#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 4.32 -0.03 0.00 0.52 -1.26 -1.50 118.95 120.99 1rbq s ARG 2 Ca 0.00 0.53 0.06 0.00 -0.52 0.00 0.00 55.73 55.80 1rbq s ARG 2 Cb 0.00 -3.41 -0.01 0.00 0.52 0.00 0.00 34.95 32.05 1rbq s ARG 2 CO 0.00 0.21 -0.20 0.08 0.02 0.00 0.00 175.30 175.41 1rbq s VAL 3 N 0.42 1.64 -0.09 3.52 1.01 -0.11 -0.07 120.40 126.72 1rbq s VAL 3 Ca 0.28 -0.86 -0.00 0.00 0.00 0.00 0.00 61.98 61.40 1rbq s VAL 3 Cb -0.16 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 1rbq s VAL 3 CO 0.12 0.46 -0.06 0.00 0.00 0.00 0.00 175.10 175.63 1rbq s ALA 4 N -0.24 3.00 -0.20 5.51 0.00 -0.23 -0.86 121.76 128.74 1rbq s ALA 4 Ca 0.02 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 51.07 1rbq s ALA 4 Cb -0.10 -1.31 -0.01 0.00 0.00 0.00 0.00 23.12 21.69 1rbq s ALA 4 CO 0.01 0.50 -0.05 0.08 0.00 0.00 0.00 175.76 176.30 1rbq s VAL 5 N -0.56 3.47 -0.15 0.00 1.01 -0.26 -0.62 120.40 123.29 1rbq s VAL 5 Ca 0.09 -0.47 -0.09 0.00 0.00 0.00 0.00 61.98 61.50 1rbq s VAL 5 Cb -0.12 -2.56 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 1rbq s VAL 5 CO 0.02 0.44 0.16 -0.76 0.00 0.00 0.00 175.10 174.96 1rbq s LEU 6 N 1.17 4.30 0.18 3.92 1.43 0.52 -0.79 118.68 129.41 1rbq s LEU 6 Ca 0.02 0.39 0.01 0.00 -1.03 0.00 0.00 54.13 53.52 1rbq s LEU 6 Cb -0.14 -2.13 -0.05 0.00 0.03 0.00 0.00 46.19 43.90 1rbq s LEU 6 CO -0.01 0.27 0.02 0.27 0.23 0.00 0.00 176.35 177.14 1rbq s ILE 7 N -0.26 0.61 0.00 -0.59 -4.36 -0.07 -0.92 121.20 115.60 1rbq s ILE 7 Ca 0.12 -1.98 0.00 0.00 -0.26 0.00 0.00 60.65 58.54 1rbq s ILE 7 Cb -0.12 -2.18 0.00 0.00 1.25 0.00 0.00 42.46 41.41 1rbq s ILE 7 CO 0.02 -0.41 0.00 -1.20 0.24 0.00 0.00 174.94 173.58 1rbq n SER 8 N -0.26 0.38 0.00 4.36 7.64 -1.13 -3.07 113.62 121.55 1rbq n SER 8 Ca -0.06 -0.14 0.00 0.00 1.01 0.00 0.00 58.87 59.69 1rbq n SER 8 Cb 0.64 0.35 0.00 0.00 -1.01 0.00 0.00 64.21 64.19 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 0.47 4.11 0.00 0.23 0.00 -1.26 -4.69 105.19 104.05 1rbq n GLY 9 Ca 0.00 -0.48 0.15 0.00 0.00 0.00 0.00 46.02 45.69 1rbq n GLY 9 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rbq n THR 10 N 0.00 0.00 -3.32 2.61 -2.24 -1.26 -1.62 114.28 108.45 1rbq n THR 10 Ca 0.00 -0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.61 1rbq n THR 10 Cb 0.00 -0.49 0.07 0.00 -2.10 0.00 0.00 70.33 67.82 1rbq n THR 10 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rbq n GLY 11 N 1.21 -0.27 3.61 3.38 0.00 -1.26 -2.91 105.19 108.95 1rbq n GLY 11 Ca 0.17 0.06 -0.48 0.00 0.00 0.00 0.00 46.02 45.77 1rbq n GLY 11 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rbq n SER 12 N -2.56 1.96 0.00 1.61 7.64 -1.26 -1.09 113.62 119.92 1rbq n SER 12 Ca -0.12 1.13 0.00 0.00 1.01 0.00 0.00 58.87 60.89 1rbq n SER 12 Cb 0.60 -1.29 0.00 0.00 -1.01 0.00 0.00 64.21 62.51 1rbq n SER 12 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1rbq n ASN 13 N 2.35 0.00 -0.13 6.43 3.02 -1.26 -4.63 115.26 121.03 1rbq n ASN 13 Ca 0.15 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.64 1rbq n ASN 13 Cb 0.25 -0.41 0.03 0.00 -0.61 0.00 0.00 39.78 39.04 1rbq n ASN 13 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1rbq h LEU 14 N 0.00 0.31 -0.80 3.41 5.85 -1.48 -0.36 115.31 122.24 1rbq h LEU 14 Ca 0.00 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 1rbq h LEU 14 Cb 0.00 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1rbq h LEU 14 CO 0.00 0.22 0.34 -0.61 -0.34 0.00 0.00 178.44 178.05 1rbq h GLN 15 N 0.43 1.17 -0.84 1.25 5.75 -1.90 -0.65 115.11 120.32 1rbq h GLN 15 Ca 0.18 -0.20 0.03 0.00 -0.15 0.00 0.00 58.65 58.52 1rbq h GLN 15 Cb 0.09 -0.20 -0.05 0.00 1.07 0.00 0.00 27.48 28.39 1rbq h GLN 15 CO -0.13 0.94 0.54 0.00 -2.65 0.00 0.00 178.83 177.53 1rbq h ALA 16 N 1.18 1.12 -0.46 3.38 0.00 -1.80 -0.51 119.26 122.16 1rbq h ALA 16 Ca 0.27 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.03 1rbq h ALA 16 Cb 0.19 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1rbq h ALA 16 CO -0.03 0.37 -0.17 -0.07 0.00 0.00 0.00 179.25 179.36 1rbq h LEU 17 N 1.05 0.94 0.39 0.00 3.38 -0.70 -2.41 115.31 117.95 1rbq h LEU 17 Ca 0.34 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1rbq h LEU 17 Cb 0.02 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.52 1rbq h LEU 17 CO -0.12 1.11 -0.19 0.40 0.09 0.00 0.00 178.44 179.73 1rbq h ILE 18 N 0.76 0.62 -1.01 1.22 2.04 -0.65 -2.01 117.51 118.48 1rbq h ILE 18 Ca 0.11 -0.07 0.07 0.00 1.00 0.00 0.00 64.86 65.97 1rbq h ILE 18 Cb 0.73 0.65 -0.07 0.00 -0.74 0.00 0.00 36.82 37.40 1rbq h ILE 18 CO 0.06 0.01 0.65 0.44 0.00 0.00 0.00 178.15 179.31 1rbq h ASP 19 N -0.56 1.03 -0.02 1.72 3.32 -1.12 -2.10 116.42 118.70 1rbq h ASP 19 Ca -0.05 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1rbq h ASP 19 Cb 0.43 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 1rbq h ASP 19 CO 0.09 0.65 0.01 -1.28 -1.72 0.00 0.00 179.24 176.99 1rbq h SER 20 N 1.17 0.01 0.79 6.45 0.87 -1.32 -2.84 113.55 118.67 1rbq h SER 20 Ca 0.44 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.00 1rbq h SER 20 Cb 0.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1rbq h SER 20 CO -0.18 0.01 0.00 0.71 -0.53 0.00 0.00 176.83 176.84 1rbq h THR 21 N 0.01 0.00 -0.02 2.23 1.35 -0.71 -2.61 112.91 113.17 1rbq h THR 21 Ca 0.01 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1rbq h THR 21 Cb 0.00 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 1rbq h THR 21 CO -0.01 0.00 -0.09 0.54 -0.25 0.00 0.00 175.52 175.71 1rbq n ARG 22 N -2.80 1.63 -2.32 4.72 1.74 -0.93 -4.74 116.66 113.96 1rbq n ARG 22 Ca 0.01 -1.12 -0.32 0.00 -0.77 0.00 0.00 57.85 55.64 1rbq n ARG 22 Cb 0.25 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.19 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 -2.14 3.79 0.59 5.56 0.41 -0.98 -5.01 118.70 120.92 1rbq s GLU 23 Ca 0.31 1.04 -0.20 0.00 -0.41 0.00 0.00 54.97 55.70 1rbq s GLU 23 Cb 0.20 -2.11 -0.03 0.00 -1.78 0.00 0.00 34.13 30.41 1rbq s GLU 23 CO 0.38 -0.41 1.31 -2.30 -0.49 0.00 0.00 175.26 173.76 1rbq n PRO 24 N -1.65 1.44 -0.88 0.39 -0.02 -1.26 -2.50 135.00 130.51 1rbq n PRO 24 Ca 0.07 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1rbq n PRO 24 Cb 0.54 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1rbq n PRO 24 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1rbq n ASN 25 N -1.31 -1.37 -4.77 2.55 3.02 -1.26 -4.99 115.26 107.13 1rbq n ASN 25 Ca 0.13 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.27 1rbq n ASN 25 Cb 0.46 -1.13 -0.01 0.00 -0.61 0.00 0.00 39.78 38.49 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 -2.43 6.60 0.00 6.41 0.15 -1.04 -4.92 113.70 118.47 1rbq s SER 26 Ca 0.00 2.83 0.25 0.00 0.70 0.00 0.00 55.95 59.72 1rbq s SER 26 Cb 0.00 -2.65 0.42 0.00 -1.71 0.00 0.00 66.02 62.07 1rbq s SER 26 CO 0.00 -0.68 1.35 -1.20 1.20 0.00 0.00 173.24 173.92 1rbq n SER 27 N 0.80 1.38 -4.23 5.45 7.64 -1.26 -4.97 113.62 118.44 1rbq n SER 27 Ca 0.01 -1.11 -0.18 0.00 1.01 0.00 0.00 58.87 58.61 1rbq n SER 27 Cb 0.41 0.30 -0.11 0.00 -1.01 0.00 0.00 64.21 63.80 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 -2.53 1.41 -0.02 -0.43 0.00 -1.26 -0.41 121.76 118.52 1rbq s ALA 28 Ca 0.21 -1.25 0.02 0.00 0.00 0.00 0.00 51.96 50.94 1rbq s ALA 28 Cb 0.19 -0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.25 1rbq s ALA 28 CO 0.56 0.09 -0.06 1.14 0.00 0.00 0.00 175.76 177.49 1rbq s GLN 29 N -2.58 0.65 -0.29 0.00 -2.07 -0.56 -4.62 119.66 110.19 1rbq s GLN 29 Ca 0.07 -0.19 -0.25 0.00 -1.82 0.00 0.00 55.36 53.17 1rbq s GLN 29 Cb -0.05 -0.64 0.00 0.00 -1.09 0.00 0.00 33.01 31.23 1rbq s GLN 29 CO 0.03 0.06 0.85 0.42 -1.32 0.00 0.00 175.29 175.33 1rbq s ILE 30 N 0.23 4.76 -0.20 3.63 1.01 -1.26 -0.94 121.20 128.44 1rbq s ILE 30 Ca -0.03 1.40 0.14 0.00 0.00 0.00 0.00 60.65 62.16 1rbq s ILE 30 Cb -0.07 -4.18 -0.20 0.00 0.01 0.00 0.00 42.46 38.02 1rbq s ILE 30 CO -0.00 -0.23 0.39 0.47 0.00 0.00 0.00 174.94 175.57 1rbq n ASP 31 N 6.25 1.44 -3.57 3.58 8.00 -0.04 -4.93 116.55 127.29 1rbq n ASP 31 Ca 0.06 -0.24 -0.16 0.00 0.71 0.00 0.00 54.79 55.16 1rbq n ASP 31 Cb 0.48 1.46 -0.06 0.00 -0.02 0.00 0.00 41.12 42.97 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 -2.78 0.00 -0.12 0.53 2.07 -1.21 -4.21 121.20 115.48 1rbq s ILE 32 Ca -0.02 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.24 1rbq s ILE 32 Cb 0.09 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.70 1rbq s ILE 32 CO 0.58 0.00 -0.19 -0.69 -1.91 0.00 0.00 174.94 172.73 1rbq s VAL 33 N -0.59 1.82 -0.12 4.00 1.01 -0.67 -1.10 120.40 124.75 1rbq s VAL 33 Ca -0.06 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.10 1rbq s VAL 33 Cb -0.02 -1.62 -0.00 0.00 0.00 0.00 0.00 36.38 34.74 1rbq s VAL 33 CO 0.06 0.50 -0.19 -0.63 0.00 0.00 0.00 175.10 174.84 1rbq s ILE 34 N 0.83 2.43 0.05 2.22 1.01 0.03 -2.09 121.20 125.68 1rbq s ILE 34 Ca -0.08 -0.88 0.04 0.00 0.00 0.00 0.00 60.65 59.73 1rbq s ILE 34 Cb -0.16 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.30 1rbq s ILE 34 CO -0.01 0.54 -0.05 -0.55 0.00 0.00 0.00 174.94 174.88 1rbq s SER 35 N 0.46 4.76 0.00 3.58 0.15 -0.70 -0.89 113.70 121.05 1rbq s SER 35 Ca -0.13 -0.18 0.27 0.00 0.70 0.00 0.00 55.95 56.61 1rbq s SER 35 Cb -0.17 -1.10 0.91 0.00 -1.71 0.00 0.00 66.02 63.95 1rbq s SER 35 CO 0.06 0.23 1.66 -0.46 1.20 0.00 0.00 173.24 175.93 1rbq n ASN 36 N 1.10 1.51 -4.02 5.45 0.23 -1.17 -0.92 115.26 117.43 1rbq n ASN 36 Ca -0.14 -1.40 -0.22 0.00 -0.53 0.00 0.00 54.58 52.30 1rbq n ASN 36 Cb 0.52 0.04 -0.16 0.00 -2.08 0.00 0.00 39.78 38.10 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 -2.12 1.14 0.60 -3.83 1.02 -1.26 -3.52 119.74 111.77 1rbq s LYS 37 Ca 0.34 -0.35 -0.15 0.00 0.02 0.00 0.00 55.97 55.83 1rbq s LYS 37 Cb 0.20 -1.04 -0.03 0.00 -0.52 0.00 0.00 37.83 36.44 1rbq s LYS 37 CO 0.38 0.11 1.05 0.00 -0.92 0.00 0.00 175.35 175.97 1rbq s ALA 38 N 0.25 2.76 -1.79 5.17 0.00 -1.26 -4.22 121.76 122.68 1rbq s ALA 38 Ca -0.05 0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1rbq s ALA 38 Cb -0.10 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1rbq s ALA 38 CO 0.01 -0.82 0.00 0.00 0.00 0.00 0.00 175.76 174.95 1rbq n ALA 39 N -2.14 -0.57 -2.33 0.00 0.00 -1.26 -4.99 120.51 109.22 1rbq n ALA 39 Ca 0.08 0.20 -0.27 0.00 0.00 0.00 0.00 53.44 53.45 1rbq n ALA 39 Cb 0.53 -2.09 -0.00 0.00 0.00 0.00 0.00 19.45 17.89 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 -2.93 4.91 0.36 0.00 -7.23 -1.26 -5.00 120.40 109.26 1rbq s VAL 40 Ca 0.00 0.08 0.12 0.00 -1.81 0.00 0.00 61.98 60.37 1rbq s VAL 40 Cb 0.00 -3.85 0.08 0.00 0.56 0.00 0.00 36.38 33.17 1rbq s VAL 40 CO 0.00 -0.79 1.81 0.00 -0.31 0.00 0.00 175.10 175.81 1rbq h ALA 41 N 0.31 1.35 -0.25 1.32 0.00 -1.85 -2.61 119.26 117.53 1rbq h ALA 41 Ca -0.47 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.06 1rbq h ALA 41 Cb 1.21 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1rbq h ALA 41 CO 0.62 0.49 0.06 0.78 0.00 0.00 0.00 179.25 181.19 1rbq h GLY 42 N 1.17 0.38 1.02 0.00 0.00 -1.17 -1.72 103.07 102.73 1rbq h GLY 42 Ca -0.00 -0.18 -0.06 0.00 0.00 0.00 0.00 47.33 47.09 1rbq h GLY 42 CO 0.05 0.17 0.15 1.41 0.00 0.00 0.00 176.54 178.32 1rbq h LEU 43 N 0.35 0.92 -0.90 3.11 3.38 -1.70 -2.17 115.31 118.30 1rbq h LEU 43 Ca 0.09 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1rbq h LEU 43 Cb 0.14 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1rbq h LEU 43 CO -0.00 0.92 0.39 0.44 0.09 0.00 0.00 178.44 180.27 1rbq h ASP 44 N 0.89 1.07 -0.61 -0.43 3.32 -1.40 0.14 116.42 119.40 1rbq h ASP 44 Ca 0.19 -0.13 0.04 0.00 0.02 0.00 0.00 57.03 57.16 1rbq h ASP 44 Cb 0.35 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.58 1rbq h ASP 44 CO 0.00 0.91 0.34 0.11 -1.72 0.00 0.00 179.24 178.88 1rbq h LYS 45 N 1.17 0.64 -0.23 3.56 1.57 -1.16 0.70 116.57 122.81 1rbq h LYS 45 Ca 0.28 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.94 1rbq h LYS 45 Cb 0.12 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 1rbq h LYS 45 CO -0.03 0.42 -0.19 0.00 -0.57 0.00 0.00 179.45 179.07 1rbq h ALA 46 N 1.30 0.33 -0.51 3.86 0.00 -1.06 -2.34 119.26 120.84 1rbq h ALA 46 Ca 0.26 -0.35 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1rbq h ALA 46 Cb 0.12 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1rbq h ALA 46 CO -0.15 0.26 0.28 0.93 0.00 0.00 0.00 179.25 180.57 1rbq h GLU 47 N 0.23 0.53 -0.57 0.00 5.08 -0.80 -1.01 114.58 118.03 1rbq h GLU 47 Ca 0.04 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1rbq h GLU 47 Cb 0.73 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 1rbq h GLU 47 CO 0.05 0.35 0.34 0.00 -1.00 0.00 0.00 179.01 178.75 1rbq h ARG 48 N 0.54 0.77 0.00 2.33 3.08 -0.80 -1.73 114.38 118.57 1rbq h ARG 48 Ca 0.22 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1rbq h ARG 48 Cb 0.09 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1rbq h ARG 48 CO -0.13 0.54 0.00 0.00 -1.07 0.00 0.00 179.97 179.31 1rbq n ALA 49 N -2.45 2.60 -2.65 0.04 0.00 -0.88 -4.90 120.51 112.26 1rbq n ALA 49 Ca 0.05 -0.18 -0.16 0.00 0.00 0.00 0.00 53.44 53.16 1rbq n ALA 49 Cb 0.07 -1.46 0.02 0.00 0.00 0.00 0.00 19.45 18.08 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 0.84 -0.21 3.57 0.00 0.00 -0.65 -5.02 105.19 103.73 1rbq n GLY 50 Ca 0.21 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.93 4.49 0.47 -0.61 1.01 -0.44 -5.03 121.20 118.16 1rbq s ILE 51 Ca 0.15 -0.14 -0.24 0.00 0.00 0.00 0.00 60.65 60.43 1rbq s ILE 51 Cb -0.07 -3.02 -0.08 0.00 0.01 0.00 0.00 42.46 39.30 1rbq s ILE 51 CO 0.19 0.45 1.24 -2.65 0.00 0.00 0.00 174.94 174.18 1rbq n PRO 52 N 3.72 1.74 -4.32 2.79 -0.02 -1.26 -4.14 135.00 133.52 1rbq n PRO 52 Ca -0.17 0.63 -0.21 0.00 -2.02 0.00 0.00 63.50 61.73 1rbq n PRO 52 Cb 0.52 -2.39 -0.11 0.00 -0.02 0.00 0.00 33.50 31.50 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 -1.26 1.72 0.04 3.45 -4.23 -1.26 -1.67 115.64 112.43 1rbq s THR 53 Ca 0.65 -1.91 0.02 0.00 -1.18 0.00 0.00 61.69 59.26 1rbq s THR 53 Cb -0.48 -1.81 -0.02 0.00 1.34 0.00 0.00 72.50 71.53 1rbq s THR 53 CO 0.55 -0.37 -0.07 -0.13 -0.54 0.00 0.00 174.62 174.06 1rbq s ARG 54 N -2.88 0.47 -0.21 3.99 1.81 -0.89 -4.97 118.95 116.28 1rbq s ARG 54 Ca 0.15 -0.70 -0.03 0.00 -1.72 0.00 0.00 55.73 53.43 1rbq s ARG 54 Cb -0.05 -0.20 -0.00 0.00 -0.45 0.00 0.00 34.95 34.25 1rbq s ARG 54 CO 0.06 0.03 -0.08 0.08 -0.68 0.00 0.00 175.30 174.71 1rbq s VAL 55 N -1.36 3.08 -0.40 3.52 1.01 -1.26 -1.72 120.40 123.27 1rbq s VAL 55 Ca -0.11 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.29 1rbq s VAL 55 Cb -0.10 -2.39 0.11 0.00 0.00 0.00 0.00 36.38 34.01 1rbq s VAL 55 CO 0.00 0.45 0.15 -0.63 0.00 0.00 0.00 175.10 175.06 1rbq s ILE 56 N 1.44 2.66 -0.33 2.22 1.01 -0.10 -4.99 121.20 123.10 1rbq s ILE 56 Ca 0.06 -2.48 -0.29 0.00 0.00 0.00 0.00 60.65 57.94 1rbq s ILE 56 Cb -0.14 -2.89 -0.01 0.00 0.01 0.00 0.00 42.46 39.43 1rbq s ILE 56 CO -0.05 -0.67 1.65 0.21 0.00 0.00 0.00 174.94 176.07 1rbq s ASN 57 N 0.91 6.12 0.51 3.58 3.84 -1.26 -4.04 114.94 124.60 1rbq s ASN 57 Ca 0.12 1.23 0.23 0.00 0.21 0.00 0.00 52.86 54.65 1rbq s ASN 57 Cb -0.21 -2.53 1.35 0.00 -0.55 0.00 0.00 41.25 39.31 1rbq s ASN 57 CO -0.06 -1.54 2.08 1.12 -2.79 0.00 0.00 177.10 175.91 1rbq h HIS 58 N 11.82 0.00 0.00 0.43 2.07 -1.94 -2.33 115.15 125.20 1rbq h HIS 58 Ca -0.32 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.20 1rbq h HIS 58 Cb 1.15 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.13 1rbq h HIS 58 CO 0.95 0.12 0.00 0.87 -3.07 0.00 0.00 177.93 176.80 1rbq h LYS 59 N 0.00 0.00 -0.18 5.12 1.57 -1.90 -2.58 116.57 118.60 1rbq h LYS 59 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1rbq h LYS 59 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1rbq h LYS 59 CO 0.02 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.18 1rbq n LEU 60 N -2.90 1.36 -4.55 2.94 4.77 -0.88 -4.89 117.00 112.86 1rbq n LEU 60 Ca -0.01 -0.61 -0.29 0.00 -0.03 0.00 0.00 56.01 55.07 1rbq n LEU 60 Cb 0.18 -0.12 -0.10 0.00 -2.33 0.00 0.00 43.42 41.05 1rbq n LEU 60 CO 0.22 0.30 -0.45 -0.31 -1.33 0.00 0.00 177.39 175.83 1rbq s TYR 61 N -1.77 2.66 0.13 -1.77 1.51 -0.97 -5.04 117.35 112.09 1rbq s TYR 61 Ca 0.27 -0.20 -0.15 0.00 -1.01 0.00 0.00 57.07 55.98 1rbq s TYR 61 Cb 0.14 -1.38 -0.01 0.00 -0.11 0.00 0.00 41.96 40.60 1rbq s TYR 61 CO 0.21 0.42 1.61 -0.22 -1.11 0.00 0.00 175.55 176.46 1rbq h LYS 62 N 3.57 0.70 -4.00 -0.62 3.64 -1.90 -3.47 116.57 114.49 1rbq h LYS 62 Ca -0.49 -0.19 -0.22 0.00 -1.27 0.00 0.00 60.65 58.48 1rbq h LYS 62 Cb 1.17 -0.08 -0.08 0.00 -0.41 0.00 0.00 32.23 32.83 1rbq h LYS 62 CO 0.50 0.74 -0.17 0.54 -2.27 0.00 0.00 179.45 178.79 1rbq s ASN 63 N -6.11 0.67 0.27 4.20 2.20 -1.26 -5.06 114.94 109.85 1rbq s ASN 63 Ca -0.13 -1.37 -0.03 0.00 -0.94 0.00 0.00 52.86 50.39 1rbq s ASN 63 Cb 0.10 0.65 0.36 0.00 -2.00 0.00 0.00 41.25 40.37 1rbq s ASN 63 CO 0.78 -1.28 1.85 0.03 -2.94 0.00 0.00 177.10 175.54 1rbq h ARG 64 N 2.15 0.96 -0.58 3.55 3.08 -1.95 -2.90 114.38 118.68 1rbq h ARG 64 Ca -0.28 -0.16 0.03 0.00 0.07 0.00 0.00 59.98 59.64 1rbq h ARG 64 Cb 1.24 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 31.09 1rbq h ARG 64 CO 0.39 0.78 0.35 0.28 -1.07 0.00 0.00 179.97 180.70 1rbq h VAL 65 N 0.94 1.06 -0.44 2.04 2.07 -1.97 0.17 116.25 120.12 1rbq h VAL 65 Ca 0.22 -0.24 -0.14 0.00 0.82 0.00 0.00 66.70 67.36 1rbq h VAL 65 Cb 0.19 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1rbq h VAL 65 CO -0.02 0.13 -0.29 -0.33 0.02 0.00 0.00 177.57 177.08 1rbq h GLU 66 N 0.69 0.97 -0.27 1.57 5.08 -1.97 -1.53 114.58 119.13 1rbq h GLU 66 Ca 0.23 -0.46 -0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1rbq h GLU 66 Cb 0.03 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1rbq h GLU 66 CO -0.10 1.13 0.15 0.35 -1.00 0.00 0.00 179.01 179.54 1rbq h PHE 67 N 0.82 0.36 -0.21 4.33 3.57 -1.25 -1.41 116.94 123.14 1rbq h PHE 67 Ca 0.09 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1rbq h PHE 67 Cb 0.87 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 1rbq h PHE 67 CO 0.06 0.29 -0.15 -0.44 -2.23 0.00 0.00 178.31 175.83 1rbq h ASP 68 N 0.33 0.34 -0.32 0.41 3.32 -0.62 -1.90 116.42 117.98 1rbq h ASP 68 Ca 0.10 -0.08 -0.11 0.00 0.02 0.00 0.00 57.03 56.95 1rbq h ASP 68 Cb 0.04 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1rbq h ASP 68 CO -0.02 0.52 -0.20 0.28 -1.72 0.00 0.00 179.24 178.10 1rbq h SER 69 N 0.33 0.80 -0.68 6.45 0.02 -1.04 0.80 113.55 120.22 1rbq h SER 69 Ca 0.06 -0.28 -0.04 0.00 -0.84 0.00 0.00 61.79 60.68 1rbq h SER 69 Cb 0.47 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 1rbq h SER 69 CO 0.03 0.99 0.25 0.00 -1.14 0.00 0.00 176.83 176.96 1rbq h ALA 70 N 1.07 0.89 -0.14 3.77 0.00 -0.85 -1.14 119.26 122.86 1rbq h ALA 70 Ca 0.10 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1rbq h ALA 70 Cb 0.72 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1rbq h ALA 70 CO 0.06 0.53 0.09 0.82 0.00 0.00 0.00 179.25 180.74 1rbq h ILE 71 N 0.98 1.06 -0.23 0.00 2.04 -1.05 -2.82 117.51 117.49 1rbq h ILE 71 Ca 0.22 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.91 1rbq h ILE 71 Cb 0.24 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1rbq h ILE 71 CO -0.02 0.06 0.05 -0.78 0.00 0.00 0.00 178.15 177.46 1rbq h ASP 72 N 0.17 0.29 0.14 1.72 3.58 -0.70 -0.96 116.42 120.65 1rbq h ASP 72 Ca 0.05 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 1rbq h ASP 72 Cb 0.02 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.00 1rbq h ASP 72 CO -0.01 0.30 -0.08 -0.07 -2.88 0.00 0.00 179.24 176.50 1rbq h LEU 73 N 0.32 -0.20 -0.29 2.28 3.38 -0.96 -0.11 115.31 119.73 1rbq h LEU 73 Ca 0.08 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1rbq h LEU 73 Cb 0.14 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1rbq h LEU 73 CO -0.00 -0.13 0.18 0.58 0.09 0.00 0.00 178.44 179.15 1rbq h VAL 74 N -0.21 1.10 -0.93 1.22 2.07 -1.27 -0.73 116.25 117.50 1rbq h VAL 74 Ca -0.01 -0.22 0.11 0.00 0.82 0.00 0.00 66.70 67.39 1rbq h VAL 74 Cb 0.17 0.73 -0.08 0.00 -1.52 0.00 0.00 31.29 30.59 1rbq h VAL 74 CO 0.02 0.10 0.57 -0.07 0.02 0.00 0.00 177.57 178.20 1rbq h LEU 75 N 0.37 0.83 -0.42 2.57 4.07 -1.00 -1.17 115.31 120.56 1rbq h LEU 75 Ca 0.10 0.04 -0.16 0.00 0.08 0.00 0.00 57.88 57.95 1rbq h LEU 75 Cb 0.00 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.62 1rbq h LEU 75 CO -0.02 0.46 -0.38 -0.33 -1.08 0.00 0.00 178.44 177.09 1rbq h GLU 76 N 0.93 0.91 -0.83 1.13 4.39 -0.73 -1.55 114.58 118.83 1rbq h GLU 76 Ca 0.45 -0.48 0.04 0.00 0.34 0.00 0.00 59.36 59.72 1rbq h GLU 76 Cb 0.41 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.03 1rbq h GLU 76 CO -0.25 1.13 0.54 1.49 -1.16 0.00 0.00 179.01 180.76 1rbq h GLU 77 N 0.75 0.96 -0.25 2.33 4.81 -0.29 -1.65 114.58 121.23 1rbq h GLU 77 Ca 0.06 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1rbq h GLU 77 Cb 0.97 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1rbq h GLU 77 CO 0.09 0.63 0.00 1.19 -0.73 0.00 0.00 179.01 180.20 1rbq n PHE 78 N -4.46 0.32 -3.83 0.92 3.01 -0.52 -4.95 117.46 107.95 1rbq n PHE 78 Ca 0.11 -0.16 -0.26 0.00 1.01 0.00 0.00 57.45 58.15 1rbq n PHE 78 Cb 0.14 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.64 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 0.52 -2.51 -4.76 4.37 2.88 -0.62 -4.92 113.62 108.59 1rbq n SER 79 Ca 0.16 -0.83 -0.40 0.00 -1.33 0.00 0.00 58.87 56.46 1rbq n SER 79 Cb 0.36 -3.82 -0.05 0.00 -0.75 0.00 0.00 64.21 59.95 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 -3.55 3.65 -0.22 2.46 -1.09 -0.62 -4.76 121.20 117.07 1rbq s ILE 80 Ca 0.28 1.64 0.03 0.00 -2.23 0.00 0.00 60.65 60.37 1rbq s ILE 80 Cb -0.14 -4.03 -0.15 0.00 -1.58 0.00 0.00 42.46 36.56 1rbq s ILE 80 CO 0.83 0.37 -0.17 0.47 -1.23 0.00 0.00 174.94 175.21 1rbq n ASP 81 N 1.18 2.16 -4.05 3.58 8.00 0.90 -4.93 116.55 123.38 1rbq n ASP 81 Ca -0.01 -0.11 -0.20 0.00 0.71 0.00 0.00 54.79 55.18 1rbq n ASP 81 Cb 0.46 -0.24 -0.15 0.00 -0.02 0.00 0.00 41.12 41.17 1rbq n ASP 81 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1rbq s ILE 82 N -2.44 0.86 -0.13 0.53 1.01 -0.68 -4.86 121.20 115.49 1rbq s ILE 82 Ca -0.28 -0.47 -0.01 0.00 0.00 0.00 0.00 60.65 59.89 1rbq s ILE 82 Cb 0.07 -0.72 -0.02 0.00 0.01 0.00 0.00 42.46 41.80 1rbq s ILE 82 CO 0.52 0.24 -0.08 -0.69 0.00 0.00 0.00 174.94 174.93 1rbq s VAL 83 N -0.26 3.51 -0.13 2.92 1.01 0.32 -1.06 120.40 126.71 1rbq s VAL 83 Ca 0.04 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.51 1rbq s VAL 83 Cb -0.04 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 1rbq s VAL 83 CO -0.00 0.53 -0.13 0.00 0.00 0.00 0.00 175.10 175.49 1rbq s LEU 85 N 0.32 4.04 -0.53 0.00 1.43 -0.04 -0.35 118.68 123.55 1rbq s LEU 85 Ca -0.11 0.36 0.04 0.00 -1.03 0.00 0.00 54.13 53.39 1rbq s LEU 85 Cb -0.16 -2.50 0.14 0.00 0.03 0.00 0.00 46.19 43.71 1rbq s LEU 85 CO 0.06 -0.21 0.32 0.00 0.23 0.00 0.00 176.35 176.75 1rbq s ALA 86 N 2.12 2.93 -0.94 4.21 0.00 -0.10 -3.66 121.76 126.33 1rbq s ALA 86 Ca 0.17 -3.15 0.00 0.00 0.00 0.00 0.00 51.96 48.98 1rbq s ALA 86 Cb -0.16 -2.03 0.00 0.00 0.00 0.00 0.00 23.12 20.93 1rbq s ALA 86 CO 0.10 -2.05 0.00 0.41 0.00 0.00 0.00 175.76 174.22 1rbq n GLY 87 N 2.93 0.99 3.71 0.00 0.00 -1.26 -4.40 105.19 107.15 1rbq n GLY 87 Ca 0.12 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.34 3.11 -0.60 1.61 5.36 -1.25 -2.83 117.98 121.03 1rbq s PHE 88 Ca 0.00 0.90 0.09 0.00 -0.96 0.00 0.00 56.93 56.96 1rbq s PHE 88 Cb 0.00 -3.68 0.26 0.00 -0.34 0.00 0.00 43.02 39.26 1rbq s PHE 88 CO 0.00 -2.44 1.21 -1.33 -1.46 0.00 0.00 175.22 171.20 1rbq n MET 89 N 4.40 2.85 -3.69 10.12 2.81 -1.26 -4.93 117.12 127.42 1rbq n MET 89 Ca 0.12 -2.03 -0.37 0.00 -1.81 0.00 0.00 57.70 53.61 1rbq n MET 89 Cb 0.43 -1.28 -0.12 0.00 -0.71 0.00 0.00 33.22 31.54 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 -1.26 3.77 0.17 0.03 1.81 -1.26 -5.07 118.95 117.13 1rbq s ARG 90 Ca 0.20 -0.42 -0.32 0.00 -1.72 0.00 0.00 55.73 53.48 1rbq s ARG 90 Cb 0.12 -3.45 -0.11 0.00 -0.45 0.00 0.00 34.95 31.07 1rbq s ARG 90 CO 0.11 -0.18 1.69 0.42 -0.68 0.00 0.00 175.30 176.66 1rbq s ILE 91 N 1.66 2.39 0.22 1.52 1.01 -1.26 -4.98 121.20 121.77 1rbq s ILE 91 Ca 0.07 0.19 -0.11 0.00 0.00 0.00 0.00 60.65 60.80 1rbq s ILE 91 Cb -0.15 -3.12 -0.07 0.00 0.01 0.00 0.00 42.46 39.12 1rbq s ILE 91 CO 0.06 0.01 0.56 -0.76 0.00 0.00 0.00 174.94 174.81 1rbq s LEU 92 N 1.59 4.18 0.70 2.97 1.43 -1.26 -5.03 118.68 123.27 1rbq s LEU 92 Ca 0.74 0.96 -0.13 0.00 -1.03 0.00 0.00 54.13 54.68 1rbq s LEU 92 Cb -0.46 -3.65 0.02 0.00 0.03 0.00 0.00 46.19 42.12 1rbq s LEU 92 CO 0.33 -0.06 1.09 -0.94 0.23 0.00 0.00 176.35 176.99 1rbq s SER 93 N -2.27 5.04 0.14 2.29 1.04 -1.26 -4.87 113.70 113.81 1rbq s SER 93 Ca 0.47 1.83 -0.32 0.00 0.48 0.00 0.00 55.95 58.41 1rbq s SER 93 Cb -0.12 -2.53 -0.09 0.00 0.10 0.00 0.00 66.02 63.39 1rbq s SER 93 CO 0.21 -1.67 1.55 1.23 0.98 0.00 0.00 173.24 175.53 1rbq h GLY 94 N -0.48 -0.94 1.19 7.32 0.00 -1.97 -2.22 103.07 105.96 1rbq h GLY 94 Ca -0.45 0.71 0.01 0.00 0.00 0.00 0.00 47.33 47.60 1rbq h GLY 94 CO 0.54 -0.11 0.54 -2.55 0.00 0.00 0.00 176.54 174.96 1rbq h PRO 95 N -0.36 1.06 0.10 4.80 0.11 -1.99 -0.05 132.00 135.68 1rbq h PRO 95 Ca 0.09 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.13 1rbq h PRO 95 Cb 0.58 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.45 1rbq h PRO 95 CO -0.63 0.70 -0.05 0.35 -0.21 0.00 0.00 178.00 178.16 1rbq h PHE 96 N 1.09 -0.13 -0.67 0.65 3.04 -1.93 -1.51 116.94 117.48 1rbq h PHE 96 Ca 0.30 -0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.32 1rbq h PHE 96 Cb -0.11 0.04 -0.06 0.00 2.56 0.00 0.00 35.95 38.38 1rbq h PHE 96 CO -0.00 0.04 0.35 0.28 -2.02 0.00 0.00 178.31 176.96 1rbq h VAL 97 N -0.27 0.91 -0.38 1.41 2.07 -0.99 -1.42 116.25 117.57 1rbq h VAL 97 Ca -0.01 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 1rbq h VAL 97 Cb 0.22 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 1rbq h VAL 97 CO 0.02 0.11 0.10 1.56 0.02 0.00 0.00 177.57 179.39 1rbq h GLN 98 N 0.63 0.61 -0.52 1.57 4.20 -0.96 -1.33 115.11 119.30 1rbq h GLN 98 Ca 0.32 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 1rbq h GLN 98 Cb 0.27 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 1rbq h GLN 98 CO -0.22 0.63 0.22 -0.22 -0.67 0.00 0.00 178.83 178.57 1rbq h LYS 99 N 0.47 0.75 -0.63 1.46 3.64 -0.79 -2.65 116.57 118.82 1rbq h LYS 99 Ca 0.12 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1rbq h LYS 99 Cb 0.29 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1rbq h LYS 99 CO -0.00 0.60 0.00 0.91 -2.27 0.00 0.00 179.45 178.69 1rbq n TRP 100 N -4.35 1.21 -1.68 1.91 7.02 -0.58 -4.97 117.44 116.00 1rbq n TRP 100 Ca 0.04 -0.49 -0.46 0.00 -1.02 0.00 0.00 57.50 55.57 1rbq n TRP 100 Cb 0.15 -0.20 -0.04 0.00 -2.42 0.00 0.00 31.31 28.80 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 0.92 3.47 0.00 -0.99 5.15 -0.52 -0.36 115.26 122.93 1rbq n ASN 101 Ca 0.21 1.00 0.00 0.00 -0.60 0.00 0.00 54.58 55.19 1rbq n ASN 101 Cb 0.74 -1.42 0.00 0.00 -0.53 0.00 0.00 39.78 38.57 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 4.12 0.77 0.00 8.20 0.00 -1.26 -4.85 105.19 112.17 1rbq n GLY 102 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.27 0.97 -4.07 1.61 4.76 0.51 -4.74 118.16 114.95 1rbq n LYS 103 Ca 0.00 -0.83 -0.26 0.00 -2.87 0.00 0.00 58.31 54.35 1rbq n LYS 103 Cb 0.01 -0.81 -0.17 0.00 -1.84 0.00 0.00 35.03 32.23 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 -0.40 1.51 0.08 1.97 1.75 -1.08 -0.52 119.30 122.61 1rbq s MET 104 Ca 0.00 -0.27 0.07 0.00 -1.25 0.00 0.00 55.69 54.23 1rbq s MET 104 Cb 0.00 -1.49 -0.04 0.00 2.84 0.00 0.00 34.83 36.14 1rbq s MET 104 CO 0.00 -0.19 -0.11 -0.51 -0.65 0.00 0.00 175.02 173.56 1rbq s LEU 105 N 1.44 2.98 0.11 4.11 1.43 0.23 -0.87 118.68 128.13 1rbq s LEU 105 Ca -0.00 -0.37 0.07 0.00 -1.03 0.00 0.00 54.13 52.80 1rbq s LEU 105 Cb -0.13 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 1rbq s LEU 105 CO -0.05 0.20 -0.17 0.21 0.23 0.00 0.00 176.35 176.77 1rbq s ASN 106 N -2.00 2.24 -0.16 2.29 2.47 0.10 -0.86 114.94 119.02 1rbq s ASN 106 Ca 0.20 -0.73 -0.03 0.00 0.42 0.00 0.00 52.86 52.72 1rbq s ASN 106 Cb -0.11 -0.11 -0.02 0.00 -1.45 0.00 0.00 41.25 39.56 1rbq s ASN 106 CO 0.12 -0.03 -0.06 -0.51 -3.72 0.00 0.00 177.10 172.89 1rbq s ILE 107 N -1.56 3.61 -0.05 -5.21 1.10 -1.24 -1.64 121.20 116.20 1rbq s ILE 107 Ca 0.07 -0.45 0.05 0.00 -0.51 0.00 0.00 60.65 59.80 1rbq s ILE 107 Cb -0.08 -2.58 -0.01 0.00 0.15 0.00 0.00 42.46 39.95 1rbq s ILE 107 CO 0.04 0.49 -0.20 -2.28 -2.11 0.00 0.00 174.94 170.88 1rbq s HIS 108 N 0.53 1.95 -0.29 3.50 5.65 0.18 -4.81 115.29 122.01 1rbq s HIS 108 Ca -0.04 -0.57 -0.04 0.00 0.25 0.00 0.00 55.06 54.65 1rbq s HIS 108 Cb -0.15 -1.30 -0.03 0.00 -1.18 0.00 0.00 32.58 29.92 1rbq s HIS 108 CO 0.03 -0.18 2.98 -0.35 -0.65 0.00 0.00 174.74 176.56 1rbq n PRO 109 N 3.08 2.20 -4.07 2.88 -0.04 -1.26 -0.63 135.00 137.16 1rbq n PRO 109 Ca -0.18 -1.81 -0.11 0.00 -0.04 0.00 0.00 63.50 61.36 1rbq n PRO 109 Cb 0.53 -2.03 -0.06 0.00 -0.04 0.00 0.00 33.50 31.89 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 0.91 0.19 -0.96 3.54 1.04 -0.63 -4.53 113.70 113.25 1rbq s SER 110 Ca 0.58 -1.16 -0.18 0.00 0.48 0.00 0.00 55.95 55.67 1rbq s SER 110 Cb 0.34 0.56 0.14 0.00 0.10 0.00 0.00 66.02 67.16 1rbq s SER 110 CO -0.13 -1.11 1.16 -0.76 0.98 0.00 0.00 173.24 173.38 1rbq s LEU 111 N -3.10 5.10 0.40 2.42 1.43 -1.25 -2.39 118.68 121.29 1rbq s LEU 111 Ca 0.28 -2.19 -0.24 0.00 -1.03 0.00 0.00 54.13 50.95 1rbq s LEU 111 Cb 0.01 -2.39 -0.12 0.00 0.03 0.00 0.00 46.19 43.72 1rbq s LEU 111 CO 0.12 -1.01 0.84 0.18 0.23 0.00 0.00 176.35 176.72 1rbq n LEU 112 N 6.35 1.59 -0.27 1.79 4.77 -1.26 -2.02 117.00 127.96 1rbq n LEU 112 Ca 0.25 1.01 0.09 0.00 -0.03 0.00 0.00 56.01 57.33 1rbq n LEU 112 Cb 0.48 -1.26 0.41 0.00 -2.33 0.00 0.00 43.42 40.73 1rbq n LEU 112 CO 0.51 -1.98 0.78 -0.81 -1.33 0.00 0.00 177.39 174.56 1rbq n PRO 113 N 0.34 1.35 -2.01 3.23 -0.04 -1.26 -5.09 135.00 131.51 1rbq n PRO 113 Ca 0.10 -0.53 -0.40 0.00 -0.04 0.00 0.00 63.50 62.64 1rbq n PRO 113 Cb 0.38 -1.31 -0.01 0.00 -0.04 0.00 0.00 33.50 32.53 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 -1.50 6.35 -1.24 3.54 0.01 -0.85 -4.18 113.70 115.83 1rbq s SER 114 Ca 0.27 2.73 -0.04 0.00 1.31 0.00 0.00 55.95 60.22 1rbq s SER 114 Cb 0.14 -2.64 -0.01 0.00 0.21 0.00 0.00 66.02 63.71 1rbq s SER 114 CO 0.22 -0.83 0.77 0.49 0.41 0.00 0.00 173.24 174.30 1rbq n PHE 115 N 0.25 -2.01 -1.83 2.43 3.72 -1.26 -4.44 117.46 114.32 1rbq n PHE 115 Ca 0.03 0.80 -0.37 0.00 -0.05 0.00 0.00 57.45 57.86 1rbq n PHE 115 Cb 0.43 -4.32 0.05 0.00 -0.94 0.00 0.00 39.48 34.70 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 -5.70 2.78 0.00 -1.08 1.02 -1.26 -4.56 119.74 110.94 1rbq s LYS 116 Ca 0.12 2.03 0.00 0.00 0.02 0.00 0.00 55.97 58.14 1rbq s LYS 116 Cb -0.03 -1.95 0.00 0.00 -0.52 0.00 0.00 37.83 35.33 1rbq s LYS 116 CO 0.80 -1.41 0.00 0.41 -0.92 0.00 0.00 175.35 174.23 1rbq n GLY 117 N 0.77 1.46 0.15 -3.33 0.00 -1.26 -4.82 105.19 98.15 1rbq n GLY 117 Ca 0.14 -2.12 0.14 0.00 0.00 0.00 0.00 46.02 44.18 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 0.59 -2.10 1.61 3.41 -1.26 -3.58 113.62 112.29 1rbq n SER 118 Ca 0.00 -0.66 -0.27 0.00 -0.26 0.00 0.00 58.87 57.68 1rbq n SER 118 Cb 0.00 -0.03 0.05 0.00 -0.26 0.00 0.00 64.21 63.96 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 -0.87 5.82 -0.24 4.04 6.94 -1.26 -4.87 115.26 124.82 1rbq n ASN 119 Ca 0.14 -3.77 0.02 0.00 -0.02 0.00 0.00 54.58 50.96 1rbq n ASN 119 Cb 0.29 -0.57 0.15 0.00 -2.36 0.00 0.00 39.78 37.28 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 2.08 0.97 -0.50 -2.53 0.00 -1.80 -1.87 119.26 115.62 1rbq h ALA 120 Ca 0.45 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.43 1rbq h ALA 120 Cb 1.29 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1rbq h ALA 120 CO 1.04 -0.12 0.28 0.45 0.00 0.00 0.00 179.25 180.90 1rbq h HIS 121 N 0.52 0.67 -0.60 0.00 3.86 -1.89 -0.11 115.15 117.60 1rbq h HIS 121 Ca 0.36 -0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.59 1rbq h HIS 121 Cb 0.44 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.66 1rbq h HIS 121 CO -0.13 0.48 0.35 1.49 0.86 0.00 0.00 177.93 180.98 1rbq h GLU 122 N 0.66 0.67 -0.36 2.45 4.81 -1.82 -1.16 114.58 119.84 1rbq h GLU 122 Ca 0.18 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1rbq h GLU 122 Cb 0.02 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 1rbq h GLU 122 CO -0.03 0.45 0.16 1.96 -0.73 0.00 0.00 179.01 180.81 1rbq h GLN 123 N 0.69 0.53 -0.21 1.92 4.20 -1.06 -0.84 115.11 120.35 1rbq h GLN 123 Ca 0.25 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 1rbq h GLN 123 Cb 0.05 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 1rbq h GLN 123 CO -0.12 0.49 0.12 0.00 -0.67 0.00 0.00 178.83 178.66 1rbq h ALA 124 N 1.01 0.27 -0.80 3.87 0.00 -0.61 0.10 119.26 123.09 1rbq h ALA 124 Ca 0.12 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1rbq h ALA 124 Cb 0.15 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1rbq h ALA 124 CO -0.01 -0.22 0.33 -0.07 0.00 0.00 0.00 179.25 179.27 1rbq h LEU 125 N 0.25 1.11 -0.69 0.00 3.38 -1.16 -1.20 115.31 117.00 1rbq h LEU 125 Ca 0.07 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 1rbq h LEU 125 Cb 0.03 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1rbq h LEU 125 CO -0.01 0.97 -0.32 -0.08 0.09 0.00 0.00 178.44 179.09 1rbq h GLU 126 N 1.17 0.65 0.00 1.13 4.81 -0.76 -2.86 114.58 118.72 1rbq h GLU 126 Ca 0.27 -0.30 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 1rbq h GLU 126 Cb 0.21 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1rbq h GLU 126 CO -0.02 0.89 -0.49 1.15 -0.73 0.00 0.00 179.01 179.80 1rbq h THR 127 N 0.55 1.19 0.00 0.32 2.02 -0.58 -3.48 112.91 112.93 1rbq h THR 127 Ca 0.06 -1.77 0.00 0.00 0.77 0.00 0.00 66.41 65.47 1rbq h THR 127 Cb 0.82 2.00 0.00 0.00 -1.74 0.00 0.00 68.15 69.23 1rbq h THR 127 CO 0.07 0.48 0.00 0.61 0.37 0.00 0.00 175.52 177.05 1rbq n GLY 128 N 0.15 0.45 3.74 2.16 0.00 -0.47 -5.05 105.19 106.17 1rbq n GLY 128 Ca -0.01 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 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 2.13 -1.08 1.61 -7.23 -1.20 -4.94 120.40 107.70 1rbq s VAL 129 Ca 0.00 0.08 0.20 0.00 -1.81 0.00 0.00 61.98 60.45 1rbq s VAL 129 Cb 0.00 -3.03 -0.18 0.00 0.56 0.00 0.00 36.38 33.73 1rbq s VAL 129 CO 0.00 -0.02 0.86 0.35 -0.31 0.00 0.00 175.10 175.98 1rbq n THR 130 N -1.79 0.00 -3.98 5.32 -2.24 -1.26 -4.73 114.28 105.60 1rbq n THR 130 Ca 0.15 -0.08 -0.25 0.00 -2.27 0.00 0.00 64.05 61.60 1rbq n THR 130 Cb 0.48 1.04 -0.17 0.00 -2.10 0.00 0.00 70.33 69.58 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 -2.75 0.87 0.00 2.28 1.01 -1.26 -0.36 120.40 120.18 1rbq s VAL 131 Ca 0.09 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1rbq s VAL 131 Cb 0.15 -0.90 0.00 0.00 0.00 0.00 0.00 36.38 35.63 1rbq s VAL 131 CO 0.75 0.33 0.00 1.07 0.00 0.00 0.00 175.10 177.26 1rbq n THR 132 N 4.78 0.00 -0.86 3.92 5.66 0.10 -4.91 114.28 122.97 1rbq n THR 132 Ca -0.14 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.86 1rbq n THR 132 Cb 0.50 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.28 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 3.90 -0.53 3.08 1.09 0.00 -1.26 0.04 105.19 111.51 1rbq n GLY 133 Ca 0.00 -0.77 -0.07 0.00 0.00 0.00 0.00 46.02 45.18 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 -3.52 0.41 -0.21 0.00 2.01 0.20 -1.94 115.64 112.58 1rbq s THR 135 Ca 0.03 -0.11 -0.09 0.00 0.31 0.00 0.00 61.69 61.84 1rbq s THR 135 Cb 0.05 -0.42 -0.04 0.00 0.01 0.00 0.00 72.50 72.09 1rbq s THR 135 CO -0.09 0.17 0.11 -0.69 -0.69 0.00 0.00 174.62 173.43 1rbq s VAL 136 N 0.60 5.06 0.02 3.82 1.01 0.06 -0.64 120.40 130.33 1rbq s VAL 136 Ca -0.07 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 1rbq s VAL 136 Cb -0.10 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.94 1rbq s VAL 136 CO -0.00 0.41 0.00 -1.38 0.00 0.00 0.00 175.10 174.13 1rbq s HIS 137 N 0.65 0.22 0.53 5.22 -0.00 -0.65 -0.06 115.29 121.19 1rbq s HIS 137 Ca 0.06 -0.45 -0.22 0.00 -0.00 0.00 0.00 55.06 54.45 1rbq s HIS 137 Cb -0.13 -0.16 -0.05 0.00 -0.00 0.00 0.00 32.58 32.24 1rbq s HIS 137 CO 0.01 -0.21 1.32 -0.06 -0.00 0.00 0.00 174.74 175.81 1rbq s PHE 138 N -1.43 2.40 -0.21 0.38 0.08 -0.09 -0.72 117.98 118.39 1rbq s PHE 138 Ca -0.16 1.40 -0.28 0.00 0.12 0.00 0.00 56.93 58.01 1rbq s PHE 138 Cb -0.09 -3.72 0.00 0.00 -0.57 0.00 0.00 43.02 38.63 1rbq s PHE 138 CO -0.01 -2.64 1.00 0.08 -0.10 0.00 0.00 175.22 173.55 1rbq s VAL 139 N -1.35 4.72 0.40 -0.44 1.01 -0.04 -3.77 120.40 120.94 1rbq s VAL 139 Ca 0.70 1.96 0.08 0.00 0.00 0.00 0.00 61.98 64.71 1rbq s VAL 139 Cb -0.38 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 1rbq s VAL 139 CO 0.45 -0.13 0.25 0.00 0.00 0.00 0.00 175.10 175.67 1rbq s ALA 140 N 2.94 3.75 0.16 5.51 0.00 -1.26 -4.76 121.76 128.09 1rbq s ALA 140 Ca 0.43 -1.98 -0.17 0.00 0.00 0.00 0.00 51.96 50.24 1rbq s ALA 140 Cb -0.16 -0.68 0.07 0.00 0.00 0.00 0.00 23.12 22.35 1rbq s ALA 140 CO 0.08 -0.15 1.70 1.49 0.00 0.00 0.00 175.76 178.87 1rbq h GLU 141 N 1.30 0.07 -6.30 0.00 4.81 -1.93 -3.39 114.58 109.13 1rbq h GLU 141 Ca -0.42 -0.00 -0.55 0.00 -0.13 0.00 0.00 59.36 58.25 1rbq h GLU 141 Cb 1.26 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 1rbq h GLU 141 CO 0.64 0.05 0.91 -0.51 -0.73 0.00 0.00 179.01 179.37 1rbq s ASP 142 N -5.24 6.82 0.18 1.04 1.01 -1.26 -4.93 116.67 114.29 1rbq s ASP 142 Ca -0.13 2.06 -0.33 0.00 0.71 0.00 0.00 52.55 54.86 1rbq s ASP 142 Cb 0.13 -2.55 -0.12 0.00 1.01 0.00 0.00 42.92 41.39 1rbq s ASP 142 CO 0.70 -0.78 1.70 0.52 0.21 0.00 0.00 175.17 177.52 1rbq n VAL 143 N 5.00 0.05 -2.47 -1.27 0.31 -1.26 -2.44 118.33 116.25 1rbq n VAL 143 Ca 0.14 -0.01 -0.16 0.00 -0.01 0.00 0.00 64.34 64.30 1rbq n VAL 143 Cb 0.44 -1.87 -0.01 0.00 -0.91 0.00 0.00 33.84 31.49 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 4.05 -4.75 0.00 4.52 8.00 -1.26 -4.82 116.55 122.29 1rbq n ASP 144 Ca 0.17 0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.75 1rbq n ASP 144 Cb 0.33 -3.98 0.00 0.00 -0.02 0.00 0.00 41.12 37.45 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 -2.23 1.45 -1.24 2.24 0.00 -1.02 -4.96 120.51 114.76 1rbq n ALA 145 Ca -0.18 -0.59 -0.29 0.00 0.00 0.00 0.00 53.44 52.38 1rbq n ALA 145 Cb 0.64 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.24 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 -0.34 1.59 0.19 0.00 0.00 -1.25 -4.92 107.32 102.59 1rbq s GLY 146 Ca 0.00 -0.26 -0.31 0.00 0.00 0.00 0.00 44.72 44.15 1rbq s GLY 146 CO 0.00 0.29 1.49 1.20 0.00 0.00 0.00 173.10 176.08 1rbq s GLN 147 N -4.99 4.25 -0.00 2.90 -1.52 -1.25 -4.62 119.66 114.42 1rbq s GLN 147 Ca 0.64 2.30 -0.30 0.00 -1.95 0.00 0.00 55.36 56.06 1rbq s GLN 147 Cb -0.18 -3.15 -0.03 0.00 -0.22 0.00 0.00 33.01 29.43 1rbq s GLN 147 CO 0.57 -0.51 1.03 0.42 -0.25 0.00 0.00 175.29 176.55 1rbq s ILE 148 N 0.65 4.69 -0.23 1.08 1.01 -1.26 -0.91 121.20 126.23 1rbq s ILE 148 Ca 0.65 1.93 -0.16 0.00 0.00 0.00 0.00 60.65 63.07 1rbq s ILE 148 Cb -0.42 -4.24 -0.12 0.00 0.01 0.00 0.00 42.46 37.70 1rbq s ILE 148 CO 0.36 0.13 -0.20 -0.38 0.00 0.00 0.00 174.94 174.85 1rbq n ILE 149 N 4.00 1.51 -3.85 2.92 5.41 0.92 -4.94 119.36 125.33 1rbq n ILE 149 Ca 0.07 -0.13 -0.10 0.00 1.00 0.00 0.00 62.75 63.59 1rbq n ILE 149 Cb 0.50 -2.07 -0.08 0.00 -0.71 0.00 0.00 39.64 37.28 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 -7.75 1.41 0.05 1.39 1.43 -1.06 -5.02 118.68 109.13 1rbq s LEU 150 Ca -0.32 -0.42 -0.06 0.00 -1.03 0.00 0.00 54.13 52.30 1rbq s LEU 150 Cb 0.09 0.94 -0.01 0.00 0.03 0.00 0.00 46.19 47.24 1rbq s LEU 150 CO 0.47 -0.58 0.11 -1.10 0.23 0.00 0.00 176.35 175.48 1rbq s GLN 151 N -2.75 0.66 -0.08 1.70 -0.21 -1.26 -0.76 119.66 116.97 1rbq s GLN 151 Ca -0.04 -0.86 -0.04 0.00 0.02 0.00 0.00 55.36 54.45 1rbq s GLN 151 Cb -0.00 0.26 0.04 0.00 1.00 0.00 0.00 33.01 34.31 1rbq s GLN 151 CO -0.05 -0.18 0.17 -2.00 -2.12 0.00 0.00 175.29 171.12 1rbq s GLU 152 N -3.10 0.13 0.35 2.91 2.12 -0.82 -5.00 118.70 115.29 1rbq s GLU 152 Ca -0.01 0.40 -0.23 0.00 0.36 0.00 0.00 54.97 55.49 1rbq s GLU 152 Cb 0.02 -0.14 -0.10 0.00 0.26 0.00 0.00 34.13 34.16 1rbq s GLU 152 CO -0.07 -0.15 0.91 0.00 -0.54 0.00 0.00 175.26 175.41 1rbq s ALA 153 N 1.11 3.18 -0.03 6.30 0.00 -1.26 -1.65 121.76 129.42 1rbq s ALA 153 Ca -0.08 0.42 0.01 0.00 0.00 0.00 0.00 51.96 52.30 1rbq s ALA 153 Cb -0.10 -3.11 0.02 0.00 0.00 0.00 0.00 23.12 19.93 1rbq s ALA 153 CO -0.06 0.19 -0.00 0.08 0.00 0.00 0.00 175.76 175.96 1rbq s VAL 154 N -1.81 0.19 0.47 0.00 1.01 0.11 -4.89 120.40 115.47 1rbq s VAL 154 Ca 0.54 0.06 -0.22 0.00 0.00 0.00 0.00 61.98 62.35 1rbq s VAL 154 Cb -0.15 -0.27 -0.08 0.00 0.00 0.00 0.00 36.38 35.89 1rbq s VAL 154 CO 0.20 0.14 1.11 -2.16 0.00 0.00 0.00 175.10 174.38 1rbq s PRO 155 N 0.89 3.76 -0.17 2.72 0.04 -1.26 0.03 135.00 141.01 1rbq s PRO 155 Ca -0.09 1.62 -0.14 0.00 0.04 0.00 0.00 61.00 62.42 1rbq s PRO 155 Cb -0.12 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 32.08 1rbq s PRO 155 CO -0.01 -0.52 0.32 0.08 0.04 0.00 0.00 177.00 176.91 1rbq s VAL 156 N -1.69 5.28 -0.03 -0.36 1.01 0.52 -4.78 120.40 120.36 1rbq s VAL 156 Ca 0.65 0.59 -0.15 0.00 0.00 0.00 0.00 61.98 63.07 1rbq s VAL 156 Cb -0.24 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1rbq s VAL 156 CO 0.29 0.36 0.42 -0.54 0.00 0.00 0.00 175.10 175.63 1rbq s LYS 157 N 0.62 4.01 0.14 2.72 1.02 -1.26 -4.82 119.74 122.19 1rbq s LYS 157 Ca 0.17 0.41 -0.35 0.00 0.02 0.00 0.00 55.97 56.23 1rbq s LYS 157 Cb -0.13 -3.27 -0.15 0.00 -0.52 0.00 0.00 37.83 33.76 1rbq s LYS 157 CO 0.05 0.58 1.49 0.54 -0.92 0.00 0.00 175.35 177.09 1rbq n ARG 158 N 2.22 1.83 -0.47 1.68 1.74 -1.26 -1.05 116.66 121.35 1rbq n ARG 158 Ca -0.13 0.66 0.00 0.00 -0.77 0.00 0.00 57.85 57.61 1rbq n ARG 158 Cb 0.52 -2.38 0.00 0.00 -1.02 0.00 0.00 32.46 29.58 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 3.06 0.74 3.65 -0.13 0.00 -1.26 -5.03 105.19 106.21 1rbq n GLY 159 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 1.84 -5.00 1.61 8.00 -0.22 -5.04 116.55 117.75 1rbq n ASP 160 Ca 0.00 1.07 -0.19 0.00 0.71 0.00 0.00 54.79 56.38 1rbq n ASP 160 Cb 0.00 -1.42 0.02 0.00 -0.02 0.00 0.00 41.12 39.71 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 2.59 0.21 -3.53 -4.23 -1.26 -4.95 115.64 103.24 1rbq s THR 161 Ca 0.62 -1.06 -0.10 0.00 -1.18 0.00 0.00 61.69 59.98 1rbq s THR 161 Cb -0.54 -2.65 0.15 0.00 1.34 0.00 0.00 72.50 70.80 1rbq s THR 161 CO 0.57 0.00 1.73 0.58 -0.54 0.00 0.00 174.62 176.96 1rbq h VAL 162 N 0.52 0.73 -0.67 2.29 2.07 -1.96 -1.32 116.25 117.91 1rbq h VAL 162 Ca -0.36 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1rbq h VAL 162 Cb 1.28 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 1rbq h VAL 162 CO 0.45 0.07 0.38 0.00 0.02 0.00 0.00 177.57 178.48 1rbq h ALA 163 N 1.43 0.86 -0.04 1.67 0.00 -1.98 0.22 119.26 121.41 1rbq h ALA 163 Ca 0.31 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1rbq h ALA 163 Cb 0.40 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1rbq h ALA 163 CO -0.33 0.37 -0.26 1.79 0.00 0.00 0.00 179.25 180.81 1rbq h THR 164 N 0.92 1.46 -0.50 0.00 1.35 -1.89 -2.46 112.91 111.79 1rbq h THR 164 Ca 0.24 -1.74 0.02 0.00 -0.55 0.00 0.00 66.41 64.37 1rbq h THR 164 Cb 0.02 2.45 -0.03 0.00 -1.73 0.00 0.00 68.15 68.86 1rbq h THR 164 CO -0.04 0.49 0.31 0.25 -0.25 0.00 0.00 175.52 176.28 1rbq h LEU 165 N -0.29 0.50 -0.62 3.87 5.85 -1.21 -2.28 115.31 121.13 1rbq h LEU 165 Ca -0.02 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1rbq h LEU 165 Cb 0.94 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 1rbq h LEU 165 CO 0.05 0.36 0.34 0.77 -0.34 0.00 0.00 178.44 179.62 1rbq h SER 166 N 0.61 0.77 -0.69 1.25 4.64 -0.59 -0.76 113.55 118.79 1rbq h SER 166 Ca 0.20 -0.09 0.03 0.00 -0.47 0.00 0.00 61.79 61.46 1rbq h SER 166 Cb -0.00 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 61.85 1rbq h SER 166 CO -0.08 0.64 0.43 -0.08 -0.87 0.00 0.00 176.83 176.86 1rbq h GLU 167 N 0.84 0.81 -0.62 4.77 4.57 -1.30 -0.24 114.58 123.40 1rbq h GLU 167 Ca 0.22 -0.05 -0.07 0.00 -1.18 0.00 0.00 59.36 58.28 1rbq h GLU 167 Cb 0.04 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.42 1rbq h GLU 167 CO -0.04 0.53 0.10 -0.09 -1.18 0.00 0.00 179.01 178.34 1rbq h ARG 168 N 0.83 1.03 -0.52 1.92 2.43 -0.86 -2.52 114.38 116.69 1rbq h ARG 168 Ca 0.28 -0.28 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1rbq h ARG 168 Cb 0.03 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 1rbq h ARG 168 CO -0.11 0.96 -0.09 0.28 -1.51 0.00 0.00 179.97 179.50 1rbq h VAL 169 N 0.94 1.26 -0.64 0.20 2.07 -0.99 -3.02 116.25 116.06 1rbq h VAL 169 Ca 0.19 -1.21 0.13 0.00 0.82 0.00 0.00 66.70 66.63 1rbq h VAL 169 Cb 0.43 0.96 -0.10 0.00 -1.52 0.00 0.00 31.29 31.06 1rbq h VAL 169 CO 0.01 0.43 0.09 0.50 0.02 0.00 0.00 177.57 178.62 1rbq h LYS 170 N 0.85 0.20 -0.96 1.57 3.64 -0.64 0.16 116.57 121.39 1rbq h LYS 170 Ca 0.14 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.53 1rbq h LYS 170 Cb 0.62 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.35 1rbq h LYS 170 CO 0.04 0.13 0.63 -0.07 -2.27 0.00 0.00 179.45 177.91 1rbq h LEU 171 N 0.20 1.08 -0.60 5.20 3.38 -1.33 0.22 115.31 123.45 1rbq h LEU 171 Ca 0.35 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.24 1rbq h LEU 171 Cb 0.56 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1rbq h LEU 171 CO -0.48 0.76 0.17 0.00 0.09 0.00 0.00 178.44 178.97 1rbq h ALA 172 N 1.37 0.79 -0.63 1.53 0.00 -1.32 -2.80 119.26 118.20 1rbq h ALA 172 Ca 0.37 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 55.11 1rbq h ALA 172 Cb -0.07 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 1rbq h ALA 172 CO -0.10 0.47 0.42 0.93 0.00 0.00 0.00 179.25 180.97 1rbq h GLU 173 N 0.86 0.68 0.00 0.00 5.08 -0.10 -1.53 114.58 119.57 1rbq h GLU 173 Ca 0.19 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1rbq h GLU 173 Cb 0.32 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 1rbq h GLU 173 CO -0.00 0.45 -0.10 0.45 -1.00 0.00 0.00 179.01 178.81 1rbq h HIS 174 N 0.70 0.00 0.01 4.33 3.86 -0.72 -1.77 115.15 121.55 1rbq h HIS 174 Ca 0.26 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.47 1rbq h HIS 174 Cb 0.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.64 1rbq h HIS 174 CO -0.00 0.10 -0.00 0.87 0.86 0.00 0.00 177.93 179.75 1rbq h LYS 175 N 0.00 -0.01 0.00 2.45 1.57 -1.25 -3.40 116.57 115.92 1rbq h LYS 175 Ca -0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 1rbq h LYS 175 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 1rbq h LYS 175 CO 0.01 0.45 -0.74 -0.84 -0.57 0.00 0.00 179.45 177.77 1rbq h ILE 176 N -1.00 1.27 0.34 1.86 3.07 -1.27 -3.04 117.51 118.73 1rbq h ILE 176 Ca -0.00 -2.79 -0.02 0.00 1.55 0.00 0.00 64.86 63.61 1rbq h ILE 176 Cb 0.46 2.62 0.00 0.00 -0.27 0.00 0.00 36.82 39.64 1rbq h ILE 176 CO 0.00 0.72 -0.16 0.15 -1.05 0.00 0.00 178.15 177.81 1rbq h PHE 177 N 0.00 -0.42 -0.24 0.16 3.04 -1.56 -0.05 116.94 117.88 1rbq h PHE 177 Ca -0.01 -0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.86 1rbq h PHE 177 Cb 1.56 0.14 -0.01 0.00 2.56 0.00 0.00 35.95 40.20 1rbq h PHE 177 CO 0.00 -0.15 -0.15 -1.35 -2.02 0.00 0.00 178.31 174.63 1rbq h PRO 178 N -0.63 0.40 -0.74 6.41 0.11 -1.78 -1.04 132.00 134.74 1rbq h PRO 178 Ca -0.05 -0.11 -0.04 0.00 0.11 0.00 0.00 66.00 65.91 1rbq h PRO 178 Cb 0.45 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.49 1rbq h PRO 178 CO 0.08 0.55 0.30 0.00 -0.21 0.00 0.00 178.00 178.71 1rbq h ALA 179 N 1.47 0.96 -0.35 -0.75 0.00 -1.40 -0.94 119.26 118.25 1rbq h ALA 179 Ca 0.07 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.62 1rbq h ALA 179 Cb 0.49 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1rbq h ALA 179 CO 0.03 0.58 -0.44 0.00 0.00 0.00 0.00 179.25 179.42 1rbq h ALA 180 N 1.15 0.56 -0.27 0.00 0.00 -0.70 -1.57 119.26 118.43 1rbq h ALA 180 Ca 0.25 -0.47 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1rbq h ALA 180 Cb 0.21 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1rbq h ALA 180 CO -0.02 0.68 0.07 1.25 0.00 0.00 0.00 179.25 181.23 1rbq h LEU 181 N 0.72 0.06 -0.87 0.00 5.85 -1.03 -1.73 115.31 118.30 1rbq h LEU 181 Ca 0.05 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1rbq h LEU 181 Cb 1.04 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 1rbq h LEU 181 CO 0.10 0.07 0.55 1.56 -0.34 0.00 0.00 178.44 180.38 1rbq h GLN 182 N 0.18 1.16 -0.53 1.25 1.08 -1.02 0.13 115.11 117.38 1rbq h GLN 182 Ca 0.12 -0.09 0.01 0.00 -1.45 0.00 0.00 58.65 57.24 1rbq h GLN 182 Cb 0.11 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 27.26 1rbq h GLN 182 CO -0.14 0.79 0.35 -0.07 -0.95 0.00 0.00 178.83 178.81 1rbq h LEU 183 N 1.19 0.59 -0.20 1.46 3.38 -1.00 0.59 115.31 121.32 1rbq h LEU 183 Ca 0.32 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 58.06 1rbq h LEU 183 Cb -0.09 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 40.52 1rbq h LEU 183 CO -0.06 0.43 -0.77 0.58 0.09 0.00 0.00 178.44 178.70 1rbq h VAL 184 N 0.70 1.29 -0.44 1.22 2.07 -1.00 -0.27 116.25 119.83 1rbq h VAL 184 Ca 0.20 -1.99 -0.12 0.00 0.82 0.00 0.00 66.70 65.61 1rbq h VAL 184 Cb -0.07 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1rbq h VAL 184 CO -0.05 0.63 -0.18 0.00 0.02 0.00 0.00 177.57 177.98 1rbq h ALA 185 N 0.61 0.83 0.00 1.67 0.00 -0.52 -2.30 119.26 119.56 1rbq h ALA 185 Ca -0.05 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1rbq h ALA 185 Cb 1.39 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1rbq h ALA 185 CO 0.16 0.64 0.00 -1.13 0.00 0.00 0.00 179.25 178.92 1rbq n SER 186 N -4.12 0.37 -0.02 0.00 3.41 0.18 -4.67 113.62 108.77 1rbq n SER 186 Ca 0.01 0.56 -0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1rbq n SER 186 Cb 0.42 -0.65 -0.00 0.00 -0.26 0.00 0.00 64.21 63.72 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 0.66 0.47 0.26 5.00 0.00 -0.87 -4.93 105.19 105.79 1rbq n GLY 187 Ca 0.04 -0.30 -0.08 0.00 0.00 0.00 0.00 46.02 45.68 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 1.27 -3.83 2.61 2.02 -1.33 -3.43 112.91 110.22 1rbq h THR 188 Ca -0.00 -1.35 -0.69 0.00 0.77 0.00 0.00 66.41 65.14 1rbq h THR 188 Cb 0.04 1.21 -0.32 0.00 -1.74 0.00 0.00 68.15 67.34 1rbq h THR 188 CO 0.01 0.45 -0.88 -0.69 0.37 0.00 0.00 175.52 174.77 1rbq s VAL 189 N -4.60 2.07 0.08 3.16 1.01 -0.67 -0.45 120.40 121.00 1rbq s VAL 189 Ca -0.09 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 60.85 1rbq s VAL 189 Cb 0.13 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 1rbq s VAL 189 CO 0.84 0.57 -0.06 -1.10 0.00 0.00 0.00 175.10 175.34 1rbq s GLN 190 N -0.03 0.74 -0.41 2.72 -0.21 -0.09 -4.30 119.66 118.08 1rbq s GLN 190 Ca -0.08 -1.21 -0.24 0.00 0.02 0.00 0.00 55.36 53.85 1rbq s GLN 190 Cb -0.15 -0.16 0.02 0.00 1.00 0.00 0.00 33.01 33.72 1rbq s GLN 190 CO 0.05 -0.02 0.85 -1.17 -2.12 0.00 0.00 175.29 172.88 1rbq s LEU 191 N -2.75 4.10 1.05 2.90 0.20 -1.26 -0.03 118.68 122.89 1rbq s LEU 191 Ca 0.07 0.24 -0.12 0.00 0.69 0.00 0.00 54.13 55.00 1rbq s LEU 191 Cb 0.03 -3.10 0.22 0.00 -0.43 0.00 0.00 46.19 42.90 1rbq s LEU 191 CO -0.04 -0.88 1.07 -0.83 -0.29 0.00 0.00 176.35 175.38 1rbq s GLY 192 N 2.02 1.57 0.41 7.98 0.00 0.11 -4.89 107.32 114.52 1rbq s GLY 192 Ca 0.34 -0.22 0.14 0.00 0.00 0.00 0.00 44.72 44.98 1rbq s GLY 192 CO 0.21 0.42 1.91 0.83 0.00 0.00 0.00 173.10 176.46 1rbq h GLU 193 N -2.14 0.00 -0.01 2.90 5.08 -1.97 -1.42 114.58 117.02 1rbq h GLU 193 Ca -0.56 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 1rbq h GLU 193 Cb 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 1rbq h GLU 193 CO 0.54 0.28 0.00 0.27 -1.00 0.00 0.00 179.01 179.10 1rbq n ASN 194 N -4.15 0.04 -0.62 1.42 6.94 -1.26 -4.88 115.26 112.74 1rbq n ASN 194 Ca -0.02 -1.90 -0.08 0.00 -0.02 0.00 0.00 54.58 52.56 1rbq n ASN 194 Cb 0.33 -0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 37.71 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 0.56 0.94 3.71 4.83 0.00 -0.53 -5.03 105.19 109.67 1rbq n GLY 195 Ca 0.03 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.77 2.63 0.12 1.61 -0.14 -1.26 -4.83 119.74 115.10 1rbq s LYS 196 Ca 0.00 -0.82 -0.31 0.00 -1.36 0.00 0.00 55.97 53.48 1rbq s LYS 196 Cb 0.00 -2.58 -0.08 0.00 -1.68 0.00 0.00 37.83 33.48 1rbq s LYS 196 CO 0.00 0.54 1.48 -1.50 -0.76 0.00 0.00 175.35 175.11 1rbq s ILE 197 N -1.36 3.07 -0.14 2.17 2.07 -1.26 0.08 121.20 125.83 1rbq s ILE 197 Ca 0.27 0.73 0.01 0.00 -1.41 0.00 0.00 60.65 60.24 1rbq s ILE 197 Cb -0.12 -3.47 0.02 0.00 0.13 0.00 0.00 42.46 39.03 1rbq s ILE 197 CO 0.19 0.04 -0.14 0.00 -1.91 0.00 0.00 174.94 173.13 1rbq s TRP 199 N 1.35 3.39 -2.31 0.00 0.52 -1.26 -0.91 118.94 119.71 1rbq s TRP 199 Ca 0.02 0.74 0.30 0.00 0.02 0.00 0.00 56.10 57.17 1rbq s TRP 199 Cb -0.13 -2.62 1.38 0.00 -1.15 0.00 0.00 33.47 30.95 1rbq s TRP 199 CO -0.08 -0.04 1.93 0.28 0.02 0.00 0.00 176.95 179.06