#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jwy s VAL 2 N 0.00 -0.03 -0.13 2.03 0.11 -1.26 -5.15 120.40 115.97 2jwy s VAL 2 Ca 0.00 0.12 0.01 0.00 -2.93 0.00 0.00 61.98 59.18 2jwy s VAL 2 Cb 0.00 -0.14 0.02 0.00 -1.53 0.00 0.00 36.38 34.73 2jwy s VAL 2 CO 0.00 0.05 -0.14 -1.58 -3.33 0.00 0.00 175.10 170.09 2jwy s GLN 3 N 0.68 2.23 -0.25 1.54 2.00 -1.26 -5.12 119.66 119.49 2jwy s GLN 3 Ca -0.05 -0.55 -0.28 0.00 -2.00 0.00 0.00 55.36 52.48 2jwy s GLN 3 Cb -0.07 -1.98 0.16 0.00 0.80 0.00 0.00 33.01 31.91 2jwy s GLN 3 CO -0.03 -0.15 1.20 -1.14 -0.50 0.00 0.00 175.29 174.67 2jwy s GLN 4 N 1.24 0.32 0.28 1.67 0.74 -1.26 -5.19 119.66 117.46 2jwy s GLN 4 Ca -0.01 0.19 0.04 0.00 0.05 0.00 0.00 55.36 55.64 2jwy s GLN 4 Cb -0.14 0.15 -0.02 0.00 1.10 0.00 0.00 33.01 34.11 2jwy s GLN 4 CO -0.06 -0.08 0.16 0.43 -0.55 0.00 0.00 175.29 175.19 2jwy n SER 5 N 1.18 0.34 -4.55 6.67 7.64 -1.26 -5.19 113.62 118.45 2jwy n SER 5 Ca -0.08 -2.66 -0.27 0.00 1.01 0.00 0.00 58.87 56.87 2jwy n SER 5 Cb 0.57 1.02 -0.10 0.00 -1.01 0.00 0.00 64.21 64.70 2jwy n SER 5 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2jwy s GLU 6 N -3.11 1.94 0.54 1.43 4.04 -1.26 -5.15 118.70 117.13 2jwy s GLU 6 Ca 0.23 -2.14 -0.11 0.00 0.04 0.00 0.00 54.97 52.99 2jwy s GLU 6 Cb 0.01 -1.29 -0.05 0.00 0.02 0.00 0.00 34.13 32.82 2jwy s GLU 6 CO 0.16 -0.21 0.94 0.14 -1.84 0.00 0.00 175.26 174.45 2jwy s VAL 7 N -2.96 4.71 -0.13 1.83 -7.23 -1.26 -5.08 120.40 110.28 2jwy s VAL 7 Ca 0.27 0.80 0.01 0.00 -1.81 0.00 0.00 61.98 61.26 2jwy s VAL 7 Cb 0.07 -3.82 0.02 0.00 0.56 0.00 0.00 36.38 33.21 2jwy s VAL 7 CO 0.13 -0.91 -0.17 -0.13 -0.31 0.00 0.00 175.10 173.72 2jwy s ARG 8 N -4.68 2.44 0.21 4.82 1.81 -1.26 -5.13 118.95 117.17 2jwy s ARG 8 Ca 0.54 -0.63 -0.15 0.00 -1.72 0.00 0.00 55.73 53.77 2jwy s ARG 8 Cb -0.11 -2.09 -0.08 0.00 -0.45 0.00 0.00 34.95 32.22 2jwy s ARG 8 CO 0.44 -0.11 0.64 -0.65 -0.68 0.00 0.00 175.30 174.94 2jwy s GLN 9 N 1.11 4.04 -0.02 3.54 -1.52 -1.26 -5.09 119.66 120.45 2jwy s GLN 9 Ca -0.03 0.60 0.04 0.00 -1.95 0.00 0.00 55.36 54.03 2jwy s GLN 9 Cb -0.14 -2.78 -0.01 0.00 -0.22 0.00 0.00 33.01 29.86 2jwy s GLN 9 CO -0.05 0.37 -0.14 -1.64 -0.25 0.00 0.00 175.29 173.58 2jwy s MET 10 N -2.28 1.24 -0.17 2.91 -1.94 -1.26 -5.14 119.30 112.66 2jwy s MET 10 Ca 0.44 -0.49 -0.09 0.00 -1.71 0.00 0.00 55.69 53.84 2jwy s MET 10 Cb -0.14 -1.16 0.06 0.00 2.01 0.00 0.00 34.83 35.60 2jwy s MET 10 CO 0.20 0.26 0.40 -1.59 -0.01 0.00 0.00 175.02 174.27 2jwy s LYS 11 N -0.17 0.37 -0.09 2.03 -2.85 -1.26 -5.16 119.74 112.62 2jwy s LYS 11 Ca 0.02 0.78 -0.04 0.00 -1.00 0.00 0.00 55.97 55.74 2jwy s LYS 11 Cb -0.07 -0.01 0.05 0.00 -2.06 0.00 0.00 37.83 35.73 2jwy s LYS 11 CO 0.00 -0.17 0.17 -1.01 0.10 0.00 0.00 175.35 174.45 2jwy s HIS 12 N 1.47 -0.22 -0.27 1.78 3.76 -1.26 -5.13 115.29 115.43 2jwy s HIS 12 Ca -0.09 0.64 -0.01 0.00 -0.15 0.00 0.00 55.06 55.45 2jwy s HIS 12 Cb -0.09 -0.17 0.08 0.00 1.11 0.00 0.00 32.58 33.51 2jwy s HIS 12 CO -0.12 -0.25 0.06 -1.12 -0.85 0.00 0.00 174.74 172.45 2jwy s SER 13 N 1.98 3.73 0.00 1.40 0.01 -1.26 -5.13 113.70 114.43 2jwy s SER 13 Ca -0.01 -1.37 0.01 0.00 1.31 0.00 0.00 55.95 55.89 2jwy s SER 13 Cb -0.12 -0.85 -0.04 0.00 0.21 0.00 0.00 66.02 65.22 2jwy s SER 13 CO -0.06 -0.36 0.03 -0.69 0.41 0.00 0.00 173.24 172.57 2jwy s VAL 14 N 1.64 4.37 -0.50 3.43 1.01 -1.26 -5.09 120.40 124.00 2jwy s VAL 14 Ca 0.05 -0.55 -0.05 0.00 0.00 0.00 0.00 61.98 61.44 2jwy s VAL 14 Cb -0.17 -2.98 0.13 0.00 0.00 0.00 0.00 36.38 33.36 2jwy s VAL 14 CO -0.18 0.35 0.32 -0.44 0.00 0.00 0.00 175.10 175.15 2jwy s SER 15 N -1.67 5.39 0.05 3.32 0.01 -1.26 -5.08 113.70 114.47 2jwy s SER 15 Ca 0.21 -2.26 0.00 0.00 1.31 0.00 0.00 55.95 55.21 2jwy s SER 15 Cb -0.12 -1.89 0.00 0.00 0.21 0.00 0.00 66.02 64.23 2jwy s SER 15 CO 0.12 -0.53 0.00 0.35 0.41 0.00 0.00 173.24 173.59 2jwy n THR 16 N 4.33 0.00 -1.87 1.44 -2.24 -1.26 -5.11 114.28 109.56 2jwy n THR 16 Ca -0.00 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 2jwy n THR 16 Cb 0.40 -1.41 0.18 0.00 -2.10 0.00 0.00 70.33 67.40 2jwy n THR 16 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2jwy s LEU 17 N 0.00 2.56 -1.05 3.22 1.43 -1.26 -4.91 118.68 118.66 2jwy s LEU 17 Ca 0.00 0.36 -0.23 0.00 -1.03 0.00 0.00 54.13 53.22 2jwy s LEU 17 Cb 0.00 -2.43 -0.13 0.00 0.03 0.00 0.00 46.19 43.65 2jwy s LEU 17 CO 0.00 -2.72 1.94 -0.46 0.23 0.00 0.00 176.35 175.34 2jwy n ASN 18 N -3.78 2.67 -4.93 2.29 0.23 -1.26 -4.92 115.26 105.56 2jwy n ASN 18 Ca 0.14 -2.66 -0.25 0.00 -0.53 0.00 0.00 54.58 51.28 2jwy n ASN 18 Cb 0.60 -1.58 0.01 0.00 -2.08 0.00 0.00 39.78 36.72 2jwy n ASN 18 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 2jwy s GLN 19 N 6.52 3.21 -0.88 -3.83 -1.52 -1.26 -5.01 119.66 116.88 2jwy s GLN 19 Ca 0.68 -0.15 -0.25 0.00 -1.95 0.00 0.00 55.36 53.69 2jwy s GLN 19 Cb 0.02 -2.44 0.04 0.00 -0.22 0.00 0.00 33.01 30.40 2jwy s GLN 19 CO 0.15 -0.32 1.39 -2.00 -0.25 0.00 0.00 175.29 174.26 2jwy s GLU 20 N -4.70 3.37 0.34 2.91 2.12 -1.26 -4.89 118.70 116.60 2jwy s GLU 20 Ca 0.49 -0.68 0.07 0.00 0.36 0.00 0.00 54.97 55.21 2jwy s GLU 20 Cb -0.10 -4.80 -0.01 0.00 0.26 0.00 0.00 34.13 29.47 2jwy s GLU 20 CO 0.42 -2.21 0.43 -1.64 -0.54 0.00 0.00 175.26 171.71 2jwy s MET 21 N 5.39 3.00 0.26 4.30 -1.94 -1.26 -5.02 119.30 124.03 2jwy s MET 21 Ca 0.42 -1.10 -0.05 0.00 -1.71 0.00 0.00 55.69 53.25 2jwy s MET 21 Cb -0.04 -2.72 0.31 0.00 2.01 0.00 0.00 34.83 34.39 2jwy s MET 21 CO 0.02 0.05 1.90 1.79 -0.01 0.00 0.00 175.02 178.77 2jwy h THR 22 N 0.97 1.24 -3.24 2.05 1.35 -2.08 -3.43 112.91 109.77 2jwy h THR 22 Ca -0.45 -0.55 -0.64 0.00 -0.55 0.00 0.00 66.41 64.22 2jwy h THR 22 Cb 1.26 0.04 -0.12 0.00 -1.73 0.00 0.00 68.15 67.60 2jwy h THR 22 CO 0.54 0.26 -0.66 0.00 -0.25 0.00 0.00 175.52 175.41 2jwy s GLN 23 N -5.86 2.52 0.36 4.72 -2.07 -1.26 -5.10 119.66 112.98 2jwy s GLN 23 Ca -0.12 -0.89 -0.28 0.00 -1.82 0.00 0.00 55.36 52.25 2jwy s GLN 23 Cb 0.17 -2.50 -0.10 0.00 -1.09 0.00 0.00 33.01 29.49 2jwy s GLN 23 CO 0.81 0.52 1.30 -1.17 -1.32 0.00 0.00 175.29 175.44 2jwy s LEU 24 N -2.46 4.34 0.17 2.60 2.96 -1.26 -4.94 118.68 120.09 2jwy s LEU 24 Ca 0.26 2.67 -0.32 0.00 -0.22 0.00 0.00 54.13 56.52 2jwy s LEU 24 Cb -0.11 -3.75 -0.11 0.00 0.50 0.00 0.00 46.19 42.72 2jwy s LEU 24 CO 0.18 -0.65 1.77 0.20 -1.32 0.00 0.00 176.35 176.53 2jwy s ASN 25 N -0.59 6.40 0.49 3.68 0.01 -1.26 -4.87 114.94 118.79 2jwy s ASN 25 Ca 0.52 2.82 0.14 0.00 -0.71 0.00 0.00 52.86 55.63 2jwy s ASN 25 Cb -0.39 -2.59 1.14 0.00 0.41 0.00 0.00 41.25 39.83 2jwy s ASN 25 CO 0.51 -0.98 2.10 1.56 -1.51 0.00 0.00 177.10 178.78 2jwy h GLN 26 N 7.57 0.10 -0.35 -0.60 1.08 -1.99 0.11 115.11 121.03 2jwy h GLN 26 Ca -0.44 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 56.77 2jwy h GLN 26 Cb 1.21 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 28.59 2jwy h GLN 26 CO 0.95 0.10 0.18 1.49 -0.95 0.00 0.00 178.83 180.61 2jwy h GLU 27 N 0.10 0.36 -0.07 1.46 4.81 -1.90 -1.21 114.58 118.14 2jwy h GLU 27 Ca 0.03 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 2jwy h GLU 27 Cb 0.05 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2jwy h GLU 27 CO -0.00 0.24 -0.27 1.15 -0.73 0.00 0.00 179.01 179.40 2jwy h THR 28 N 0.37 1.22 -0.37 0.32 2.02 -1.22 -2.12 112.91 113.13 2jwy h THR 28 Ca 0.14 -1.04 -0.03 0.00 0.77 0.00 0.00 66.41 66.25 2jwy h THR 28 Cb 0.04 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 2jwy h THR 28 CO -0.09 0.31 0.13 0.58 0.37 0.00 0.00 175.52 176.82 2jwy h VAL 29 N 0.11 1.21 -0.31 3.16 2.07 -0.63 -0.71 116.25 121.13 2jwy h VAL 29 Ca 0.02 -0.66 0.04 0.00 0.82 0.00 0.00 66.70 66.92 2jwy h VAL 29 Cb 0.53 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 2jwy h VAL 29 CO 0.04 0.23 0.07 0.11 0.02 0.00 0.00 177.57 178.04 2jwy h LYS 30 N 0.46 0.18 -0.11 1.57 1.79 -0.82 0.13 116.57 119.77 2jwy h LYS 30 Ca 0.12 -0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.61 2jwy h LYS 30 Cb 0.24 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.81 2jwy h LYS 30 CO -0.01 0.12 -0.11 0.82 -1.08 0.00 0.00 179.45 179.20 2jwy h ILE 31 N 0.19 0.69 -0.58 1.86 2.04 -1.24 0.15 117.51 120.62 2jwy h ILE 31 Ca 0.15 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.04 2jwy h ILE 31 Cb 0.15 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 2jwy h ILE 31 CO -0.18 0.00 0.34 0.74 0.00 0.00 0.00 178.15 179.05 2jwy h THR 32 N -0.13 1.05 -0.59 -0.27 2.02 -0.84 -2.00 112.91 112.15 2jwy h THR 32 Ca 0.08 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 67.03 2jwy h THR 32 Cb 0.25 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 66.94 2jwy h THR 32 CO -0.19 0.12 0.37 -0.61 0.37 0.00 0.00 175.52 175.59 2jwy h GLN 33 N 0.67 0.78 -0.09 6.66 4.15 -0.66 -2.49 115.11 124.14 2jwy h GLN 33 Ca 0.24 -0.06 0.03 0.00 0.77 0.00 0.00 58.65 59.63 2jwy h GLN 33 Cb 0.05 -0.17 -0.03 0.00 0.21 0.00 0.00 27.48 27.54 2jwy h GLN 33 CO -0.11 0.54 -0.08 0.37 -1.93 0.00 0.00 178.83 177.61 2jwy h GLN 34 N 0.79 -0.10 -0.66 1.69 4.15 -0.47 -1.07 115.11 119.45 2jwy h GLN 34 Ca 0.21 0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.68 2jwy h GLN 34 Cb -0.06 0.02 -0.05 0.00 0.21 0.00 0.00 27.48 27.61 2jwy h GLN 34 CO -0.04 -0.06 0.40 -0.91 -1.93 0.00 0.00 178.83 176.28 2jwy h ASN 35 N -0.10 0.64 -0.14 -0.69 2.35 -1.26 0.24 115.58 116.62 2jwy h ASN 35 Ca 0.06 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 2jwy h ASN 35 Cb 0.19 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 2jwy h ASN 35 CO -0.15 0.43 0.05 0.03 -1.65 0.00 0.00 177.43 176.15 2jwy h ARG 36 N 0.77 0.21 -0.31 0.81 3.08 -1.16 -0.34 114.38 117.44 2jwy h ARG 36 Ca 0.27 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.24 2jwy h ARG 36 Cb 0.07 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 2jwy h ARG 36 CO -0.13 0.32 0.02 -0.07 -1.07 0.00 0.00 179.97 179.05 2jwy h LEU 37 N 0.05 0.42 -0.67 3.04 3.38 -0.98 -0.30 115.31 120.26 2jwy h LEU 37 Ca 0.05 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2jwy h LEU 37 Cb 0.20 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 2jwy h LEU 37 CO -0.00 0.47 0.24 -1.13 0.09 0.00 0.00 178.44 178.11 2jwy h ASN 38 N 0.45 0.94 0.51 -0.43 -0.73 -0.10 0.12 115.58 116.34 2jwy h ASN 38 Ca 0.10 -0.19 -0.14 0.00 1.87 0.00 0.00 56.30 57.94 2jwy h ASN 38 Cb 0.26 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 38.59 2jwy h ASN 38 CO 0.00 0.88 -0.64 0.00 -0.37 0.00 0.00 177.43 177.30 2jwy h ALA 39 N 1.10 0.87 -0.00 1.57 0.00 -0.63 -2.92 119.26 119.25 2jwy h ALA 39 Ca 0.22 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2jwy h ALA 39 Cb 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2jwy h ALA 39 CO -0.01 0.77 -0.09 1.63 0.00 0.00 0.00 179.25 181.55 2jwy n LYS 40 N -3.82 0.23 -1.64 0.00 5.02 -0.16 -4.90 118.16 112.89 2jwy n LYS 40 Ca -0.02 -0.04 -0.47 0.00 -2.02 0.00 0.00 58.31 55.76 2jwy n LYS 40 Cb 0.64 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 34.10 2jwy n LYS 40 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2jwy n SER 41 N -1.35 3.39 -0.01 4.39 2.88 0.39 -4.88 113.62 118.43 2jwy n SER 41 Ca 0.10 0.80 -0.10 0.00 -1.33 0.00 0.00 58.87 58.33 2jwy n SER 41 Cb 0.30 -1.41 0.04 0.00 -0.75 0.00 0.00 64.21 62.40 2jwy n SER 41 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2jwy h SER 42 N 10.58 0.68 -2.63 -3.46 0.87 -1.90 -3.44 113.55 114.25 2jwy h SER 42 Ca -0.45 -0.36 -0.10 0.00 -1.23 0.00 0.00 61.79 59.64 2jwy h SER 42 Cb 1.27 -0.20 -0.27 0.00 -0.44 0.00 0.00 62.40 62.76 2jwy h SER 42 CO 0.96 1.09 -0.36 -0.44 -0.53 0.00 0.00 176.83 177.54 2jwy s SER 43 N -6.92 -0.28 0.00 6.23 0.01 -1.26 -5.12 113.70 106.36 2jwy s SER 43 Ca -0.08 0.97 0.00 0.00 1.31 0.00 0.00 55.95 58.15 2jwy s SER 43 Cb 0.11 1.25 0.00 0.00 0.21 0.00 0.00 66.02 67.59 2jwy s SER 43 CO 0.85 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.88 2jwy n GLY 44 N 5.22 -0.74 3.04 3.44 0.00 -1.26 -4.82 105.19 110.06 2jwy n GLY 44 Ca -0.11 -1.60 -0.13 0.00 0.00 0.00 0.00 46.02 44.18 2jwy n GLY 44 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jwy s VAL 45 N 0.00 0.49 -0.16 1.61 -7.23 -0.57 -4.88 120.40 109.66 2jwy s VAL 45 Ca 0.00 -0.96 -0.14 0.00 -1.81 0.00 0.00 61.98 59.07 2jwy s VAL 45 Cb 0.00 -0.55 -0.05 0.00 0.56 0.00 0.00 36.38 36.34 2jwy s VAL 45 CO 0.00 -0.33 0.30 -0.31 -0.31 0.00 0.00 175.10 174.45 2jwy s TYR 46 N -1.23 3.46 0.03 2.82 1.51 -1.26 -0.61 117.35 122.07 2jwy s TYR 46 Ca -0.09 0.61 0.07 0.00 -1.01 0.00 0.00 57.07 56.65 2jwy s TYR 46 Cb -0.09 -2.35 -0.02 0.00 -0.11 0.00 0.00 41.96 39.38 2jwy s TYR 46 CO 0.00 0.23 -0.20 -0.51 -1.11 0.00 0.00 175.55 173.97 2jwy s LEU 47 N 0.47 2.14 -0.08 -1.29 1.43 0.46 -4.63 118.68 117.19 2jwy s LEU 47 Ca 0.17 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 2jwy s LEU 47 Cb -0.13 -0.96 -0.02 0.00 0.03 0.00 0.00 46.19 45.11 2jwy s LEU 47 CO 0.04 0.17 -0.14 -0.76 0.23 0.00 0.00 176.35 175.89 2jwy s LEU 48 N -1.02 2.73 0.26 1.79 1.43 -1.26 -0.04 118.68 122.57 2jwy s LEU 48 Ca 0.07 -0.24 0.19 0.00 -1.03 0.00 0.00 54.13 53.11 2jwy s LEU 48 Cb -0.08 -1.57 0.97 0.00 0.03 0.00 0.00 46.19 45.53 2jwy s LEU 48 CO 0.01 0.28 1.57 -2.65 0.23 0.00 0.00 176.35 175.79 2jwy n PRO 49 N 2.75 0.12 -0.09 1.29 -0.02 -1.26 -1.32 135.00 136.47 2jwy n PRO 49 Ca -0.18 0.58 0.05 0.00 -2.02 0.00 0.00 63.50 61.93 2jwy n PRO 49 Cb 0.52 -1.87 0.09 0.00 -0.02 0.00 0.00 33.50 32.22 2jwy n PRO 49 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jwy n GLY 50 N -1.13 1.61 3.20 -1.23 0.00 -1.26 -4.92 105.19 101.46 2jwy n GLY 50 Ca -0.01 -0.29 -0.38 0.00 0.00 0.00 0.00 46.02 45.34 2jwy n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jwy s ALA 51 N -0.92 3.20 -1.60 4.61 0.00 -0.43 -4.68 121.76 121.94 2jwy s ALA 51 Ca 0.16 -2.29 -0.10 0.00 0.00 0.00 0.00 51.96 49.73 2jwy s ALA 51 Cb 0.09 -2.51 -0.07 0.00 0.00 0.00 0.00 23.12 20.63 2jwy s ALA 51 CO 0.12 -1.69 2.89 1.17 0.00 0.00 0.00 175.76 178.25 2jwy n LYS 52 N 4.77 3.72 -3.84 0.00 4.81 -1.26 -4.66 118.16 121.69 2jwy n LYS 52 Ca -0.07 -2.30 -0.11 0.00 -0.87 0.00 0.00 58.31 54.95 2jwy n LYS 52 Cb 0.42 -2.82 -0.09 0.00 0.02 0.00 0.00 35.03 32.56 2jwy n LYS 52 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2jwy s THR 53 N 2.02 0.08 0.79 3.15 -4.23 -1.26 -5.09 115.64 111.10 2jwy s THR 53 Ca 0.68 -0.68 -0.11 0.00 -1.18 0.00 0.00 61.69 60.40 2jwy s THR 53 Cb 0.18 -0.54 0.09 0.00 1.34 0.00 0.00 72.50 73.56 2jwy s THR 53 CO -0.06 -0.37 1.14 -2.16 -0.54 0.00 0.00 174.62 172.63 2jwy s PRO 54 N -1.54 1.90 0.05 3.99 0.04 -1.26 -4.58 135.00 133.60 2jwy s PRO 54 Ca -0.13 -0.06 -0.05 0.00 0.04 0.00 0.00 61.00 60.80 2jwy s PRO 54 Cb -0.06 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.45 2jwy s PRO 54 CO 0.01 -1.57 0.08 0.00 0.04 0.00 0.00 177.00 175.56 2jwy s ALA 55 N -3.51 0.05 -0.22 8.56 0.00 0.50 -4.99 121.76 122.16 2jwy s ALA 55 Ca 0.63 -0.73 -0.03 0.00 0.00 0.00 0.00 51.96 51.83 2jwy s ALA 55 Cb -0.10 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.32 2jwy s ALA 55 CO 0.48 -0.37 -0.07 0.50 0.00 0.00 0.00 175.76 176.31 2jwy s ARG 56 N -3.16 3.25 -0.15 0.00 3.52 -1.26 -0.45 118.95 120.70 2jwy s ARG 56 Ca -0.00 -0.70 0.00 0.00 -0.13 0.00 0.00 55.73 54.90 2jwy s ARG 56 Cb 0.02 -2.94 -0.00 0.00 -1.56 0.00 0.00 34.95 30.47 2jwy s ARG 56 CO -0.07 -0.23 -0.15 -1.17 -0.81 0.00 0.00 175.30 172.87 2jwy s LEU 57 N 1.43 2.52 -0.49 -0.88 2.96 0.74 -4.95 118.68 120.01 2jwy s LEU 57 Ca 0.05 -0.45 -0.24 0.00 -0.22 0.00 0.00 54.13 53.27 2jwy s LEU 57 Cb -0.14 -1.57 0.03 0.00 0.50 0.00 0.00 46.19 45.01 2jwy s LEU 57 CO -0.05 0.10 0.88 -0.70 -1.32 0.00 0.00 176.35 175.26 2jwy s GLU 58 N 0.74 3.41 0.42 1.98 2.12 -1.26 -0.60 118.70 125.51 2jwy s GLU 58 Ca -0.06 -0.10 0.03 0.00 0.36 0.00 0.00 54.97 55.19 2jwy s GLU 58 Cb -0.15 -3.98 0.03 0.00 0.26 0.00 0.00 34.13 30.28 2jwy s GLU 58 CO 0.01 -1.29 0.22 -1.13 -0.54 0.00 0.00 175.26 172.53 2jwy n SER 59 N 7.12 2.59 0.29 -1.70 3.41 -0.00 -4.92 113.62 120.40 2jwy n SER 59 Ca 0.03 -2.55 0.19 0.00 -0.26 0.00 0.00 58.87 56.28 2jwy n SER 59 Cb 0.48 0.07 0.81 0.00 -0.26 0.00 0.00 64.21 65.31 2jwy n SER 59 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2jwy h GLN 60 N 0.00 0.00 -0.01 4.33 4.20 -1.93 -1.45 115.11 120.25 2jwy h GLN 60 Ca -0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.42 2jwy h GLN 60 Cb 0.99 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.77 2jwy h GLN 60 CO 0.46 0.00 -0.50 0.44 -0.67 0.00 0.00 178.83 178.56 2jwy n ILE 61 N -3.06 0.00 0.00 2.54 -5.35 -1.26 -4.89 119.36 107.34 2jwy n ILE 61 Ca -0.00 -0.13 0.00 0.00 -0.27 0.00 0.00 62.75 62.35 2jwy n ILE 61 Cb 0.24 0.77 0.00 0.00 -1.74 0.00 0.00 39.64 38.91 2jwy n ILE 61 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jwy n GLY 62 N 1.42 0.90 3.72 3.28 0.00 -0.55 -4.97 105.19 108.99 2jwy n GLY 62 Ca 0.09 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 2jwy n GLY 62 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jwy s THR 63 N -0.98 4.71 0.28 2.61 2.01 -1.26 -0.82 115.64 122.19 2jwy s THR 63 Ca 0.00 2.05 0.00 0.00 0.31 0.00 0.00 61.69 64.05 2jwy s THR 63 Cb 0.00 -4.31 -0.02 0.00 0.01 0.00 0.00 72.50 68.18 2jwy s THR 63 CO 0.00 0.22 0.29 -1.48 -0.69 0.00 0.00 174.62 172.96 2jwy s LEU 64 N 0.64 1.25 -0.13 4.42 0.05 0.24 -0.77 118.68 124.38 2jwy s LEU 64 Ca 0.50 -1.50 0.01 0.00 0.05 0.00 0.00 54.13 53.20 2jwy s LEU 64 Cb -0.22 0.82 0.02 0.00 -2.05 0.00 0.00 46.19 44.76 2jwy s LEU 64 CO 0.29 -1.05 -0.16 -0.60 -0.55 0.00 0.00 176.35 174.28 2jwy s ARG 65 N -3.64 2.34 0.22 1.48 3.52 0.17 -0.19 118.95 122.85 2jwy s ARG 65 Ca 0.36 -0.59 0.11 0.00 -0.13 0.00 0.00 55.73 55.47 2jwy s ARG 65 Cb 0.03 -2.03 -0.04 0.00 -1.56 0.00 0.00 34.95 31.34 2jwy s ARG 65 CO 0.19 -0.12 -0.17 -1.64 -0.81 0.00 0.00 175.30 172.75 2jwy s MET 66 N 1.15 1.76 0.28 5.12 -1.94 0.40 -0.66 119.30 125.42 2jwy s MET 66 Ca -0.02 -1.51 -0.20 0.00 -1.71 0.00 0.00 55.69 52.25 2jwy s MET 66 Cb -0.14 -1.93 0.02 0.00 2.01 0.00 0.00 34.83 34.78 2jwy s MET 66 CO -0.05 0.39 0.69 0.45 -0.01 0.00 0.00 175.02 176.49 2jwy s SER 67 N -3.00 -0.22 -0.32 3.03 0.15 -0.47 -0.37 113.70 112.50 2jwy s SER 67 Ca 0.25 -0.69 -0.00 0.00 0.70 0.00 0.00 55.95 56.21 2jwy s SER 67 Cb -0.07 0.72 0.07 0.00 -1.71 0.00 0.00 66.02 65.03 2jwy s SER 67 CO 0.13 -1.34 0.03 -0.76 1.20 0.00 0.00 173.24 172.51 2jwy s LEU 68 N -2.94 4.25 0.30 3.45 1.43 -1.26 -1.27 118.68 122.63 2jwy s LEU 68 Ca 0.13 -1.61 0.09 0.00 -1.03 0.00 0.00 54.13 51.71 2jwy s LEU 68 Cb -0.05 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 2jwy s LEU 68 CO 0.08 -0.33 0.03 0.68 0.23 0.00 0.00 176.35 177.04 2jwy s VAL 69 N 1.14 3.17 -1.41 -1.59 -7.23 -0.41 -4.75 120.40 109.32 2jwy s VAL 69 Ca -0.00 -1.88 -0.01 0.00 -1.81 0.00 0.00 61.98 58.28 2jwy s VAL 69 Cb -0.20 -2.86 0.00 0.00 0.56 0.00 0.00 36.38 33.88 2jwy s VAL 69 CO -0.04 -0.29 0.12 0.59 -0.31 0.00 0.00 175.10 175.16 2jwy n ASN 70 N -0.97 -5.08 -4.57 4.85 3.02 -1.26 0.14 115.26 111.39 2jwy n ASN 70 Ca -0.05 -0.07 -0.41 0.00 -0.03 0.00 0.00 54.58 54.03 2jwy n ASN 70 Cb 0.60 -4.11 -0.03 0.00 -0.61 0.00 0.00 39.78 35.63 2jwy n ASN 70 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2jwy s ILE 71 N -2.90 3.59 0.04 2.41 1.01 -1.26 -4.24 121.20 119.86 2jwy s ILE 71 Ca 0.06 0.48 0.01 0.00 0.00 0.00 0.00 60.65 61.19 2jwy s ILE 71 Cb -0.03 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.24 2jwy s ILE 71 CO 0.07 -1.00 -0.05 0.42 0.00 0.00 0.00 174.94 174.38 2jwy s THR 72 N 7.15 0.38 1.10 2.92 -4.23 -0.15 -5.01 115.64 117.80 2jwy s THR 72 Ca 0.61 -1.22 -0.13 0.00 -1.18 0.00 0.00 61.69 59.77 2jwy s THR 72 Cb -0.13 -0.74 0.25 0.00 1.34 0.00 0.00 72.50 73.22 2jwy s THR 72 CO 0.24 -0.56 1.05 -2.16 -0.54 0.00 0.00 174.62 172.66 2jwy s PRO 73 N -2.11 -0.39 0.22 3.99 0.04 -1.26 -0.30 135.00 135.20 2jwy s PRO 73 Ca -0.07 0.76 -0.04 0.00 0.04 0.00 0.00 61.00 61.69 2jwy s PRO 73 Cb -0.06 -1.62 -0.03 0.00 0.04 0.00 0.00 34.50 32.83 2jwy s PRO 73 CO -0.02 -3.35 0.25 0.34 0.04 0.00 0.00 177.00 174.27 2jwy s ASP 74 N -2.85 0.15 0.15 6.66 2.15 0.11 -4.39 116.67 118.65 2jwy s ASP 74 Ca 0.67 -1.26 -0.16 0.00 0.43 0.00 0.00 52.55 52.23 2jwy s ASP 74 Cb -0.23 0.46 0.01 0.00 -0.30 0.00 0.00 42.92 42.86 2jwy s ASP 74 CO 0.62 -0.95 1.74 0.00 -0.17 0.00 0.00 175.17 176.41 2jwy h ALA 75 N 2.48 0.54 0.09 3.66 0.00 -1.98 -3.19 119.26 120.86 2jwy h ALA 75 Ca -0.32 -0.09 -0.29 0.00 0.00 0.00 0.00 54.91 54.20 2jwy h ALA 75 Cb 1.25 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2jwy h ALA 75 CO 0.47 0.08 -1.46 -0.44 0.00 0.00 0.00 179.25 177.90 2jwy h ASP 76 N 0.55 0.29 0.00 0.00 5.19 -1.97 -3.49 116.42 116.98 2jwy h ASP 76 Ca 0.15 -0.40 0.00 0.00 -0.62 0.00 0.00 57.03 56.16 2jwy h ASP 76 Cb 0.08 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.49 2jwy h ASP 76 CO -0.02 1.33 0.00 0.61 -3.12 0.00 0.00 179.24 178.04 2jwy n GLY 77 N 1.60 -0.91 3.04 2.75 0.00 -1.21 -0.21 105.19 110.25 2jwy n GLY 77 Ca -0.14 0.63 -0.13 0.00 0.00 0.00 0.00 46.02 46.39 2jwy n GLY 77 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jwy s THR 78 N 1.08 -0.04 -0.09 2.61 2.01 0.49 0.05 115.64 121.76 2jwy s THR 78 Ca 0.00 0.13 -0.01 0.00 0.31 0.00 0.00 61.69 62.13 2jwy s THR 78 Cb 0.00 -0.35 -0.03 0.00 0.01 0.00 0.00 72.50 72.13 2jwy s THR 78 CO 0.00 0.05 -0.05 0.42 -0.69 0.00 0.00 174.62 174.35 2jwy s THR 79 N 1.10 3.85 0.35 -0.82 -4.23 0.59 -0.15 115.64 116.34 2jwy s THR 79 Ca -0.08 -0.41 -0.03 0.00 -1.18 0.00 0.00 61.69 59.99 2jwy s THR 79 Cb -0.09 -2.60 0.01 0.00 1.34 0.00 0.00 72.50 71.15 2jwy s THR 79 CO -0.07 0.58 0.51 0.00 -0.54 0.00 0.00 174.62 175.09 2jwy n LEU 80 N 2.50 0.00 -4.02 4.79 -0.00 -0.33 -0.97 117.00 118.97 2jwy n LEU 80 Ca -0.18 -2.82 -0.30 0.00 -0.00 0.00 0.00 56.01 52.70 2jwy n LEU 80 Cb 0.53 2.62 -0.16 0.00 -0.00 0.00 0.00 43.42 46.41 2jwy n LEU 80 CO 0.28 -0.67 -0.48 -0.89 -0.00 0.00 0.00 177.39 175.64 2jwy s THR 81 N -2.77 1.63 -0.39 1.47 2.01 0.12 0.19 115.64 117.91 2jwy s THR 81 Ca 0.28 -0.81 -0.27 0.00 0.31 0.00 0.00 61.69 61.21 2jwy s THR 81 Cb -0.01 -1.60 0.02 0.00 0.01 0.00 0.00 72.50 70.92 2jwy s THR 81 CO 0.20 0.34 0.97 -0.22 -0.69 0.00 0.00 174.62 175.22 2jwy s LEU 82 N 1.44 3.94 -0.09 4.42 1.98 0.13 -1.29 118.68 129.21 2jwy s LEU 82 Ca 0.02 0.57 -0.12 0.00 -2.89 0.00 0.00 54.13 51.71 2jwy s LEU 82 Cb -0.14 -3.32 -0.05 0.00 0.66 0.00 0.00 46.19 43.34 2jwy s LEU 82 CO -0.10 -0.93 0.29 -0.13 -1.89 0.00 0.00 176.35 173.59 2jwy s ARG 83 N 3.65 3.89 -0.04 1.98 0.52 -0.40 -0.83 118.95 127.73 2jwy s ARG 83 Ca 0.40 0.14 0.02 0.00 -0.52 0.00 0.00 55.73 55.77 2jwy s ARG 83 Cb -0.11 -3.28 0.01 0.00 0.52 0.00 0.00 34.95 32.08 2jwy s ARG 83 CO 0.21 0.56 -0.09 0.42 0.02 0.00 0.00 175.30 176.42 2jwy s ILE 84 N -0.53 0.84 -0.06 1.52 1.01 0.11 -1.36 121.20 122.72 2jwy s ILE 84 Ca 0.19 -0.36 -0.03 0.00 0.00 0.00 0.00 60.65 60.45 2jwy s ILE 84 Cb -0.14 -0.76 0.04 0.00 0.01 0.00 0.00 42.46 41.61 2jwy s ILE 84 CO 0.07 0.27 0.12 -1.58 0.00 0.00 0.00 174.94 173.83 2jwy s GLN 85 N 0.36 0.03 0.39 2.79 0.74 0.17 0.02 119.66 124.16 2jwy s GLN 85 Ca -0.06 0.42 -0.24 0.00 0.05 0.00 0.00 55.36 55.53 2jwy s GLN 85 Cb -0.11 -0.27 -0.09 0.00 1.10 0.00 0.00 33.01 33.64 2jwy s GLN 85 CO 0.01 -0.24 1.04 0.20 -0.55 0.00 0.00 175.29 175.74 2jwy s GLY 86 N 1.73 2.72 0.27 2.59 0.00 -0.72 0.43 107.32 114.34 2jwy s GLY 86 Ca -0.02 0.67 -0.04 0.00 0.00 0.00 0.00 44.72 45.33 2jwy s GLY 86 CO -0.05 1.09 1.93 -2.09 0.00 0.00 0.00 173.10 173.98 2jwy h GLU 87 N 2.52 1.22 -5.20 2.90 4.57 -1.28 -3.35 114.58 115.96 2jwy h GLU 87 Ca -0.48 -0.07 -0.66 0.00 -1.18 0.00 0.00 59.36 56.96 2jwy h GLU 87 Cb 1.21 -0.28 -0.16 0.00 -0.16 0.00 0.00 28.75 29.37 2jwy h GLU 87 CO 0.62 0.81 -0.03 -1.12 -1.18 0.00 0.00 179.01 178.11 2jwy s SER 88 N -6.12 6.29 0.00 1.04 0.01 -1.26 -4.95 113.70 108.71 2jwy s SER 88 Ca -0.12 -0.28 0.06 0.00 1.31 0.00 0.00 55.95 56.92 2jwy s SER 88 Cb 0.18 -2.27 0.30 0.00 0.21 0.00 0.00 66.02 64.44 2jwy s SER 88 CO 0.81 -0.60 1.13 -0.46 0.41 0.00 0.00 173.24 174.53 2jwy n ASN 89 N 5.88 0.00 -4.73 2.44 0.23 -1.26 -4.70 115.26 113.11 2jwy n ASN 89 Ca -0.04 0.34 -0.33 0.00 -0.53 0.00 0.00 54.58 54.01 2jwy n ASN 89 Cb 0.48 -0.39 0.10 0.00 -2.08 0.00 0.00 39.78 37.89 2jwy n ASN 89 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2jwy s ASP 90 N -2.77 4.23 -0.10 0.53 1.11 -1.26 -0.79 116.67 117.62 2jwy s ASP 90 Ca 0.05 2.16 -0.37 0.00 0.18 0.00 0.00 52.55 54.56 2jwy s ASP 90 Cb 0.04 -2.57 -0.15 0.00 1.07 0.00 0.00 42.92 41.32 2jwy s ASP 90 CO 0.11 -2.23 1.68 -0.81 1.18 0.00 0.00 175.17 175.10 2jwy n PRO 91 N -3.04 1.55 -3.92 8.23 -0.04 -1.26 -4.46 135.00 132.06 2jwy n PRO 91 Ca 0.12 0.56 -0.32 0.00 -0.04 0.00 0.00 63.50 63.82 2jwy n PRO 91 Cb 0.51 -2.29 -0.04 0.00 -0.04 0.00 0.00 33.50 31.64 2jwy n PRO 91 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2jwy s LEU 92 N 2.73 4.35 0.99 1.53 1.43 0.76 -4.90 118.68 125.57 2jwy s LEU 92 Ca 0.92 0.30 -0.14 0.00 -1.03 0.00 0.00 54.13 54.17 2jwy s LEU 92 Cb -0.90 -2.77 0.18 0.00 0.03 0.00 0.00 46.19 42.74 2jwy s LEU 92 CO 0.55 0.22 1.15 -2.16 0.23 0.00 0.00 176.35 176.34 2jwy s PRO 93 N -2.21 0.50 0.28 1.29 0.04 -1.26 0.10 135.00 133.74 2jwy s PRO 93 Ca 0.31 0.13 -0.29 0.00 0.04 0.00 0.00 61.00 61.19 2jwy s PRO 93 Cb -0.13 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 32.54 2jwy s PRO 93 CO 0.23 -2.60 1.08 0.00 0.04 0.00 0.00 177.00 175.74 2jwy s ALA 94 N -3.28 3.37 0.12 8.56 0.00 -1.26 -4.12 121.76 125.15 2jwy s ALA 94 Ca 0.67 0.85 -0.08 0.00 0.00 0.00 0.00 51.96 53.40 2jwy s ALA 94 Cb -0.12 -3.31 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 2jwy s ALA 94 CO 0.54 -0.12 0.20 -0.59 0.00 0.00 0.00 175.76 175.80 2jwy s PHE 95 N -1.20 0.31 0.01 0.00 -0.71 -0.93 -1.25 117.98 114.21 2jwy s PHE 95 Ca 0.45 -0.72 -0.10 0.00 -1.04 0.00 0.00 56.93 55.52 2jwy s PHE 95 Cb -0.30 -0.10 0.01 0.00 -1.21 0.00 0.00 43.02 41.41 2jwy s PHE 95 CO 0.39 -0.60 0.21 -1.12 -1.34 0.00 0.00 175.22 172.76 2jwy s SER 96 N -2.92 -0.04 0.25 1.98 0.01 -0.06 -0.93 113.70 112.00 2jwy s SER 96 Ca 0.11 -0.17 -0.11 0.00 1.31 0.00 0.00 55.95 57.09 2jwy s SER 96 Cb 0.05 0.27 -0.01 0.00 0.21 0.00 0.00 66.02 66.53 2jwy s SER 96 CO -0.06 -0.46 0.44 -0.83 0.41 0.00 0.00 173.24 172.74 2jwy s GLY 97 N -1.60 0.70 -0.16 3.44 0.00 -0.54 -0.69 107.32 108.48 2jwy s GLY 97 Ca -0.11 -1.02 -0.06 0.00 0.00 0.00 0.00 44.72 43.54 2jwy s GLY 97 CO 0.01 -0.74 0.03 -1.59 0.00 0.00 0.00 173.10 170.81 2jwy s THR 98 N -3.96 4.53 -0.14 0.90 2.01 0.88 -0.30 115.64 119.56 2jwy s THR 98 Ca 0.25 -0.13 -0.02 0.00 0.31 0.00 0.00 61.69 62.09 2jwy s THR 98 Cb 0.00 -3.01 -0.02 0.00 0.01 0.00 0.00 72.50 69.48 2jwy s THR 98 CO 0.10 0.50 -0.07 0.68 -0.69 0.00 0.00 174.62 175.14 2jwy s VAL 99 N 0.09 3.61 -0.39 3.82 -7.23 0.60 -1.30 120.40 119.61 2jwy s VAL 99 Ca 0.03 -0.46 -0.16 0.00 -1.81 0.00 0.00 61.98 59.58 2jwy s VAL 99 Cb -0.13 -2.56 0.01 0.00 0.56 0.00 0.00 36.38 34.26 2jwy s VAL 99 CO 0.01 0.51 0.37 -1.61 -0.31 0.00 0.00 175.10 174.07 2jwy s GLU 100 N 0.30 3.23 -0.15 4.82 0.41 0.33 -1.92 118.70 125.72 2jwy s GLU 100 Ca -0.06 -0.71 0.01 0.00 -0.41 0.00 0.00 54.97 53.80 2jwy s GLU 100 Cb -0.15 -3.91 0.02 0.00 -1.78 0.00 0.00 34.13 28.31 2jwy s GLU 100 CO 0.04 -0.71 -0.17 1.52 -0.49 0.00 0.00 175.26 175.45 2jwy s TYR 101 N 1.97 2.39 0.00 1.61 1.13 -0.31 -0.25 117.35 123.89 2jwy s TYR 101 Ca 0.10 -1.34 0.00 0.00 -1.41 0.00 0.00 57.07 54.42 2jwy s TYR 101 Cb -0.17 -1.70 0.00 0.00 -1.10 0.00 0.00 41.96 38.98 2jwy s TYR 101 CO 0.12 -0.69 0.00 0.41 -2.51 0.00 0.00 175.55 172.88 2jwy n GLY 102 N 4.61 3.21 3.35 5.49 0.00 -1.03 -0.81 105.19 120.01 2jwy n GLY 102 Ca -0.19 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.21 2jwy n GLY 102 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jwy s GLN 103 N 2.24 1.33 -0.16 1.61 -0.21 0.38 -0.24 119.66 124.61 2jwy s GLN 103 Ca 0.00 -1.50 0.01 0.00 0.02 0.00 0.00 55.36 53.89 2jwy s GLN 103 Cb 0.00 -1.30 0.02 0.00 1.00 0.00 0.00 33.01 32.72 2jwy s GLN 103 CO 0.00 0.25 -0.19 0.42 -2.12 0.00 0.00 175.29 173.65 2jwy s ILE 104 N -2.39 1.91 -1.79 1.08 1.01 -1.26 -0.66 121.20 119.10 2jwy s ILE 104 Ca 0.19 -0.86 0.17 0.00 0.00 0.00 0.00 60.65 60.16 2jwy s ILE 104 Cb -0.04 -1.73 0.35 0.00 0.01 0.00 0.00 42.46 41.05 2jwy s ILE 104 CO 0.07 0.52 1.27 0.00 0.00 0.00 0.00 174.94 176.80 2jwy n GLN 105 N 4.54 2.27 -3.70 2.79 10.64 -1.01 -4.97 117.38 127.93 2jwy n GLN 105 Ca -0.20 -2.05 -0.23 0.00 -1.83 0.00 0.00 57.00 52.68 2jwy n GLN 105 Cb 0.50 -1.40 -0.02 0.00 -0.86 0.00 0.00 30.24 28.47 2jwy n GLN 105 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2jwy n GLY 106 N 1.08 3.13 3.99 2.61 0.00 -1.26 -4.80 105.19 109.95 2jwy n GLY 106 Ca 0.15 -2.30 -0.25 0.00 0.00 0.00 0.00 46.02 43.63 2jwy n GLY 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jwy s THR 107 N -2.33 2.03 0.31 2.61 -4.23 -0.36 -4.70 115.64 108.97 2jwy s THR 107 Ca 0.16 -0.52 0.18 0.00 -1.18 0.00 0.00 61.69 60.32 2jwy s THR 107 Cb -0.01 -2.51 0.14 0.00 1.34 0.00 0.00 72.50 71.46 2jwy s THR 107 CO 0.10 0.00 1.84 0.40 -0.54 0.00 0.00 174.62 176.42 2jwy h ILE 108 N -0.77 0.99 0.01 2.99 1.08 -2.01 -1.20 117.51 118.60 2jwy h ILE 108 Ca -0.36 -1.24 -0.20 0.00 -0.39 0.00 0.00 64.86 62.67 2jwy h ILE 108 Cb 1.25 1.72 -0.01 0.00 -3.07 0.00 0.00 36.82 36.71 2jwy h ILE 108 CO 0.37 0.32 -0.89 0.44 -0.69 0.00 0.00 178.15 177.70 2jwy h ASP 109 N 0.00 0.21 -1.77 1.72 5.19 -2.03 -3.42 116.42 116.34 2jwy h ASP 109 Ca -0.00 -0.18 -0.31 0.00 -0.62 0.00 0.00 57.03 55.92 2jwy h ASP 109 Cb 0.69 -0.07 -0.29 0.00 0.18 0.00 0.00 39.33 39.85 2jwy h ASP 109 CO 0.04 1.00 -0.64 0.54 -3.12 0.00 0.00 179.24 177.07 2jwy s ASN 110 N -6.91 0.64 -0.31 6.45 4.22 -1.06 -5.13 114.94 112.83 2jwy s ASN 110 Ca -0.02 -1.40 -0.15 0.00 -2.14 0.00 0.00 52.86 49.14 2jwy s ASN 110 Cb 0.10 0.84 -0.02 0.00 1.28 0.00 0.00 41.25 43.45 2jwy s ASN 110 CO 0.83 -0.24 0.38 0.72 -2.04 0.00 0.00 177.10 176.74 2jwy s PHE 111 N 1.54 3.22 -0.42 1.54 -0.71 -0.48 -1.22 117.98 121.45 2jwy s PHE 111 Ca 0.17 0.17 -0.24 0.00 -1.04 0.00 0.00 56.93 55.98 2jwy s PHE 111 Cb -0.13 -2.65 0.02 0.00 -1.21 0.00 0.00 43.02 39.05 2jwy s PHE 111 CO -0.05 -0.36 0.84 -0.65 -1.34 0.00 0.00 175.22 173.67 2jwy s GLN 112 N 2.07 3.61 -0.63 1.99 -0.21 -1.26 -4.85 119.66 120.38 2jwy s GLN 112 Ca 0.14 0.19 -0.27 0.00 0.02 0.00 0.00 55.36 55.43 2jwy s GLN 112 Cb -0.16 -3.88 0.03 0.00 1.00 0.00 0.00 33.01 30.00 2jwy s GLN 112 CO 0.11 -1.04 1.19 -1.21 -2.12 0.00 0.00 175.29 172.22 2jwy s GLU 113 N 3.39 3.39 0.13 2.91 2.02 -1.26 -2.40 118.70 126.88 2jwy s GLU 113 Ca 0.33 0.03 0.08 0.00 0.02 0.00 0.00 54.97 55.43 2jwy s GLU 113 Cb -0.12 -4.07 -0.04 0.00 0.10 0.00 0.00 34.13 30.00 2jwy s GLU 113 CO 0.21 -1.81 -0.10 0.96 0.02 0.00 0.00 175.26 174.55 2jwy s ILE 114 N 5.08 3.31 -1.53 -1.63 -4.36 0.17 -4.69 121.20 117.55 2jwy s ILE 114 Ca 0.39 -1.41 -0.05 0.00 -0.26 0.00 0.00 60.65 59.32 2jwy s ILE 114 Cb -0.08 -2.58 0.01 0.00 1.25 0.00 0.00 42.46 41.06 2jwy s ILE 114 CO 0.21 0.03 0.50 0.59 0.24 0.00 0.00 174.94 176.51 2jwy n ASN 115 N 0.44 -5.71 -4.59 4.36 3.02 -1.26 -0.47 115.26 111.05 2jwy n ASN 115 Ca -0.12 -0.25 -0.41 0.00 -0.03 0.00 0.00 54.58 53.76 2jwy n ASN 115 Cb 0.53 -4.65 -0.07 0.00 -0.61 0.00 0.00 39.78 34.99 2jwy n ASN 115 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2jwy s VAL 116 N -3.11 4.95 0.46 2.41 0.11 -1.26 -4.24 120.40 119.72 2jwy s VAL 116 Ca 0.27 0.73 0.08 0.00 -2.93 0.00 0.00 61.98 60.13 2jwy s VAL 116 Cb -0.13 -3.99 0.03 0.00 -1.53 0.00 0.00 36.38 30.76 2jwy s VAL 116 CO 0.34 -0.16 0.63 -1.10 -3.33 0.00 0.00 175.10 171.47 2jwy s GLN 117 N 2.57 2.70 0.02 1.54 1.11 0.01 -4.87 119.66 122.74 2jwy s GLN 117 Ca 0.24 -1.30 0.05 0.00 0.01 0.00 0.00 55.36 54.35 2jwy s GLN 117 Cb -0.15 -2.72 -0.02 0.00 -1.01 0.00 0.00 33.01 29.11 2jwy s GLN 117 CO 0.12 -0.42 -0.15 0.54 0.01 0.00 0.00 175.29 175.40 2jwy s ASN 118 N -4.42 1.75 -0.01 5.90 4.22 -1.26 -1.16 114.94 119.96 2jwy s ASN 118 Ca 0.57 -0.39 -0.07 0.00 -2.14 0.00 0.00 52.86 50.83 2jwy s ASN 118 Cb -0.09 -0.15 0.00 0.00 1.28 0.00 0.00 41.25 42.30 2jwy s ASN 118 CO 0.35 0.10 0.15 -1.58 -2.04 0.00 0.00 177.10 174.07 2jwy s GLN 119 N -0.84 0.42 -0.19 3.55 0.74 -0.81 -4.95 119.66 117.59 2jwy s GLN 119 Ca 0.04 -0.25 -0.17 0.00 0.05 0.00 0.00 55.36 55.02 2jwy s GLN 119 Cb -0.07 0.18 -0.04 0.00 1.10 0.00 0.00 33.01 34.18 2jwy s GLN 119 CO 0.01 -0.10 0.46 -0.51 -0.55 0.00 0.00 175.29 174.60 2jwy s LEU 120 N -1.05 4.17 -0.27 3.68 1.43 -1.26 -0.29 118.68 125.09 2jwy s LEU 120 Ca -0.11 0.62 -0.10 0.00 -1.03 0.00 0.00 54.13 53.51 2jwy s LEU 120 Cb -0.06 -2.62 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 2jwy s LEU 120 CO 0.01 -0.11 0.15 0.27 0.23 0.00 0.00 176.35 176.90 2jwy s ILE 121 N 1.35 5.00 -0.22 -0.59 -4.36 0.58 -4.94 121.20 118.02 2jwy s ILE 121 Ca 0.22 0.06 -0.06 0.00 -0.26 0.00 0.00 60.65 60.61 2jwy s ILE 121 Cb -0.15 -3.36 -0.03 0.00 1.25 0.00 0.00 42.46 40.17 2jwy s ILE 121 CO 0.09 0.29 0.04 0.20 0.24 0.00 0.00 174.94 175.79 2jwy s ASN 122 N 1.63 4.99 -0.04 4.36 -0.87 -1.26 -1.46 114.94 122.28 2jwy s ASN 122 Ca 0.07 -0.20 0.07 0.00 -1.57 0.00 0.00 52.86 51.22 2jwy s ASN 122 Cb -0.15 -1.88 -0.02 0.00 -0.02 0.00 0.00 41.25 39.18 2jwy s ASN 122 CO 0.08 0.02 -0.24 0.00 -2.57 0.00 0.00 177.10 174.39 2jwy s ALA 123 N 1.30 2.24 0.94 0.60 0.00 -0.10 -5.01 121.76 121.73 2jwy s ALA 123 Ca 0.04 -1.07 -0.13 0.00 0.00 0.00 0.00 51.96 50.81 2jwy s ALA 123 Cb -0.15 -0.66 0.16 0.00 0.00 0.00 0.00 23.12 22.47 2jwy s ALA 123 CO 0.02 0.49 1.13 -1.25 0.00 0.00 0.00 175.76 176.15 2jwy s PRO 124 N -0.45 0.89 -0.10 0.00 0.04 -1.26 -2.18 135.00 131.93 2jwy s PRO 124 Ca 0.05 0.31 -0.29 0.00 0.04 0.00 0.00 61.00 61.11 2jwy s PRO 124 Cb -0.11 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.56 2jwy s PRO 124 CO 0.01 -2.37 1.77 0.00 0.04 0.00 0.00 177.00 176.45 2jwy s ALA 125 N -3.21 3.42 -1.53 8.56 0.00 -1.26 -4.45 121.76 123.29 2jwy s ALA 125 Ca 0.65 0.88 -0.12 0.00 0.00 0.00 0.00 51.96 53.37 2jwy s ALA 125 Cb -0.15 -3.83 -0.04 0.00 0.00 0.00 0.00 23.12 19.09 2jwy s ALA 125 CO 0.54 -1.73 2.66 0.43 0.00 0.00 0.00 175.76 177.66 2jwy n SER 126 N 8.06 6.77 0.04 0.00 7.64 0.11 -4.69 113.62 131.55 2jwy n SER 126 Ca 0.20 -2.66 0.11 0.00 1.01 0.00 0.00 58.87 57.53 2jwy n SER 126 Cb 0.43 -1.57 0.47 0.00 -1.01 0.00 0.00 64.21 62.52 2jwy n SER 126 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2jwy n VAL 127 N 4.20 0.55 -3.67 0.44 0.24 -1.25 -0.17 118.33 118.66 2jwy n VAL 127 Ca 0.68 0.06 -0.37 0.00 -2.04 0.00 0.00 64.34 62.66 2jwy n VAL 127 Cb 0.29 -0.78 -0.11 0.00 -1.47 0.00 0.00 33.84 31.77 2jwy n VAL 127 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2jwy s LEU 128 N -3.53 3.80 0.09 1.34 1.43 -1.26 -4.63 118.68 115.92 2jwy s LEU 128 Ca 0.10 -0.07 -0.21 0.00 -1.03 0.00 0.00 54.13 52.91 2jwy s LEU 128 Cb 0.13 -2.04 -0.07 0.00 0.03 0.00 0.00 46.19 44.25 2jwy s LEU 128 CO 0.44 -0.03 0.64 0.00 0.23 0.00 0.00 176.35 177.63 2jwy s ALA 129 N 1.61 3.53 0.43 4.21 0.00 -1.26 -3.29 121.76 126.99 2jwy s ALA 129 Ca 0.07 0.13 -0.24 0.00 0.00 0.00 0.00 51.96 51.92 2jwy s ALA 129 Cb -0.15 -2.75 -0.08 0.00 0.00 0.00 0.00 23.12 20.14 2jwy s ALA 129 CO 0.07 0.33 1.15 -1.25 0.00 0.00 0.00 175.76 176.06 2jwy s PRO 130 N -0.96 3.91 -0.83 0.00 0.04 -1.26 -5.06 135.00 130.84 2jwy s PRO 130 Ca 0.31 1.76 -0.23 0.00 0.04 0.00 0.00 61.00 62.88 2jwy s PRO 130 Cb -0.20 -2.51 0.06 0.00 0.04 0.00 0.00 34.50 31.89 2jwy s PRO 130 CO 0.21 -0.42 1.21 -1.54 0.04 0.00 0.00 177.00 176.50 2jwy s SER 131 N -1.32 6.34 -0.03 6.66 1.04 0.03 -4.97 113.70 121.46 2jwy s SER 131 Ca 0.61 -1.15 -0.01 0.00 0.48 0.00 0.00 55.95 55.88 2jwy s SER 131 Cb -0.28 -2.50 0.03 0.00 0.10 0.00 0.00 66.02 63.37 2jwy s SER 131 CO 0.35 -1.51 0.05 1.51 0.98 0.00 0.00 173.24 174.62 2jwy s ASP 132 N 4.04 0.37 -0.01 7.02 -4.77 -1.26 -1.75 116.67 120.30 2jwy s ASP 132 Ca 0.34 0.07 0.03 0.00 -3.30 0.00 0.00 52.55 49.69 2jwy s ASP 132 Cb -0.08 -0.07 -0.01 0.00 -1.09 0.00 0.00 42.92 41.68 2jwy s ASP 132 CO 0.03 -0.17 -0.09 -0.69 0.70 0.00 0.00 175.17 174.94 2jwy s VAL 133 N 1.41 0.76 -0.10 2.11 1.01 0.10 -4.97 120.40 120.73 2jwy s VAL 133 Ca -0.05 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 61.54 2jwy s VAL 133 Cb -0.13 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.60 2jwy s VAL 133 CO -0.03 0.22 -0.15 1.51 0.00 0.00 0.00 175.10 176.65 2jwy s ASP 134 N -0.17 3.93 -0.01 3.32 -4.77 -1.26 0.05 116.67 117.76 2jwy s ASP 134 Ca 0.03 -0.31 0.04 0.00 -3.30 0.00 0.00 52.55 49.01 2jwy s ASP 134 Cb -0.04 -1.32 -0.01 0.00 -1.09 0.00 0.00 42.92 40.45 2jwy s ASP 134 CO -0.00 0.23 -0.12 0.27 0.70 0.00 0.00 175.17 176.24 2jwy s ILE 135 N -0.02 0.98 0.68 2.11 -4.36 -0.01 -4.97 121.20 115.62 2jwy s ILE 135 Ca -0.04 -0.54 -0.14 0.00 -0.26 0.00 0.00 60.65 59.67 2jwy s ILE 135 Cb -0.14 -0.82 0.01 0.00 1.25 0.00 0.00 42.46 42.76 2jwy s ILE 135 CO 0.04 0.27 1.10 -2.16 0.24 0.00 0.00 174.94 174.43 2jwy s PRO 136 N -0.32 2.72 -0.14 0.37 0.04 -1.26 0.22 135.00 136.63 2jwy s PRO 136 Ca 0.05 1.32 -0.04 0.00 0.04 0.00 0.00 61.00 62.36 2jwy s PRO 136 Cb -0.05 -1.95 0.07 0.00 0.04 0.00 0.00 34.50 32.62 2jwy s PRO 136 CO -0.00 -1.30 0.22 -1.17 0.04 0.00 0.00 177.00 174.79 2jwy s LEU 137 N -5.08 -0.18 -0.59 -3.56 0.20 0.13 -4.77 118.68 104.81 2jwy s LEU 137 Ca 0.65 0.26 -0.12 0.00 0.69 0.00 0.00 54.13 55.61 2jwy s LEU 137 Cb -0.19 0.49 0.15 0.00 -0.43 0.00 0.00 46.19 46.21 2jwy s LEU 137 CO 0.45 -0.27 0.51 -1.58 -0.29 0.00 0.00 176.35 175.16 2jwy s GLN 138 N 2.36 2.93 0.02 1.98 0.74 -1.26 -1.19 119.66 125.23 2jwy s GLN 138 Ca 0.04 -1.97 -0.30 0.00 0.05 0.00 0.00 55.36 53.18 2jwy s GLN 138 Cb -0.13 -4.16 -0.04 0.00 1.10 0.00 0.00 33.01 29.78 2jwy s GLN 138 CO -0.09 -1.26 1.06 -0.51 -0.55 0.00 0.00 175.29 173.94 2jwy s LEU 139 N 1.06 4.37 -0.04 3.68 1.43 0.79 -4.94 118.68 125.02 2jwy s LEU 139 Ca 0.08 1.79 0.05 0.00 -1.03 0.00 0.00 54.13 55.02 2jwy s LEU 139 Cb -0.23 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.39 2jwy s LEU 139 CO -0.01 -0.34 -0.18 -0.54 0.23 0.00 0.00 176.35 175.50 2jwy s LYS 140 N 1.06 2.42 0.00 1.70 1.02 -1.26 -0.37 119.74 124.30 2jwy s LYS 140 Ca 0.54 -0.77 0.00 0.00 0.02 0.00 0.00 55.97 55.76 2jwy s LYS 140 Cb -0.24 -2.28 0.00 0.00 -0.52 0.00 0.00 37.83 34.79 2jwy s LYS 140 CO 0.28 0.58 0.00 0.41 -0.92 0.00 0.00 175.35 175.70 2jwy n GLY 141 N 2.41 0.48 3.64 -3.33 0.00 0.70 -4.89 105.19 104.21 2jwy n GLY 141 Ca -0.17 -0.92 -0.04 0.00 0.00 0.00 0.00 46.02 44.89 2jwy n GLY 141 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jwy s ILE 142 N -2.00 -0.55 0.25 -0.61 2.07 -1.24 -5.01 121.20 114.11 2jwy s ILE 142 Ca 0.00 0.00 -0.17 0.00 -1.41 0.00 0.00 60.65 59.07 2jwy s ILE 142 Cb 0.00 -1.00 -0.08 0.00 0.13 0.00 0.00 42.46 41.51 2jwy s ILE 142 CO 0.00 0.00 0.70 -0.44 -1.91 0.00 0.00 174.94 173.29 2jwy s SER 143 N 2.33 6.92 0.39 4.50 0.01 -1.26 -2.57 113.70 124.02 2jwy s SER 143 Ca -0.08 1.31 0.11 0.00 1.31 0.00 0.00 55.95 58.61 2jwy s SER 143 Cb -0.09 -2.38 0.91 0.00 0.21 0.00 0.00 66.02 64.67 2jwy s SER 143 CO -0.19 -0.05 1.91 1.62 0.41 0.00 0.00 173.24 176.94 2jwy h VAL 144 N 2.45 0.86 0.00 3.43 3.04 -1.94 0.18 116.25 124.26 2jwy h VAL 144 Ca -0.48 -0.20 -0.02 0.00 -1.01 0.00 0.00 66.70 64.99 2jwy h VAL 144 Cb 1.19 0.23 -0.00 0.00 -2.01 0.00 0.00 31.29 30.69 2jwy h VAL 144 CO 0.65 0.11 -0.09 -0.78 -1.01 0.00 0.00 177.57 176.45 2jwy h ASP 145 N 0.58 0.00 -0.36 3.17 3.58 -1.98 -2.55 116.42 118.86 2jwy h ASP 145 Ca 0.38 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.83 2jwy h ASP 145 Cb 0.68 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.73 2jwy h ASP 145 CO -0.15 0.09 0.00 0.00 -2.88 0.00 0.00 179.24 176.30 2jwy n GLN 146 N -3.44 2.62 -3.26 0.28 1.13 0.51 -4.99 117.38 110.23 2jwy n GLN 146 Ca -0.01 -2.04 -0.39 0.00 -1.94 0.00 0.00 57.00 52.62 2jwy n GLN 146 Cb 0.24 -1.31 -0.06 0.00 0.11 0.00 0.00 30.24 29.22 2jwy n GLN 146 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2jwy s LEU 147 N -1.01 4.19 -0.11 1.08 0.20 -0.55 -4.81 118.68 117.67 2jwy s LEU 147 Ca 0.26 0.73 -0.08 0.00 0.69 0.00 0.00 54.13 55.73 2jwy s LEU 147 Cb 0.14 -2.71 -0.03 0.00 -0.43 0.00 0.00 46.19 43.16 2jwy s LEU 147 CO 0.18 -0.12 -0.15 0.61 -0.29 0.00 0.00 176.35 176.58 2jwy n GLY 148 N 3.68 -0.82 3.12 7.98 0.00 0.67 -4.80 105.19 115.02 2jwy n GLY 148 Ca -0.05 -0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 2jwy n GLY 148 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jwy s PHE 149 N -2.00 0.47 -0.29 1.61 -0.71 -0.86 -4.57 117.98 111.63 2jwy s PHE 149 Ca -0.12 -0.98 -0.02 0.00 -1.04 0.00 0.00 56.93 54.76 2jwy s PHE 149 Cb 0.02 -0.33 0.09 0.00 -1.21 0.00 0.00 43.02 41.59 2jwy s PHE 149 CO 0.18 -0.42 0.10 0.08 -1.34 0.00 0.00 175.22 173.82 2jwy s VAL 150 N -3.92 0.52 -0.32 -2.49 1.01 0.94 -2.45 120.40 113.69 2jwy s VAL 150 Ca 0.08 -1.07 -0.14 0.00 0.00 0.00 0.00 61.98 60.85 2jwy s VAL 150 Cb 0.07 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 2jwy s VAL 150 CO -0.09 -0.63 0.31 -0.60 0.00 0.00 0.00 175.10 174.09 2jwy s ARG 151 N 1.81 3.68 -0.05 2.72 3.52 0.65 -0.40 118.95 130.88 2jwy s ARG 151 Ca 0.08 -0.38 -0.25 0.00 -0.13 0.00 0.00 55.73 55.05 2jwy s ARG 151 Cb -0.17 -3.76 -0.04 0.00 -1.56 0.00 0.00 34.95 29.43 2jwy s ARG 151 CO -0.26 -0.41 0.75 0.42 -0.81 0.00 0.00 175.30 174.98 2jwy s ILE 152 N 1.92 5.00 0.39 4.11 -1.09 0.22 -0.51 121.20 131.24 2jwy s ILE 152 Ca 0.10 1.55 -0.14 0.00 -2.23 0.00 0.00 60.65 59.93 2jwy s ILE 152 Cb -0.17 -4.09 0.05 0.00 -1.58 0.00 0.00 42.46 36.68 2jwy s ILE 152 CO 0.11 0.25 0.76 -1.38 -1.23 0.00 0.00 174.94 173.45 2jwy s HIS 153 N 0.77 0.25 -1.72 3.97 -3.43 -0.42 -1.51 115.29 113.19 2jwy s HIS 153 Ca 0.40 -0.90 -0.01 0.00 -0.80 0.00 0.00 55.06 53.75 2jwy s HIS 153 Cb -0.18 0.75 0.00 0.00 -1.43 0.00 0.00 32.58 31.72 2jwy s HIS 153 CO 0.20 -1.55 0.11 -0.25 -2.00 0.00 0.00 174.74 171.24 2jwy n ASP 154 N -1.49 -5.90 -4.58 7.38 9.92 -1.26 -0.09 116.55 120.53 2jwy n ASP 154 Ca -0.08 -0.07 -0.42 0.00 -0.53 0.00 0.00 54.79 53.70 2jwy n ASP 154 Cb 0.60 -4.87 -0.03 0.00 -0.64 0.00 0.00 41.12 36.18 2jwy n ASP 154 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2jwy s ILE 155 N -3.05 3.61 0.07 0.53 -1.09 -1.26 -4.09 121.20 115.92 2jwy s ILE 155 Ca 0.05 0.55 0.06 0.00 -2.23 0.00 0.00 60.65 59.08 2jwy s ILE 155 Cb -0.02 -4.01 -0.03 0.00 -1.58 0.00 0.00 42.46 36.81 2jwy s ILE 155 CO 0.07 -0.78 -0.15 0.00 -1.23 0.00 0.00 174.94 172.85 2jwy s GLN 156 N 5.80 0.88 0.24 2.79 -2.07 0.14 -2.91 119.66 124.54 2jwy s GLN 156 Ca 0.67 -0.96 -0.30 0.00 -1.82 0.00 0.00 55.36 52.95 2jwy s GLN 156 Cb -0.16 -0.93 -0.09 0.00 -1.09 0.00 0.00 33.01 30.74 2jwy s GLN 156 CO 0.28 0.21 1.22 -2.14 -1.32 0.00 0.00 175.29 173.55 2jwy s PRO 157 N -1.68 4.47 0.16 9.60 0.02 -1.26 -0.88 135.00 145.44 2jwy s PRO 157 Ca -0.00 1.97 0.00 0.00 0.02 0.00 0.00 61.00 62.99 2jwy s PRO 157 Cb -0.10 -3.19 -0.04 0.00 0.02 0.00 0.00 34.50 31.20 2jwy s PRO 157 CO 0.02 -0.08 0.33 0.14 -0.33 0.00 0.00 177.00 177.09 2jwy s VAL 158 N -0.47 5.27 0.02 3.83 -7.23 -0.38 -4.89 120.40 116.54 2jwy s VAL 158 Ca 0.51 -0.46 -0.28 0.00 -1.81 0.00 0.00 61.98 59.94 2jwy s VAL 158 Cb -0.35 -3.72 0.10 0.00 0.56 0.00 0.00 36.38 32.97 2jwy s VAL 158 CO 0.41 -0.10 0.88 0.00 -0.31 0.00 0.00 175.10 175.99 2jwy s MET 159 N -3.16 0.87 -0.26 4.82 0.23 -1.26 -4.74 119.30 115.80 2jwy s MET 159 Ca 0.37 -0.34 -0.29 0.00 -1.03 0.00 0.00 55.69 54.40 2jwy s MET 159 Cb -0.11 0.39 0.01 0.00 -1.53 0.00 0.00 34.83 33.58 2jwy s MET 159 CO 0.28 -0.38 1.12 -1.14 -2.03 0.00 0.00 175.02 172.87 2jwy s GLN 160 N -3.16 4.15 0.25 3.16 0.74 -1.26 -4.97 119.66 118.56 2jwy s GLN 160 Ca 0.06 1.29 -0.31 0.00 0.05 0.00 0.00 55.36 56.45 2jwy s GLN 160 Cb -0.01 -3.72 -0.12 0.00 1.10 0.00 0.00 33.01 30.25 2jwy s GLN 160 CO -0.08 -0.80 1.59 -0.11 -0.55 0.00 0.00 175.29 175.34 2jwy n LEU 161 N 6.71 3.86 0.00 3.68 7.94 -1.26 -5.02 117.00 132.92 2jwy n LEU 161 Ca 0.13 1.12 -0.27 0.00 -1.11 0.00 0.00 56.01 55.87 2jwy n LEU 161 Cb 0.46 -1.53 -0.05 0.00 0.53 0.00 0.00 43.42 42.83 2jwy n LEU 161 CO 0.56 -0.03 -0.17 -0.62 -1.11 0.00 0.00 177.39 176.03 2jwy n GLU 162 N 2.71 0.91 -4.43 1.96 1.02 -1.26 -5.17 120.64 116.39 2jwy n GLU 162 Ca 0.12 -3.17 -0.26 0.00 -0.02 0.00 0.00 57.16 53.83 2jwy n GLU 162 Cb 0.34 0.77 -0.13 0.00 -0.02 0.00 0.00 31.44 32.40 2jwy n GLU 162 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 2jwy s HIS 163 N -2.55 1.96 -0.11 -0.32 -3.43 -1.26 -5.14 115.29 104.44 2jwy s HIS 163 Ca 0.04 -0.40 -0.07 0.00 -0.80 0.00 0.00 55.06 53.83 2jwy s HIS 163 Cb -0.00 -1.10 0.04 0.00 -1.43 0.00 0.00 32.58 30.09 2jwy s HIS 163 CO 0.03 0.21 0.26 -1.58 -2.00 0.00 0.00 174.74 171.66 2jwy s HIS 164 N -1.04 -0.32 -0.17 0.38 2.46 -1.26 -5.16 115.29 110.18 2jwy s HIS 164 Ca 0.09 0.77 -0.10 0.00 0.47 0.00 0.00 55.06 56.29 2jwy s HIS 164 Cb -0.10 0.09 0.05 0.00 -0.13 0.00 0.00 32.58 32.49 2jwy s HIS 164 CO 0.04 -0.19 0.41 -3.38 -2.47 0.00 0.00 174.74 169.15 2jwy s HIS 165 N 0.71 -0.56 0.30 3.88 -3.43 -1.26 -5.18 115.29 109.75 2jwy s HIS 165 Ca -0.05 1.24 0.10 0.00 -0.80 0.00 0.00 55.06 55.55 2jwy s HIS 165 Cb -0.06 0.24 -0.05 0.00 -1.43 0.00 0.00 32.58 31.28 2jwy s HIS 165 CO -0.04 -0.31 -0.08 -3.38 -2.00 0.00 0.00 174.74 168.93 2jwy s HIS 166 N 1.10 2.49 -0.16 0.38 -3.43 -1.26 -5.07 115.29 109.34 2jwy s HIS 166 Ca -0.07 -0.34 -0.19 0.00 -0.80 0.00 0.00 55.06 53.67 2jwy s HIS 166 Cb -0.07 -1.21 -0.23 0.00 -1.43 0.00 0.00 32.58 29.64 2jwy s HIS 166 CO -0.09 0.62 0.39 0.45 -2.00 0.00 0.00 174.74 174.11 2jwy h HIS 167 N 2.01 0.20 -0.01 0.38 3.86 -2.10 -3.58 115.15 115.91 2jwy h HIS 167 Ca -0.42 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 58.64 2jwy h HIS 167 Cb 1.25 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.72 2jwy h HIS 167 CO 0.74 1.50 0.00 1.58 0.86 0.00 0.00 177.93 182.61