00 0.00 175.26 176.52 2rcq n MET 10 N 3.53 2.57 -0.00 4.30 0.00 0.03 -0.29 117.12 127.26 2rcq n MET 10 Ca -0.18 0.93 0.05 0.00 -0.00 0.00 0.00 57.70 58.50 2rcq n MET 10 Cb 0.53 -2.76 -0.07 0.00 0.00 0.00 0.00 33.22 30.92 2rcq n MET 10 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 2rcq n GLU 11 N 4.10 0.82 -3.58 2.12 0.28 0.87 -4.78 120.64 120.47 2rcq n GLU 11 Ca 0.17 -0.08 -0.15 0.00 -0.16 0.00 0.00 57.16 56.94 2rcq n GLU 11 Cb 0.33 -1.19 -0.06 0.00 1.43 0.00 0.00 31.44 31.95 2rcq n GLU 11 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2rcq s SER 12 N -2.96 -0.47 -0.19 -1.84 1.04 -1.00 -4.98 113.70 103.29 2rcq s SER 12 Ca -0.03 0.31 -0.07 0.00 0.48 0.00 0.00 55.95 56.64 2rcq s SER 12 Cb 0.06 0.48 0.09 0.00 0.10 0.00 0.00 66.02 66.76 2rcq s SER 12 CO 0.41 -0.66 0.41 0.21 0.98 0.00 0.00 173.24 174.59 2rcq s ASN 13 N -1.70 -0.23 -0.06 7.02 3.84 -1.26 -1.68 114.94 120.88 2rcq s ASN 13 Ca -0.08 0.97 0.02 0.00 0.21 0.00 0.00 52.86 53.99 2rcq s ASN 13 Cb -0.01 1.31 0.01 0.00 -0.55 0.00 0.00 41.25 42.01 2rcq s ASN 13 CO 0.02 -0.23 -0.11 -1.61 -2.79 0.00 0.00 177.10 172.38 2rcq s GLU 14 N 2.58 1.48 -1.71 0.43 0.41 -0.10 -4.74 118.70 117.05 2rcq s GLU 14 Ca -0.02 -0.36 -0.01 0.00 -0.41 0.00 0.00 54.97 54.18 2rcq s GLU 14 Cb -0.12 -1.26 0.00 0.00 -1.78 0.00 0.00 34.13 30.97 2rcq s GLU 14 CO -0.13 0.03 0.07 -1.71 -0.49 0.00 0.00 175.26 173.04 2rcq n ASN 15 N 3.75 -5.80 0.03 -0.19 5.15 -1.26 -1.51 115.26 115.42 2rcq n ASN 15 Ca -0.23 -0.05 0.03 0.00 -0.60 0.00 0.00 54.58 53.73 2rcq n ASN 15 Cb 0.52 -4.80 0.40 0.00 -0.53 0.00 0.00 39.78 35.37 2rcq n ASN 15 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2rcq h PHE 16 N -0.16 0.47 -0.33 1.20 3.57 -1.88 -2.45 116.94 117.36 2rcq h PHE 16 Ca -0.49 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.01 2rcq h PHE 16 Cb 1.36 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.93 2rcq h PHE 16 CO 0.54 0.37 0.21 1.49 -2.23 0.00 0.00 178.31 178.68 2rcq h GLU 17 N 0.48 0.44 -0.53 1.11 4.57 -1.91 -0.51 114.58 118.23 2rcq h GLU 17 Ca 0.12 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.23 2rcq h GLU 17 Cb 0.09 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 2rcq h GLU 17 CO -0.01 0.32 0.20 0.78 -1.18 0.00 0.00 179.01 179.11 2rcq h GLY 18 N 0.43 0.86 0.91 1.92 0.00 -1.90 0.64 103.07 105.93 2rcq h GLY 18 Ca 0.12 -0.48 0.01 0.00 0.00 0.00 0.00 47.33 46.98 2rcq h GLY 18 CO -0.02 0.45 0.03 -1.82 0.00 0.00 0.00 176.54 175.18 2rcq h TYR 19 N 0.72 0.06 -0.78 5.60 3.20 -1.30 -0.83 116.97 123.64 2rcq h TYR 19 Ca 0.18 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 2rcq h TYR 19 Cb 0.22 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.44 2rcq h TYR 19 CO 0.01 0.03 0.44 0.52 -1.64 0.00 0.00 178.16 177.52 2rcq h MET 20 N 0.09 1.07 -0.80 1.82 2.86 -0.83 -2.40 114.93 116.75 2rcq h MET 20 Ca 0.05 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 2rcq h MET 20 Cb 0.03 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 31.43 2rcq h MET 20 CO -0.05 0.78 0.39 -0.22 1.06 0.00 0.00 176.91 178.87 2rcq h LYS 21 N 1.07 1.13 0.00 1.72 3.64 -0.65 -1.75 116.57 121.74 2rcq h LYS 21 Ca 0.28 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2rcq h LYS 21 Cb 0.01 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.61 2rcq h LYS 21 CO -0.05 0.86 -0.09 0.00 -2.27 0.00 0.00 179.45 177.90 2rcq h ALA 22 N 1.31 1.55 -0.06 5.00 0.00 -0.67 -0.49 119.26 125.89 2rcq h ALA 22 Ca 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2rcq h ALA 22 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2rcq h ALA 22 CO -0.04 0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.60 2rcq n LEU 23 N -3.99 1.28 -1.34 0.00 4.77 -0.77 -4.92 117.00 112.03 2rcq n LEU 23 Ca -0.02 -0.47 -0.14 0.00 -0.03 0.00 0.00 56.01 55.34 2rcq n LEU 23 Cb 0.18 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.20 2rcq n LEU 23 CO 0.31 0.24 -0.16 0.47 -1.33 0.00 0.00 177.39 176.92 2rcq n ASP 24 N 0.02 -4.57 -4.74 -1.43 8.00 -0.19 -4.77 116.55 108.87 2rcq n ASP 24 Ca 0.18 0.19 -0.41 0.00 0.71 0.00 0.00 54.79 55.46 2rcq n ASP 24 Cb 0.30 -3.51 -0.03 0.00 -0.02 0.00 0.00 41.12 37.86 2rcq n ASP 24 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2rcq s ILE 25 N -2.62 2.92 0.73 0.53 1.01 -0.73 -4.96 121.20 118.08 2rcq s ILE 25 Ca 0.00 0.76 -0.13 0.00 0.00 0.00 0.00 60.65 61.27 2rcq s ILE 25 Cb 0.00 -3.48 0.04 0.00 0.01 0.00 0.00 42.46 39.02 2rcq s ILE 25 CO 0.00 0.11 1.13 1.51 0.00 0.00 0.00 174.94 177.69 2rcq s ASP 26 N 0.42 4.55 0.18 3.58 -4.77 -1.26 -4.62 116.67 114.75 2rcq s ASP 26 Ca 0.59 2.06 -0.14 0.00 -3.30 0.00 0.00 52.55 51.76 2rcq s ASP 26 Cb -0.39 -2.55 0.17 0.00 -1.09 0.00 0.00 42.92 39.06 2rcq s ASP 26 CO 0.40 -2.01 1.70 0.15 0.70 0.00 0.00 175.17 176.11 2rcq h PHE 27 N -0.49 0.05 -0.75 2.11 3.57 -1.99 -1.27 116.94 118.17 2rcq h PHE 27 Ca -0.46 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.03 2rcq h PHE 27 Cb 1.26 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 40.01 2rcq h PHE 27 CO 0.53 -0.06 0.31 0.00 -2.23 0.00 0.00 178.31 176.86 2rcq h ALA 28 N 1.40 0.97 -0.41 2.41 0.00 -2.00 -1.08 119.26 120.55 2rcq h ALA 28 Ca 0.24 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2rcq h ALA 28 Cb 0.34 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2rcq h ALA 28 CO -0.36 0.58 0.08 1.15 0.00 0.00 0.00 179.25 180.70 2rcq h THR 29 N 1.07 1.24 -0.71 0.00 2.02 -1.80 -2.35 112.91 112.38 2rcq h THR 29 Ca 0.25 -0.84 0.02 0.00 0.77 0.00 0.00 66.41 66.61 2rcq h THR 29 Cb 0.19 1.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.56 2rcq h THR 29 CO -0.02 0.29 0.46 0.03 0.37 0.00 0.00 175.52 176.65 2rcq h ARG 30 N 0.53 0.89 -0.60 6.66 3.08 -0.82 -1.02 114.38 123.11 2rcq h ARG 30 Ca 0.13 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 2rcq h ARG 30 Cb 0.35 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 2rcq h ARG 30 CO 0.00 0.59 0.10 0.87 -1.07 0.00 0.00 179.97 180.47 2rcq h LYS 31 N 0.92 0.96 -0.17 0.04 1.79 -1.04 -0.46 116.57 118.62 2rcq h LYS 31 Ca 0.27 -0.23 -0.04 0.00 -2.18 0.00 0.00 60.65 58.47 2rcq h LYS 31 Cb -0.05 -0.12 -0.00 0.00 -1.58 0.00 0.00 32.23 30.47 2rcq h LYS 31 CO -0.08 0.88 -0.07 0.82 -1.08 0.00 0.00 179.45 179.93 2rcq h ILE 32 N 0.91 1.30 0.00 1.86 2.04 -1.07 -3.35 117.51 119.21 2rcq h ILE 32 Ca 0.19 -1.08 -0.17 0.00 1.00 0.00 0.00 64.86 64.79 2rcq h ILE 32 Cb 0.39 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 2rcq h ILE 32 CO 0.01 0.32 -0.95 0.00 0.00 0.00 0.00 178.15 177.53 2rcq h ALA 33 N 0.69 0.57 -0.84 1.87 0.00 -0.99 -3.41 119.26 117.16 2rcq h ALA 33 Ca 0.04 -0.78 0.11 0.00 0.00 0.00 0.00 54.91 54.27 2rcq h ALA 33 Cb 0.53 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.25 2rcq h ALA 33 CO 0.02 0.99 0.47 -0.24 0.00 0.00 0.00 179.25 180.49 2rcq h VAL 34 N 0.00 0.87 -0.12 0.00 3.04 -1.22 -2.71 116.25 116.11 2rcq h VAL 34 Ca -0.06 -0.26 -0.03 0.00 -1.01 0.00 0.00 66.70 65.33 2rcq h VAL 34 Cb 1.62 0.04 -0.02 0.00 -2.01 0.00 0.00 31.29 30.91 2rcq h VAL 34 CO 0.09 0.14 -0.12 0.54 -1.01 0.00 0.00 177.57 177.20 2rcq n ARG 35 N -4.76 1.81 -3.00 4.17 1.74 -1.26 -4.91 116.66 110.44 2rcq n ARG 35 Ca 0.15 -2.91 -0.40 0.00 -0.77 0.00 0.00 57.85 53.92 2rcq n ARG 35 Cb 0.32 -1.66 -0.05 0.00 -1.02 0.00 0.00 32.46 30.05 2rcq n ARG 35 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2rcq s LEU 36 N -3.02 4.29 0.23 0.55 1.43 -1.02 -5.02 118.68 116.12 2rcq s LEU 36 Ca 0.38 1.20 -0.31 0.00 -1.03 0.00 0.00 54.13 54.37 2rcq s LEU 36 Cb 0.34 -3.13 -0.11 0.00 0.03 0.00 0.00 46.19 43.32 2rcq s LEU 36 CO 0.02 -0.18 1.59 -0.89 0.23 0.00 0.00 176.35 177.12 2rcq s THR 37 N 1.10 2.31 0.03 5.49 2.01 -1.26 -5.01 115.64 120.30 2rcq s THR 37 Ca 0.38 0.24 0.01 0.00 0.31 0.00 0.00 61.69 62.63 2rcq s THR 37 Cb -0.18 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 2rcq s THR 37 CO 0.17 0.03 0.09 -1.10 -0.69 0.00 0.00 174.62 173.12 2rcq s GLN 38 N 0.35 3.02 -0.07 4.92 -0.21 -1.26 -4.55 119.66 121.86 2rcq s GLN 38 Ca 0.67 -0.56 0.04 0.00 0.02 0.00 0.00 55.36 55.53 2rcq s GLN 38 Cb -0.46 -2.82 -0.02 0.00 1.00 0.00 0.00 33.01 30.71 2rcq s GLN 38 CO 0.39 0.61 -0.19 0.99 -2.12 0.00 0.00 175.29 174.97 2rcq s THR 39 N -1.29 2.57 -0.13 -0.19 2.01 -0.07 -0.79 115.64 117.75 2rcq s THR 39 Ca 0.26 -0.88 0.03 0.00 0.31 0.00 0.00 61.69 61.41 2rcq s THR 39 Cb -0.12 -1.99 0.01 0.00 0.01 0.00 0.00 72.50 70.40 2rcq s THR 39 CO 0.18 0.57 -0.22 -0.75 -0.69 0.00 0.00 174.62 173.70 2rcq s LYS 40 N -0.21 3.02 -0.20 4.92 2.20 0.53 -0.40 119.74 129.61 2rcq s LYS 40 Ca -0.01 -0.86 -0.03 0.00 -0.36 0.00 0.00 55.97 54.71 2rcq s LYS 40 Cb -0.13 -2.41 -0.01 0.00 -1.51 0.00 0.00 37.83 33.76 2rcq s LYS 40 CO 0.03 0.01 -0.06 0.08 -0.36 0.00 0.00 175.35 175.06 2rcq s VAL 41 N 0.74 3.32 -0.17 4.02 1.01 0.42 -0.46 120.40 129.28 2rcq s VAL 41 Ca -0.09 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.37 2rcq s VAL 41 Cb -0.16 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 33.74 2rcq s VAL 41 CO -0.00 0.45 -0.15 -0.63 0.00 0.00 0.00 175.10 174.76 2rcq s ILE 42 N 1.25 2.57 -0.31 2.22 1.01 0.16 -1.25 121.20 126.85 2rcq s ILE 42 Ca 0.03 -0.79 -0.01 0.00 0.00 0.00 0.00 60.65 59.88 2rcq s ILE 42 Cb -0.14 -2.09 0.06 0.00 0.01 0.00 0.00 42.46 40.29 2rcq s ILE 42 CO -0.02 0.51 0.01 -0.62 0.00 0.00 0.00 174.94 174.82 2rcq s ASP 43 N 1.01 4.85 -0.16 3.58 3.68 -0.16 -1.50 116.67 127.97 2rcq s ASP 43 Ca -0.02 -1.43 0.00 0.00 2.13 0.00 0.00 52.55 53.24 2rcq s ASP 43 Cb -0.15 -1.69 0.02 0.00 -1.45 0.00 0.00 42.92 39.65 2rcq s ASP 43 CO -0.04 -0.29 -0.15 -1.58 0.13 0.00 0.00 175.17 173.25 2rcq s GLN 44 N 1.19 2.44 -0.34 4.34 0.74 -1.26 -0.78 119.66 125.99 2rcq s GLN 44 Ca -0.03 -0.62 0.01 0.00 0.05 0.00 0.00 55.36 54.77 2rcq s GLN 44 Cb -0.20 -2.21 0.10 0.00 1.10 0.00 0.00 33.01 31.80 2rcq s GLN 44 CO -0.02 -0.24 0.10 0.34 -0.55 0.00 0.00 175.29 174.92 2rcq s ASP 45 N 1.44 4.28 1.77 6.67 2.15 0.29 -4.89 116.67 128.37 2rcq s ASP 45 Ca 0.05 -1.94 0.00 0.00 0.43 0.00 0.00 52.55 51.09 2rcq s ASP 45 Cb -0.13 -1.17 0.00 0.00 -0.30 0.00 0.00 42.92 41.32 2rcq s ASP 45 CO -0.11 -0.39 0.00 0.61 -0.17 0.00 0.00 175.17 175.11 2rcq n GLY 46 N 4.48 3.96 0.10 2.66 0.00 -1.26 -1.28 105.19 113.85 2rcq n GLY 46 Ca 0.01 0.20 0.13 0.00 0.00 0.00 0.00 46.02 46.36 2rcq n GLY 46 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2rcq n ASP 47 N 8.37 0.54 -4.61 1.61 10.43 -1.26 -4.84 116.55 126.80 2rcq n ASP 47 Ca 0.00 -0.40 -0.39 0.00 2.57 0.00 0.00 54.79 56.56 2rcq n ASP 47 Cb 0.00 0.00 -0.09 0.00 1.84 0.00 0.00 41.12 42.88 2rcq n ASP 47 CO 0.00 0.00 0.00 0.20 -1.07 0.00 0.00 177.20 176.33 2rcq s ASN 48 N -2.70 6.31 -0.07 -2.24 0.02 -0.40 -0.65 114.94 115.21 2rcq s ASN 48 Ca 0.21 0.35 0.03 0.00 -1.02 0.00 0.00 52.86 52.43 2rcq s ASN 48 Cb 0.19 -2.24 -0.02 0.00 0.02 0.00 0.00 41.25 39.20 2rcq s ASN 48 CO 0.56 -0.23 -0.15 -0.36 0.02 0.00 0.00 177.10 176.94 2rcq s PHE 49 N 2.16 2.71 -0.13 2.20 0.40 0.25 -0.55 117.98 125.02 2rcq s PHE 49 Ca 0.17 -0.33 0.01 0.00 -0.60 0.00 0.00 56.93 56.18 2rcq s PHE 49 Cb -0.16 -1.69 0.02 0.00 0.51 0.00 0.00 43.02 41.70 2rcq s PHE 49 CO 0.10 0.05 -0.16 0.15 0.70 0.00 0.00 175.22 176.05 2rcq s LYS 50 N -0.38 2.42 0.01 0.44 3.01 0.04 -1.45 119.74 123.82 2rcq s LYS 50 Ca 0.04 -0.62 0.06 0.00 -1.01 0.00 0.00 55.97 54.44 2rcq s LYS 50 Cb -0.12 -2.11 -0.02 0.00 -1.01 0.00 0.00 37.83 34.57 2rcq s LYS 50 CO 0.02 -0.14 -0.20 0.95 0.51 0.00 0.00 175.35 176.50 2rcq s THR 51 N 1.19 1.58 -0.08 2.17 -4.23 -0.49 -0.99 115.64 114.79 2rcq s THR 51 Ca -0.01 -0.97 0.00 0.00 -1.18 0.00 0.00 61.69 59.53 2rcq s THR 51 Cb -0.14 -1.34 0.02 0.00 1.34 0.00 0.00 72.50 72.39 2rcq s THR 51 CO -0.06 0.35 -0.05 -0.54 -0.54 0.00 0.00 174.62 173.77 2rcq s LYS 52 N -0.73 1.12 -0.19 3.99 1.02 -0.38 -1.80 119.74 122.76 2rcq s LYS 52 Ca 0.07 -0.14 0.00 0.00 0.02 0.00 0.00 55.97 55.92 2rcq s LYS 52 Cb -0.08 -1.19 0.02 0.00 -0.52 0.00 0.00 37.83 36.06 2rcq s LYS 52 CO 0.00 -0.18 -0.17 0.99 -0.92 0.00 0.00 175.35 175.08 2rcq s THR 53 N 1.39 2.30 0.07 2.17 2.01 -1.19 -0.44 115.64 121.95 2rcq s THR 53 Ca -0.03 -0.91 0.08 0.00 0.31 0.00 0.00 61.69 61.15 2rcq s THR 53 Cb -0.13 -2.00 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 2rcq s THR 53 CO -0.03 0.48 -0.22 0.42 -0.69 0.00 0.00 174.62 174.58 2rcq s THR 54 N 1.31 1.79 0.34 -0.82 -4.23 0.47 0.59 115.64 115.09 2rcq s THR 54 Ca 0.04 -1.39 0.05 0.00 -1.18 0.00 0.00 61.69 59.21 2rcq s THR 54 Cb -0.14 -1.58 -0.02 0.00 1.34 0.00 0.00 72.50 72.10 2rcq s THR 54 CO -0.11 0.12 0.34 -0.94 -0.54 0.00 0.00 174.62 173.49 2rcq s SER 55 N -1.52 1.49 0.00 3.99 1.04 -0.86 -0.89 113.70 116.96 2rcq s SER 55 Ca 0.08 -1.69 0.30 0.00 0.48 0.00 0.00 55.95 55.12 2rcq s SER 55 Cb -0.09 0.59 1.77 0.00 0.10 0.00 0.00 66.02 68.39 2rcq s SER 55 CO 0.03 -1.14 2.14 0.35 0.98 0.00 0.00 173.24 175.60 2rcq n THR 56 N -0.61 0.01 0.00 2.02 -2.24 -1.26 -4.08 114.28 108.11 2rcq n THR 56 Ca 0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2rcq n THR 56 Cb 0.62 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 2rcq n THR 56 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2rcq n PHE 57 N -1.05 0.00 -4.29 4.78 7.35 -1.26 -5.10 117.46 117.90 2rcq n PHE 57 Ca 0.21 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.75 2rcq n PHE 57 Cb 0.13 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 39.86 2rcq n PHE 57 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2rcq s ARG 58 N -0.67 1.16 0.21 -4.13 0.52 -1.26 -5.16 118.95 109.63 2rcq s ARG 58 Ca 0.00 -1.51 0.08 0.00 -0.52 0.00 0.00 55.73 53.78 2rcq s ARG 58 Cb 0.00 -0.78 -0.04 0.00 0.52 0.00 0.00 34.95 34.65 2rcq s ARG 58 CO 0.00 0.10 0.04 -0.80 0.02 0.00 0.00 175.30 174.66 2rcq s ASN 59 N -3.22 4.90 -0.54 0.23 0.02 -1.26 -2.02 114.94 113.05 2rcq s ASN 59 Ca 0.19 -0.41 0.05 0.00 -1.02 0.00 0.00 52.86 51.67 2rcq s ASN 59 Cb 0.02 -1.07 0.17 0.00 0.02 0.00 0.00 41.25 40.39 2rcq s ASN 59 CO 0.03 0.05 0.42 -1.22 0.02 0.00 0.00 177.10 176.39 2rcq n TYR 60 N -0.50 0.91 -3.82 2.20 4.02 0.20 -4.77 117.16 115.39 2rcq n TYR 60 Ca -0.08 -3.75 -0.37 0.00 -0.01 0.00 0.00 57.90 53.69 2rcq n TYR 60 Cb 0.56 -0.14 -0.07 0.00 -0.02 0.00 0.00 39.34 39.68 2rcq n TYR 60 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2rcq s ASP 61 N -0.67 6.36 -0.12 7.72 -0.00 -1.26 -3.15 116.67 125.55 2rcq s ASP 61 Ca 0.30 0.43 -0.09 0.00 -0.00 0.00 0.00 52.55 53.19 2rcq s ASP 61 Cb 0.01 -2.08 0.04 0.00 -0.00 0.00 0.00 42.92 40.89 2rcq s ASP 61 CO -0.18 0.34 0.30 0.54 -0.00 0.00 0.00 175.17 176.17 2rcq s VAL 62 N -0.66 -0.01 0.04 -1.27 0.11 -0.74 -5.01 120.40 112.85 2rcq s VAL 62 Ca 0.14 0.05 0.08 0.00 -2.93 0.00 0.00 61.98 59.31 2rcq s VAL 62 Cb -0.12 -0.44 -0.03 0.00 -1.53 0.00 0.00 36.38 34.26 2rcq s VAL 62 CO 0.03 0.02 -0.22 -1.81 -3.33 0.00 0.00 175.10 169.79 2rcq s ASP 63 N 0.60 3.51 0.18 3.54 1.01 -1.26 -1.40 116.67 122.85 2rcq s ASP 63 Ca -0.04 -0.49 -0.23 0.00 0.71 0.00 0.00 52.55 52.50 2rcq s ASP 63 Cb -0.05 -0.47 0.06 0.00 1.01 0.00 0.00 42.92 43.47 2rcq s ASP 63 CO -0.04 0.26 0.67 0.72 0.21 0.00 0.00 175.17 176.99 2rcq s PHE 64 N -0.86 -0.41 -0.14 4.23 -0.12 -0.53 -5.02 117.98 115.13 2rcq s PHE 64 Ca 0.13 0.13 -0.00 0.00 -0.05 0.00 0.00 56.93 57.14 2rcq s PHE 64 Cb -0.10 0.60 -0.01 0.00 -0.63 0.00 0.00 43.02 42.88 2rcq s PHE 64 CO 0.03 -0.94 -0.13 0.99 -0.05 0.00 0.00 175.22 175.13 2rcq s THR 65 N -3.74 2.98 0.15 -4.49 2.01 -1.26 -0.58 115.64 110.71 2rcq s THR 65 Ca 0.04 -0.67 -0.34 0.00 0.31 0.00 0.00 61.69 61.03 2rcq s THR 65 Cb -0.02 -2.26 -0.15 0.00 0.01 0.00 0.00 72.50 70.07 2rcq s THR 65 CO -0.07 0.51 1.46 0.52 -0.69 0.00 0.00 174.62 176.36 2rcq n VAL 66 N 3.77 0.21 -1.07 3.82 0.31 0.18 -1.62 118.33 123.93 2rcq n VAL 66 Ca -0.18 -0.05 -0.02 0.00 -0.01 0.00 0.00 64.34 64.07 2rcq n VAL 66 Cb 0.52 -1.29 -0.01 0.00 -0.91 0.00 0.00 33.84 32.16 2rcq n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2rcq n GLY 67 N 2.88 0.57 2.87 2.92 0.00 0.61 -4.99 105.19 110.04 2rcq n GLY 67 Ca 0.16 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 2rcq n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rcq s VAL 68 N -2.07 1.17 0.38 1.61 1.01 -0.64 -5.04 120.40 116.82 2rcq s VAL 68 Ca 0.00 -0.95 -0.27 0.00 0.00 0.00 0.00 61.98 60.75 2rcq s VAL 68 Cb 0.00 -1.50 -0.11 0.00 0.00 0.00 0.00 36.38 34.77 2rcq s VAL 68 CO 0.00 -0.12 1.37 -0.62 0.00 0.00 0.00 175.10 175.74 2rcq n GLU 69 N 4.81 2.30 -3.91 2.72 4.71 -1.26 -4.65 120.64 125.37 2rcq n GLU 69 Ca -0.11 0.81 -0.09 0.00 -0.01 0.00 0.00 57.16 57.76 2rcq n GLU 69 Cb 0.45 -2.49 -0.09 0.00 -1.01 0.00 0.00 31.44 28.31 2rcq n GLU 69 CO 0.00 0.00 0.00 -0.59 0.09 0.00 0.00 177.13 176.63 2rcq s PHE 70 N -1.13 0.21 -0.66 -0.32 -0.71 -0.18 -4.97 117.98 110.23 2rcq s PHE 70 Ca 0.56 -0.58 -0.27 0.00 -1.04 0.00 0.00 56.93 55.60 2rcq s PHE 70 Cb -0.51 -0.13 0.03 0.00 -1.21 0.00 0.00 43.02 41.20 2rcq s PHE 70 CO 0.62 -0.44 1.20 0.34 -1.34 0.00 0.00 175.22 175.59 2rcq s ASP 71 N -2.50 6.29 -0.39 1.98 -1.08 -1.26 -0.82 116.67 118.89 2rcq s ASP 71 Ca 0.00 -0.25 -0.20 0.00 -0.52 0.00 0.00 52.55 51.58 2rcq s ASP 71 Cb 0.02 -2.54 0.01 0.00 -1.46 0.00 0.00 42.92 38.96 2rcq s ASP 71 CO -0.08 -1.62 0.58 -0.70 0.52 0.00 0.00 175.17 173.88 2rcq s GLU 72 N 5.17 3.46 -0.39 4.34 2.12 -0.35 -4.96 118.70 128.09 2rcq s GLU 72 Ca 0.37 -0.25 -0.17 0.00 0.36 0.00 0.00 54.97 55.28 2rcq s GLU 72 Cb -0.09 -3.88 0.01 0.00 0.26 0.00 0.00 34.13 30.44 2rcq s GLU 72 CO 0.19 -0.82 0.46 -0.47 -0.54 0.00 0.00 175.26 174.09 2rcq s TYR 73 N 2.60 3.17 -1.06 5.30 5.04 -1.26 -1.37 117.35 129.77 2rcq s TYR 73 Ca 0.21 -0.15 -0.06 0.00 -2.44 0.00 0.00 57.07 54.63 2rcq s TYR 73 Cb -0.15 -2.91 0.03 0.00 0.35 0.00 0.00 41.96 39.28 2rcq s TYR 73 CO 0.16 -0.63 2.71 0.25 -1.34 0.00 0.00 175.55 176.70 2rcq n THR 74 N 5.45 4.42 0.03 4.34 -2.24 0.04 -4.73 114.28 121.58 2rcq n THR 74 Ca -0.06 -3.40 0.19 0.00 -2.27 0.00 0.00 64.05 58.50 2rcq n THR 74 Cb 0.48 -2.07 0.69 0.00 -2.10 0.00 0.00 70.33 67.33 2rcq n THR 74 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2rcq h LYS 75 N 4.16 0.00 -0.00 -0.78 2.10 -1.93 0.30 116.57 120.42 2rcq h LYS 75 Ca 0.62 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.27 2rcq h LYS 75 Cb 0.51 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 2rcq h LYS 75 CO 1.28 0.00 -0.07 -1.13 -2.00 0.00 0.00 179.45 177.53 2rcq n SER 76 N -4.39 0.40 0.00 7.07 3.41 -1.26 -4.59 113.62 114.25 2rcq n SER 76 Ca 0.08 -0.63 0.00 0.00 -0.26 0.00 0.00 58.87 58.06 2rcq n SER 76 Cb 0.55 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 2rcq n SER 76 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2rcq n LEU 77 N -0.94 0.00 -0.87 1.04 4.77 -0.39 -4.98 117.00 115.63 2rcq n LEU 77 Ca 0.16 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.24 2rcq n LEU 77 Cb 0.25 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.46 2rcq n LEU 77 CO 0.22 0.00 0.60 -0.90 -1.33 0.00 0.00 177.39 175.98 2rcq n ASP 78 N 0.00 2.87 -3.71 -1.43 3.85 -1.07 -4.94 116.55 112.13 2rcq n ASP 78 Ca 0.00 -1.87 -0.24 0.00 -0.71 0.00 0.00 54.79 51.97 2rcq n ASP 78 Cb 0.00 -0.09 0.05 0.00 -1.35 0.00 0.00 41.12 39.73 2rcq n ASP 78 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2rcq n ASN 79 N 1.17 -3.76 -4.76 -1.12 3.02 -0.04 -5.00 115.26 104.77 2rcq n ASN 79 Ca 0.14 -0.71 -0.25 0.00 -0.03 0.00 0.00 54.58 53.73 2rcq n ASN 79 Cb 0.51 -4.40 -0.07 0.00 -0.61 0.00 0.00 39.78 35.22 2rcq n ASN 79 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2rcq s ARG 80 N -6.18 2.24 -0.14 3.52 0.52 -1.26 -4.85 118.95 112.79 2rcq s ARG 80 Ca 0.36 -1.87 -0.04 0.00 -0.52 0.00 0.00 55.73 53.66 2rcq s ARG 80 Cb -0.17 -1.99 -0.03 0.00 0.52 0.00 0.00 34.95 33.28 2rcq s ARG 80 CO 0.79 -0.17 -0.01 -1.01 0.02 0.00 0.00 175.30 174.91 2rcq s HIS 81 N -2.62 3.08 0.07 -0.53 3.76 -1.26 -0.78 115.29 117.00 2rcq s HIS 81 Ca 0.39 -0.12 0.06 0.00 -0.15 0.00 0.00 55.06 55.24 2rcq s HIS 81 Cb 0.03 -1.93 -0.03 0.00 1.11 0.00 0.00 32.58 31.76 2rcq s HIS 81 CO 0.22 0.11 -0.16 0.14 -0.85 0.00 0.00 174.74 174.20 2rcq s VAL 82 N 0.06 1.31 -0.60 -0.90 -7.23 -0.47 -4.74 120.40 107.84 2rcq s VAL 82 Ca 0.01 -1.26 -0.25 0.00 -1.81 0.00 0.00 61.98 58.67 2rcq s VAL 82 Cb -0.13 -1.21 0.04 0.00 0.56 0.00 0.00 36.38 35.64 2rcq s VAL 82 CO 0.02 -0.07 1.01 -0.75 -0.31 0.00 0.00 175.10 175.00 2rcq s LYS 83 N -1.54 3.29 -0.08 4.82 2.20 0.46 -1.22 119.74 127.67 2rcq s LYS 83 Ca 0.02 -0.32 -0.12 0.00 -0.36 0.00 0.00 55.97 55.18 2rcq s LYS 83 Cb -0.09 -4.10 -0.05 0.00 -1.51 0.00 0.00 37.83 32.08 2rcq s LYS 83 CO 0.02 -1.65 0.30 0.00 -0.36 0.00 0.00 175.35 173.67 2rcq s ALA 84 N 4.28 3.72 -0.05 3.13 0.00 -0.00 -0.80 121.76 132.04 2rcq s ALA 84 Ca 0.31 -0.40 -0.01 0.00 0.00 0.00 0.00 51.96 51.86 2rcq s ALA 84 Cb -0.12 -2.27 0.03 0.00 0.00 0.00 0.00 23.12 20.75 2rcq s ALA 84 CO 0.18 0.42 0.01 -1.17 0.00 0.00 0.00 175.76 175.19 2rcq s LEU 85 N -0.66 0.80 -0.18 0.00 2.96 -0.44 -1.01 118.68 120.16 2rcq s LEU 85 Ca 0.19 -0.04 -0.04 0.00 -0.22 0.00 0.00 54.13 54.02 2rcq s LEU 85 Cb -0.14 -0.31 -0.02 0.00 0.50 0.00 0.00 46.19 46.21 2rcq s LEU 85 CO 0.08 -0.15 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.24 2rcq s VAL 86 N 1.55 3.84 0.13 1.68 1.01 -1.26 -1.15 120.40 126.20 2rcq s VAL 86 Ca -0.02 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 61.62 2rcq s VAL 86 Cb -0.13 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 2rcq s VAL 86 CO -0.03 0.46 -0.06 0.42 0.00 0.00 0.00 175.10 175.89 2rcq s THR 87 N 0.72 0.85 -0.06 3.92 -4.23 0.47 -0.29 115.64 117.02 2rcq s THR 87 Ca -0.01 -1.99 -0.18 0.00 -1.18 0.00 0.00 61.69 58.33 2rcq s THR 87 Cb -0.14 -1.84 -0.05 0.00 1.34 0.00 0.00 72.50 71.80 2rcq s THR 87 CO 0.02 -0.74 0.49 0.26 -0.54 0.00 0.00 174.62 174.12 2rcq s TRP 88 N -3.53 3.61 -0.35 3.99 0.52 -1.26 -0.06 118.94 121.86 2rcq s TRP 88 Ca 0.16 1.00 0.00 0.00 0.02 0.00 0.00 56.10 57.28 2rcq s TRP 88 Cb 0.05 -2.50 0.09 0.00 -1.15 0.00 0.00 33.47 29.95 2rcq s TRP 88 CO -0.01 0.33 0.08 -1.21 0.02 0.00 0.00 176.95 176.16 2rcq s GLU 89 N 0.00 1.97 7.96 4.98 2.02 0.24 -4.95 118.70 130.92 2rcq s GLU 89 Ca 0.27 -1.66 0.00 0.00 0.02 0.00 0.00 54.97 53.59 2rcq s GLU 89 Cb -0.16 -3.31 0.00 0.00 0.10 0.00 0.00 34.13 30.76 2rcq s GLU 89 CO 0.13 -0.88 0.00 0.41 0.02 0.00 0.00 175.26 174.94 2rcq n GLY 90 N 4.48 3.97 1.41 -1.39 0.00 -1.26 -1.14 105.19 111.26 2rcq n GLY 90 Ca -0.04 0.03 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 2rcq n GLY 90 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2rcq n ASP 91 N 7.55 3.26 -4.47 1.61 9.92 -1.26 -4.92 116.55 128.24 2rcq n ASP 91 Ca 0.00 -3.54 -0.35 0.00 -0.53 0.00 0.00 54.79 50.38 2rcq n ASP 91 Cb 0.00 -0.67 -0.12 0.00 -0.64 0.00 0.00 41.12 39.69 2rcq n ASP 91 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2rcq s VAL 92 N -3.15 3.98 -0.32 2.53 1.01 -0.29 -3.95 120.40 120.22 2rcq s VAL 92 Ca 0.48 -0.31 -0.23 0.00 0.00 0.00 0.00 61.98 61.92 2rcq s VAL 92 Cb 0.41 -2.79 0.00 0.00 0.00 0.00 0.00 36.38 34.00 2rcq s VAL 92 CO 0.05 0.44 0.78 -0.22 0.00 0.00 0.00 175.10 176.15 2rcq s LEU 93 N 0.85 4.10 -0.18 3.92 2.96 0.07 -0.59 118.68 129.80 2rcq s LEU 93 Ca 0.01 0.57 -0.02 0.00 -0.22 0.00 0.00 54.13 54.47 2rcq s LEU 93 Cb -0.14 -3.05 -0.01 0.00 0.50 0.00 0.00 46.19 43.49 2rcq s LEU 93 CO 0.02 -0.64 -0.10 -0.69 -1.32 0.00 0.00 176.35 173.62 2rcq s VAL 94 N 2.98 3.04 -0.14 1.68 1.01 0.91 -0.57 120.40 129.31 2rcq s VAL 94 Ca 0.32 -0.63 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 2rcq s VAL 94 Cb -0.14 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 2rcq s VAL 94 CO 0.14 0.48 -0.09 0.00 0.00 0.00 0.00 175.10 175.62 2rcq s VAL 96 N 0.38 3.45 -0.52 0.00 1.01 -0.30 -1.39 120.40 123.04 2rcq s VAL 96 Ca -0.08 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.36 2rcq s VAL 96 Cb -0.15 -2.50 0.14 0.00 0.00 0.00 0.00 36.38 33.86 2rcq s VAL 96 CO 0.04 0.49 0.33 -1.10 0.00 0.00 0.00 175.10 174.87 2rcq s GLN 97 N 0.57 2.31 0.14 2.72 -0.21 0.23 -1.32 119.66 124.10 2rcq s GLN 97 Ca -0.05 -2.18 -0.29 0.00 0.02 0.00 0.00 55.36 52.86 2rcq s GLN 97 Cb -0.15 -3.67 -0.07 0.00 1.00 0.00 0.00 33.01 30.12 2rcq s GLN 97 CO 0.03 -1.13 0.91 0.15 -2.12 0.00 0.00 175.29 173.13 2rcq s LYS 98 N 0.54 4.70 0.00 2.91 -0.14 0.02 -4.42 119.74 123.34 2rcq s LYS 98 Ca 0.13 1.37 0.00 0.00 -1.36 0.00 0.00 55.97 56.11 2rcq s LYS 98 Cb -0.22 -3.34 0.00 0.00 -1.68 0.00 0.00 37.83 32.60 2rcq s LYS 98 CO -0.04 0.34 0.00 0.41 -0.76 0.00 0.00 175.35 175.31 2rcq n GLY 99 N 2.00 -0.58 0.06 -3.33 0.00 -1.26 -0.41 105.19 101.66 2rcq n GLY 99 Ca -0.00 -0.69 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 2rcq n GLY 99 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2rcq h GLU 100 N 0.00 0.02 -6.85 1.61 4.22 -1.92 -3.42 114.58 108.24 2rcq h GLU 100 Ca 0.00 -0.00 -0.51 0.00 0.08 0.00 0.00 59.36 58.93 2rcq h GLU 100 Cb 0.00 -0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.28 2rcq h GLU 100 CO 0.00 0.01 0.53 0.15 -2.18 0.00 0.00 179.01 177.52 2rcq s LYS 101 N -6.19 4.47 0.43 1.92 -0.14 -1.26 -5.02 119.74 113.95 2rcq s LYS 101 Ca -0.13 1.93 -0.18 0.00 -1.36 0.00 0.00 55.97 56.22 2rcq s LYS 101 Cb 0.07 -3.08 -0.10 0.00 -1.68 0.00 0.00 37.83 33.05 2rcq s LYS 101 CO 0.67 0.02 0.91 -1.21 -0.76 0.00 0.00 175.35 174.98 2rcq s GLU 102 N -1.68 4.10 -1.55 1.68 0.41 -1.26 -4.34 118.70 116.06 2rcq s GLU 102 Ca 0.48 0.96 -0.05 0.00 -0.41 0.00 0.00 54.97 55.95 2rcq s GLU 102 Cb -0.34 -2.23 0.01 0.00 -1.78 0.00 0.00 34.13 29.80 2rcq s GLU 102 CO 0.44 -0.05 0.54 0.09 -0.49 0.00 0.00 175.26 175.79 2rcq n ASN 103 N -0.84 -5.87 -4.72 -0.19 3.02 -1.26 -0.13 115.26 105.28 2rcq n ASN 103 Ca 0.06 -0.27 -0.36 0.00 -0.03 0.00 0.00 54.58 53.98 2rcq n ASN 103 Cb 0.54 -4.76 -0.07 0.00 -0.61 0.00 0.00 39.78 34.87 2rcq n ASN 103 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2rcq s ARG 104 N -5.67 4.23 0.00 3.52 3.52 -1.26 -3.22 118.95 120.06 2rcq s ARG 104 Ca 0.29 0.01 0.00 0.00 -0.13 0.00 0.00 55.73 55.90 2rcq s ARG 104 Cb -0.13 -3.44 0.00 0.00 -1.56 0.00 0.00 34.95 29.82 2rcq s ARG 104 CO 0.35 0.22 0.00 0.41 -0.81 0.00 0.00 175.30 175.47 2rcq n GLY 105 N 3.51 -0.64 3.53 8.12 0.00 -0.79 -0.60 105.19 118.32 2rcq n GLY 105 Ca -0.13 -0.94 -0.11 0.00 0.00 0.00 0.00 46.02 44.85 2rcq n GLY 105 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2rcq s TRP 106 N -3.00 -0.43 -0.03 1.61 1.48 -0.48 -0.92 118.94 117.17 2rcq s TRP 106 Ca 0.00 0.15 0.01 0.00 -1.06 0.00 0.00 56.10 55.21 2rcq s TRP 106 Cb 0.00 0.58 0.01 0.00 -1.16 0.00 0.00 33.47 32.90 2rcq s TRP 106 CO 0.00 -0.94 -0.04 0.15 -4.06 0.00 0.00 176.95 172.06 2rcq s LYS 107 N -3.80 0.56 -0.04 3.25 1.02 0.10 -0.00 119.74 120.84 2rcq s LYS 107 Ca 0.04 -0.10 0.01 0.00 0.02 0.00 0.00 55.97 55.94 2rcq s LYS 107 Cb -0.02 -0.60 0.02 0.00 -0.52 0.00 0.00 37.83 36.71 2rcq s LYS 107 CO -0.08 -0.02 -0.05 -1.14 -0.92 0.00 0.00 175.35 173.15 2rcq s GLN 108 N 0.54 0.78 0.08 1.68 0.74 0.26 -0.58 119.66 123.15 2rcq s GLN 108 Ca -0.06 -0.12 -0.19 0.00 0.05 0.00 0.00 55.36 55.03 2rcq s GLN 108 Cb -0.10 -0.78 0.04 0.00 1.10 0.00 0.00 33.01 33.28 2rcq s GLN 108 CO -0.00 -0.04 0.45 1.67 -0.55 0.00 0.00 175.29 176.81 2rcq s TRP 109 N 0.74 -0.31 -0.16 1.67 -2.14 -0.30 -0.75 118.94 117.69 2rcq s TRP 109 Ca -0.10 0.20 -0.09 0.00 2.66 0.00 0.00 56.10 58.77 2rcq s TRP 109 Cb -0.13 0.29 -0.05 0.00 -3.10 0.00 0.00 33.47 30.48 2rcq s TRP 109 CO 0.00 -0.65 0.15 0.42 -2.66 0.00 0.00 176.95 174.22 2rcq s ILE 110 N -2.94 5.44 -0.28 0.66 -1.09 -1.26 -0.28 121.20 121.44 2rcq s ILE 110 Ca -0.02 0.24 0.02 0.00 -2.23 0.00 0.00 60.65 58.66 2rcq s ILE 110 Cb 0.00 -3.46 0.07 0.00 -1.58 0.00 0.00 42.46 37.50 2rcq s ILE 110 CO -0.06 0.52 -0.03 -1.61 -1.23 0.00 0.00 174.94 172.53 2rcq s GLU 111 N -0.30 1.74 5.28 2.79 2.02 -0.36 -0.46 118.70 129.42 2rcq s GLU 111 Ca 0.12 -1.36 0.00 0.00 0.02 0.00 0.00 54.97 53.75 2rcq s GLU 111 Cb -0.12 -2.82 0.00 0.00 0.10 0.00 0.00 34.13 31.29 2rcq s GLU 111 CO 0.02 -0.71 0.00 0.41 0.02 0.00 0.00 175.26 175.00 2rcq n GLY 112 N 4.48 0.95 0.84 -1.39 0.00 -1.26 -1.85 105.19 106.97 2rcq n GLY 112 Ca -0.08 0.49 0.07 0.00 0.00 0.00 0.00 46.02 46.51 2rcq n GLY 112 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2rcq n ASP 113 N 10.58 3.52 -4.27 1.61 5.75 -1.26 -4.98 116.55 127.49 2rcq n ASP 113 Ca 0.00 -2.47 -0.21 0.00 -0.01 0.00 0.00 54.79 52.10 2rcq n ASP 113 Cb 0.00 -0.40 -0.12 0.00 -1.03 0.00 0.00 41.12 39.58 2rcq n ASP 113 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2rcq s LYS 114 N -1.84 1.10 -0.12 0.11 1.02 -0.77 -3.31 119.74 115.93 2rcq s LYS 114 Ca 0.34 -1.22 -0.02 0.00 0.02 0.00 0.00 55.97 55.09 2rcq s LYS 114 Cb 0.23 -1.17 -0.03 0.00 -0.52 0.00 0.00 37.83 36.34 2rcq s LYS 114 CO 0.14 0.25 -0.06 -1.17 -0.92 0.00 0.00 175.35 173.59 2rcq s LEU 115 N -2.23 3.15 -0.03 3.17 0.20 -0.31 -1.22 118.68 121.40 2rcq s LEU 115 Ca 0.08 -0.11 0.05 0.00 0.69 0.00 0.00 54.13 54.84 2rcq s LEU 115 Cb -0.08 -1.73 -0.02 0.00 -0.43 0.00 0.00 46.19 43.93 2rcq s LEU 115 CO 0.04 0.24 -0.18 -0.31 -0.29 0.00 0.00 176.35 175.85 2rcq s TYR 116 N -0.07 2.58 -0.04 5.38 1.51 0.61 0.04 117.35 127.36 2rcq s TYR 116 Ca 0.01 -0.25 -0.01 0.00 -1.01 0.00 0.00 57.07 55.80 2rcq s TYR 116 Cb -0.13 -1.57 0.03 0.00 -0.11 0.00 0.00 41.96 40.17 2rcq s TYR 116 CO 0.03 0.13 0.05 -1.17 -1.11 0.00 0.00 175.55 173.48 2rcq s LEU 117 N -0.78 0.41 -0.21 -1.29 2.96 -0.35 -1.15 118.68 118.27 2rcq s LEU 117 Ca 0.11 0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 54.04 2rcq s LEU 117 Cb -0.10 -0.14 -0.01 0.00 0.50 0.00 0.00 46.19 46.43 2rcq s LEU 117 CO 0.01 -0.22 -0.03 -0.70 -1.32 0.00 0.00 176.35 174.09 2rcq s GLU 118 N 1.87 3.43 -0.11 1.98 2.12 0.25 -0.32 118.70 127.93 2rcq s GLU 118 Ca 0.01 -0.60 -0.02 0.00 0.36 0.00 0.00 54.97 54.72 2rcq s GLU 118 Cb -0.12 -3.02 -0.03 0.00 0.26 0.00 0.00 34.13 31.22 2rcq s GLU 118 CO -0.03 -0.14 -0.03 -0.51 -0.54 0.00 0.00 175.26 174.01 2rcq s LEU 119 N 1.34 3.34 0.05 2.70 1.43 0.32 -0.72 118.68 127.14 2rcq s LEU 119 Ca 0.04 -0.02 0.06 0.00 -1.03 0.00 0.00 54.13 53.18 2rcq s LEU 119 Cb -0.14 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 2rcq s LEU 119 CO -0.01 0.28 -0.17 0.42 0.23 0.00 0.00 176.35 177.09 2rcq s THR 120 N -0.28 1.35 -0.26 5.49 -4.23 -0.09 -0.43 115.64 117.19 2rcq s THR 120 Ca 0.05 -1.13 -0.13 0.00 -1.18 0.00 0.00 61.69 59.30 2rcq s THR 120 Cb -0.13 -1.21 0.09 0.00 1.34 0.00 0.00 72.50 72.60 2rcq s THR 120 CO 0.02 0.05 0.61 0.00 -0.54 0.00 0.00 174.62 174.76 2rcq n GLY 122 N 4.61 4.28 1.44 0.00 0.00 0.82 -0.84 105.19 115.50 2rcq n GLY 122 Ca -0.18 0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.04 2rcq n GLY 122 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2rcq n ASP 123 N 8.34 4.75 -4.66 1.61 5.75 -1.26 -4.74 116.55 126.34 2rcq n ASP 123 Ca 0.00 -2.74 -0.35 0.00 -0.01 0.00 0.00 54.79 51.70 2rcq n ASP 123 Cb 0.00 -0.58 -0.10 0.00 -1.03 0.00 0.00 41.12 39.41 2rcq n ASP 123 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2rcq s GLN 124 N -2.37 3.08 -0.08 0.11 -1.52 -0.02 -5.10 119.66 113.75 2rcq s GLN 124 Ca 0.48 -0.42 0.01 0.00 -1.95 0.00 0.00 55.36 53.48 2rcq s GLN 124 Cb 0.35 -2.81 0.02 0.00 -0.22 0.00 0.00 33.01 30.35 2rcq s GLN 124 CO 0.17 0.64 -0.10 0.08 -0.25 0.00 0.00 175.29 175.82 2rcq s VAL 125 N -0.70 1.08 -0.15 1.09 1.01 -1.26 -1.74 120.40 119.73 2rcq s VAL 125 Ca 0.11 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 61.65 2rcq s VAL 125 Cb -0.12 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 35.20 2rcq s VAL 125 CO 0.02 0.36 -0.02 0.00 0.00 0.00 0.00 175.10 175.46 2rcq s ARG 127 N 0.26 3.38 0.02 0.00 3.52 -0.57 -0.52 118.95 125.05 2rcq s ARG 127 Ca -0.02 -0.67 0.07 0.00 -0.13 0.00 0.00 55.73 54.98 2rcq s ARG 127 Cb -0.14 -2.71 -0.02 0.00 -1.56 0.00 0.00 34.95 30.52 2rcq s ARG 127 CO 0.02 0.12 -0.20 -0.65 -0.81 0.00 0.00 175.30 173.78 2rcq s GLN 128 N 0.59 1.47 -0.03 5.12 -0.21 0.57 -0.92 119.66 126.24 2rcq s GLN 128 Ca -0.07 -0.86 0.04 0.00 0.02 0.00 0.00 55.36 54.49 2rcq s GLN 128 Cb -0.15 -1.52 -0.00 0.00 1.00 0.00 0.00 33.01 32.34 2rcq s GLN 128 CO 0.03 0.40 -0.14 0.08 -2.12 0.00 0.00 175.29 173.54 2rcq s VAL 129 N -0.68 1.15 -0.07 1.09 1.01 -0.67 -1.21 120.40 121.00 2rcq s VAL 129 Ca 0.07 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.53 2rcq s VAL 129 Cb -0.08 -0.99 -0.00 0.00 0.00 0.00 0.00 36.38 35.30 2rcq s VAL 129 CO 0.01 0.34 -0.22 -0.36 0.00 0.00 0.00 175.10 174.86 2rcq s PHE 130 N 0.02 2.30 0.47 5.22 0.40 0.11 -0.09 117.98 126.41 2rcq s PHE 130 Ca -0.02 -0.81 -0.08 0.00 -0.60 0.00 0.00 56.93 55.42 2rcq s PHE 130 Cb -0.09 -1.53 -0.05 0.00 0.51 0.00 0.00 43.02 41.85 2rcq s PHE 130 CO 0.01 -0.30 0.82 -1.59 0.70 0.00 0.00 175.22 174.86 2rcq s LYS 131 N 0.14 3.66 0.10 0.44 -2.85 0.60 -1.16 119.74 120.67 2rcq s LYS 131 Ca -0.11 0.40 -0.31 0.00 -1.00 0.00 0.00 55.97 54.96 2rcq s LYS 131 Cb -0.15 -2.34 -0.07 0.00 -2.06 0.00 0.00 37.83 33.21 2rcq s LYS 131 CO 0.06 -0.18 1.25 0.21 0.10 0.00 0.00 175.35 176.79 2rcq s LYS 132 N -4.41 4.41 -0.27 1.78 2.20 -1.21 -0.49 119.74 121.75 2rcq s LYS 132 Ca 0.50 1.88 -0.14 0.00 -0.36 0.00 0.00 55.97 57.85 2rcq s LYS 132 Cb -0.10 -3.30 -0.11 0.00 -1.51 0.00 0.00 37.83 32.80 2rcq s LYS 132 CO 0.40 -0.28 -0.36 1.63 -0.36 0.00 0.00 175.35 176.38 2rcq n LYS 133 N 3.67 0.58 -3.80 4.03 4.76 0.17 -4.84 118.16 122.74 2rcq n LYS 133 Ca 0.09 0.25 -0.13 0.00 -2.87 0.00 0.00 58.31 55.66 2rcq n LYS 133 Cb 0.45 -1.48 -0.12 0.00 -1.84 0.00 0.00 35.03 32.04 2rcq n LYS 133 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2rcq s LEU 134 N -7.54 1.15 0.04 -0.35 1.43 -0.71 -4.97 118.68 107.73 2rcq s LEU 134 Ca -0.38 0.44 0.02 0.00 -1.03 0.00 0.00 54.13 53.18 2rcq s LEU 134 Cb 0.14 0.76 -0.02 0.00 0.03 0.00 0.00 46.19 47.10 2rcq s LEU 134 CO 0.48 -0.08 -0.07 0.68 0.23 0.00 0.00 176.35 177.59 2rcq s VAL 135 N 0.11 0.48 0.30 -1.59 -7.23 -1.26 -0.51 120.40 110.70 2rcq s VAL 135 Ca -0.00 -1.07 0.05 0.00 -1.81 0.00 0.00 61.98 59.15 2rcq s VAL 135 Cb -0.02 -0.57 0.08 0.00 0.56 0.00 0.00 36.38 36.43 2rcq s VAL 135 CO 0.00 -0.41 1.76 -0.65 -0.31 0.00 0.00 175.10 175.49 2rcq h PRO 136 N 4.50 0.38 0.00 4.82 0.11 -1.99 -3.50 132.00 136.31 2rcq h PRO 136 Ca -0.35 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2rcq h PRO 136 Cb 1.20 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2rcq h PRO 136 CO 0.41 0.61 0.00 2.89 -0.21 0.00 0.00 178.00 181.70