#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 4.50 -0.22 1.12 1.01 -1.26 -5.03 120.40 120.52 2jwy s VAL 2 Ca 0.00 1.28 -0.15 0.00 0.00 0.00 0.00 61.98 63.11 2jwy s VAL 2 Cb 0.00 -4.40 -0.04 0.00 0.00 0.00 0.00 36.38 31.94 2jwy s VAL 2 CO 0.00 -0.62 0.36 -1.10 0.00 0.00 0.00 175.10 173.73 2jwy s GLN 3 N 3.69 4.13 -0.20 2.72 -1.52 -1.26 -5.05 119.66 122.17 2jwy s GLN 3 Ca 0.41 0.10 -0.29 0.00 -1.95 0.00 0.00 55.36 53.63 2jwy s GLN 3 Cb -0.11 -3.56 -0.01 0.00 -0.22 0.00 0.00 33.01 29.11 2jwy s GLN 3 CO 0.21 -0.06 1.23 1.14 -0.25 0.00 0.00 175.29 177.56 2jwy s GLN 4 N 1.40 4.18 -0.87 2.91 -2.07 -1.26 -4.98 119.66 118.97 2jwy s GLN 4 Ca 0.16 1.53 -0.08 0.00 -1.82 0.00 0.00 55.36 55.15 2jwy s GLN 4 Cb -0.15 -3.77 0.22 0.00 -1.09 0.00 0.00 33.01 28.23 2jwy s GLN 4 CO 0.08 -0.77 0.79 -1.54 -1.32 0.00 0.00 175.29 172.52 2jwy s SER 5 N 2.00 6.45 -1.37 12.60 1.04 -1.26 -4.99 113.70 128.17 2jwy s SER 5 Ca 0.53 -3.13 -0.16 0.00 0.48 0.00 0.00 55.95 53.67 2jwy s SER 5 Cb -0.20 -2.08 0.03 0.00 0.10 0.00 0.00 66.02 63.87 2jwy s SER 5 CO 0.15 -0.39 2.08 -0.62 0.98 0.00 0.00 173.24 175.43 2jwy n GLU 6 N 3.27 2.82 -3.15 4.02 1.02 -1.26 -4.95 120.64 122.41 2jwy n GLU 6 Ca 0.16 -2.72 -0.27 0.00 -0.02 0.00 0.00 57.16 54.31 2jwy n GLU 6 Cb 0.41 -3.33 -0.02 0.00 -0.02 0.00 0.00 31.44 28.49 2jwy n GLU 6 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2jwy s VAL 7 N 3.77 5.01 -0.23 2.62 -7.23 -1.26 -5.10 120.40 117.99 2jwy s VAL 7 Ca 0.50 -0.05 0.01 0.00 -1.81 0.00 0.00 61.98 60.63 2jwy s VAL 7 Cb 0.11 -3.81 0.06 0.00 0.56 0.00 0.00 36.38 33.30 2jwy s VAL 7 CO -0.03 -0.55 -0.06 -0.13 -0.31 0.00 0.00 175.10 174.03 2jwy s ARG 8 N -4.12 1.64 -0.00 4.82 0.52 -1.26 -5.12 118.95 115.42 2jwy s ARG 8 Ca 0.44 -0.96 -0.13 0.00 -0.52 0.00 0.00 55.73 54.56 2jwy s ARG 8 Cb -0.10 -2.55 -0.06 0.00 0.52 0.00 0.00 34.95 32.76 2jwy s ARG 8 CO 0.36 -0.58 0.38 -1.14 0.02 0.00 0.00 175.30 174.34 2jwy s GLN 9 N 1.41 3.85 -0.06 3.54 0.74 -1.26 -5.10 119.66 122.78 2jwy s GLN 9 Ca -0.05 0.33 0.01 0.00 0.05 0.00 0.00 55.36 55.70 2jwy s GLN 9 Cb -0.19 -3.19 0.02 0.00 1.10 0.00 0.00 33.01 30.75 2jwy s GLN 9 CO -0.06 0.69 -0.08 0.00 -0.55 0.00 0.00 175.29 175.28 2jwy s MET 10 N -1.16 1.32 -0.07 1.67 0.23 -1.26 -5.13 119.30 114.90 2jwy s MET 10 Ca 0.24 -0.26 -0.17 0.00 -1.03 0.00 0.00 55.69 54.46 2jwy s MET 10 Cb -0.16 -1.20 0.04 0.00 -1.53 0.00 0.00 34.83 31.98 2jwy s MET 10 CO 0.13 -0.05 0.41 -1.59 -2.03 0.00 0.00 175.02 171.88 2jwy s LYS 11 N 0.91 0.68 -0.37 3.16 0.00 -1.26 -5.13 119.74 117.72 2jwy s LYS 11 Ca -0.11 0.15 -0.29 0.00 0.00 0.00 0.00 55.97 55.72 2jwy s LYS 11 Cb -0.15 0.31 0.02 0.00 0.00 0.00 0.00 37.83 38.01 2jwy s LYS 11 CO 0.01 -0.17 1.19 -1.58 0.00 0.00 0.00 175.35 174.81 2jwy s HIS 12 N -0.78 2.84 0.09 1.78 5.65 -1.26 -4.98 115.29 118.63 2jwy s HIS 12 Ca -0.09 0.90 -0.31 0.00 0.25 0.00 0.00 55.06 55.82 2jwy s HIS 12 Cb -0.04 -4.05 -0.10 0.00 -1.18 0.00 0.00 32.58 27.22 2jwy s HIS 12 CO 0.04 -1.31 1.85 0.45 -0.65 0.00 0.00 174.74 175.12 2jwy s SER 13 N 2.46 6.45 -0.05 9.88 0.15 -1.26 -4.99 113.70 126.34 2jwy s SER 13 Ca 0.51 2.71 -0.10 0.00 0.70 0.00 0.00 55.95 59.77 2jwy s SER 13 Cb -0.12 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.59 2jwy s SER 13 CO 0.24 -1.01 0.26 -0.69 1.20 0.00 0.00 173.24 173.25 2jwy s VAL 14 N 3.21 5.30 -0.13 4.45 1.01 -1.26 -5.10 120.40 127.87 2jwy s VAL 14 Ca 0.82 0.42 -0.03 0.00 0.00 0.00 0.00 61.98 63.20 2jwy s VAL 14 Cb -0.44 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 2jwy s VAL 14 CO 0.37 0.55 -0.04 -0.55 0.00 0.00 0.00 175.10 175.43 2jwy s SER 15 N -1.19 4.77 0.08 3.32 0.15 -1.26 -5.12 113.70 114.46 2jwy s SER 15 Ca 0.21 -0.09 0.03 0.00 0.70 0.00 0.00 55.95 56.79 2jwy s SER 15 Cb -0.14 -1.64 -0.04 0.00 -1.71 0.00 0.00 66.02 62.50 2jwy s SER 15 CO 0.10 0.22 -0.08 0.42 1.20 0.00 0.00 173.24 175.10 2jwy s THR 16 N 0.04 0.77 0.41 6.45 -4.23 -1.26 -5.15 115.64 112.67 2jwy s THR 16 Ca -0.00 -1.61 -0.23 0.00 -1.18 0.00 0.00 61.69 58.67 2jwy s THR 16 Cb -0.13 -1.29 -0.09 0.00 1.34 0.00 0.00 72.50 72.33 2jwy s THR 16 CO 0.03 -0.62 1.05 -0.76 -0.54 0.00 0.00 174.62 173.78 2jwy s LEU 17 N -2.44 4.10 -0.66 4.79 1.43 -1.26 -5.00 118.68 119.64 2jwy s LEU 17 Ca 0.04 2.04 -0.24 0.00 -1.03 0.00 0.00 54.13 54.94 2jwy s LEU 17 Cb -0.02 -4.23 0.06 0.00 0.03 0.00 0.00 46.19 42.02 2jwy s LEU 17 CO -0.01 -0.55 1.03 0.20 0.23 0.00 0.00 176.35 177.24 2jwy s ASN 18 N -1.60 6.20 -0.05 2.29 -0.87 -1.26 -4.88 114.94 114.77 2jwy s ASN 18 Ca 0.59 -0.76 0.01 0.00 -1.57 0.00 0.00 52.86 51.13 2jwy s ASN 18 Cb -0.22 -2.45 0.11 0.00 -0.02 0.00 0.00 41.25 38.67 2jwy s ASN 18 CO 0.27 -1.49 0.86 0.00 -2.57 0.00 0.00 177.10 174.16 2jwy n GLN 19 N 8.03 1.42 -2.87 -0.60 6.02 -1.26 -4.90 117.38 123.22 2jwy n GLN 19 Ca -0.01 -0.45 -0.21 0.00 -0.01 0.00 0.00 57.00 56.31 2jwy n GLN 19 Cb 0.47 -1.44 0.09 0.00 1.02 0.00 0.00 30.24 30.37 2jwy n GLN 19 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 2jwy s GLU 20 N -0.96 2.00 0.00 -1.09 -1.05 -1.26 -5.14 118.70 111.19 2jwy s GLU 20 Ca 0.08 -1.49 0.00 0.00 -0.15 0.00 0.00 54.97 53.41 2jwy s GLU 20 Cb 0.06 -2.52 0.00 0.00 -0.44 0.00 0.00 34.13 31.24 2jwy s GLU 20 CO 0.02 -1.15 0.00 -1.33 0.95 0.00 0.00 175.26 173.75 2jwy n MET 21 N -2.51 1.46 -0.06 -4.83 2.81 -1.26 -5.16 117.12 107.57 2jwy n MET 21 Ca 0.16 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 2jwy n MET 21 Cb 0.61 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.12 2jwy n MET 21 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2jwy n THR 22 N -0.54 0.00 -1.40 2.03 -2.24 -1.26 -5.00 114.28 105.87 2jwy n THR 22 Ca 0.00 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.34 2jwy n THR 22 Cb 0.00 -1.83 -0.01 0.00 -2.10 0.00 0.00 70.33 66.39 2jwy n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jwy n GLN 23 N -0.36 0.28 -4.67 -0.78 10.64 -1.26 -5.01 117.38 116.22 2jwy n GLN 23 Ca 0.00 0.10 -0.27 0.00 -1.83 0.00 0.00 57.00 55.00 2jwy n GLN 23 Cb 0.00 -1.21 -0.14 0.00 -0.86 0.00 0.00 30.24 28.03 2jwy n GLN 23 CO 0.00 0.00 0.00 -1.17 -1.83 0.00 0.00 177.06 174.06 2jwy s LEU 24 N 2.82 2.18 0.25 2.61 2.96 -1.26 -5.12 118.68 123.13 2jwy s LEU 24 Ca 0.62 -0.56 -0.31 0.00 -0.22 0.00 0.00 54.13 53.66 2jwy s LEU 24 Cb -0.75 -1.05 -0.11 0.00 0.50 0.00 0.00 46.19 44.79 2jwy s LEU 24 CO 0.59 0.18 1.56 0.21 -1.32 0.00 0.00 176.35 177.57 2jwy s ASN 25 N -1.28 6.49 0.34 3.68 2.47 -1.26 -4.82 114.94 120.56 2jwy s ASN 25 Ca 0.09 2.80 0.12 0.00 0.42 0.00 0.00 52.86 56.29 2jwy s ASN 25 Cb -0.09 -2.62 0.98 0.00 -1.45 0.00 0.00 41.25 38.07 2jwy s ASN 25 CO 0.02 -0.85 1.71 1.56 -3.72 0.00 0.00 177.10 175.83 2jwy h GLN 26 N 5.52 0.46 -0.03 0.43 1.08 -1.99 -0.68 115.11 119.89 2jwy h GLN 26 Ca -0.45 -0.03 0.04 0.00 -1.45 0.00 0.00 58.65 56.75 2jwy h GLN 26 Cb 1.21 -0.10 -0.06 0.00 -0.05 0.00 0.00 27.48 28.48 2jwy h GLN 26 CO 0.83 0.31 -0.37 1.49 -0.95 0.00 0.00 178.83 180.14 2jwy h GLU 27 N 0.48 -0.49 0.00 1.46 4.81 -1.92 -0.51 114.58 118.41 2jwy h GLU 27 Ca 0.67 0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.86 2jwy h GLU 27 Cb 1.42 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.90 2jwy h GLU 27 CO -0.49 -0.33 -0.35 1.15 -0.73 0.00 0.00 179.01 178.26 2jwy h THR 28 N -0.51 1.08 -0.10 0.32 2.02 -1.55 -2.52 112.91 111.65 2jwy h THR 28 Ca 0.06 -1.28 -0.00 0.00 0.77 0.00 0.00 66.41 65.96 2jwy h THR 28 Cb 0.61 1.72 -0.00 0.00 -1.74 0.00 0.00 68.15 68.74 2jwy h THR 28 CO -0.32 0.34 0.06 0.58 0.37 0.00 0.00 175.52 176.56 2jwy h VAL 29 N 0.00 1.06 -0.24 3.16 2.07 -0.46 0.55 116.25 122.39 2jwy h VAL 29 Ca -0.00 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.36 2jwy h VAL 29 Cb 0.70 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 2jwy h VAL 29 CO 0.05 0.05 0.15 0.11 0.02 0.00 0.00 177.57 177.95 2jwy h LYS 30 N 0.09 0.30 -0.24 1.57 6.56 -0.95 -1.35 116.57 122.56 2jwy h LYS 30 Ca 0.03 -0.02 0.04 0.00 -1.06 0.00 0.00 60.65 59.65 2jwy h LYS 30 Cb 0.04 -0.07 -0.04 0.00 -0.57 0.00 0.00 32.23 31.59 2jwy h LYS 30 CO -0.01 0.20 -0.01 0.82 -2.06 0.00 0.00 179.45 178.40 2jwy h ILE 31 N 0.31 0.82 -0.70 1.86 2.04 -1.31 -0.64 117.51 119.89 2jwy h ILE 31 Ca 0.09 -0.02 0.05 0.00 1.00 0.00 0.00 64.86 65.98 2jwy h ILE 31 Cb -0.03 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 36.75 2jwy h ILE 31 CO -0.03 0.01 0.41 0.74 0.00 0.00 0.00 178.15 179.29 2jwy h THR 32 N 0.06 1.01 -0.56 -0.27 2.02 -0.76 -2.16 112.91 112.24 2jwy h THR 32 Ca 0.11 -0.26 0.02 0.00 0.77 0.00 0.00 66.41 67.05 2jwy h THR 32 Cb 0.15 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 66.70 2jwy h THR 32 CO -0.20 0.14 0.35 -0.61 0.37 0.00 0.00 175.52 175.57 2jwy h GLN 33 N 0.77 0.68 -0.64 6.66 4.15 -0.68 -2.08 115.11 123.97 2jwy h GLN 33 Ca 0.31 -0.04 0.05 0.00 0.77 0.00 0.00 58.65 59.73 2jwy h GLN 33 Cb 0.14 -0.15 -0.05 0.00 0.21 0.00 0.00 27.48 27.63 2jwy h GLN 33 CO -0.16 0.45 0.37 0.37 -1.93 0.00 0.00 178.83 177.92 2jwy h GLN 34 N 0.70 0.67 -0.54 1.69 4.15 -0.56 -1.18 115.11 120.04 2jwy h GLN 34 Ca 0.22 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.56 2jwy h GLN 34 Cb -0.01 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.50 2jwy h GLN 34 CO -0.08 0.44 0.16 -0.91 -1.93 0.00 0.00 178.83 176.51 2jwy h ASN 35 N 0.69 0.76 0.01 -0.69 2.35 -1.03 0.24 115.58 117.90 2jwy h ASN 35 Ca 0.28 -0.12 -0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2jwy h ASN 35 Cb 0.14 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.31 2jwy h ASN 35 CO -0.16 0.72 -0.00 0.03 -1.65 0.00 0.00 177.43 176.37 2jwy h ARG 36 N 0.79 -0.01 -0.78 0.81 3.08 -0.69 -1.11 114.38 116.47 2jwy h ARG 36 Ca 0.18 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.18 2jwy h ARG 36 Cb 0.25 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 2jwy h ARG 36 CO -0.01 0.24 0.28 -0.07 -1.07 0.00 0.00 179.97 179.34 2jwy h LEU 37 N -0.26 1.10 -1.00 3.04 3.38 -1.09 -2.32 115.31 118.16 2jwy h LEU 37 Ca -0.00 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 2jwy h LEU 37 Cb 0.26 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 2jwy h LEU 37 CO 0.00 1.00 0.48 -1.13 0.09 0.00 0.00 178.44 178.89 2jwy h ASN 38 N 1.15 1.05 0.06 -0.43 -0.73 -0.47 0.20 115.58 116.41 2jwy h ASN 38 Ca 0.26 -0.08 -0.08 0.00 1.87 0.00 0.00 56.30 58.26 2jwy h ASN 38 Cb 0.26 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.57 2jwy h ASN 38 CO -0.01 0.83 -0.25 0.00 -0.37 0.00 0.00 177.43 177.63 2jwy h ALA 39 N 1.34 1.25 -0.05 1.57 0.00 -0.92 -2.48 119.26 119.97 2jwy h ALA 39 Ca 0.30 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jwy h ALA 39 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2jwy h ALA 39 CO -0.05 0.49 0.00 1.63 0.00 0.00 0.00 179.25 181.32 2jwy n LYS 40 N -4.15 1.77 -2.45 0.00 5.02 -0.74 -4.82 118.16 112.80 2jwy n LYS 40 Ca -0.01 -1.13 -0.41 0.00 -2.02 0.00 0.00 58.31 54.74 2jwy n LYS 40 Cb 0.37 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 33.89 2jwy n LYS 40 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2jwy s SER 41 N -1.92 6.14 0.17 4.39 0.15 0.63 -4.85 113.70 118.40 2jwy s SER 41 Ca 0.36 0.04 0.19 0.00 0.70 0.00 0.00 55.95 57.24 2jwy s SER 41 Cb 0.20 -2.55 -0.03 0.00 -1.71 0.00 0.00 66.02 61.93 2jwy s SER 41 CO 0.32 -1.75 1.03 -1.28 1.20 0.00 0.00 173.24 172.76 2jwy h SER 42 N 10.75 0.00 -3.28 5.45 0.87 -1.87 -3.44 113.55 122.03 2jwy h SER 42 Ca -0.27 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.72 2jwy h SER 42 Cb 1.08 0.00 -0.40 0.00 -0.44 0.00 0.00 62.40 62.64 2jwy h SER 42 CO 1.21 0.31 -0.76 -0.94 -0.53 0.00 0.00 176.83 176.12 2jwy s SER 43 N -5.72 3.71 0.00 6.23 1.04 -1.26 -5.08 113.70 112.62 2jwy s SER 43 Ca -0.01 -1.35 0.00 0.00 0.48 0.00 0.00 55.95 55.07 2jwy s SER 43 Cb 0.09 -0.87 0.00 0.00 0.10 0.00 0.00 66.02 65.34 2jwy s SER 43 CO 0.79 -0.35 0.00 0.61 0.98 0.00 0.00 173.24 175.26 2jwy n GLY 44 N 4.86 -1.70 3.10 7.32 0.00 -1.26 -4.93 105.19 112.58 2jwy n GLY 44 Ca -0.05 -1.54 -0.18 0.00 0.00 0.00 0.00 46.02 44.25 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 0.92 -0.27 1.61 -7.23 -0.52 -4.89 120.40 110.02 2jwy s VAL 45 Ca 0.00 -0.91 -0.14 0.00 -1.81 0.00 0.00 61.98 59.13 2jwy s VAL 45 Cb 0.00 -0.85 -0.04 0.00 0.56 0.00 0.00 36.38 36.05 2jwy s VAL 45 CO 0.00 -0.05 0.31 -0.31 -0.31 0.00 0.00 175.10 174.74 2jwy s TYR 46 N -0.84 3.25 -0.09 2.82 2.02 -1.26 -1.04 117.35 122.20 2jwy s TYR 46 Ca -0.00 0.33 0.01 0.00 -0.37 0.00 0.00 57.07 57.04 2jwy s TYR 46 Cb -0.07 -2.50 -0.02 0.00 -0.40 0.00 0.00 41.96 38.96 2jwy s TYR 46 CO 0.01 -0.18 -0.11 -0.51 -1.57 0.00 0.00 175.55 173.19 2jwy s LEU 47 N 1.88 2.90 -0.16 -1.29 1.43 0.24 -4.72 118.68 118.96 2jwy s LEU 47 Ca 0.13 -0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 53.00 2jwy s LEU 47 Cb -0.16 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.40 2jwy s LEU 47 CO 0.10 0.28 -0.00 -0.76 0.23 0.00 0.00 176.35 176.20 2jwy s LEU 48 N -0.33 3.46 0.51 1.79 1.43 -1.26 -0.15 118.68 124.13 2jwy s LEU 48 Ca 0.04 -0.05 0.16 0.00 -1.03 0.00 0.00 54.13 53.25 2jwy s LEU 48 Cb -0.13 -1.85 1.24 0.00 0.03 0.00 0.00 46.19 45.48 2jwy s LEU 48 CO 0.02 0.18 2.13 1.55 0.23 0.00 0.00 176.35 180.46 2jwy h PRO 49 N 6.66 0.01 0.00 1.29 0.13 -1.86 -0.08 132.00 138.15 2jwy h PRO 49 Ca -0.33 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2jwy h PRO 49 Cb 1.18 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2jwy h PRO 49 CO 0.66 0.02 -0.11 0.41 -0.23 0.00 0.00 178.00 178.75 2jwy n GLY 50 N -1.49 -1.58 2.72 1.56 0.00 -1.26 -4.38 105.19 100.76 2jwy n GLY 50 Ca -0.03 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.62 2jwy n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jwy n ALA 51 N -1.68 3.61 -2.01 4.61 0.00 -0.04 -4.80 120.51 120.20 2jwy n ALA 51 Ca 0.06 -4.56 -0.26 0.00 0.00 0.00 0.00 53.44 48.67 2jwy n ALA 51 Cb 0.40 -0.98 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 2jwy n ALA 51 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2jwy s LYS 52 N -1.76 2.31 0.05 0.00 1.02 -1.25 -4.35 119.74 115.77 2jwy s LYS 52 Ca 0.30 -1.08 0.02 0.00 0.02 0.00 0.00 55.97 55.23 2jwy s LYS 52 Cb 0.03 -5.21 -0.03 0.00 -0.52 0.00 0.00 37.83 32.10 2jwy s LYS 52 CO -0.12 -4.21 -0.07 0.95 -0.92 0.00 0.00 175.35 170.98 2jwy s THR 53 N 11.87 0.55 0.45 2.17 -4.23 -1.26 -4.88 115.64 120.30 2jwy s THR 53 Ca 0.70 -1.29 -0.23 0.00 -1.18 0.00 0.00 61.69 59.69 2jwy s THR 53 Cb -0.01 -0.87 -0.08 0.00 1.34 0.00 0.00 72.50 72.88 2jwy s THR 53 CO 0.14 -0.52 1.14 -2.16 -0.54 0.00 0.00 174.62 172.68 2jwy s PRO 54 N -2.16 3.82 -0.02 3.99 0.04 -1.26 -4.41 135.00 135.00 2jwy s PRO 54 Ca -0.05 1.70 -0.02 0.00 0.04 0.00 0.00 61.00 62.67 2jwy s PRO 54 Cb -0.06 -2.40 0.01 0.00 0.04 0.00 0.00 34.50 32.08 2jwy s PRO 54 CO -0.01 -0.48 0.06 0.00 0.04 0.00 0.00 177.00 176.61 2jwy s ALA 55 N -1.59 -0.15 0.13 8.56 0.00 0.73 -4.99 121.76 124.44 2jwy s ALA 55 Ca 0.63 0.18 -0.23 0.00 0.00 0.00 0.00 51.96 52.54 2jwy s ALA 55 Cb -0.27 -0.11 -0.07 0.00 0.00 0.00 0.00 23.12 22.67 2jwy s ALA 55 CO 0.32 -0.03 0.70 0.50 0.00 0.00 0.00 175.76 177.26 2jwy s ARG 56 N 0.05 4.44 -0.08 0.00 3.52 -1.26 -0.32 118.95 125.31 2jwy s ARG 56 Ca -0.00 1.01 -0.03 0.00 -0.13 0.00 0.00 55.73 56.58 2jwy s ARG 56 Cb -0.01 -3.25 0.04 0.00 -1.56 0.00 0.00 34.95 30.17 2jwy s ARG 56 CO -0.00 0.59 0.17 -1.17 -0.81 0.00 0.00 175.30 174.09 2jwy s LEU 57 N -1.12 0.62 0.18 -0.88 2.96 0.05 -4.92 118.68 115.56 2jwy s LEU 57 Ca 0.33 0.36 -0.26 0.00 -0.22 0.00 0.00 54.13 54.34 2jwy s LEU 57 Cb -0.22 0.46 -0.08 0.00 0.50 0.00 0.00 46.19 46.85 2jwy s LEU 57 CO 0.24 -0.16 0.81 -0.70 -1.32 0.00 0.00 176.35 175.22 2jwy s GLU 58 N 1.23 4.63 0.24 1.98 2.12 -1.26 -1.00 118.70 126.63 2jwy s GLU 58 Ca -0.09 1.23 0.01 0.00 0.36 0.00 0.00 54.97 56.48 2jwy s GLU 58 Cb -0.11 -3.27 -0.00 0.00 0.26 0.00 0.00 34.13 31.01 2jwy s GLU 58 CO -0.07 0.55 0.03 -1.13 -0.54 0.00 0.00 175.26 174.11 2jwy n SER 59 N 1.61 2.06 -0.82 -1.70 3.41 0.57 -4.85 113.62 113.90 2jwy n SER 59 Ca -0.05 -2.13 0.06 0.00 -0.26 0.00 0.00 58.87 56.50 2jwy n SER 59 Cb 0.48 0.32 0.18 0.00 -0.26 0.00 0.00 64.21 64.94 2jwy n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jwy n GLN 60 N -0.57 2.12 0.00 4.33 6.02 -0.12 -3.47 117.38 125.68 2jwy n GLN 60 Ca -0.08 -1.49 0.00 0.00 -0.01 0.00 0.00 57.00 55.42 2jwy n GLN 60 Cb 0.32 -1.41 0.00 0.00 1.02 0.00 0.00 30.24 30.18 2jwy n GLN 60 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 2jwy n ILE 61 N 0.63 0.00 0.00 5.09 -5.35 -1.26 -4.67 119.36 113.80 2jwy n ILE 61 Ca 0.14 -0.46 0.00 0.00 -0.27 0.00 0.00 62.75 62.16 2jwy n ILE 61 Cb 0.41 1.05 0.00 0.00 -1.74 0.00 0.00 39.64 39.35 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 0.41 0.94 3.64 3.28 0.00 -1.23 -4.99 105.19 107.23 2jwy n GLY 62 Ca 0.00 -1.94 -0.39 0.00 0.00 0.00 0.00 46.02 43.69 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 -2.03 5.15 0.32 2.61 2.01 -1.26 -0.31 115.64 122.12 2jwy s THR 63 Ca 0.00 0.74 0.01 0.00 0.31 0.00 0.00 61.69 62.75 2jwy s THR 63 Cb 0.00 -3.76 -0.00 0.00 0.01 0.00 0.00 72.50 68.75 2jwy s THR 63 CO 0.00 0.17 0.03 0.00 -0.69 0.00 0.00 174.62 174.13 2jwy n LEU 64 N 5.06 0.00 -3.33 4.42 -0.00 -0.17 -3.08 117.00 119.90 2jwy n LEU 64 Ca -0.07 -2.12 -0.09 0.00 -0.00 0.00 0.00 56.01 53.73 2jwy n LEU 64 Cb 0.51 0.38 -0.07 0.00 -0.00 0.00 0.00 43.42 44.24 2jwy n LEU 64 CO 0.39 -0.31 -0.06 -0.60 -0.00 0.00 0.00 177.39 176.81 2jwy s ARG 65 N -3.17 0.38 0.34 1.47 3.52 0.27 -0.77 118.95 121.00 2jwy s ARG 65 Ca 0.04 0.33 0.07 0.00 -0.13 0.00 0.00 55.73 56.04 2jwy s ARG 65 Cb 0.00 -0.38 -0.01 0.00 -1.56 0.00 0.00 34.95 33.00 2jwy s ARG 65 CO 0.03 -0.84 0.44 -1.64 -0.81 0.00 0.00 175.30 172.48 2jwy s MET 66 N 2.54 3.01 0.19 5.12 -1.94 0.57 0.62 119.30 129.41 2jwy s MET 66 Ca 0.11 -1.09 -0.23 0.00 -1.71 0.00 0.00 55.69 52.77 2jwy s MET 66 Cb -0.14 -2.74 0.05 0.00 2.01 0.00 0.00 34.83 34.01 2jwy s MET 66 CO -0.23 0.04 0.79 0.45 -0.01 0.00 0.00 175.02 176.05 2jwy s SER 67 N -4.15 -0.30 -0.17 3.03 0.15 -0.60 -0.19 113.70 111.47 2jwy s SER 67 Ca 0.45 -0.37 0.01 0.00 0.70 0.00 0.00 55.95 56.74 2jwy s SER 67 Cb -0.09 0.60 0.01 0.00 -1.71 0.00 0.00 66.02 64.82 2jwy s SER 67 CO 0.30 -1.07 -0.17 -0.76 1.20 0.00 0.00 173.24 172.75 2jwy s LEU 68 N -2.85 2.34 0.24 3.45 1.43 -1.26 -1.40 118.68 120.63 2jwy s LEU 68 Ca 0.09 -0.54 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 2jwy s LEU 68 Cb -0.03 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 2jwy s LEU 68 CO 0.00 0.05 0.14 0.68 0.23 0.00 0.00 176.35 177.45 2jwy s VAL 69 N 1.02 0.18 -1.47 -1.59 -7.23 -0.65 -4.55 120.40 106.10 2jwy s VAL 69 Ca -0.02 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.12 2jwy s VAL 69 Cb -0.15 -2.53 0.02 0.00 0.56 0.00 0.00 36.38 34.28 2jwy s VAL 69 CO -0.04 0.00 0.33 0.59 -0.31 0.00 0.00 175.10 175.67 2jwy n ASN 70 N -0.52 -5.25 -4.60 4.85 3.02 -1.26 0.27 115.26 111.78 2jwy n ASN 70 Ca 0.02 -0.16 -0.43 0.00 -0.03 0.00 0.00 54.58 53.99 2jwy n ASN 70 Cb 0.66 -4.32 -0.02 0.00 -0.61 0.00 0.00 39.78 35.48 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 -3.00 3.68 0.07 2.41 1.01 -1.26 -4.24 121.20 119.86 2jwy s ILE 71 Ca 0.20 0.68 0.03 0.00 0.00 0.00 0.00 60.65 61.55 2jwy s ILE 71 Cb -0.09 -3.96 -0.03 0.00 0.01 0.00 0.00 42.46 38.38 2jwy s ILE 71 CO 0.24 -0.64 -0.09 0.42 0.00 0.00 0.00 174.94 174.87 2jwy s THR 72 N 6.28 0.71 0.25 2.92 -4.23 -0.00 -5.01 115.64 116.55 2jwy s THR 72 Ca 0.69 -1.36 -0.30 0.00 -1.18 0.00 0.00 61.69 59.55 2jwy s THR 72 Cb -0.17 -0.99 -0.09 0.00 1.34 0.00 0.00 72.50 72.59 2jwy s THR 72 CO 0.32 -0.48 1.27 -2.16 -0.54 0.00 0.00 174.62 173.03 2jwy s PRO 73 N -2.21 4.43 0.21 3.99 0.04 -1.26 -1.04 135.00 139.17 2jwy s PRO 73 Ca -0.02 2.05 0.09 0.00 0.04 0.00 0.00 61.00 63.15 2jwy s PRO 73 Cb -0.06 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.28 2jwy s PRO 73 CO -0.00 -0.14 -0.06 0.34 0.04 0.00 0.00 177.00 177.18 2jwy s ASP 74 N -0.12 4.39 0.48 6.66 2.15 -0.06 -4.74 116.67 125.44 2jwy s ASP 74 Ca 0.52 -0.60 0.21 0.00 0.43 0.00 0.00 52.55 53.11 2jwy s ASP 74 Cb -0.36 -0.78 1.23 0.00 -0.30 0.00 0.00 42.92 42.71 2jwy s ASP 74 CO 0.43 0.06 2.03 0.00 -0.17 0.00 0.00 175.17 177.53 2jwy h ALA 75 N 2.51 1.48 0.00 3.66 0.00 -1.96 -2.96 119.26 121.99 2jwy h ALA 75 Ca -0.46 -0.14 -0.33 0.00 0.00 0.00 0.00 54.91 53.98 2jwy h ALA 75 Cb 1.22 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 2jwy h ALA 75 CO 0.57 0.19 -2.29 -0.25 0.00 0.00 0.00 179.25 177.47 2jwy n ASP 76 N -3.97 0.29 0.00 0.00 8.00 -1.26 -5.07 116.55 114.54 2jwy n ASP 76 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 2jwy n ASP 76 Cb 0.24 1.01 0.00 0.00 -0.02 0.00 0.00 41.12 42.36 2jwy n ASP 76 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jwy n GLY 77 N 1.80 -0.51 3.27 0.44 0.00 -1.12 -1.74 105.19 107.34 2jwy n GLY 77 Ca -0.30 0.56 -0.10 0.00 0.00 0.00 0.00 46.02 46.18 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 1.21 -0.13 -0.14 2.61 2.01 -0.37 -0.88 115.64 119.93 2jwy s THR 78 Ca 0.00 0.11 -0.04 0.00 0.31 0.00 0.00 61.69 62.07 2jwy s THR 78 Cb 0.00 -0.62 -0.03 0.00 0.01 0.00 0.00 72.50 71.86 2jwy s THR 78 CO 0.00 0.04 -0.01 0.42 -0.69 0.00 0.00 174.62 174.39 2jwy s THR 79 N 1.62 4.17 -0.08 -0.82 -4.23 -0.20 -0.81 115.64 115.29 2jwy s THR 79 Ca -0.08 -0.27 -0.11 0.00 -1.18 0.00 0.00 61.69 60.05 2jwy s THR 79 Cb -0.09 -2.82 0.03 0.00 1.34 0.00 0.00 72.50 70.96 2jwy s THR 79 CO -0.13 0.52 0.29 -1.48 -0.54 0.00 0.00 174.62 173.28 2jwy s LEU 80 N 0.03 0.91 -0.32 4.79 0.05 -0.68 -0.82 118.68 122.64 2jwy s LEU 80 Ca 0.02 0.41 -0.28 0.00 0.05 0.00 0.00 54.13 54.33 2jwy s LEU 80 Cb -0.13 1.05 0.01 0.00 -2.05 0.00 0.00 46.19 45.08 2jwy s LEU 80 CO 0.02 -0.21 1.01 -0.89 -0.55 0.00 0.00 176.35 175.73 2jwy s THR 81 N -0.33 4.57 -0.31 5.48 2.01 0.14 0.07 115.64 127.27 2jwy s THR 81 Ca -0.04 1.60 -0.22 0.00 0.31 0.00 0.00 61.69 63.34 2jwy s THR 81 Cb -0.03 -4.36 -0.00 0.00 0.01 0.00 0.00 72.50 68.12 2jwy s THR 81 CO 0.01 -0.43 0.72 -0.22 -0.69 0.00 0.00 174.62 174.01 2jwy s LEU 82 N 3.50 4.12 -0.12 4.42 1.98 0.31 -1.64 118.68 131.25 2jwy s LEU 82 Ca 0.42 0.52 -0.09 0.00 -2.89 0.00 0.00 54.13 52.09 2jwy s LEU 82 Cb -0.13 -2.95 -0.04 0.00 0.66 0.00 0.00 46.19 43.73 2jwy s LEU 82 CO 0.15 -0.57 0.20 -0.13 -1.89 0.00 0.00 176.35 174.10 2jwy s ARG 83 N 2.82 3.72 -0.54 1.98 0.52 -0.49 -1.72 118.95 125.24 2jwy s ARG 83 Ca 0.29 -0.04 0.02 0.00 -0.52 0.00 0.00 55.73 55.49 2jwy s ARG 83 Cb -0.14 -3.26 0.14 0.00 0.52 0.00 0.00 34.95 32.21 2jwy s ARG 83 CO 0.13 0.63 0.30 0.42 0.02 0.00 0.00 175.30 176.80 2jwy s ILE 84 N -0.66 2.89 -0.21 1.52 1.09 0.73 -1.56 121.20 125.00 2jwy s ILE 84 Ca 0.15 -3.19 -0.29 0.00 -1.10 0.00 0.00 60.65 56.22 2jwy s ILE 84 Cb -0.13 -2.97 0.01 0.00 -1.06 0.00 0.00 42.46 38.31 2jwy s ILE 84 CO 0.04 -0.81 1.03 -1.10 -0.10 0.00 0.00 174.94 174.00 2jwy s GLN 85 N -0.19 4.28 -0.20 2.79 -0.21 0.20 -0.91 119.66 125.42 2jwy s GLN 85 Ca 0.17 1.36 -0.23 0.00 0.02 0.00 0.00 55.36 56.68 2jwy s GLN 85 Cb -0.24 -3.62 -0.02 0.00 1.00 0.00 0.00 33.01 30.13 2jwy s GLN 85 CO -0.01 -0.58 0.72 0.20 -2.12 0.00 0.00 175.29 173.50 2jwy s GLY 86 N 1.19 2.00 0.31 3.09 0.00 -0.29 0.97 107.32 114.58 2jwy s GLY 86 Ca 0.45 -0.17 0.07 0.00 0.00 0.00 0.00 44.72 45.06 2jwy s GLY 86 CO 0.08 1.50 1.77 0.83 0.00 0.00 0.00 173.10 177.29 2jwy h GLU 87 N 7.51 0.72 -6.26 2.90 4.39 -1.84 -3.36 114.58 118.63 2jwy h GLU 87 Ca -0.29 -0.04 -0.57 0.00 0.34 0.00 0.00 59.36 58.80 2jwy h GLU 87 Cb 1.13 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 29.58 2jwy h GLU 87 CO 0.81 0.48 0.97 -1.12 -1.16 0.00 0.00 179.01 178.98 2jwy s SER 88 N -5.40 6.74 0.47 1.42 0.01 -1.26 -4.91 113.70 110.75 2jwy s SER 88 Ca -0.11 1.47 0.12 0.00 1.31 0.00 0.00 55.95 58.74 2jwy s SER 88 Cb 0.25 -2.54 1.07 0.00 0.21 0.00 0.00 66.02 65.01 2jwy s SER 88 CO 0.80 -0.98 2.09 0.78 0.41 0.00 0.00 173.24 176.35 2jwy h ASN 89 N 9.08 0.19 -4.07 2.44 2.35 -1.95 -3.40 115.58 120.22 2jwy h ASN 89 Ca -0.28 -0.01 -0.52 0.00 -0.55 0.00 0.00 56.30 54.94 2jwy h ASN 89 Cb 1.11 -0.05 0.10 0.00 0.05 0.00 0.00 38.32 39.53 2jwy h ASN 89 CO 1.00 0.16 0.48 1.51 -1.65 0.00 0.00 177.43 178.94 2jwy s ASP 90 N -6.91 5.44 0.08 5.81 -4.77 -1.26 -2.15 116.67 112.91 2jwy s ASP 90 Ca -0.06 2.39 -0.32 0.00 -3.30 0.00 0.00 52.55 51.25 2jwy s ASP 90 Cb 0.17 -2.60 -0.11 0.00 -1.09 0.00 0.00 42.92 39.29 2jwy s ASP 90 CO 0.70 -1.42 1.83 -0.81 0.70 0.00 0.00 175.17 176.16 2jwy n PRO 91 N -1.30 2.61 -3.04 2.11 -0.04 -1.23 -4.49 135.00 129.61 2jwy n PRO 91 Ca 0.12 0.95 -0.33 0.00 -0.04 0.00 0.00 63.50 64.20 2jwy n PRO 91 Cb 0.49 -2.83 -0.06 0.00 -0.04 0.00 0.00 33.50 31.06 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 2.92 4.08 0.97 1.53 1.43 -1.26 -4.89 118.68 123.47 2jwy s LEU 92 Ca 0.84 1.42 -0.15 0.00 -1.03 0.00 0.00 54.13 55.22 2jwy s LEU 92 Cb -0.54 -4.13 0.18 0.00 0.03 0.00 0.00 46.19 41.73 2jwy s LEU 92 CO 0.40 -0.21 1.19 -2.16 0.23 0.00 0.00 176.35 175.81 2jwy s PRO 93 N -2.86 0.62 0.34 1.29 0.04 -1.26 -0.94 135.00 132.23 2jwy s PRO 93 Ca 0.54 -0.01 -0.27 0.00 0.04 0.00 0.00 61.00 61.30 2jwy s PRO 93 Cb -0.11 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.53 2jwy s PRO 93 CO 0.17 -2.49 1.14 0.00 0.04 0.00 0.00 177.00 175.86 2jwy s ALA 94 N -3.45 3.31 0.12 8.56 0.00 -1.26 -4.60 121.76 124.45 2jwy s ALA 94 Ca 0.68 0.94 -0.11 0.00 0.00 0.00 0.00 51.96 53.47 2jwy s ALA 94 Cb -0.10 -3.36 0.01 0.00 0.00 0.00 0.00 23.12 19.67 2jwy s ALA 94 CO 0.53 -0.34 0.29 -0.59 0.00 0.00 0.00 175.76 175.65 2jwy s PHE 95 N -1.30 0.10 0.12 0.00 -0.71 -1.13 -1.52 117.98 113.55 2jwy s PHE 95 Ca 0.50 -0.48 0.08 0.00 -1.04 0.00 0.00 56.93 56.00 2jwy s PHE 95 Cb -0.31 0.05 -0.04 0.00 -1.21 0.00 0.00 43.02 41.51 2jwy s PHE 95 CO 0.40 -0.65 -0.20 -1.54 -1.34 0.00 0.00 175.22 171.89 2jwy s SER 96 N -2.87 2.58 0.04 1.98 1.04 0.58 -0.24 113.70 116.80 2jwy s SER 96 Ca 0.07 -0.74 -0.07 0.00 0.48 0.00 0.00 55.95 55.69 2jwy s SER 96 Cb 0.03 -0.14 -0.00 0.00 0.10 0.00 0.00 66.02 66.00 2jwy s SER 96 CO -0.08 0.03 0.13 -0.83 0.98 0.00 0.00 173.24 173.47 2jwy s GLY 97 N -2.15 0.12 -0.47 7.32 0.00 -0.49 -0.75 107.32 110.89 2jwy s GLY 97 Ca 0.09 -0.44 -0.17 0.00 0.00 0.00 0.00 44.72 44.21 2jwy s GLY 97 CO 0.05 -0.59 0.45 -1.59 0.00 0.00 0.00 173.10 171.42 2jwy s THR 98 N -2.55 5.12 -0.09 0.90 2.01 -0.80 -1.50 115.64 118.73 2jwy s THR 98 Ca -0.05 -0.76 -0.13 0.00 0.31 0.00 0.00 61.69 61.06 2jwy s THR 98 Cb -0.01 -4.14 -0.05 0.00 0.01 0.00 0.00 72.50 68.31 2jwy s THR 98 CO -0.04 -0.58 0.32 0.68 -0.69 0.00 0.00 174.62 174.30 2jwy s VAL 99 N 1.98 5.23 -0.26 3.82 -7.23 -0.17 -2.73 120.40 121.04 2jwy s VAL 99 Ca 0.08 0.62 -0.02 0.00 -1.81 0.00 0.00 61.98 60.85 2jwy s VAL 99 Cb -0.21 -3.63 0.03 0.00 0.56 0.00 0.00 36.38 33.13 2jwy s VAL 99 CO 0.09 0.51 -0.05 -1.61 -0.31 0.00 0.00 175.10 173.73 2jwy s GLU 100 N -0.45 2.77 -0.14 4.82 2.02 0.45 -1.12 118.70 127.04 2jwy s GLU 100 Ca 0.20 -1.02 0.02 0.00 0.02 0.00 0.00 54.97 54.18 2jwy s GLU 100 Cb -0.14 -3.01 0.01 0.00 0.10 0.00 0.00 34.13 31.09 2jwy s GLU 100 CO 0.08 -0.43 -0.20 1.52 0.02 0.00 0.00 175.26 176.25 2jwy s TYR 101 N 1.31 2.51 0.00 1.61 1.13 -0.23 -0.05 117.35 123.63 2jwy s TYR 101 Ca -0.01 -1.31 0.00 0.00 -1.41 0.00 0.00 57.07 54.34 2jwy s TYR 101 Cb -0.17 -1.74 0.00 0.00 -1.10 0.00 0.00 41.96 38.95 2jwy s TYR 101 CO -0.04 -0.63 0.00 0.41 -2.51 0.00 0.00 175.55 172.78 2jwy n GLY 102 N 4.27 2.82 3.30 5.49 0.00 -0.82 -0.84 105.19 119.41 2jwy n GLY 102 Ca -0.20 -0.31 -0.20 0.00 0.00 0.00 0.00 46.02 45.32 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 2.93 1.19 -0.12 1.61 -0.21 -0.05 -0.10 119.66 124.90 2jwy s GLN 103 Ca 0.00 -1.38 -0.00 0.00 0.02 0.00 0.00 55.36 54.00 2jwy s GLN 103 Cb 0.00 -1.13 -0.02 0.00 1.00 0.00 0.00 33.01 32.87 2jwy s GLN 103 CO 0.00 0.22 -0.12 0.42 -2.12 0.00 0.00 175.29 173.69 2jwy s ILE 104 N -2.28 3.18 -2.17 1.08 1.01 -1.26 -0.53 121.20 120.23 2jwy s ILE 104 Ca 0.15 -0.63 0.21 0.00 0.00 0.00 0.00 60.65 60.38 2jwy s ILE 104 Cb -0.04 -2.33 0.06 0.00 0.01 0.00 0.00 42.46 40.16 2jwy s ILE 104 CO 0.05 0.53 1.07 0.00 0.00 0.00 0.00 174.94 176.60 2jwy n GLN 105 N 3.34 1.62 0.00 2.79 10.64 -1.08 -4.99 117.38 129.70 2jwy n GLN 105 Ca -0.18 -1.26 0.00 0.00 -1.83 0.00 0.00 57.00 53.73 2jwy n GLN 105 Cb 0.53 -1.41 0.00 0.00 -0.86 0.00 0.00 30.24 28.50 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 1.28 6.71 2.73 2.61 0.00 -1.26 -4.88 105.19 112.38 2jwy n GLY 106 Ca 0.10 -1.78 -0.14 0.00 0.00 0.00 0.00 46.02 44.20 2jwy n GLY 106 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jwy n THR 107 N 0.00 0.00 0.22 2.61 -2.24 0.20 -4.85 114.28 110.22 2jwy n THR 107 Ca 0.00 -1.33 0.09 0.00 -2.27 0.00 0.00 64.05 60.54 2jwy n THR 107 Cb 0.00 -0.70 0.47 0.00 -2.10 0.00 0.00 70.33 68.00 2jwy n THR 107 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2jwy h ILE 108 N 0.01 0.68 0.14 2.28 1.08 -2.01 -3.24 117.51 116.44 2jwy h ILE 108 Ca -0.19 -1.14 -0.28 0.00 -0.39 0.00 0.00 64.86 62.86 2jwy h ILE 108 Cb 0.87 1.74 0.00 0.00 -3.07 0.00 0.00 36.82 36.36 2jwy h ILE 108 CO 0.27 0.25 -1.39 0.44 -0.69 0.00 0.00 178.15 177.03 2jwy h ASP 109 N 0.00 0.45 -2.98 1.72 5.19 -2.01 -3.46 116.42 115.33 2jwy h ASP 109 Ca -0.00 -0.88 -0.34 0.00 -0.62 0.00 0.00 57.03 55.19 2jwy h ASP 109 Cb 0.72 -0.15 -0.37 0.00 0.18 0.00 0.00 39.33 39.71 2jwy h ASP 109 CO 0.03 1.62 -0.67 0.54 -3.12 0.00 0.00 179.24 177.65 2jwy s ASN 110 N -7.09 1.23 0.13 6.45 6.03 -1.22 -5.15 114.94 115.31 2jwy s ASN 110 Ca -0.18 0.01 -0.08 0.00 -1.03 0.00 0.00 52.86 51.58 2jwy s ASN 110 Cb 0.04 0.16 -0.01 0.00 -3.03 0.00 0.00 41.25 38.41 2jwy s ASN 110 CO 0.80 -0.28 0.22 0.72 -2.03 0.00 0.00 177.10 176.52 2jwy s PHE 111 N 2.26 0.35 -0.05 1.54 -0.71 -1.24 -0.63 117.98 119.50 2jwy s PHE 111 Ca 0.04 -0.75 0.01 0.00 -1.04 0.00 0.00 56.93 55.19 2jwy s PHE 111 Cb -0.14 -0.11 0.02 0.00 -1.21 0.00 0.00 43.02 41.58 2jwy s PHE 111 CO -0.07 -0.62 -0.06 -0.65 -1.34 0.00 0.00 175.22 172.47 2jwy s GLN 112 N -3.93 1.07 -0.58 1.99 -0.21 -1.26 -4.91 119.66 111.82 2jwy s GLN 112 Ca 0.13 -0.18 -0.27 0.00 0.02 0.00 0.00 55.36 55.05 2jwy s GLN 112 Cb 0.04 -1.00 0.03 0.00 1.00 0.00 0.00 33.01 33.08 2jwy s GLN 112 CO -0.04 -0.06 1.15 -1.21 -2.12 0.00 0.00 175.29 173.01 2jwy s GLU 113 N 0.88 3.47 0.27 2.91 8.01 -1.26 -2.65 118.70 130.34 2jwy s GLU 113 Ca -0.11 0.15 0.09 0.00 0.01 0.00 0.00 54.97 55.10 2jwy s GLU 113 Cb -0.15 -4.03 -0.04 0.00 -4.31 0.00 0.00 34.13 25.61 2jwy s GLU 113 CO 0.01 -1.66 0.06 0.96 0.01 0.00 0.00 175.26 174.63 2jwy s ILE 114 N 4.81 3.67 -2.06 -1.63 -4.36 0.31 -4.65 121.20 117.28 2jwy s ILE 114 Ca 0.41 -1.77 0.00 0.00 -0.26 0.00 0.00 60.65 59.03 2jwy s ILE 114 Cb -0.08 -2.99 0.00 0.00 1.25 0.00 0.00 42.46 40.63 2jwy s ILE 114 CO 0.24 -0.36 0.00 0.59 0.24 0.00 0.00 174.94 175.66 2jwy n ASN 115 N -0.99 -5.27 -4.76 4.36 3.02 -1.26 -0.88 115.26 109.48 2jwy n ASN 115 Ca -0.06 0.44 -0.40 0.00 -0.03 0.00 0.00 54.58 54.53 2jwy n ASN 115 Cb 0.59 -4.65 -0.06 0.00 -0.61 0.00 0.00 39.78 35.05 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 -2.72 4.49 0.29 2.41 0.11 -1.26 -4.51 120.40 119.22 2jwy s VAL 116 Ca 0.00 1.70 0.11 0.00 -2.93 0.00 0.00 61.98 60.86 2jwy s VAL 116 Cb 0.00 -4.14 -0.05 0.00 -1.53 0.00 0.00 36.38 30.66 2jwy s VAL 116 CO 0.00 0.46 -0.12 -1.10 -3.33 0.00 0.00 175.10 171.01 2jwy s GLN 117 N -0.73 1.88 0.12 1.54 -0.21 -0.02 -4.92 119.66 117.33 2jwy s GLN 117 Ca 0.37 -1.70 0.06 0.00 0.02 0.00 0.00 55.36 54.11 2jwy s GLN 117 Cb -0.22 -1.87 -0.04 0.00 1.00 0.00 0.00 33.01 31.88 2jwy s GLN 117 CO 0.25 0.29 -0.03 0.54 -2.12 0.00 0.00 175.29 174.23 2jwy s ASN 118 N -3.58 4.76 -0.06 5.90 4.22 -1.26 -1.06 114.94 123.85 2jwy s ASN 118 Ca 0.31 -0.31 -0.11 0.00 -2.14 0.00 0.00 52.86 50.60 2jwy s ASN 118 Cb -0.04 -1.03 0.02 0.00 1.28 0.00 0.00 41.25 41.48 2jwy s ASN 118 CO 0.17 0.15 0.28 -1.58 -2.04 0.00 0.00 177.10 174.07 2jwy s GLN 119 N -2.51 0.48 -0.38 3.55 0.74 -0.28 -4.97 119.66 116.29 2jwy s GLN 119 Ca 0.25 0.07 -0.14 0.00 0.05 0.00 0.00 55.36 55.60 2jwy s GLN 119 Cb -0.11 0.22 0.01 0.00 1.10 0.00 0.00 33.01 34.23 2jwy s GLN 119 CO 0.17 -0.10 0.26 -0.51 -0.55 0.00 0.00 175.29 174.56 2jwy s LEU 120 N -0.61 4.82 -0.32 3.68 1.43 -1.26 -1.00 118.68 125.43 2jwy s LEU 120 Ca -0.07 -0.74 -0.17 0.00 -1.03 0.00 0.00 54.13 52.13 2jwy s LEU 120 Cb -0.04 -2.13 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 2jwy s LEU 120 CO 0.02 -0.36 0.45 0.27 0.23 0.00 0.00 176.35 176.96 2jwy s ILE 121 N 1.68 5.09 -0.45 -0.59 -4.36 -0.56 -4.90 121.20 117.10 2jwy s ILE 121 Ca 0.05 0.42 -0.13 0.00 -0.26 0.00 0.00 60.65 60.73 2jwy s ILE 121 Cb -0.18 -3.86 0.07 0.00 1.25 0.00 0.00 42.46 39.74 2jwy s ILE 121 CO 0.10 -0.06 0.34 0.20 0.24 0.00 0.00 174.94 175.75 2jwy s ASN 122 N 1.70 5.97 0.19 4.36 -0.87 -1.26 -1.40 114.94 123.62 2jwy s ASN 122 Ca 0.17 -1.33 -0.13 0.00 -1.57 0.00 0.00 52.86 49.99 2jwy s ASN 122 Cb -0.16 -2.12 -0.07 0.00 -0.02 0.00 0.00 41.25 38.89 2jwy s ASN 122 CO 0.12 -0.59 0.57 0.00 -2.57 0.00 0.00 177.10 174.63 2jwy s ALA 123 N 1.58 3.55 0.95 0.60 0.00 0.66 -4.99 121.76 124.10 2jwy s ALA 123 Ca 0.04 -0.14 -0.12 0.00 0.00 0.00 0.00 51.96 51.73 2jwy s ALA 123 Cb -0.23 -2.53 0.16 0.00 0.00 0.00 0.00 23.12 20.52 2jwy s ALA 123 CO 0.06 0.46 1.12 -1.25 0.00 0.00 0.00 175.76 176.14 2jwy s PRO 124 N -2.27 0.85 -0.13 0.00 0.04 -1.26 -2.84 135.00 129.39 2jwy s PRO 124 Ca 0.42 0.38 -0.21 0.00 0.04 0.00 0.00 61.00 61.63 2jwy s PRO 124 Cb -0.14 -1.80 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 2jwy s PRO 124 CO 0.20 -2.42 0.61 0.00 0.04 0.00 0.00 177.00 175.43 2jwy s ALA 125 N -3.15 3.45 0.03 8.56 0.00 -1.26 -4.12 121.76 125.27 2jwy s ALA 125 Ca 0.64 -0.10 -0.23 0.00 0.00 0.00 0.00 51.96 52.27 2jwy s ALA 125 Cb -0.16 -2.86 -0.06 0.00 0.00 0.00 0.00 23.12 20.04 2jwy s ALA 125 CO 0.55 -0.22 0.70 0.45 0.00 0.00 0.00 175.76 177.24 2jwy s SER 126 N 0.88 7.13 0.00 0.00 0.15 -0.11 -4.88 113.70 116.88 2jwy s SER 126 Ca 0.31 1.35 0.03 0.00 0.70 0.00 0.00 55.95 58.34 2jwy s SER 126 Cb -0.16 -2.43 0.04 0.00 -1.71 0.00 0.00 66.02 61.76 2jwy s SER 126 CO 0.13 0.06 0.78 1.33 1.20 0.00 0.00 173.24 176.74 2jwy n VAL 127 N 2.70 0.41 -4.28 4.45 0.24 -1.26 -4.26 118.33 116.33 2jwy n VAL 127 Ca -0.04 -0.70 -0.15 0.00 -2.04 0.00 0.00 64.34 61.40 2jwy n VAL 127 Cb 0.50 0.83 -0.10 0.00 -1.47 0.00 0.00 33.84 33.60 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 -0.54 1.46 0.05 1.34 1.43 -1.26 -4.89 118.68 116.27 2jwy s LEU 128 Ca 0.04 -1.40 0.08 0.00 -1.03 0.00 0.00 54.13 51.82 2jwy s LEU 128 Cb 0.02 0.17 -0.03 0.00 0.03 0.00 0.00 46.19 46.39 2jwy s LEU 128 CO 0.04 -0.78 -0.22 0.00 0.23 0.00 0.00 176.35 175.61 2jwy s ALA 129 N -3.89 1.88 0.59 4.21 0.00 -1.26 -3.54 121.76 119.75 2jwy s ALA 129 Ca 0.38 -1.13 -0.15 0.00 0.00 0.00 0.00 51.96 51.06 2jwy s ALA 129 Cb 0.07 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 2jwy s ALA 129 CO 0.13 0.42 1.03 -1.25 0.00 0.00 0.00 175.76 176.10 2jwy s PRO 130 N -1.29 3.50 -1.05 0.00 0.04 -1.26 -5.07 135.00 129.87 2jwy s PRO 130 Ca 0.08 1.03 -0.13 0.00 0.04 0.00 0.00 61.00 62.02 2jwy s PRO 130 Cb -0.09 -2.07 0.21 0.00 0.04 0.00 0.00 34.50 32.59 2jwy s PRO 130 CO 0.02 -0.65 1.14 0.45 0.04 0.00 0.00 177.00 178.01 2jwy s SER 131 N -3.21 7.03 -0.27 6.66 0.15 -0.91 -4.95 113.70 118.19 2jwy s SER 131 Ca 0.60 -3.00 0.03 0.00 0.70 0.00 0.00 55.95 54.28 2jwy s SER 131 Cb -0.13 -2.30 0.07 0.00 -1.71 0.00 0.00 66.02 61.95 2jwy s SER 131 CO 0.40 -0.60 -0.09 1.51 1.20 0.00 0.00 173.24 175.66 2jwy s ASP 132 N 2.29 4.50 0.07 5.45 -4.77 -1.26 -1.13 116.67 121.82 2jwy s ASP 132 Ca 0.32 -1.50 -0.11 0.00 -3.30 0.00 0.00 52.55 47.96 2jwy s ASP 132 Cb -0.07 -1.56 -0.06 0.00 -1.09 0.00 0.00 42.92 40.14 2jwy s ASP 132 CO -0.06 -0.22 0.42 -0.69 0.70 0.00 0.00 175.17 175.32 2jwy s VAL 133 N 1.08 5.05 -0.19 2.11 1.01 -0.09 -4.86 120.40 124.50 2jwy s VAL 133 Ca -0.06 0.58 -0.01 0.00 0.00 0.00 0.00 61.98 62.49 2jwy s VAL 133 Cb -0.20 -3.67 0.01 0.00 0.00 0.00 0.00 36.38 32.52 2jwy s VAL 133 CO -0.05 0.34 -0.14 -1.81 0.00 0.00 0.00 175.10 173.44 2jwy s ASP 134 N -1.62 3.63 -0.07 3.32 1.01 -1.26 -0.19 116.67 121.49 2jwy s ASP 134 Ca 0.32 -0.52 0.01 0.00 0.71 0.00 0.00 52.55 53.06 2jwy s ASP 134 Cb -0.15 -1.58 0.02 0.00 1.01 0.00 0.00 42.92 42.22 2jwy s ASP 134 CO 0.17 0.01 -0.06 0.27 0.21 0.00 0.00 175.17 175.78 2jwy s ILE 135 N 1.23 0.73 -0.22 0.77 -4.36 -0.70 -5.00 121.20 113.66 2jwy s ILE 135 Ca 0.03 -0.18 -0.29 0.00 -0.26 0.00 0.00 60.65 59.95 2jwy s ILE 135 Cb -0.14 -0.75 -0.02 0.00 1.25 0.00 0.00 42.46 42.79 2jwy s ILE 135 CO -0.07 0.29 1.55 -2.16 0.24 0.00 0.00 174.94 174.79 2jwy s PRO 136 N 1.24 3.87 -0.42 0.37 0.04 -1.26 -0.53 135.00 138.30 2jwy s PRO 136 Ca -0.05 1.64 -0.20 0.00 0.04 0.00 0.00 61.00 62.42 2jwy s PRO 136 Cb -0.14 -3.99 0.02 0.00 0.04 0.00 0.00 34.50 30.43 2jwy s PRO 136 CO -0.02 -1.20 0.63 -1.17 0.04 0.00 0.00 177.00 175.28 2jwy s LEU 137 N 4.89 4.46 -0.51 -3.56 0.20 0.11 -4.91 118.68 119.36 2jwy s LEU 137 Ca 0.68 -0.25 -0.15 0.00 0.69 0.00 0.00 54.13 55.11 2jwy s LEU 137 Cb -0.24 -2.73 0.11 0.00 -0.43 0.00 0.00 46.19 42.91 2jwy s LEU 137 CO 0.27 -0.73 0.44 -1.58 -0.29 0.00 0.00 176.35 174.46 2jwy s GLN 138 N 2.77 2.89 0.25 1.98 0.74 -1.26 -1.69 119.66 125.34 2jwy s GLN 138 Ca 0.23 -1.63 -0.12 0.00 0.05 0.00 0.00 55.36 53.88 2jwy s GLN 138 Cb -0.14 -4.18 -0.08 0.00 1.10 0.00 0.00 33.01 29.71 2jwy s GLN 138 CO 0.18 -1.23 0.61 -0.51 -0.55 0.00 0.00 175.29 173.79 2jwy s LEU 139 N 1.57 4.17 0.13 3.68 1.43 0.01 -4.96 118.68 124.70 2jwy s LEU 139 Ca 0.04 1.07 0.10 0.00 -1.03 0.00 0.00 54.13 54.30 2jwy s LEU 139 Cb -0.28 -3.74 -0.04 0.00 0.03 0.00 0.00 46.19 42.16 2jwy s LEU 139 CO 0.03 -0.09 -0.24 -0.54 0.23 0.00 0.00 176.35 175.74 2jwy s LYS 140 N -2.72 1.31 -1.46 1.70 1.02 -1.26 -1.24 119.74 117.09 2jwy s LYS 140 Ca 0.48 -1.30 0.00 0.00 0.02 0.00 0.00 55.97 55.17 2jwy s LYS 140 Cb -0.12 -1.71 0.00 0.00 -0.52 0.00 0.00 37.83 35.49 2jwy s LYS 140 CO 0.20 0.40 0.00 0.41 -0.92 0.00 0.00 175.35 175.44 2jwy n GLY 141 N 0.89 -0.12 3.58 -3.33 0.00 -0.71 -4.88 105.19 100.62 2jwy n GLY 141 Ca -0.18 -0.19 -0.11 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.81 -0.00 0.05 -0.61 2.07 -1.26 -5.07 121.20 113.56 2jwy s ILE 142 Ca 0.00 0.01 0.00 0.00 -1.41 0.00 0.00 60.65 59.25 2jwy s ILE 142 Cb 0.00 -0.94 -0.04 0.00 0.13 0.00 0.00 42.46 41.61 2jwy s ILE 142 CO 0.00 0.00 0.17 -0.44 -1.91 0.00 0.00 174.94 172.76 2jwy s SER 143 N 0.96 6.15 0.15 4.50 0.01 -1.26 -3.18 113.70 121.03 2jwy s SER 143 Ca -0.05 0.22 -0.21 0.00 1.31 0.00 0.00 55.95 57.22 2jwy s SER 143 Cb -0.05 -1.85 0.03 0.00 0.21 0.00 0.00 66.02 64.36 2jwy s SER 143 CO -0.09 0.20 1.65 1.62 0.41 0.00 0.00 173.24 177.03 2jwy h VAL 144 N 2.40 0.50 0.00 3.43 3.04 -1.91 0.17 116.25 123.88 2jwy h VAL 144 Ca -0.46 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.23 2jwy h VAL 144 Cb 1.17 0.50 0.00 0.00 -2.01 0.00 0.00 31.29 30.95 2jwy h VAL 144 CO 0.72 0.00 0.00 -0.78 -1.01 0.00 0.00 177.57 176.50 2jwy h ASP 145 N -0.16 0.00 -0.01 3.17 3.58 -1.99 -2.50 116.42 118.51 2jwy h ASP 145 Ca 0.14 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.59 2jwy h ASP 145 Cb 0.38 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.43 2jwy h ASP 145 CO -0.35 0.00 -0.15 0.00 -2.88 0.00 0.00 179.24 175.85 2jwy n GLN 146 N -2.69 1.86 -2.68 0.28 1.13 -0.40 -4.94 117.38 109.93 2jwy n GLN 146 Ca 0.02 -1.49 -0.42 0.00 -1.94 0.00 0.00 57.00 53.17 2jwy n GLN 146 Cb 0.31 -1.47 -0.03 0.00 0.11 0.00 0.00 30.24 29.16 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 -2.17 4.35 -0.17 1.08 0.20 0.47 -4.81 118.68 117.64 2jwy s LEU 147 Ca 0.26 1.67 -0.13 0.00 0.69 0.00 0.00 54.13 56.62 2jwy s LEU 147 Cb 0.19 -3.57 -0.06 0.00 -0.43 0.00 0.00 46.19 42.32 2jwy s LEU 147 CO 0.39 -0.30 -0.17 0.61 -0.29 0.00 0.00 176.35 176.59 2jwy n GLY 148 N 2.95 -0.83 3.18 7.98 0.00 0.85 -4.78 105.19 114.55 2jwy n GLY 148 Ca 0.07 -0.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.41 0.13 -0.31 1.61 -0.71 -0.46 -4.62 117.98 111.21 2jwy s PHE 149 Ca -0.21 -0.47 -0.00 0.00 -1.04 0.00 0.00 56.93 55.21 2jwy s PHE 149 Cb 0.04 -0.06 0.10 0.00 -1.21 0.00 0.00 43.02 41.88 2jwy s PHE 149 CO 0.33 -0.48 0.09 0.08 -1.34 0.00 0.00 175.22 173.90 2jwy s VAL 150 N -3.25 1.05 -0.20 -2.49 1.01 0.79 -1.95 120.40 115.36 2jwy s VAL 150 Ca 0.00 -1.51 -0.16 0.00 0.00 0.00 0.00 61.98 60.32 2jwy s VAL 150 Cb 0.02 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 2jwy s VAL 150 CO -0.08 -0.66 0.38 -0.60 0.00 0.00 0.00 175.10 174.14 2jwy s ARG 151 N 1.53 4.17 -0.09 2.72 3.52 0.92 -0.59 118.95 131.13 2jwy s ARG 151 Ca 0.10 0.17 -0.03 0.00 -0.13 0.00 0.00 55.73 55.84 2jwy s ARG 151 Cb -0.17 -3.53 -0.03 0.00 -1.56 0.00 0.00 34.95 29.65 2jwy s ARG 151 CO -0.23 -0.03 0.03 0.42 -0.81 0.00 0.00 175.30 174.69 2jwy s ILE 152 N 1.27 4.58 0.14 4.11 -1.09 -0.21 -0.41 121.20 129.59 2jwy s ILE 152 Ca 0.18 -0.16 -0.25 0.00 -2.23 0.00 0.00 60.65 58.20 2jwy s ILE 152 Cb -0.15 -2.95 0.08 0.00 -1.58 0.00 0.00 42.46 37.86 2jwy s ILE 152 CO 0.08 0.60 1.05 -1.38 -1.23 0.00 0.00 174.94 174.06 2jwy s HIS 153 N -0.93 -0.03 -1.33 3.97 -3.43 -1.10 -1.44 115.29 111.00 2jwy s HIS 153 Ca 0.14 -0.28 -0.08 0.00 -0.80 0.00 0.00 55.06 54.04 2jwy s HIS 153 Cb -0.11 0.65 0.01 0.00 -1.43 0.00 0.00 32.58 31.69 2jwy s HIS 153 CO 0.03 -0.77 1.16 -0.25 -2.00 0.00 0.00 174.74 172.92 2jwy n ASP 154 N -0.80 -6.08 -4.57 7.38 9.92 -1.26 -1.90 116.55 119.24 2jwy n ASP 154 Ca -0.05 -0.54 -0.41 0.00 -0.53 0.00 0.00 54.79 53.26 2jwy n ASP 154 Cb 0.60 -4.99 -0.03 0.00 -0.64 0.00 0.00 41.12 36.07 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 -3.32 3.63 0.06 0.53 -1.09 -1.26 -4.11 121.20 115.64 2jwy s ILE 155 Ca 0.55 0.52 0.08 0.00 -2.23 0.00 0.00 60.65 59.56 2jwy s ILE 155 Cb -0.24 -4.21 -0.03 0.00 -1.58 0.00 0.00 42.46 36.40 2jwy s ILE 155 CO 0.72 -1.02 -0.22 0.00 -1.23 0.00 0.00 174.94 173.20 2jwy s GLN 156 N 5.93 1.37 0.33 2.79 -2.07 0.07 -0.95 119.66 127.13 2jwy s GLN 156 Ca 0.59 -1.03 -0.28 0.00 -1.82 0.00 0.00 55.36 52.82 2jwy s GLN 156 Cb -0.13 -1.55 -0.09 0.00 -1.09 0.00 0.00 33.01 30.15 2jwy s GLN 156 CO 0.25 0.39 1.16 -1.25 -1.32 0.00 0.00 175.29 174.52 2jwy s PRO 157 N -1.40 4.40 0.35 9.60 0.04 -1.26 -0.31 135.00 146.42 2jwy s PRO 157 Ca 0.08 1.89 0.02 0.00 0.04 0.00 0.00 61.00 63.03 2jwy s PRO 157 Cb -0.09 -2.99 -0.02 0.00 0.04 0.00 0.00 34.50 31.43 2jwy s PRO 157 CO 0.03 -0.03 0.54 0.14 0.04 0.00 0.00 177.00 177.71 2jwy s VAL 158 N -1.25 4.80 -1.82 -0.36 -7.23 -0.57 -4.24 120.40 109.72 2jwy s VAL 158 Ca 0.49 -0.59 0.00 0.00 -1.81 0.00 0.00 61.98 60.07 2jwy s VAL 158 Cb -0.33 -3.74 0.00 0.00 0.56 0.00 0.00 36.38 32.87 2jwy s VAL 158 CO 0.42 -0.45 0.00 0.23 -0.31 0.00 0.00 175.10 175.00 2jwy n MET 159 N -1.78 -1.43 -2.45 4.82 2.81 -1.26 -4.84 117.12 112.99 2jwy n MET 159 Ca -0.04 1.05 -0.35 0.00 -1.81 0.00 0.00 57.70 56.55 2jwy n MET 159 Cb 0.57 -5.48 -0.02 0.00 -0.71 0.00 0.00 33.22 27.57 2jwy n MET 159 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 2jwy s GLN 160 N -4.30 3.69 0.59 0.03 0.00 -1.26 -5.04 119.66 113.37 2jwy s GLN 160 Ca 0.00 1.46 -0.14 0.00 -0.00 0.00 0.00 55.36 56.68 2jwy s GLN 160 Cb 0.00 -2.11 -0.05 0.00 0.00 0.00 0.00 33.01 30.85 2jwy s GLN 160 CO 0.00 -0.54 1.02 -1.17 0.00 0.00 0.00 175.29 174.60 2jwy s LEU 161 N -3.50 3.42 0.32 2.60 2.96 -1.26 -5.00 118.68 118.22 2jwy s LEU 161 Ca 0.68 1.58 -0.29 0.00 -0.22 0.00 0.00 54.13 55.88 2jwy s LEU 161 Cb -0.19 -4.50 -0.11 0.00 0.50 0.00 0.00 46.19 41.88 2jwy s LEU 161 CO 0.23 -0.91 1.55 -1.83 -1.32 0.00 0.00 176.35 174.07 2jwy s GLU 162 N -4.52 4.12 -0.37 1.98 -1.05 -1.26 -5.00 118.70 112.60 2jwy s GLU 162 Ca 0.59 2.57 0.01 0.00 -0.15 0.00 0.00 54.97 57.99 2jwy s GLU 162 Cb -0.12 -3.00 0.15 0.00 -0.44 0.00 0.00 34.13 30.72 2jwy s GLU 162 CO 0.42 -0.59 0.25 -1.01 0.95 0.00 0.00 175.26 175.28 2jwy s HIS 163 N -0.43 0.84 0.05 4.83 3.76 -1.26 -5.13 115.29 117.95 2jwy s HIS 163 Ca 0.59 -1.85 -0.29 0.00 -0.15 0.00 0.00 55.06 53.37 2jwy s HIS 163 Cb -0.47 -0.92 -0.05 0.00 1.11 0.00 0.00 32.58 32.25 2jwy s HIS 163 CO 0.54 -0.83 0.92 -1.01 -0.85 0.00 0.00 174.74 173.51 2jwy s HIS 164 N 0.75 3.73 -0.16 1.40 3.76 -1.26 -5.05 115.29 118.45 2jwy s HIS 164 Ca 0.23 1.68 -0.01 0.00 -0.15 0.00 0.00 55.06 56.80 2jwy s HIS 164 Cb -0.15 -3.03 -0.01 0.00 1.11 0.00 0.00 32.58 30.50 2jwy s HIS 164 CO -0.06 0.12 -0.11 -1.01 -0.85 0.00 0.00 174.74 172.84 2jwy s HIS 165 N 0.44 2.86 -0.11 1.40 3.76 -1.26 -5.12 115.29 117.26 2jwy s HIS 165 Ca 0.47 -0.76 -0.05 0.00 -0.15 0.00 0.00 55.06 54.57 2jwy s HIS 165 Cb -0.22 -1.92 -0.04 0.00 1.11 0.00 0.00 32.58 31.52 2jwy s HIS 165 CO 0.27 -0.32 0.09 -3.38 -0.85 0.00 0.00 174.74 170.55 2jwy s HIS 166 N 0.69 3.44 -2.00 1.40 -3.43 -1.26 -4.99 115.29 109.13 2jwy s HIS 166 Ca -0.05 0.40 0.05 0.00 -0.80 0.00 0.00 55.06 54.66 2jwy s HIS 166 Cb -0.15 -1.88 0.32 0.00 -1.43 0.00 0.00 32.58 29.43 2jwy s HIS 166 CO 0.02 0.64 1.03 -2.39 -2.00 0.00 0.00 174.74 172.04 2jwy n HIS 167 N 2.04 0.00 -1.43 0.38 1.44 -1.26 -5.37 115.22 111.03 2jwy n HIS 167 Ca -0.19 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.52 2jwy n HIS 167 Cb 0.54 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.65 2jwy n HIS 167 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14