#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rbq s ARG 2 N 0.00 4.18 -0.08 0.00 0.52 -1.26 -1.73 118.95 120.58 1rbq s ARG 2 Ca 0.00 0.20 0.04 0.00 -0.52 0.00 0.00 55.73 55.44 1rbq s ARG 2 Cb 0.00 -3.53 -0.02 0.00 0.52 0.00 0.00 34.95 31.93 1rbq s ARG 2 CO 0.00 -0.01 -0.19 0.08 0.02 0.00 0.00 175.30 175.19 1rbq s VAL 3 N 1.23 2.55 -0.11 3.52 1.01 0.30 -0.21 120.40 128.70 1rbq s VAL 3 Ca 0.19 -0.88 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 1rbq s VAL 3 Cb -0.15 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 1rbq s VAL 3 CO 0.08 0.56 0.08 0.00 0.00 0.00 0.00 175.10 175.82 1rbq s ALA 4 N -0.16 3.62 -0.18 5.51 0.00 -0.31 -0.63 121.76 129.62 1rbq s ALA 4 Ca -0.02 -0.71 -0.01 0.00 0.00 0.00 0.00 51.96 51.21 1rbq s ALA 4 Cb -0.14 -1.77 -0.00 0.00 0.00 0.00 0.00 23.12 21.22 1rbq s ALA 4 CO 0.04 0.60 -0.12 0.08 0.00 0.00 0.00 175.76 176.36 1rbq s VAL 5 N -0.94 2.87 -0.06 0.00 1.01 -0.61 -0.25 120.40 122.42 1rbq s VAL 5 Ca 0.14 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.33 1rbq s VAL 5 Cb -0.12 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.96 1rbq s VAL 5 CO 0.03 0.49 0.28 -0.76 0.00 0.00 0.00 175.10 175.14 1rbq s LEU 6 N 1.06 4.42 0.12 3.92 1.43 0.08 -0.64 118.68 129.07 1rbq s LEU 6 Ca -0.00 0.71 -0.02 0.00 -1.03 0.00 0.00 54.13 53.79 1rbq s LEU 6 Cb -0.15 -2.34 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 1rbq s LEU 6 CO -0.03 0.35 0.06 0.27 0.23 0.00 0.00 176.35 177.23 1rbq s ILE 7 N -0.96 0.12 0.00 -0.59 -4.36 0.16 -1.30 121.20 114.27 1rbq s ILE 7 Ca 0.19 -1.85 0.00 0.00 -0.26 0.00 0.00 60.65 58.74 1rbq s ILE 7 Cb -0.14 -1.94 0.00 0.00 1.25 0.00 0.00 42.46 41.63 1rbq s ILE 7 CO 0.09 -0.53 0.29 -1.20 0.24 0.00 0.00 174.94 173.82 1rbq n SER 8 N -0.07 0.32 0.00 4.36 7.64 -0.98 -2.98 113.62 121.90 1rbq n SER 8 Ca -0.07 -1.08 0.00 0.00 1.01 0.00 0.00 58.87 58.73 1rbq n SER 8 Cb 0.63 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.83 1rbq n SER 8 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rbq n GLY 9 N -0.04 3.51 0.27 0.23 0.00 -1.26 -4.80 105.19 103.10 1rbq n GLY 9 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1rbq n GLY 9 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1rbq h THR 10 N 0.00 0.72 0.00 2.61 2.02 -1.93 -1.21 112.91 115.13 1rbq h THR 10 Ca 0.00 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1rbq h THR 10 Cb 0.00 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 1rbq h THR 10 CO 0.00 0.09 0.00 0.61 0.37 0.00 0.00 175.52 176.59 1rbq n GLY 11 N -1.32 0.64 0.37 2.16 0.00 -1.26 -1.81 105.19 103.99 1rbq n GLY 11 Ca 0.13 -0.60 -0.01 0.00 0.00 0.00 0.00 46.02 45.53 1rbq n GLY 11 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1rbq h SER 12 N 0.00 1.10 -0.23 1.61 4.64 -1.93 0.12 113.55 118.86 1rbq h SER 12 Ca 0.00 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 1rbq h SER 12 Cb 0.00 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.81 1rbq h SER 12 CO 0.00 0.80 0.05 0.78 -0.87 0.00 0.00 176.83 177.58 1rbq h ASN 13 N 1.30 0.36 -0.65 4.97 2.35 -1.94 -2.36 115.58 119.61 1rbq h ASN 13 Ca 0.35 -0.25 0.13 0.00 -0.55 0.00 0.00 56.30 55.98 1rbq h ASN 13 Cb -0.15 -0.10 -0.12 0.00 0.05 0.00 0.00 38.32 38.00 1rbq h ASN 13 CO -0.08 0.52 -0.19 0.25 -1.65 0.00 0.00 177.43 176.28 1rbq h LEU 14 N 0.19 -0.71 -0.57 1.61 6.46 -1.76 -1.40 115.31 119.14 1rbq h LEU 14 Ca 0.07 0.20 0.05 0.00 -0.12 0.00 0.00 57.88 58.08 1rbq h LEU 14 Cb 0.30 0.44 -0.05 0.00 -0.73 0.00 0.00 40.66 40.62 1rbq h LEU 14 CO 0.00 -0.24 0.30 -0.61 -0.62 0.00 0.00 178.44 177.28 1rbq h GLN 15 N -0.03 0.56 -0.47 1.25 5.75 -0.51 0.23 115.11 121.90 1rbq h GLN 15 Ca 0.30 -0.03 -0.09 0.00 -0.15 0.00 0.00 58.65 58.68 1rbq h GLN 15 Cb 0.50 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.90 1rbq h GLN 15 CO -0.68 0.37 -0.06 0.00 -2.65 0.00 0.00 178.83 175.81 1rbq h ALA 16 N 1.30 1.01 -0.29 3.38 0.00 -1.04 -1.21 119.26 122.42 1rbq h ALA 16 Ca 0.25 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1rbq h ALA 16 Cb 0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1rbq h ALA 16 CO -0.16 0.60 0.05 -0.07 0.00 0.00 0.00 179.25 179.67 1rbq h LEU 17 N 0.75 0.46 -0.16 0.00 3.38 -0.29 -1.86 115.31 117.59 1rbq h LEU 17 Ca 0.13 -0.26 0.05 0.00 0.09 0.00 0.00 57.88 57.90 1rbq h LEU 17 Cb 0.54 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.11 1rbq h LEU 17 CO 0.03 0.60 -0.22 0.40 0.09 0.00 0.00 178.44 179.34 1rbq h ILE 18 N 0.30 0.46 -0.45 1.22 2.04 -0.19 -1.02 117.51 119.87 1rbq h ILE 18 Ca 0.09 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.97 1rbq h ILE 18 Cb 0.33 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1rbq h ILE 18 CO 0.01 0.00 0.27 0.44 0.00 0.00 0.00 178.15 178.86 1rbq h ASP 19 N -0.26 0.44 0.07 1.72 3.32 -1.18 -2.95 116.42 117.59 1rbq h ASP 19 Ca 0.11 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.04 1rbq h ASP 19 Cb 0.42 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 1rbq h ASP 19 CO -0.31 0.31 -0.40 0.77 -1.72 0.00 0.00 179.24 177.89 1rbq h SER 20 N 0.54 0.45 0.62 6.45 4.64 -1.09 -2.65 113.55 122.51 1rbq h SER 20 Ca 0.18 -0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1rbq h SER 20 Cb 0.00 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1rbq h SER 20 CO -0.08 0.80 0.00 0.35 -0.87 0.00 0.00 176.83 177.04 1rbq n THR 21 N -4.03 0.88 0.67 2.95 -2.24 -0.41 -2.41 114.28 109.69 1rbq n THR 21 Ca -0.02 0.22 0.09 0.00 -2.27 0.00 0.00 64.05 62.07 1rbq n THR 21 Cb 0.50 -1.01 0.08 0.00 -2.10 0.00 0.00 70.33 67.80 1rbq n THR 21 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1rbq n ARG 22 N -1.75 1.54 -1.78 -0.78 1.74 -1.01 -4.71 116.66 109.90 1rbq n ARG 22 Ca 0.03 -1.61 -0.33 0.00 -0.77 0.00 0.00 57.85 55.18 1rbq n ARG 22 Cb 0.20 -1.34 0.04 0.00 -1.02 0.00 0.00 32.46 30.34 1rbq n ARG 22 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1rbq s GLU 23 N -1.44 2.86 0.60 5.56 0.41 -1.01 -5.01 118.70 120.67 1rbq s GLU 23 Ca 0.22 1.36 -0.17 0.00 -0.41 0.00 0.00 54.97 55.97 1rbq s GLU 23 Cb 0.15 -1.96 -0.03 0.00 -1.78 0.00 0.00 34.13 30.51 1rbq s GLU 23 CO 0.22 -1.20 1.10 -1.25 -0.49 0.00 0.00 175.26 173.64 1rbq s PRO 24 N -4.11 3.13 -0.76 0.39 0.04 -1.26 -3.12 135.00 129.30 1rbq s PRO 24 Ca 0.66 1.40 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1rbq s PRO 24 Cb -0.20 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.35 1rbq s PRO 24 CO 0.41 -0.99 0.00 0.09 0.04 0.00 0.00 177.00 176.55 1rbq n ASN 25 N -1.96 -4.54 -4.75 6.66 3.02 -1.26 -5.00 115.26 107.43 1rbq n ASN 25 Ca 0.10 0.18 -0.41 0.00 -0.03 0.00 0.00 54.58 54.42 1rbq n ASN 25 Cb 0.52 -2.68 -0.02 0.00 -0.61 0.00 0.00 39.78 36.99 1rbq n ASN 25 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1rbq s SER 26 N -2.53 6.58 0.00 6.41 0.15 -1.18 -4.92 113.70 118.21 1rbq s SER 26 Ca 0.00 2.77 0.23 0.00 0.70 0.00 0.00 55.95 59.65 1rbq s SER 26 Cb 0.00 -2.64 0.74 0.00 -1.71 0.00 0.00 66.02 62.42 1rbq s SER 26 CO 0.00 -0.73 1.56 -1.20 1.20 0.00 0.00 173.24 174.06 1rbq n SER 27 N 1.82 1.93 -4.07 5.45 7.64 -1.26 -4.93 113.62 120.19 1rbq n SER 27 Ca 0.05 -1.71 -0.14 0.00 1.01 0.00 0.00 58.87 58.08 1rbq n SER 27 Cb 0.40 -0.09 -0.12 0.00 -1.01 0.00 0.00 64.21 63.39 1rbq n SER 27 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rbq s ALA 28 N -1.82 0.66 -0.02 -0.43 0.00 -1.26 0.43 121.76 119.32 1rbq s ALA 28 Ca 0.34 -0.75 0.02 0.00 0.00 0.00 0.00 51.96 51.56 1rbq s ALA 28 Cb 0.19 0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.32 1rbq s ALA 28 CO 0.29 0.02 -0.05 1.14 0.00 0.00 0.00 175.76 177.16 1rbq s GLN 29 N -1.47 0.61 -0.32 0.00 -2.07 -0.71 -4.73 119.66 110.97 1rbq s GLN 29 Ca -0.08 -0.17 -0.24 0.00 -1.82 0.00 0.00 55.36 53.06 1rbq s GLN 29 Cb -0.09 -0.61 0.00 0.00 -1.09 0.00 0.00 33.01 31.22 1rbq s GLN 29 CO 0.01 0.05 0.80 0.42 -1.32 0.00 0.00 175.29 175.24 1rbq s ILE 30 N 0.29 4.77 -0.11 3.63 1.01 -1.26 -0.54 121.20 129.00 1rbq s ILE 30 Ca -0.03 1.16 0.15 0.00 0.00 0.00 0.00 60.65 61.93 1rbq s ILE 30 Cb -0.07 -4.17 -0.23 0.00 0.01 0.00 0.00 42.46 38.00 1rbq s ILE 30 CO -0.00 -0.29 0.37 0.47 0.00 0.00 0.00 174.94 175.49 1rbq n ASP 31 N 6.27 1.43 -3.71 3.58 8.00 0.20 -4.92 116.55 127.40 1rbq n ASP 31 Ca 0.04 -0.11 -0.14 0.00 0.71 0.00 0.00 54.79 55.29 1rbq n ASP 31 Cb 0.48 1.60 -0.09 0.00 -0.02 0.00 0.00 41.12 43.09 1rbq n ASP 31 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1rbq s ILE 32 N -2.97 0.01 -0.11 0.53 1.10 -1.21 -4.31 121.20 114.25 1rbq s ILE 32 Ca -0.04 -0.12 0.03 0.00 -0.51 0.00 0.00 60.65 60.01 1rbq s ILE 32 Cb 0.10 -0.67 0.01 0.00 0.15 0.00 0.00 42.46 42.05 1rbq s ILE 32 CO 0.63 -0.06 -0.20 -0.69 -2.11 0.00 0.00 174.94 172.50 1rbq s VAL 33 N -0.30 1.83 -0.12 4.00 1.01 -0.83 -1.58 120.40 124.42 1rbq s VAL 33 Ca -0.04 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.10 1rbq s VAL 33 Cb -0.03 -1.62 0.00 0.00 0.00 0.00 0.00 36.38 34.73 1rbq s VAL 33 CO 0.03 0.51 -0.22 -0.63 0.00 0.00 0.00 175.10 174.78 1rbq s ILE 34 N 0.66 2.13 -0.02 2.22 1.01 0.19 -1.59 121.20 125.80 1rbq s ILE 34 Ca -0.12 -0.98 0.04 0.00 0.00 0.00 0.00 60.65 59.59 1rbq s ILE 34 Cb -0.16 -1.83 -0.03 0.00 0.01 0.00 0.00 42.46 40.45 1rbq s ILE 34 CO 0.03 0.55 -0.14 -0.55 0.00 0.00 0.00 174.94 174.83 1rbq s SER 35 N 0.56 4.08 0.00 3.58 0.15 0.27 -0.66 113.70 121.68 1rbq s SER 35 Ca -0.13 -0.24 0.29 0.00 0.70 0.00 0.00 55.95 56.57 1rbq s SER 35 Cb -0.17 -0.83 1.24 0.00 -1.71 0.00 0.00 66.02 64.55 1rbq s SER 35 CO 0.04 0.31 1.86 -0.46 1.20 0.00 0.00 173.24 176.19 1rbq n ASN 36 N 1.99 0.74 -4.05 5.45 0.23 -1.16 -0.50 115.26 117.96 1rbq n ASN 36 Ca -0.17 -0.94 -0.21 0.00 -0.53 0.00 0.00 54.58 52.73 1rbq n ASN 36 Cb 0.52 -0.01 -0.15 0.00 -2.08 0.00 0.00 39.78 38.06 1rbq n ASN 36 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1rbq s LYS 37 N -2.26 1.02 0.55 -3.83 1.02 -1.26 -3.68 119.74 111.30 1rbq s LYS 37 Ca 0.34 -0.39 -0.16 0.00 0.02 0.00 0.00 55.97 55.77 1rbq s LYS 37 Cb 0.21 -0.96 -0.06 0.00 -0.52 0.00 0.00 37.83 36.50 1rbq s LYS 37 CO 0.42 0.20 1.03 0.00 -0.92 0.00 0.00 175.35 176.08 1rbq s ALA 38 N -0.09 2.88 -1.31 5.17 0.00 -1.26 -4.29 121.76 122.86 1rbq s ALA 38 Ca 0.01 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.30 1rbq s ALA 38 Cb -0.06 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1rbq s ALA 38 CO 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 175.76 175.22 1rbq n ALA 39 N -1.76 -0.21 -2.27 0.00 0.00 -1.26 -5.00 120.51 110.01 1rbq n ALA 39 Ca 0.08 0.19 -0.34 0.00 0.00 0.00 0.00 53.44 53.37 1rbq n ALA 39 Cb 0.53 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 1rbq n ALA 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1rbq s VAL 40 N -2.49 4.78 0.54 0.00 -7.23 -1.26 -4.98 120.40 109.76 1rbq s VAL 40 Ca 0.00 0.86 0.28 0.00 -1.81 0.00 0.00 61.98 61.31 1rbq s VAL 40 Cb 0.00 -3.71 0.33 0.00 0.56 0.00 0.00 36.38 33.56 1rbq s VAL 40 CO 0.00 0.08 2.20 0.00 -0.31 0.00 0.00 175.10 177.06 1rbq h ALA 41 N 3.03 1.50 -0.52 1.32 0.00 -1.77 -1.74 119.26 121.08 1rbq h ALA 41 Ca -0.48 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.42 1rbq h ALA 41 Cb 1.18 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1rbq h ALA 41 CO 0.66 0.05 0.34 0.78 0.00 0.00 0.00 179.25 181.08 1rbq h GLY 42 N 0.23 0.68 0.94 0.00 0.00 -0.41 -1.56 103.07 102.95 1rbq h GLY 42 Ca -0.00 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 1rbq h GLY 42 CO 0.00 0.22 0.09 1.41 0.00 0.00 0.00 176.54 178.27 1rbq h LEU 43 N 0.62 0.64 -0.74 3.11 3.38 -1.56 -1.90 115.31 118.85 1rbq h LEU 43 Ca 0.20 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1rbq h LEU 43 Cb 0.05 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 1rbq h LEU 43 CO -0.05 0.71 0.45 0.44 0.09 0.00 0.00 178.44 180.08 1rbq h ASP 44 N 0.53 0.89 -0.55 -0.43 3.32 -1.53 -1.51 116.42 117.14 1rbq h ASP 44 Ca 0.13 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1rbq h ASP 44 Cb 0.33 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 1rbq h ASP 44 CO 0.00 0.69 0.35 0.11 -1.72 0.00 0.00 179.24 178.68 1rbq h LYS 45 N 1.01 0.73 0.00 3.56 1.57 -1.17 0.06 116.57 122.34 1rbq h LYS 45 Ca 0.27 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1rbq h LYS 45 Cb -0.04 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.11 1rbq h LYS 45 CO -0.05 0.50 -0.00 0.00 -0.57 0.00 0.00 179.45 179.33 1rbq h ALA 46 N 1.18 -0.01 -0.20 3.86 0.00 -1.10 -2.47 119.26 120.53 1rbq h ALA 46 Ca 0.20 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 1rbq h ALA 46 Cb -0.06 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1rbq h ALA 46 CO -0.04 -0.51 -0.31 0.93 0.00 0.00 0.00 179.25 179.33 1rbq h GLU 47 N -0.01 0.40 0.00 0.00 5.08 -1.08 -0.82 114.58 118.15 1rbq h GLU 47 Ca 0.00 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.16 1rbq h GLU 47 Cb 0.01 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1rbq h GLU 47 CO -0.00 0.67 -0.19 0.00 -1.00 0.00 0.00 179.01 178.49 1rbq h ARG 48 N 0.35 0.00 -0.01 2.33 3.08 -0.92 -2.11 114.38 117.09 1rbq h ARG 48 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1rbq h ARG 48 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.77 1rbq h ARG 48 CO 0.05 0.19 -0.02 0.00 -1.07 0.00 0.00 179.97 179.12 1rbq n ALA 49 N -2.29 2.64 -1.87 0.04 0.00 -0.84 -4.93 120.51 113.25 1rbq n ALA 49 Ca -0.01 -0.39 -0.06 0.00 0.00 0.00 0.00 53.44 52.98 1rbq n ALA 49 Cb 0.32 -1.24 -0.01 0.00 0.00 0.00 0.00 19.45 18.52 1rbq n ALA 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rbq n GLY 50 N 1.16 0.31 3.52 0.00 0.00 -0.79 -5.05 105.19 104.33 1rbq n GLY 50 Ca 0.19 -0.68 -0.34 0.00 0.00 0.00 0.00 46.02 45.20 1rbq n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rbq s ILE 51 N -2.28 4.10 0.62 -0.61 1.01 -0.37 -5.01 121.20 118.66 1rbq s ILE 51 Ca 0.00 -0.28 -0.19 0.00 0.00 0.00 0.00 60.65 60.18 1rbq s ILE 51 Cb 0.00 -2.82 -0.02 0.00 0.01 0.00 0.00 42.46 39.63 1rbq s ILE 51 CO 0.00 0.47 1.24 -2.65 0.00 0.00 0.00 174.94 174.00 1rbq n PRO 52 N 3.67 1.16 -4.28 2.79 -0.02 -1.26 -3.71 135.00 133.36 1rbq n PRO 52 Ca -0.17 0.45 -0.19 0.00 -2.02 0.00 0.00 63.50 61.56 1rbq n PRO 52 Cb 0.52 -2.46 -0.11 0.00 -0.02 0.00 0.00 33.50 31.43 1rbq n PRO 52 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1rbq s THR 53 N -1.39 1.52 0.02 3.45 -4.23 -1.26 -1.96 115.64 111.78 1rbq s THR 53 Ca 0.80 -1.82 0.02 0.00 -1.18 0.00 0.00 61.69 59.50 1rbq s THR 53 Cb -0.39 -1.68 -0.01 0.00 1.34 0.00 0.00 72.50 71.75 1rbq s THR 53 CO 0.43 -0.40 -0.06 -0.13 -0.54 0.00 0.00 174.62 173.92 1rbq s ARG 54 N -2.79 0.47 -0.26 3.99 1.81 -0.62 -4.96 118.95 116.59 1rbq s ARG 54 Ca 0.12 -0.46 -0.07 0.00 -1.72 0.00 0.00 55.73 53.60 1rbq s ARG 54 Cb -0.05 -0.34 -0.02 0.00 -0.45 0.00 0.00 34.95 34.09 1rbq s ARG 54 CO 0.04 0.08 0.07 0.08 -0.68 0.00 0.00 175.30 174.89 1rbq s VAL 55 N -0.74 4.20 -0.41 3.52 1.01 -1.26 -0.56 120.40 126.16 1rbq s VAL 55 Ca -0.04 -0.30 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 1rbq s VAL 55 Cb -0.06 -3.01 0.11 0.00 0.00 0.00 0.00 36.38 33.43 1rbq s VAL 55 CO 0.00 0.29 0.18 -0.63 0.00 0.00 0.00 175.10 174.93 1rbq s ILE 56 N 1.59 2.99 -0.42 2.22 1.01 0.35 -4.98 121.20 123.96 1rbq s ILE 56 Ca 0.06 -2.25 -0.28 0.00 0.00 0.00 0.00 60.65 58.17 1rbq s ILE 56 Cb -0.15 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.23 1rbq s ILE 56 CO 0.03 -0.68 1.55 0.21 0.00 0.00 0.00 174.94 176.05 1rbq s ASN 57 N 1.40 6.11 0.53 3.58 3.84 -1.26 -4.12 114.94 125.02 1rbq s ASN 57 Ca 0.10 0.86 0.21 0.00 0.21 0.00 0.00 52.86 54.24 1rbq s ASN 57 Cb -0.22 -2.54 1.34 0.00 -0.55 0.00 0.00 41.25 39.29 1rbq s ASN 57 CO -0.05 -1.61 2.08 1.12 -2.79 0.00 0.00 177.10 175.85 1rbq h HIS 58 N 11.65 0.00 0.00 0.43 2.07 -1.94 -1.84 115.15 125.53 1rbq h HIS 58 Ca -0.29 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.23 1rbq h HIS 58 Cb 1.13 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.11 1rbq h HIS 58 CO 0.98 0.00 0.00 1.63 -3.07 0.00 0.00 177.93 177.47 1rbq n LYS 59 N -4.44 0.03 -0.22 5.12 5.02 -1.26 -2.55 118.16 119.85 1rbq n LYS 59 Ca 0.03 0.33 0.09 0.00 -2.02 0.00 0.00 58.31 56.74 1rbq n LYS 59 Cb 0.33 -1.57 0.25 0.00 -0.02 0.00 0.00 35.03 34.02 1rbq n LYS 59 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1rbq n LEU 60 N -1.63 2.67 -4.39 -0.35 4.77 -0.69 -4.90 117.00 112.48 1rbq n LEU 60 Ca 0.03 -1.28 -0.31 0.00 -0.03 0.00 0.00 56.01 54.42 1rbq n LEU 60 Cb 0.15 -0.29 -0.14 0.00 -2.33 0.00 0.00 43.42 40.80 1rbq n LEU 60 CO 0.12 0.64 -0.54 -0.31 -1.33 0.00 0.00 177.39 175.98 1rbq s TYR 61 N -1.41 2.42 0.27 -1.77 1.51 -1.06 -5.03 117.35 112.28 1rbq s TYR 61 Ca 0.35 -0.35 0.00 0.00 -1.01 0.00 0.00 57.07 56.06 1rbq s TYR 61 Cb 0.18 -1.44 0.39 0.00 -0.11 0.00 0.00 41.96 40.98 1rbq s TYR 61 CO 0.25 0.16 1.76 0.87 -1.11 0.00 0.00 175.55 177.47 1rbq h LYS 62 N 4.80 0.66 -3.70 -0.62 1.57 -1.90 -3.47 116.57 113.91 1rbq h LYS 62 Ca -0.47 -0.20 -0.13 0.00 -1.87 0.00 0.00 60.65 57.99 1rbq h LYS 62 Cb 1.14 -0.07 -0.07 0.00 0.08 0.00 0.00 32.23 33.32 1rbq h LYS 62 CO 0.46 0.74 -0.06 0.54 -0.57 0.00 0.00 179.45 180.55 1rbq s ASN 63 N -6.72 0.32 0.19 0.86 2.20 -1.26 -5.07 114.94 105.45 1rbq s ASN 63 Ca -0.08 -1.18 -0.08 0.00 -0.94 0.00 0.00 52.86 50.58 1rbq s ASN 63 Cb 0.14 0.67 0.10 0.00 -2.00 0.00 0.00 41.25 40.16 1rbq s ASN 63 CO 0.80 -1.31 1.62 0.03 -2.94 0.00 0.00 177.10 175.29 1rbq h ARG 64 N 2.14 0.96 -0.43 3.55 3.08 -1.96 -2.59 114.38 119.13 1rbq h ARG 64 Ca -0.28 -0.35 0.06 0.00 0.07 0.00 0.00 59.98 59.48 1rbq h ARG 64 Cb 1.25 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 31.18 1rbq h ARG 64 CO 0.37 1.02 0.12 0.28 -1.07 0.00 0.00 179.97 180.70 1rbq h VAL 65 N 0.85 0.82 -0.52 2.04 2.07 -1.97 0.28 116.25 119.82 1rbq h VAL 65 Ca 0.13 -0.09 -0.10 0.00 0.82 0.00 0.00 66.70 67.46 1rbq h VAL 65 Cb 0.67 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1rbq h VAL 65 CO 0.05 0.05 -0.05 -0.33 0.02 0.00 0.00 177.57 177.31 1rbq h GLU 66 N 0.27 0.96 -0.22 1.57 5.08 -1.97 -0.52 114.58 119.74 1rbq h GLU 66 Ca 0.21 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 1rbq h GLU 66 Cb 0.23 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1rbq h GLU 66 CO -0.24 1.00 0.11 0.35 -1.00 0.00 0.00 179.01 179.22 1rbq h PHE 67 N 0.83 0.32 -0.52 4.33 3.57 -1.07 -2.11 116.94 122.29 1rbq h PHE 67 Ca 0.14 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.66 1rbq h PHE 67 Cb 0.60 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 1rbq h PHE 67 CO 0.04 0.31 0.35 -0.44 -2.23 0.00 0.00 178.31 176.34 1rbq h ASP 68 N 0.23 0.49 -0.49 0.41 3.32 -0.31 -2.14 116.42 117.92 1rbq h ASP 68 Ca 0.08 -0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.00 1rbq h ASP 68 Cb 0.11 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1rbq h ASP 68 CO -0.01 0.34 -0.17 0.28 -1.72 0.00 0.00 179.24 177.96 1rbq h SER 69 N 0.57 1.00 -0.66 6.45 0.02 -0.83 0.10 113.55 120.19 1rbq h SER 69 Ca 0.21 -0.38 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1rbq h SER 69 Cb 0.14 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 1rbq h SER 69 CO -0.06 1.15 0.42 0.00 -1.14 0.00 0.00 176.83 177.21 1rbq h ALA 70 N 0.88 0.84 0.04 3.77 0.00 -0.89 -0.21 119.26 123.68 1rbq h ALA 70 Ca 0.12 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1rbq h ALA 70 Cb 0.74 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1rbq h ALA 70 CO 0.06 0.29 -0.02 0.82 0.00 0.00 0.00 179.25 180.39 1rbq h ILE 71 N 0.89 0.95 -0.90 0.00 2.04 -1.25 -3.07 117.51 116.17 1rbq h ILE 71 Ca 0.24 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.21 1rbq h ILE 71 Cb -0.07 0.95 -0.07 0.00 -0.74 0.00 0.00 36.82 36.89 1rbq h ILE 71 CO -0.05 0.00 0.58 -0.78 0.00 0.00 0.00 178.15 177.90 1rbq h ASP 72 N -0.06 0.78 -0.23 1.72 3.58 -0.57 -1.54 116.42 120.10 1rbq h ASP 72 Ca -0.00 0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.50 1rbq h ASP 72 Cb 0.05 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 40.95 1rbq h ASP 72 CO 0.00 0.44 0.08 0.25 -2.88 0.00 0.00 179.24 177.13 1rbq h LEU 73 N 0.85 0.10 -0.76 2.28 6.46 -0.96 -0.03 115.31 123.26 1rbq h LEU 73 Ca 0.43 0.02 0.01 0.00 -0.12 0.00 0.00 57.88 58.23 1rbq h LEU 73 Cb 0.49 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.39 1rbq h LEU 73 CO -0.19 0.09 0.50 0.58 -0.62 0.00 0.00 178.44 178.79 1rbq h VAL 74 N 0.20 1.18 -0.67 1.05 2.07 -1.23 0.17 116.25 119.01 1rbq h VAL 74 Ca 0.10 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1rbq h VAL 74 Cb 0.06 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.88 1rbq h VAL 74 CO -0.10 0.18 0.32 -0.07 0.02 0.00 0.00 177.57 177.92 1rbq h LEU 75 N 1.01 0.86 -0.21 2.57 4.07 -0.98 -1.07 115.31 121.56 1rbq h LEU 75 Ca 0.28 -0.09 -0.08 0.00 0.08 0.00 0.00 57.88 58.07 1rbq h LEU 75 Cb -0.09 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.43 1rbq h LEU 75 CO -0.07 0.73 -0.19 -0.33 -1.08 0.00 0.00 178.44 177.50 1rbq h GLU 76 N 0.95 0.51 -0.86 1.13 4.39 -0.54 -1.01 114.58 119.15 1rbq h GLU 76 Ca 0.23 -0.26 0.20 0.00 0.34 0.00 0.00 59.36 59.88 1rbq h GLU 76 Cb 0.10 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.70 1rbq h GLU 76 CO -0.03 0.83 0.58 0.93 -1.16 0.00 0.00 179.01 180.16 1rbq h GLU 77 N 0.19 0.29 -0.35 2.33 5.08 -0.19 -1.37 114.58 120.55 1rbq h GLU 77 Ca 0.04 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1rbq h GLU 77 Cb 0.73 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1rbq h GLU 77 CO 0.05 0.19 0.00 1.19 -1.00 0.00 0.00 179.01 179.44 1rbq n PHE 78 N -4.45 0.45 -3.66 4.33 3.01 -0.45 -4.99 117.46 111.71 1rbq n PHE 78 Ca 0.18 -0.28 -0.23 0.00 1.01 0.00 0.00 57.45 58.12 1rbq n PHE 78 Cb 0.72 -0.01 0.06 0.00 -0.01 0.00 0.00 39.48 40.25 1rbq n PHE 78 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1rbq n SER 79 N 1.18 -3.75 -4.71 4.37 2.88 -0.52 -4.91 113.62 108.16 1rbq n SER 79 Ca 0.16 -0.68 -0.42 0.00 -1.33 0.00 0.00 58.87 56.60 1rbq n SER 79 Cb 0.52 -4.56 -0.03 0.00 -0.75 0.00 0.00 64.21 59.40 1rbq n SER 79 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1rbq s ILE 80 N -3.41 3.97 -0.12 2.46 -1.09 -0.45 -4.75 121.20 117.81 1rbq s ILE 80 Ca 0.33 1.42 -0.08 0.00 -2.23 0.00 0.00 60.65 60.09 1rbq s ILE 80 Cb -0.15 -3.91 -0.26 0.00 -1.58 0.00 0.00 42.46 36.55 1rbq s ILE 80 CO 0.77 0.11 0.38 0.44 -1.23 0.00 0.00 174.94 175.41 1rbq h ASP 81 N 6.76 0.41 -3.73 3.58 3.32 -0.94 -3.48 116.42 122.34 1rbq h ASP 81 Ca -0.42 -0.94 -0.34 0.00 0.02 0.00 0.00 57.03 55.35 1rbq h ASP 81 Cb 1.21 -0.13 -0.31 0.00 0.22 0.00 0.00 39.33 40.32 1rbq h ASP 81 CO 0.81 1.84 -0.76 -0.63 -1.72 0.00 0.00 179.24 178.79 1rbq s ILE 82 N -2.55 0.38 -0.17 0.35 1.01 -0.83 -4.84 121.20 114.55 1rbq s ILE 82 Ca -0.22 -0.13 -0.04 0.00 0.00 0.00 0.00 60.65 60.25 1rbq s ILE 82 Cb 0.06 -0.37 -0.03 0.00 0.01 0.00 0.00 42.46 42.14 1rbq s ILE 82 CO 0.77 0.14 -0.03 -0.69 0.00 0.00 0.00 174.94 175.13 1rbq s VAL 83 N 0.33 3.91 -0.20 2.92 1.01 0.22 -1.16 120.40 127.42 1rbq s VAL 83 Ca -0.03 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 61.55 1rbq s VAL 83 Cb -0.07 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 1rbq s VAL 83 CO -0.00 0.47 -0.00 0.00 0.00 0.00 0.00 175.10 175.57 1rbq s LEU 85 N 1.01 4.56 -0.54 0.00 1.43 0.86 -0.74 118.68 125.27 1rbq s LEU 85 Ca 0.02 -0.33 0.04 0.00 -1.03 0.00 0.00 54.13 52.82 1rbq s LEU 85 Cb -0.14 -2.50 0.15 0.00 0.03 0.00 0.00 46.19 43.73 1rbq s LEU 85 CO 0.02 -0.54 0.34 0.00 0.23 0.00 0.00 176.35 176.40 1rbq s ALA 86 N 2.31 2.80 -1.08 4.21 0.00 -0.42 -2.73 121.76 126.86 1rbq s ALA 86 Ca 0.16 -3.11 0.00 0.00 0.00 0.00 0.00 51.96 49.01 1rbq s ALA 86 Cb -0.16 -1.99 0.00 0.00 0.00 0.00 0.00 23.12 20.97 1rbq s ALA 86 CO 0.14 -2.05 0.00 0.41 0.00 0.00 0.00 175.76 174.26 1rbq n GLY 87 N 2.85 0.88 3.69 0.00 0.00 -1.26 -4.44 105.19 106.91 1rbq n GLY 87 Ca 0.15 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 1rbq n GLY 87 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1rbq s PHE 88 N -2.43 3.12 -1.08 1.61 5.36 -1.26 -2.33 117.98 120.97 1rbq s PHE 88 Ca 0.00 1.08 0.16 0.00 -0.96 0.00 0.00 56.93 57.21 1rbq s PHE 88 Cb 0.00 -3.52 0.54 0.00 -0.34 0.00 0.00 43.02 39.70 1rbq s PHE 88 CO 0.00 -1.75 1.46 -1.33 -1.46 0.00 0.00 175.22 172.14 1rbq n MET 89 N 4.97 3.15 -4.26 10.12 2.81 -1.26 -4.92 117.12 127.72 1rbq n MET 89 Ca 0.11 -2.56 -0.34 0.00 -1.81 0.00 0.00 57.70 53.10 1rbq n MET 89 Cb 0.45 -1.61 -0.12 0.00 -0.71 0.00 0.00 33.22 31.22 1rbq n MET 89 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1rbq s ARG 90 N -1.54 3.63 0.09 0.03 1.81 -1.26 -5.08 118.95 116.63 1rbq s ARG 90 Ca 0.40 -0.53 -0.31 0.00 -1.72 0.00 0.00 55.73 53.57 1rbq s ARG 90 Cb 0.25 -2.97 -0.07 0.00 -0.45 0.00 0.00 34.95 31.70 1rbq s ARG 90 CO 0.21 0.13 1.33 0.42 -0.68 0.00 0.00 175.30 176.71 1rbq s ILE 91 N 0.67 3.57 0.15 1.52 1.01 -1.26 -5.01 121.20 121.84 1rbq s ILE 91 Ca -0.02 1.12 -0.13 0.00 0.00 0.00 0.00 60.65 61.62 1rbq s ILE 91 Cb -0.14 -3.71 -0.07 0.00 0.01 0.00 0.00 42.46 38.54 1rbq s ILE 91 CO 0.02 0.08 0.53 -0.76 0.00 0.00 0.00 174.94 174.82 1rbq s LEU 92 N 1.17 4.32 0.73 2.97 1.43 -1.26 -5.04 118.68 123.00 1rbq s LEU 92 Ca 0.63 1.03 -0.12 0.00 -1.03 0.00 0.00 54.13 54.64 1rbq s LEU 92 Cb -0.34 -3.28 0.04 0.00 0.03 0.00 0.00 46.19 42.64 1rbq s LEU 92 CO 0.30 0.09 1.10 -0.94 0.23 0.00 0.00 176.35 177.13 1rbq s SER 93 N -1.79 4.73 0.12 2.29 1.04 -1.26 -4.83 113.70 114.01 1rbq s SER 93 Ca 0.38 1.89 -0.24 0.00 0.48 0.00 0.00 55.95 58.46 1rbq s SER 93 Cb -0.14 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.39 1rbq s SER 93 CO 0.19 -1.89 1.36 0.61 0.98 0.00 0.00 173.24 174.49 1rbq n GLY 94 N -0.96 -2.54 0.27 7.32 0.00 -1.26 -1.99 105.19 106.03 1rbq n GLY 94 Ca 0.10 1.02 -0.03 0.00 0.00 0.00 0.00 46.02 47.10 1rbq n GLY 94 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1rbq h PRO 95 N 0.00 0.62 -0.09 1.61 0.11 -1.98 -0.40 132.00 131.87 1rbq h PRO 95 Ca 0.12 -0.17 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1rbq h PRO 95 Cb 0.31 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.35 1rbq h PRO 95 CO -0.72 0.69 0.06 0.35 -0.21 0.00 0.00 178.00 178.16 1rbq h PHE 96 N 0.57 0.12 -0.55 0.65 3.57 -1.89 -0.54 116.94 118.87 1rbq h PHE 96 Ca 0.11 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1rbq h PHE 96 Cb 0.47 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.14 1rbq h PHE 96 CO 0.02 0.09 0.33 0.28 -2.23 0.00 0.00 178.31 176.79 1rbq h VAL 97 N 0.11 1.17 -0.45 1.41 2.07 -1.06 -1.52 116.25 117.97 1rbq h VAL 97 Ca 0.03 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1rbq h VAL 97 Cb 0.00 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 1rbq h VAL 97 CO -0.01 0.17 0.29 1.56 0.02 0.00 0.00 177.57 179.61 1rbq h GLN 98 N 0.74 0.60 -0.53 1.57 4.20 -1.01 -1.20 115.11 119.47 1rbq h GLN 98 Ca 0.20 -0.04 0.04 0.00 0.06 0.00 0.00 58.65 58.91 1rbq h GLN 98 Cb -0.01 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 27.60 1rbq h GLN 98 CO -0.04 0.41 0.28 -0.22 -0.67 0.00 0.00 178.83 178.59 1rbq h LYS 99 N 0.61 0.52 -0.57 1.46 3.64 -0.68 -2.56 116.57 118.99 1rbq h LYS 99 Ca 0.16 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1rbq h LYS 99 Cb -0.05 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.65 1rbq h LYS 99 CO -0.03 0.34 0.00 0.91 -2.27 0.00 0.00 179.45 178.40 1rbq n TRP 100 N -4.86 0.80 -1.68 1.91 7.02 -0.61 -4.96 117.44 115.05 1rbq n TRP 100 Ca 0.05 -0.32 -0.45 0.00 -1.02 0.00 0.00 57.50 55.75 1rbq n TRP 100 Cb 0.13 -0.14 -0.04 0.00 -2.42 0.00 0.00 31.31 28.84 1rbq n TRP 100 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1rbq n ASN 101 N 0.53 3.46 0.00 -0.99 5.15 -0.49 -0.69 115.26 122.24 1rbq n ASN 101 Ca 0.14 1.03 0.00 0.00 -0.60 0.00 0.00 54.58 55.16 1rbq n ASN 101 Cb 0.53 -1.45 0.00 0.00 -0.53 0.00 0.00 39.78 38.32 1rbq n ASN 101 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1rbq n GLY 102 N 3.86 1.55 0.00 8.20 0.00 -1.26 -4.84 105.19 112.71 1rbq n GLY 102 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1rbq n GLY 102 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rbq n LYS 103 N -2.00 0.33 -4.21 1.61 4.76 0.13 -4.65 118.16 114.12 1rbq n LYS 103 Ca 0.00 -0.69 -0.27 0.00 -2.87 0.00 0.00 58.31 54.48 1rbq n LYS 103 Cb 0.00 -0.88 -0.17 0.00 -1.84 0.00 0.00 35.03 32.14 1rbq n LYS 103 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 1rbq s MET 104 N -0.27 1.76 0.13 1.97 1.75 -1.07 -0.61 119.30 122.95 1rbq s MET 104 Ca 0.00 -0.38 0.08 0.00 -1.25 0.00 0.00 55.69 54.14 1rbq s MET 104 Cb 0.00 -1.62 -0.04 0.00 2.84 0.00 0.00 34.83 36.01 1rbq s MET 104 CO 0.00 -0.14 -0.09 -0.51 -0.65 0.00 0.00 175.02 173.63 1rbq s LEU 105 N 1.25 3.04 0.05 4.11 1.43 0.57 -1.35 118.68 127.78 1rbq s LEU 105 Ca -0.03 -0.45 0.04 0.00 -1.03 0.00 0.00 54.13 52.66 1rbq s LEU 105 Cb -0.14 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.26 1rbq s LEU 105 CO -0.04 0.15 -0.11 0.21 0.23 0.00 0.00 176.35 176.79 1rbq s ASN 106 N -2.46 1.29 -0.20 2.29 2.47 -0.58 -0.10 114.94 117.65 1rbq s ASN 106 Ca 0.23 -0.56 -0.07 0.00 0.42 0.00 0.00 52.86 52.88 1rbq s ASN 106 Cb -0.10 -0.02 -0.03 0.00 -1.45 0.00 0.00 41.25 39.65 1rbq s ASN 106 CO 0.15 -0.12 0.05 -0.51 -3.72 0.00 0.00 177.10 172.94 1rbq s ILE 107 N -1.26 4.47 -0.09 -5.21 1.10 -1.10 -1.98 121.20 117.13 1rbq s ILE 107 Ca -0.05 -0.14 0.02 0.00 -0.51 0.00 0.00 60.65 59.97 1rbq s ILE 107 Cb -0.10 -3.03 0.01 0.00 0.15 0.00 0.00 42.46 39.50 1rbq s ILE 107 CO 0.01 0.42 -0.14 -2.28 -2.11 0.00 0.00 174.94 170.84 1rbq s HIS 108 N 0.82 1.75 -0.05 3.50 5.65 0.44 -4.74 115.29 122.65 1rbq s HIS 108 Ca 0.03 -0.74 -0.04 0.00 0.25 0.00 0.00 55.06 54.56 1rbq s HIS 108 Cb -0.14 -1.27 -0.16 0.00 -1.18 0.00 0.00 32.58 29.83 1rbq s HIS 108 CO 0.02 -0.38 3.14 -0.35 -0.65 0.00 0.00 174.74 176.52 1rbq n PRO 109 N 3.99 1.80 -4.10 2.88 -0.04 -1.26 -0.50 135.00 137.77 1rbq n PRO 109 Ca -0.20 -0.91 -0.13 0.00 -0.04 0.00 0.00 63.50 62.22 1rbq n PRO 109 Cb 0.52 -1.78 -0.06 0.00 -0.04 0.00 0.00 33.50 32.14 1rbq n PRO 109 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1rbq s SER 110 N 1.80 0.48 -0.94 3.54 1.04 -0.90 -4.56 113.70 114.15 1rbq s SER 110 Ca 0.50 -1.31 -0.20 0.00 0.48 0.00 0.00 55.95 55.42 1rbq s SER 110 Cb 0.25 0.57 0.10 0.00 0.10 0.00 0.00 66.02 67.04 1rbq s SER 110 CO -0.02 -1.13 1.21 -0.76 0.98 0.00 0.00 173.24 173.52 1rbq s LEU 111 N -3.16 4.58 0.48 2.42 1.43 -1.25 -2.66 118.68 120.51 1rbq s LEU 111 Ca 0.31 -1.81 -0.23 0.00 -1.03 0.00 0.00 54.13 51.37 1rbq s LEU 111 Cb 0.01 -2.45 -0.08 0.00 0.03 0.00 0.00 46.19 43.70 1rbq s LEU 111 CO 0.15 -1.21 1.08 0.18 0.23 0.00 0.00 176.35 176.78 1rbq n LEU 112 N 7.27 3.42 -0.77 1.79 4.77 -1.26 -1.79 117.00 130.42 1rbq n LEU 112 Ca 0.25 0.98 0.05 0.00 -0.03 0.00 0.00 56.01 57.26 1rbq n LEU 112 Cb 0.49 -1.41 0.16 0.00 -2.33 0.00 0.00 43.42 40.33 1rbq n LEU 112 CO 0.55 -1.35 0.60 -0.81 -1.33 0.00 0.00 177.39 175.06 1rbq n PRO 113 N -0.28 2.08 -2.37 3.23 -0.04 -1.26 -5.10 135.00 131.26 1rbq n PRO 113 Ca 0.10 -1.28 -0.39 0.00 -0.04 0.00 0.00 63.50 61.89 1rbq n PRO 113 Cb 0.42 -1.44 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 1rbq n PRO 113 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1rbq s SER 114 N -0.81 6.87 -1.14 3.54 0.01 -0.74 -4.34 113.70 117.10 1rbq s SER 114 Ca 0.23 2.32 -0.04 0.00 1.31 0.00 0.00 55.95 59.77 1rbq s SER 114 Cb 0.14 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 1rbq s SER 114 CO 0.13 -0.43 0.91 0.49 0.41 0.00 0.00 173.24 174.75 1rbq n PHE 115 N 0.58 -2.25 -1.90 2.43 3.72 -1.26 -4.40 117.46 114.38 1rbq n PHE 115 Ca 0.02 0.85 -0.35 0.00 -0.05 0.00 0.00 57.45 57.92 1rbq n PHE 115 Cb 0.46 -4.44 0.04 0.00 -0.94 0.00 0.00 39.48 34.60 1rbq n PHE 115 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1rbq s LYS 116 N -5.06 2.83 0.00 -1.08 1.02 -1.26 -4.55 119.74 111.64 1rbq s LYS 116 Ca 0.24 1.74 0.00 0.00 0.02 0.00 0.00 55.97 57.97 1rbq s LYS 116 Cb -0.04 -1.92 0.00 0.00 -0.52 0.00 0.00 37.83 35.35 1rbq s LYS 116 CO 0.76 -1.29 0.00 0.41 -0.92 0.00 0.00 175.35 174.30 1rbq n GLY 117 N 0.32 2.02 0.08 -3.33 0.00 -1.26 -4.79 105.19 98.24 1rbq n GLY 117 Ca 0.13 -2.01 0.12 0.00 0.00 0.00 0.00 46.02 44.26 1rbq n GLY 117 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1rbq n SER 118 N 0.00 0.51 -2.49 1.61 3.41 -1.26 -3.37 113.62 112.02 1rbq n SER 118 Ca 0.00 0.58 -0.30 0.00 -0.26 0.00 0.00 58.87 58.89 1rbq n SER 118 Cb 0.00 -0.71 0.02 0.00 -0.26 0.00 0.00 64.21 63.27 1rbq n SER 118 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1rbq n ASN 119 N -2.01 5.75 -0.28 4.04 6.94 -1.26 -4.85 115.26 123.58 1rbq n ASN 119 Ca 0.04 -3.76 0.02 0.00 -0.02 0.00 0.00 54.58 50.86 1rbq n ASN 119 Cb 0.31 -0.64 0.15 0.00 -2.36 0.00 0.00 39.78 37.24 1rbq n ASN 119 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rbq h ALA 120 N 2.55 1.11 -0.27 -2.53 0.00 -1.79 -2.24 119.26 116.09 1rbq h ALA 120 Ca 0.41 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.32 1rbq h ALA 120 Cb 0.80 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1rbq h ALA 120 CO 1.05 0.08 0.06 0.45 0.00 0.00 0.00 179.25 180.90 1rbq h HIS 121 N 0.76 0.45 -0.83 0.00 3.86 -1.89 0.70 115.15 118.21 1rbq h HIS 121 Ca 0.37 -0.05 0.12 0.00 -1.16 0.00 0.00 60.37 59.65 1rbq h HIS 121 Cb 0.32 -0.13 -0.08 0.00 1.06 0.00 0.00 27.41 28.58 1rbq h HIS 121 CO -0.07 0.51 0.44 1.49 0.86 0.00 0.00 177.93 181.16 1rbq h GLU 122 N 0.26 0.67 -0.33 2.45 4.81 -1.89 0.05 114.58 120.59 1rbq h GLU 122 Ca 0.08 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.15 1rbq h GLU 122 Cb 0.28 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1rbq h GLU 122 CO 0.00 0.44 -0.30 1.96 -0.73 0.00 0.00 179.01 180.38 1rbq h GLN 123 N 0.69 0.71 -0.39 1.92 4.20 -0.95 -1.99 115.11 119.31 1rbq h GLN 123 Ca 0.42 -0.32 -0.07 0.00 0.06 0.00 0.00 58.65 58.75 1rbq h GLN 123 Cb 0.50 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1rbq h GLN 123 CO -0.30 0.93 -0.01 0.00 -0.67 0.00 0.00 178.83 178.77 1rbq h ALA 124 N 1.05 0.53 -0.32 3.87 0.00 0.02 -1.52 119.26 122.89 1rbq h ALA 124 Ca 0.07 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1rbq h ALA 124 Cb 0.82 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1rbq h ALA 124 CO 0.07 0.31 0.02 -0.07 0.00 0.00 0.00 179.25 179.59 1rbq h LEU 125 N 0.52 0.54 -0.76 0.00 3.38 -1.00 -2.18 115.31 115.81 1rbq h LEU 125 Ca 0.11 -0.29 0.08 0.00 0.09 0.00 0.00 57.88 57.87 1rbq h LEU 125 Cb 0.49 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.03 1rbq h LEU 125 CO 0.02 0.70 0.42 -0.08 0.09 0.00 0.00 178.44 179.59 1rbq h GLU 126 N 0.37 0.71 0.00 1.13 4.81 -1.30 -2.89 114.58 117.41 1rbq h GLU 126 Ca 0.09 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 1rbq h GLU 126 Cb 0.40 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1rbq h GLU 126 CO 0.01 0.47 -0.52 1.15 -0.73 0.00 0.00 179.01 179.39 1rbq h THR 127 N 0.73 1.16 0.00 0.32 2.02 -1.18 -3.48 112.91 112.49 1rbq h THR 127 Ca 0.36 -1.94 0.00 0.00 0.77 0.00 0.00 66.41 65.59 1rbq h THR 127 Cb 0.30 2.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.82 1rbq h THR 127 CO -0.23 0.51 0.00 0.61 0.37 0.00 0.00 175.52 176.79 1rbq n GLY 128 N 0.39 0.58 3.74 2.16 0.00 -0.83 -5.05 105.19 106.17 1rbq n GLY 128 Ca -0.00 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 44.88 1rbq n GLY 128 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1rbq s VAL 129 N -2.00 2.16 -1.00 1.61 -7.23 -1.21 -4.93 120.40 107.80 1rbq s VAL 129 Ca 0.00 0.11 0.19 0.00 -1.81 0.00 0.00 61.98 60.47 1rbq s VAL 129 Cb 0.00 -3.05 -0.19 0.00 0.56 0.00 0.00 36.38 33.70 1rbq s VAL 129 CO 0.00 -0.01 0.84 0.35 -0.31 0.00 0.00 175.10 175.97 1rbq n THR 130 N -1.47 0.00 -4.14 5.32 -2.24 -1.26 -4.76 114.28 105.73 1rbq n THR 130 Ca 0.13 -0.06 -0.26 0.00 -2.27 0.00 0.00 64.05 61.59 1rbq n THR 130 Cb 0.47 1.02 -0.17 0.00 -2.10 0.00 0.00 70.33 69.55 1rbq n THR 130 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1rbq s VAL 131 N -2.80 1.03 0.00 2.28 1.01 -1.26 -0.17 120.40 120.50 1rbq s VAL 131 Ca 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1rbq s VAL 131 Cb 0.15 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.51 1rbq s VAL 131 CO 0.78 0.36 0.00 1.07 0.00 0.00 0.00 175.10 177.30 1rbq n THR 132 N 4.53 0.00 -1.05 3.92 5.66 0.23 -4.91 114.28 122.66 1rbq n THR 132 Ca -0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 1rbq n THR 132 Cb 0.51 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.29 1rbq n THR 132 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1rbq n GLY 133 N 3.46 -0.59 3.17 1.09 0.00 -1.26 0.14 105.19 111.21 1rbq n GLY 133 Ca 0.00 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.26 1rbq n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rbq s THR 135 N -3.98 -0.04 -0.21 0.00 2.01 0.34 -1.97 115.64 111.80 1rbq s THR 135 Ca 0.16 0.15 -0.09 0.00 0.31 0.00 0.00 61.69 62.22 1rbq s THR 135 Cb 0.07 -0.13 -0.05 0.00 0.01 0.00 0.00 72.50 72.40 1rbq s THR 135 CO -0.03 0.06 0.11 -0.69 -0.69 0.00 0.00 174.62 173.38 1rbq s VAL 136 N 0.81 5.13 0.05 3.82 1.01 0.12 -0.42 120.40 130.92 1rbq s VAL 136 Ca -0.07 0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.02 1rbq s VAL 136 Cb -0.09 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.91 1rbq s VAL 136 CO -0.03 0.41 -0.06 -1.38 0.00 0.00 0.00 175.10 174.04 1rbq s HIS 137 N 0.66 0.60 0.55 5.22 -0.00 -0.83 -0.69 115.29 120.79 1rbq s HIS 137 Ca 0.06 -0.60 -0.21 0.00 -0.00 0.00 0.00 55.06 54.31 1rbq s HIS 137 Cb -0.12 -0.37 -0.05 0.00 -0.00 0.00 0.00 32.58 32.04 1rbq s HIS 137 CO 0.01 -0.13 1.29 -0.06 -0.00 0.00 0.00 174.74 175.85 1rbq s PHE 138 N -1.87 2.40 -0.18 0.38 0.08 -0.02 -1.53 117.98 117.25 1rbq s PHE 138 Ca -0.07 1.44 -0.21 0.00 0.12 0.00 0.00 56.93 58.21 1rbq s PHE 138 Cb -0.07 -3.65 -0.03 0.00 -0.57 0.00 0.00 43.02 38.70 1rbq s PHE 138 CO -0.01 -2.51 0.64 0.08 -0.10 0.00 0.00 175.22 173.32 1rbq s VAL 139 N -1.41 5.02 0.44 -0.44 1.01 -0.45 -3.62 120.40 120.95 1rbq s VAL 139 Ca 0.72 1.23 0.07 0.00 0.00 0.00 0.00 61.98 64.00 1rbq s VAL 139 Cb -0.36 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 1rbq s VAL 139 CO 0.42 0.13 0.28 0.00 0.00 0.00 0.00 175.10 175.93 1rbq s ALA 140 N 1.76 3.90 0.18 5.51 0.00 -1.26 -4.80 121.76 127.06 1rbq s ALA 140 Ca 0.30 -1.84 -0.13 0.00 0.00 0.00 0.00 51.96 50.29 1rbq s ALA 140 Cb -0.16 -0.63 0.16 0.00 0.00 0.00 0.00 23.12 22.49 1rbq s ALA 140 CO 0.11 -0.23 1.77 0.93 0.00 0.00 0.00 175.76 178.33 1rbq h GLU 141 N 1.18 0.42 -6.43 0.00 5.08 -1.93 -3.40 114.58 109.49 1rbq h GLU 141 Ca -0.41 -0.03 -0.54 0.00 -1.00 0.00 0.00 59.36 57.38 1rbq h GLU 141 Cb 1.27 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 30.43 1rbq h GLU 141 CO 0.64 0.28 0.83 -0.51 -1.00 0.00 0.00 179.01 179.24 1rbq s ASP 142 N -5.44 6.81 0.26 1.42 1.11 -1.26 -4.93 116.67 114.64 1rbq s ASP 142 Ca -0.13 2.21 -0.31 0.00 0.18 0.00 0.00 52.55 54.50 1rbq s ASP 142 Cb 0.14 -2.57 -0.12 0.00 1.07 0.00 0.00 42.92 41.44 1rbq s ASP 142 CO 0.73 -0.72 1.57 0.52 1.18 0.00 0.00 175.17 178.45 1rbq n VAL 143 N 4.49 0.79 -3.18 -1.27 0.31 -1.26 -2.65 118.33 115.56 1rbq n VAL 143 Ca 0.13 -0.20 -0.21 0.00 -0.01 0.00 0.00 64.34 64.05 1rbq n VAL 143 Cb 0.43 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 1rbq n VAL 143 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1rbq n ASP 144 N 2.51 -4.07 -0.01 4.52 8.00 -1.26 -4.80 116.55 121.44 1rbq n ASP 144 Ca 0.11 -0.29 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1rbq n ASP 144 Cb 0.35 -3.36 0.00 0.00 -0.02 0.00 0.00 41.12 38.09 1rbq n ASP 144 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rbq n ALA 145 N -3.34 1.31 -1.48 2.24 0.00 -1.08 -4.94 120.51 113.22 1rbq n ALA 145 Ca -0.05 -0.67 -0.29 0.00 0.00 0.00 0.00 53.44 52.43 1rbq n ALA 145 Cb 0.56 -0.02 0.16 0.00 0.00 0.00 0.00 19.45 20.16 1rbq n ALA 145 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rbq s GLY 146 N -0.33 1.60 0.23 0.00 0.00 -1.24 -4.87 107.32 102.71 1rbq s GLY 146 Ca 0.00 -0.67 -0.30 0.00 0.00 0.00 0.00 44.72 43.75 1rbq s GLY 146 CO 0.00 -0.03 1.47 1.20 0.00 0.00 0.00 173.10 175.75 1rbq s GLN 147 N -5.35 4.25 -0.05 2.90 -1.52 -1.24 -4.65 119.66 113.99 1rbq s GLN 147 Ca 0.66 2.32 -0.30 0.00 -1.95 0.00 0.00 55.36 56.10 1rbq s GLN 147 Cb -0.13 -3.12 -0.02 0.00 -0.22 0.00 0.00 33.01 29.52 1rbq s GLN 147 CO 0.54 -0.47 1.00 0.42 -0.25 0.00 0.00 175.29 176.54 1rbq s ILE 148 N 0.26 4.79 -0.19 1.08 1.01 -1.26 -0.84 121.20 126.05 1rbq s ILE 148 Ca 0.62 2.03 -0.15 0.00 0.00 0.00 0.00 60.65 63.15 1rbq s ILE 148 Cb -0.42 -4.30 -0.08 0.00 0.01 0.00 0.00 42.46 37.66 1rbq s ILE 148 CO 0.41 0.07 -0.21 -0.38 0.00 0.00 0.00 174.94 174.83 1rbq n ILE 149 N 4.26 1.48 -4.00 2.92 5.41 0.13 -4.94 119.36 124.62 1rbq n ILE 149 Ca 0.08 0.04 -0.09 0.00 1.00 0.00 0.00 62.75 63.78 1rbq n ILE 149 Cb 0.50 -2.23 -0.11 0.00 -0.71 0.00 0.00 39.64 37.09 1rbq n ILE 149 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1rbq s LEU 150 N -7.93 2.24 0.04 1.39 1.43 -1.13 -5.01 118.68 109.71 1rbq s LEU 150 Ca -0.26 -0.60 -0.01 0.00 -1.03 0.00 0.00 54.13 52.23 1rbq s LEU 150 Cb 0.06 0.17 -0.03 0.00 0.03 0.00 0.00 46.19 46.42 1rbq s LEU 150 CO 0.40 -0.38 -0.03 -1.10 0.23 0.00 0.00 176.35 175.47 1rbq s GLN 151 N -2.09 0.47 -0.06 1.70 -0.21 -1.26 -0.70 119.66 117.52 1rbq s GLN 151 Ca -0.10 -0.93 -0.02 0.00 0.02 0.00 0.00 55.36 54.33 1rbq s GLN 151 Cb -0.05 0.16 0.04 0.00 1.00 0.00 0.00 33.01 34.16 1rbq s GLN 151 CO -0.03 -0.08 0.12 -2.00 -2.12 0.00 0.00 175.29 171.17 1rbq s GLU 152 N -2.74 0.05 0.37 2.91 2.12 -0.83 -5.00 118.70 115.58 1rbq s GLU 152 Ca -0.04 0.34 -0.24 0.00 0.36 0.00 0.00 54.97 55.39 1rbq s GLU 152 Cb -0.01 -0.21 -0.10 0.00 0.26 0.00 0.00 34.13 34.08 1rbq s GLU 152 CO -0.06 -0.18 0.99 0.00 -0.54 0.00 0.00 175.26 175.48 1rbq s ALA 153 N 1.24 3.13 -0.03 6.30 0.00 -1.26 -1.41 121.76 129.73 1rbq s ALA 153 Ca -0.08 0.58 -0.01 0.00 0.00 0.00 0.00 51.96 52.46 1rbq s ALA 153 Cb -0.12 -3.22 0.03 0.00 0.00 0.00 0.00 23.12 19.81 1rbq s ALA 153 CO -0.05 -0.01 0.05 0.08 0.00 0.00 0.00 175.76 175.83 1rbq s VAL 154 N -1.73 -0.05 0.47 0.00 1.01 0.12 -4.89 120.40 115.33 1rbq s VAL 154 Ca 0.56 0.18 -0.23 0.00 0.00 0.00 0.00 61.98 62.49 1rbq s VAL 154 Cb -0.19 -0.10 -0.07 0.00 0.00 0.00 0.00 36.38 36.02 1rbq s VAL 154 CO 0.24 0.07 1.16 -2.16 0.00 0.00 0.00 175.10 174.41 1rbq s PRO 155 N 0.93 3.72 -0.13 2.72 0.04 -1.26 -0.61 135.00 140.41 1rbq s PRO 155 Ca -0.08 1.77 -0.14 0.00 0.04 0.00 0.00 61.00 62.59 1rbq s PRO 155 Cb -0.11 -2.37 -0.05 0.00 0.04 0.00 0.00 34.50 32.01 1rbq s PRO 155 CO -0.03 -0.58 0.31 0.08 0.04 0.00 0.00 177.00 176.82 1rbq s VAL 156 N -1.56 5.28 -0.03 -0.36 1.01 0.77 -4.78 120.40 120.71 1rbq s VAL 156 Ca 0.64 0.59 -0.13 0.00 0.00 0.00 0.00 61.98 63.08 1rbq s VAL 156 Cb -0.28 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 1rbq s VAL 156 CO 0.34 0.43 0.34 -0.54 0.00 0.00 0.00 175.10 175.67 1rbq s LYS 157 N 0.13 3.81 0.03 2.72 1.02 -1.26 -4.80 119.74 121.39 1rbq s LYS 157 Ca 0.18 0.27 -0.36 0.00 0.02 0.00 0.00 55.97 56.08 1rbq s LYS 157 Cb -0.14 -3.22 -0.15 0.00 -0.52 0.00 0.00 37.83 33.80 1rbq s LYS 157 CO 0.06 0.70 1.53 0.54 -0.92 0.00 0.00 175.35 177.25 1rbq n ARG 158 N 1.92 1.54 -0.65 1.68 1.74 -1.26 -1.18 116.66 120.45 1rbq n ARG 158 Ca -0.15 0.56 0.00 0.00 -0.77 0.00 0.00 57.85 57.48 1rbq n ARG 158 Cb 0.53 -2.26 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 1rbq n ARG 158 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rbq n GLY 159 N 3.23 0.79 3.60 -0.13 0.00 -1.26 -5.04 105.19 106.38 1rbq n GLY 159 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1rbq n GLY 159 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rbq n ASP 160 N 0.00 1.27 -5.01 1.61 8.00 -0.33 -5.04 116.55 117.05 1rbq n ASP 160 Ca 0.00 1.07 -0.20 0.00 0.71 0.00 0.00 54.79 56.37 1rbq n ASP 160 Cb 0.00 -1.34 0.04 0.00 -0.02 0.00 0.00 41.12 39.80 1rbq n ASP 160 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1rbq s THR 161 N -1.23 2.35 0.23 -3.53 -4.23 -1.26 -4.95 115.64 103.03 1rbq s THR 161 Ca 0.62 -1.06 -0.06 0.00 -1.18 0.00 0.00 61.69 60.01 1rbq s THR 161 Cb -0.59 -2.42 0.19 0.00 1.34 0.00 0.00 72.50 71.03 1rbq s THR 161 CO 0.58 0.00 1.79 0.58 -0.54 0.00 0.00 174.62 177.03 1rbq h VAL 162 N 0.39 0.86 0.00 2.29 2.07 -1.96 -2.07 116.25 117.83 1rbq h VAL 162 Ca -0.34 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1rbq h VAL 162 Cb 1.29 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1rbq h VAL 162 CO 0.44 0.12 -0.00 0.00 0.02 0.00 0.00 177.57 178.15 1rbq h ALA 163 N 1.45 -0.00 -0.42 1.67 0.00 -1.98 0.18 119.26 120.15 1rbq h ALA 163 Ca 0.37 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.08 1rbq h ALA 163 Cb 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1rbq h ALA 163 CO -0.27 -0.44 -0.29 1.79 0.00 0.00 0.00 179.25 180.03 1rbq h THR 164 N -0.12 1.27 -0.56 0.00 1.35 -1.91 -1.71 112.91 111.23 1rbq h THR 164 Ca -0.00 -1.46 -0.07 0.00 -0.55 0.00 0.00 66.41 64.33 1rbq h THR 164 Cb 0.12 1.29 -0.02 0.00 -1.73 0.00 0.00 68.15 67.81 1rbq h THR 164 CO 0.00 0.49 0.08 0.25 -0.25 0.00 0.00 175.52 176.09 1rbq h LEU 165 N 0.76 0.90 -0.61 3.87 5.85 -1.39 -2.28 115.31 122.42 1rbq h LEU 165 Ca 0.08 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.54 1rbq h LEU 165 Cb 0.88 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 1rbq h LEU 165 CO 0.08 0.94 0.40 -1.28 -0.34 0.00 0.00 178.44 178.23 1rbq h SER 166 N 0.82 0.70 -0.66 1.25 0.87 -0.77 -1.67 113.55 114.09 1rbq h SER 166 Ca 0.17 -0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.66 1rbq h SER 166 Cb 0.43 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 1rbq h SER 166 CO 0.01 0.52 0.23 -0.33 -0.53 0.00 0.00 176.83 176.73 1rbq h GLU 167 N 0.82 1.02 -0.73 2.24 4.39 -1.14 -1.00 114.58 120.17 1rbq h GLU 167 Ca 0.22 -0.20 -0.06 0.00 0.34 0.00 0.00 59.36 59.66 1rbq h GLU 167 Cb -0.08 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.38 1rbq h GLU 167 CO -0.05 0.87 0.21 -0.09 -1.16 0.00 0.00 179.01 178.80 1rbq h ARG 168 N 0.95 1.15 -0.19 2.33 2.43 -1.08 -2.82 114.38 117.15 1rbq h ARG 168 Ca 0.22 -0.26 -0.19 0.00 -0.81 0.00 0.00 59.98 58.94 1rbq h ARG 168 Cb 0.26 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1rbq h ARG 168 CO -0.01 0.99 -0.64 0.28 -1.51 0.00 0.00 179.97 179.08 1rbq h VAL 169 N 1.09 1.31 -0.93 0.20 2.07 -1.19 -3.01 116.25 115.80 1rbq h VAL 169 Ca 0.23 -1.88 0.09 0.00 0.82 0.00 0.00 66.70 65.97 1rbq h VAL 169 Cb 0.33 1.84 -0.07 0.00 -1.52 0.00 0.00 31.29 31.87 1rbq h VAL 169 CO -0.00 0.59 0.60 0.11 0.02 0.00 0.00 177.57 178.88 1rbq h LYS 170 N 0.50 0.94 -0.95 1.57 1.57 -1.08 -0.36 116.57 118.76 1rbq h LYS 170 Ca -0.01 -0.06 0.11 0.00 -1.87 0.00 0.00 60.65 58.82 1rbq h LYS 170 Cb 1.23 -0.21 -0.07 0.00 0.08 0.00 0.00 32.23 33.25 1rbq h LYS 170 CO 0.13 0.62 0.61 -0.07 -0.57 0.00 0.00 179.45 180.16 1rbq h LEU 171 N 0.97 0.85 -0.04 2.94 3.38 -1.36 -1.00 115.31 121.05 1rbq h LEU 171 Ca 0.42 0.04 -0.26 0.00 0.09 0.00 0.00 57.88 58.17 1rbq h LEU 171 Cb 0.35 -0.14 0.02 0.00 0.09 0.00 0.00 40.66 40.98 1rbq h LEU 171 CO -0.18 0.47 -1.05 0.00 0.09 0.00 0.00 178.44 177.77 1rbq h ALA 172 N 1.55 0.19 -0.72 1.53 0.00 -1.17 -3.27 119.26 117.37 1rbq h ALA 172 Ca 0.46 -0.72 0.07 0.00 0.00 0.00 0.00 54.91 54.71 1rbq h ALA 172 Cb 0.48 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 1rbq h ALA 172 CO -0.22 0.75 0.41 0.93 0.00 0.00 0.00 179.25 181.12 1rbq h GLU 173 N 0.30 0.71 0.00 0.00 5.08 -0.53 -0.87 114.58 119.28 1rbq h GLU 173 Ca -0.12 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1rbq h GLU 173 Cb 1.70 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.79 1rbq h GLU 173 CO 0.20 0.47 0.00 0.72 -1.00 0.00 0.00 179.01 179.40 1rbq n HIS 174 N -4.76 0.80 -0.09 4.33 8.25 -0.44 -1.30 115.22 122.01 1rbq n HIS 174 Ca 0.10 0.34 -0.15 0.00 -0.26 0.00 0.00 57.72 57.75 1rbq n HIS 174 Cb 0.19 -1.05 -0.08 0.00 1.12 0.00 0.00 29.99 30.18 1rbq n HIS 174 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 1rbq h LYS 175 N 0.00 0.00 -0.00 -0.41 1.57 -1.25 -3.42 116.57 113.07 1rbq h LYS 175 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 1rbq h LYS 175 Cb 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1rbq h LYS 175 CO 0.00 0.63 -0.78 -0.84 -0.57 0.00 0.00 179.45 177.88 1rbq h ILE 176 N -1.00 1.54 0.16 1.86 3.07 -1.14 -2.92 117.51 119.08 1rbq h ILE 176 Ca -0.22 -2.63 -0.01 0.00 1.55 0.00 0.00 64.86 63.55 1rbq h ILE 176 Cb 1.01 2.42 0.00 0.00 -0.27 0.00 0.00 36.82 39.98 1rbq h ILE 176 CO -0.13 0.75 -0.08 0.15 -1.05 0.00 0.00 178.15 177.79 1rbq h PHE 177 N 0.02 -0.20 -0.69 0.16 3.57 -1.45 0.16 116.94 118.51 1rbq h PHE 177 Ca -0.01 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.51 1rbq h PHE 177 Cb 1.38 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 40.15 1rbq h PHE 177 CO 0.00 0.06 0.46 -1.35 -2.23 0.00 0.00 178.31 175.25 1rbq h PRO 178 N -0.46 0.83 -0.52 6.41 0.11 -1.79 -0.88 132.00 135.71 1rbq h PRO 178 Ca -0.02 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.91 1rbq h PRO 178 Cb 0.35 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 1rbq h PRO 178 CO 0.04 0.55 -0.16 0.00 -0.21 0.00 0.00 178.00 178.21 1rbq h ALA 179 N 1.59 0.73 -0.18 -0.75 0.00 -1.28 -2.15 119.26 117.23 1rbq h ALA 179 Ca 0.27 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 1rbq h ALA 179 Cb 0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1rbq h ALA 179 CO -0.07 0.68 -0.51 0.00 0.00 0.00 0.00 179.25 179.34 1rbq h ALA 180 N 0.91 0.78 -0.49 0.00 0.00 -0.34 -1.97 119.26 118.15 1rbq h ALA 180 Ca 0.13 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.50 1rbq h ALA 180 Cb 0.74 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1rbq h ALA 180 CO 0.06 0.68 0.13 1.25 0.00 0.00 0.00 179.25 181.37 1rbq h LEU 181 N 0.39 0.74 -1.00 0.00 5.85 -1.08 -1.55 115.31 118.66 1rbq h LEU 181 Ca 0.01 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 1rbq h LEU 181 Cb 1.03 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.83 1rbq h LEU 181 CO 0.09 0.77 0.51 1.56 -0.34 0.00 0.00 178.44 181.03 1rbq h GLN 182 N 0.67 1.20 -0.53 1.25 1.08 -1.19 0.26 115.11 117.86 1rbq h GLN 182 Ca 0.16 -0.12 -0.03 0.00 -1.45 0.00 0.00 58.65 57.21 1rbq h GLN 182 Cb 0.31 -0.25 -0.02 0.00 -0.05 0.00 0.00 27.48 27.47 1rbq h GLN 182 CO -0.00 0.86 0.23 -0.07 -0.95 0.00 0.00 178.83 178.90 1rbq h LEU 183 N 1.22 0.71 -0.02 1.46 3.38 -0.95 -1.46 115.31 119.66 1rbq h LEU 183 Ca 0.31 -0.15 -0.20 0.00 0.09 0.00 0.00 57.88 57.93 1rbq h LEU 183 Cb -0.02 -0.18 0.02 0.00 0.09 0.00 0.00 40.66 40.56 1rbq h LEU 183 CO -0.06 0.67 -0.78 0.58 0.09 0.00 0.00 178.44 178.95 1rbq h VAL 184 N 0.71 1.36 -0.09 1.22 2.07 -0.99 -0.50 116.25 120.03 1rbq h VAL 184 Ca 0.18 -2.12 -0.04 0.00 0.82 0.00 0.00 66.70 65.54 1rbq h VAL 184 Cb 0.16 2.45 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1rbq h VAL 184 CO -0.02 0.64 -0.13 0.00 0.02 0.00 0.00 177.57 178.08 1rbq h ALA 185 N 0.37 1.62 -0.00 1.67 0.00 -0.44 -1.98 119.26 120.50 1rbq h ALA 185 Ca -0.09 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1rbq h ALA 185 Cb 1.46 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1rbq h ALA 185 CO 0.15 0.28 -0.18 -1.13 0.00 0.00 0.00 179.25 178.37 1rbq n SER 186 N -4.32 0.56 -0.07 0.00 3.41 -0.56 -4.59 113.62 108.05 1rbq n SER 186 Ca -0.01 -0.52 -0.01 0.00 -0.26 0.00 0.00 58.87 58.07 1rbq n SER 186 Cb 0.24 -0.02 -0.00 0.00 -0.26 0.00 0.00 64.21 64.16 1rbq n SER 186 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rbq n GLY 187 N 1.34 0.44 0.23 5.00 0.00 -0.75 -4.90 105.19 106.55 1rbq n GLY 187 Ca 0.12 -0.13 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 1rbq n GLY 187 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1rbq h THR 188 N 0.00 1.30 -3.32 2.61 2.02 -1.39 -3.43 112.91 110.71 1rbq h THR 188 Ca -0.02 -1.63 -0.67 0.00 0.77 0.00 0.00 66.41 64.86 1rbq h THR 188 Cb 0.29 1.59 -0.33 0.00 -1.74 0.00 0.00 68.15 67.96 1rbq h THR 188 CO 0.03 0.51 -0.87 -0.69 0.37 0.00 0.00 175.52 174.87 1rbq s VAL 189 N -4.19 2.01 0.09 3.16 1.01 -0.56 -0.91 120.40 121.00 1rbq s VAL 189 Ca -0.08 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 60.96 1rbq s VAL 189 Cb 0.12 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 1rbq s VAL 189 CO 0.83 0.55 -0.10 -1.10 0.00 0.00 0.00 175.10 175.28 1rbq s GLN 190 N 0.45 0.80 -0.34 2.72 -0.21 0.16 -4.25 119.66 118.99 1rbq s GLN 190 Ca -0.17 -1.08 -0.27 0.00 0.02 0.00 0.00 55.36 53.86 1rbq s GLN 190 Cb -0.17 -0.53 0.01 0.00 1.00 0.00 0.00 33.01 33.31 1rbq s GLN 190 CO 0.07 0.09 0.96 -1.17 -2.12 0.00 0.00 175.29 173.11 1rbq s LEU 191 N -2.25 3.99 0.87 2.90 0.20 -1.26 -0.22 118.68 122.90 1rbq s LEU 191 Ca 0.03 0.79 -0.12 0.00 0.69 0.00 0.00 54.13 55.52 1rbq s LEU 191 Cb -0.05 -3.34 0.11 0.00 -0.43 0.00 0.00 46.19 42.49 1rbq s LEU 191 CO 0.00 -0.82 1.14 -0.83 -0.29 0.00 0.00 176.35 175.55 1rbq s GLY 192 N 1.73 1.59 0.33 7.98 0.00 0.80 -4.93 107.32 114.81 1rbq s GLY 192 Ca 0.40 -0.49 0.03 0.00 0.00 0.00 0.00 44.72 44.65 1rbq s GLY 192 CO 0.16 0.02 1.89 0.83 0.00 0.00 0.00 173.10 176.00 1rbq h GLU 193 N -1.32 0.66 -0.05 2.90 5.08 -1.97 -1.92 114.58 117.96 1rbq h GLU 193 Ca -0.49 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 57.75 1rbq h GLU 193 Cb 1.32 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1rbq h GLU 193 CO 0.62 0.60 0.00 0.27 -1.00 0.00 0.00 179.01 179.50 1rbq n ASN 194 N -4.31 0.05 0.00 1.42 6.94 -1.26 -4.81 115.26 113.29 1rbq n ASN 194 Ca 0.03 -1.06 0.00 0.00 -0.02 0.00 0.00 54.58 53.53 1rbq n ASN 194 Cb 0.20 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.60 1rbq n ASN 194 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1rbq n GLY 195 N 0.05 1.30 3.91 4.83 0.00 -0.72 -5.00 105.19 109.56 1rbq n GLY 195 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1rbq n GLY 195 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rbq s LYS 196 N -0.12 3.28 0.33 1.61 -0.14 -1.26 -4.78 119.74 118.66 1rbq s LYS 196 Ca 0.00 -0.77 -0.29 0.00 -1.36 0.00 0.00 55.97 53.55 1rbq s LYS 196 Cb 0.00 -2.83 -0.11 0.00 -1.68 0.00 0.00 37.83 33.22 1rbq s LYS 196 CO 0.00 0.46 1.44 -1.50 -0.76 0.00 0.00 175.35 174.99 1rbq s ILE 197 N -1.90 2.36 -0.08 2.17 2.07 -1.26 -0.14 121.20 124.42 1rbq s ILE 197 Ca 0.34 0.34 0.02 0.00 -1.41 0.00 0.00 60.65 59.93 1rbq s ILE 197 Cb -0.10 -3.22 0.02 0.00 0.13 0.00 0.00 42.46 39.29 1rbq s ILE 197 CO 0.27 0.07 -0.12 0.00 -1.91 0.00 0.00 174.94 173.26 1rbq s TRP 199 N 0.94 3.22 -2.50 0.00 0.52 -1.26 -0.66 118.94 119.19 1rbq s TRP 199 Ca -0.09 -0.01 0.28 0.00 0.02 0.00 0.00 56.10 56.30 1rbq s TRP 199 Cb -0.15 -2.19 1.05 0.00 -1.15 0.00 0.00 33.47 31.03 1rbq s TRP 199 CO 0.00 -0.02 1.74 0.28 0.02 0.00 0.00 176.95 178.97