#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 0.05 -0.07 1.12 0.11 -1.26 -5.15 120.40 115.20 2jwy s VAL 2 Ca 0.00 0.23 0.03 0.00 -2.93 0.00 0.00 61.98 59.31 2jwy s VAL 2 Cb 0.00 -0.21 -0.02 0.00 -1.53 0.00 0.00 36.38 34.61 2jwy s VAL 2 CO 0.00 0.15 -0.15 0.00 -3.33 0.00 0.00 175.10 171.77 2jwy s GLN 3 N 1.51 2.68 0.29 1.54 -2.07 -1.26 -5.13 119.66 117.22 2jwy s GLN 3 Ca -0.03 -0.71 0.04 0.00 -1.82 0.00 0.00 55.36 52.84 2jwy s GLN 3 Cb -0.13 -2.41 -0.03 0.00 -1.09 0.00 0.00 33.01 29.35 2jwy s GLN 3 CO -0.03 0.52 0.24 1.14 -1.32 0.00 0.00 175.29 175.84 2jwy s GLN 4 N -0.46 1.58 -0.30 9.60 1.03 -1.26 -5.17 119.66 124.67 2jwy s GLN 4 Ca 0.06 -1.88 -0.16 0.00 0.04 0.00 0.00 55.36 53.42 2jwy s GLN 4 Cb -0.12 0.31 0.17 0.00 0.03 0.00 0.00 33.01 33.40 2jwy s GLN 4 CO 0.02 -0.57 1.04 0.45 -2.54 0.00 0.00 175.29 173.68 2jwy s SER 5 N -3.30 -0.49 0.28 12.60 0.15 -1.26 -5.19 113.70 116.50 2jwy s SER 5 Ca 0.40 0.68 0.02 0.00 0.70 0.00 0.00 55.95 57.75 2jwy s SER 5 Cb 0.04 1.53 -0.01 0.00 -1.71 0.00 0.00 66.02 65.87 2jwy s SER 5 CO 0.22 -0.10 0.07 -0.62 1.20 0.00 0.00 173.24 174.02 2jwy n GLU 6 N 4.79 0.84 -4.46 5.44 -0.58 -1.26 -5.18 120.64 120.23 2jwy n GLU 6 Ca -0.09 -2.29 -0.22 0.00 -0.42 0.00 0.00 57.16 54.13 2jwy n GLU 6 Cb 0.53 1.06 -0.10 0.00 -0.57 0.00 0.00 31.44 32.36 2jwy n GLU 6 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2jwy s VAL 7 N -2.45 1.59 -0.23 2.62 -7.23 -1.26 -5.14 120.40 108.31 2jwy s VAL 7 Ca 0.10 -2.09 -0.06 0.00 -1.81 0.00 0.00 61.98 58.12 2jwy s VAL 7 Cb 0.00 -2.59 -0.03 0.00 0.56 0.00 0.00 36.38 34.33 2jwy s VAL 7 CO 0.07 -0.20 0.03 -0.13 -0.31 0.00 0.00 175.10 174.56 2jwy s ARG 8 N -3.76 3.63 0.67 4.82 0.52 -1.26 -5.11 118.95 118.46 2jwy s ARG 8 Ca 0.32 -0.50 -0.09 0.00 -0.52 0.00 0.00 55.73 54.93 2jwy s ARG 8 Cb 0.05 -3.20 0.02 0.00 0.52 0.00 0.00 34.95 32.34 2jwy s ARG 8 CO 0.13 -0.10 1.03 -0.65 0.02 0.00 0.00 175.30 175.74 2jwy s GLN 9 N 1.34 2.80 0.99 3.54 -0.21 -1.26 -5.09 119.66 121.77 2jwy s GLN 9 Ca 0.05 0.26 -0.17 0.00 0.02 0.00 0.00 55.36 55.52 2jwy s GLN 9 Cb -0.15 -2.10 0.24 0.00 1.00 0.00 0.00 33.01 32.00 2jwy s GLN 9 CO 0.02 -0.96 1.10 0.00 -2.12 0.00 0.00 175.29 173.33 2jwy n MET 10 N -2.88 -1.99 -4.02 2.91 0.00 -1.26 -5.11 117.12 104.78 2jwy n MET 10 Ca 0.06 -1.73 -0.08 0.00 0.00 0.00 0.00 57.70 55.95 2jwy n MET 10 Cb 0.58 -1.35 -0.11 0.00 0.00 0.00 0.00 33.22 32.34 2jwy n MET 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 175.97 174.38 2jwy s LYS 11 N -5.44 0.43 0.03 3.17 0.00 -1.26 -5.16 119.74 111.50 2jwy s LYS 11 Ca 0.66 -0.84 0.07 0.00 0.00 0.00 0.00 55.97 55.86 2jwy s LYS 11 Cb -0.04 0.15 -0.02 0.00 0.00 0.00 0.00 37.83 37.92 2jwy s LYS 11 CO 0.48 -0.08 -0.19 -1.58 0.00 0.00 0.00 175.35 173.98 2jwy s HIS 12 N -2.40 1.71 0.74 1.78 2.46 -1.26 -5.16 115.29 113.16 2jwy s HIS 12 Ca -0.07 -0.35 -0.12 0.00 0.47 0.00 0.00 55.06 54.98 2jwy s HIS 12 Cb -0.03 -1.04 0.18 0.00 -0.13 0.00 0.00 32.58 31.56 2jwy s HIS 12 CO -0.04 0.05 0.72 0.45 -2.47 0.00 0.00 174.74 173.45 2jwy n SER 13 N 2.08 -1.32 -4.41 9.88 2.88 -1.26 -5.08 113.62 116.40 2jwy n SER 13 Ca -0.17 -1.00 -0.30 0.00 -1.33 0.00 0.00 58.87 56.07 2jwy n SER 13 Cb 0.54 -0.63 -0.13 0.00 -0.75 0.00 0.00 64.21 63.23 2jwy n SER 13 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2jwy s VAL 14 N -2.37 2.48 -0.10 2.46 0.11 -1.26 -5.12 120.40 116.60 2jwy s VAL 14 Ca 0.45 -1.38 -0.25 0.00 -2.93 0.00 0.00 61.98 57.87 2jwy s VAL 14 Cb -0.04 -2.04 -0.03 0.00 -1.53 0.00 0.00 36.38 32.75 2jwy s VAL 14 CO 0.34 0.28 0.79 -0.94 -3.33 0.00 0.00 175.10 172.24 2jwy s SER 15 N -1.54 7.02 -0.30 3.54 1.04 -1.26 -5.04 113.70 117.17 2jwy s SER 15 Ca 0.14 1.24 -0.15 0.00 0.48 0.00 0.00 55.95 57.66 2jwy s SER 15 Cb -0.10 -2.45 -0.03 0.00 0.10 0.00 0.00 66.02 63.54 2jwy s SER 15 CO 0.05 -0.25 0.39 0.42 0.98 0.00 0.00 173.24 174.83 2jwy s THR 16 N 1.36 5.15 0.61 2.02 -4.23 -1.26 -5.07 115.64 114.22 2jwy s THR 16 Ca 0.40 0.44 -0.17 0.00 -1.18 0.00 0.00 61.69 61.18 2jwy s THR 16 Cb -0.18 -3.76 -0.02 0.00 1.34 0.00 0.00 72.50 69.88 2jwy s THR 16 CO 0.17 0.05 1.12 -0.76 -0.54 0.00 0.00 174.62 174.66 2jwy s LEU 17 N 2.11 3.53 -0.27 4.79 1.43 -1.26 -4.99 118.68 124.02 2jwy s LEU 17 Ca 0.15 2.06 -0.24 0.00 -1.03 0.00 0.00 54.13 55.07 2jwy s LEU 17 Cb -0.16 -4.56 -0.00 0.00 0.03 0.00 0.00 46.19 41.50 2jwy s LEU 17 CO 0.11 -1.46 0.82 0.54 0.23 0.00 0.00 176.35 176.59 2jwy s ASN 18 N -2.28 6.77 0.39 2.29 4.22 -1.26 -5.05 114.94 120.02 2jwy s ASN 18 Ca 0.69 0.90 0.08 0.00 -2.14 0.00 0.00 52.86 52.38 2jwy s ASN 18 Cb -0.22 -2.43 -0.04 0.00 1.28 0.00 0.00 41.25 39.85 2jwy s ASN 18 CO 0.36 -0.56 0.26 -1.10 -2.04 0.00 0.00 177.10 174.01 2jwy s GLN 19 N 2.91 2.41 -0.41 3.55 -1.52 -1.26 -5.04 119.66 120.30 2jwy s GLN 19 Ca 0.34 -1.62 -0.32 0.00 -1.95 0.00 0.00 55.36 51.81 2jwy s GLN 19 Cb -0.15 -2.21 -0.10 0.00 -0.22 0.00 0.00 33.01 30.33 2jwy s GLN 19 CO 0.10 -0.09 2.29 0.39 -0.25 0.00 0.00 175.29 177.73 2jwy n GLU 20 N -1.36 1.14 -1.89 2.91 1.02 -1.26 -4.94 120.64 116.26 2jwy n GLU 20 Ca 0.00 0.25 -0.29 0.00 -0.02 0.00 0.00 57.16 57.11 2jwy n GLU 20 Cb 0.62 -2.71 0.09 0.00 -0.02 0.00 0.00 31.44 29.42 2jwy n GLU 20 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jwy s MET 21 N 6.90 1.99 0.00 3.49 0.23 -1.26 -5.10 119.30 125.54 2jwy s MET 21 Ca 1.08 0.13 0.00 0.00 -1.03 0.00 0.00 55.69 55.87 2jwy s MET 21 Cb -0.66 -1.95 0.00 0.00 -1.53 0.00 0.00 34.83 30.69 2jwy s MET 21 CO 0.42 -1.58 0.00 0.25 -2.03 0.00 0.00 175.02 172.08 2jwy n THR 22 N -3.31 0.00 -0.25 3.16 -2.24 -1.26 -5.12 114.28 105.25 2jwy n THR 22 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 2jwy n THR 22 Cb 0.61 -1.20 0.00 0.00 -2.10 0.00 0.00 70.33 67.63 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 -0.24 0.00 -1.74 -0.78 1.13 -1.26 -4.96 117.38 109.54 2jwy n GLN 23 Ca 0.00 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.64 2jwy n GLN 23 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.34 2jwy n GLN 23 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 2jwy n LEU 24 N 0.00 4.22 -4.64 1.08 7.94 -1.26 -5.01 117.00 119.32 2jwy n LEU 24 Ca 0.00 1.18 -0.26 0.00 -1.11 0.00 0.00 56.01 55.82 2jwy n LEU 24 Cb 0.00 -1.56 -0.08 0.00 0.53 0.00 0.00 43.42 42.31 2jwy n LEU 24 CO 0.00 -0.03 -0.35 0.20 -1.11 0.00 0.00 177.39 176.10 2jwy s ASN 25 N 0.13 4.66 0.32 1.96 0.01 -1.26 -4.98 114.94 115.77 2jwy s ASN 25 Ca 0.59 -0.45 0.05 0.00 -0.71 0.00 0.00 52.86 52.35 2jwy s ASN 25 Cb -0.52 -0.95 0.70 0.00 0.41 0.00 0.00 41.25 40.89 2jwy s ASN 25 CO 0.56 0.09 1.85 1.56 -1.51 0.00 0.00 177.10 179.64 2jwy h GLN 26 N 2.70 0.80 -0.07 -0.60 1.08 -1.98 0.13 115.11 117.16 2jwy h GLN 26 Ca -0.47 -0.05 0.04 0.00 -1.45 0.00 0.00 58.65 56.72 2jwy h GLN 26 Cb 1.21 -0.18 -0.04 0.00 -0.05 0.00 0.00 27.48 28.41 2jwy h GLN 26 CO 0.57 0.53 -0.19 1.49 -0.95 0.00 0.00 178.83 180.28 2jwy h GLU 27 N 0.83 -0.27 0.00 1.46 4.81 -1.95 -1.51 114.58 117.94 2jwy h GLU 27 Ca 0.48 0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.65 2jwy h GLU 27 Cb 0.64 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 2jwy h GLU 27 CO -0.25 -0.18 -0.39 1.15 -0.73 0.00 0.00 179.01 178.61 2jwy h THR 28 N -0.28 1.15 -0.53 0.32 2.02 -1.42 -2.29 112.91 111.88 2jwy h THR 28 Ca 0.08 -1.41 -0.01 0.00 0.77 0.00 0.00 66.41 65.84 2jwy h THR 28 Cb 0.39 1.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.56 2jwy h THR 28 CO -0.23 0.39 0.31 0.58 0.37 0.00 0.00 175.52 176.93 2jwy h VAL 29 N 0.00 1.17 -0.66 3.16 2.07 -0.40 0.16 116.25 121.76 2jwy h VAL 29 Ca -0.00 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 2jwy h VAL 29 Cb 0.76 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 2jwy h VAL 29 CO 0.05 0.18 0.25 0.50 0.02 0.00 0.00 177.57 178.57 2jwy h LYS 30 N 0.71 0.99 -0.26 1.57 1.63 -0.95 -0.86 116.57 119.41 2jwy h LYS 30 Ca 0.19 -0.19 0.04 0.00 -0.85 0.00 0.00 60.65 59.84 2jwy h LYS 30 Cb 0.02 -0.16 -0.04 0.00 -0.60 0.00 0.00 32.23 31.45 2jwy h LYS 30 CO -0.03 0.84 0.03 0.82 -3.45 0.00 0.00 179.45 177.65 2jwy h ILE 31 N 0.93 0.85 -0.77 2.00 2.04 -1.08 -1.81 117.51 119.67 2jwy h ILE 31 Ca 0.22 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 66.07 2jwy h ILE 31 Cb 0.23 0.73 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 2jwy h ILE 31 CO -0.02 0.02 0.49 0.74 0.00 0.00 0.00 178.15 179.39 2jwy h THR 32 N 0.11 1.12 -0.47 -0.27 2.02 -0.30 -0.58 112.91 114.55 2jwy h THR 32 Ca 0.12 -0.33 0.04 0.00 0.77 0.00 0.00 66.41 67.01 2jwy h THR 32 Cb 0.14 0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 66.58 2jwy h THR 32 CO -0.18 0.17 0.23 -0.61 0.37 0.00 0.00 175.52 175.50 2jwy h GLN 33 N 0.96 0.43 -0.08 6.66 4.15 -0.86 0.34 115.11 126.72 2jwy h GLN 33 Ca 0.31 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.72 2jwy h GLN 33 Cb 0.01 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 2jwy h GLN 33 CO -0.11 0.29 -0.02 0.37 -1.93 0.00 0.00 178.83 177.43 2jwy h GLN 34 N 0.45 -0.00 0.00 1.69 4.15 -0.54 -1.12 115.11 119.73 2jwy h GLN 34 Ca 0.21 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.60 2jwy h GLN 34 Cb 0.13 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.81 2jwy h GLN 34 CO -0.15 -0.00 -0.13 -0.91 -1.93 0.00 0.00 178.83 175.71 2jwy h ASN 35 N -0.00 0.00 -0.09 -0.69 4.21 -0.80 0.12 115.58 118.34 2jwy h ASN 35 Ca 0.04 0.00 -0.21 0.00 1.21 0.00 0.00 56.30 57.34 2jwy h ASN 35 Cb 0.06 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.27 2jwy h ASN 35 CO -0.08 0.13 -0.76 0.03 -1.29 0.00 0.00 177.43 175.46 2jwy h ARG 36 N 0.00 0.67 -0.35 0.81 3.08 -0.47 -2.20 114.38 115.93 2jwy h ARG 36 Ca -0.00 -0.61 -0.07 0.00 0.07 0.00 0.00 59.98 59.37 2jwy h ARG 36 Cb 0.28 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 2jwy h ARG 36 CO 0.02 1.21 -0.09 -0.07 -1.07 0.00 0.00 179.97 179.97 2jwy h LEU 37 N 0.34 0.58 -1.27 3.04 3.38 -0.64 -1.96 115.31 118.77 2jwy h LEU 37 Ca -0.07 -0.15 0.02 0.00 0.09 0.00 0.00 57.88 57.77 2jwy h LEU 37 Cb 1.41 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.97 2jwy h LEU 37 CO 0.15 0.71 0.50 -1.13 0.09 0.00 0.00 178.44 178.77 2jwy h ASN 38 N 0.55 0.83 -0.75 -0.43 -0.73 -0.76 -1.58 115.58 112.71 2jwy h ASN 38 Ca 0.10 -0.01 -0.06 0.00 1.87 0.00 0.00 56.30 58.20 2jwy h ASN 38 Cb 0.49 -0.20 -0.03 0.00 0.27 0.00 0.00 38.32 38.85 2jwy h ASN 38 CO 0.03 0.58 0.25 0.00 -0.37 0.00 0.00 177.43 177.92 2jwy h ALA 39 N 1.54 0.98 0.00 1.57 0.00 -0.70 -2.55 119.26 120.11 2jwy h ALA 39 Ca 0.29 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2jwy h ALA 39 Cb -0.02 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 2jwy h ALA 39 CO -0.08 0.65 -0.13 0.87 0.00 0.00 0.00 179.25 180.56 2jwy h LYS 40 N 1.11 0.00 -6.00 0.00 1.57 -1.04 -3.44 116.57 108.77 2jwy h LYS 40 Ca 0.24 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.42 2jwy h LYS 40 Cb 0.28 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.54 2jwy h LYS 40 CO -0.01 0.13 -0.19 0.45 -0.57 0.00 0.00 179.45 179.27 2jwy s SER 41 N -6.03 6.82 0.00 0.86 0.15 -0.64 -5.06 113.70 109.80 2jwy s SER 41 Ca 0.02 0.97 0.00 0.00 0.70 0.00 0.00 55.95 57.63 2jwy s SER 41 Cb 0.09 -2.26 0.00 0.00 -1.71 0.00 0.00 66.02 62.14 2jwy s SER 41 CO 0.61 0.29 0.09 -1.20 1.20 0.00 0.00 173.24 174.23 2jwy n SER 42 N 1.98 0.00 -0.09 5.45 7.64 -1.26 -4.79 113.62 122.54 2jwy n SER 42 Ca -0.13 0.09 -0.15 0.00 1.01 0.00 0.00 58.87 59.68 2jwy n SER 42 Cb 0.52 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.58 2jwy n SER 42 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2jwy n SER 43 N -0.34 1.33 -4.27 6.43 7.64 -1.26 -4.86 113.62 118.29 2jwy n SER 43 Ca 0.00 0.01 -0.29 0.00 1.01 0.00 0.00 58.87 59.60 2jwy n SER 43 Cb 0.00 -0.04 0.17 0.00 -1.01 0.00 0.00 64.21 63.32 2jwy n SER 43 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2jwy s GLY 44 N -5.94 1.77 0.05 0.23 0.00 -1.26 -0.89 107.32 101.27 2jwy s GLY 44 Ca -0.23 -1.26 0.02 0.00 0.00 0.00 0.00 44.72 43.25 2jwy s GLY 44 CO 0.71 -0.54 -0.08 -1.34 0.00 0.00 0.00 173.10 171.86 2jwy s VAL 45 N -3.75 0.59 -0.52 1.40 -7.23 -0.82 -4.79 120.40 105.28 2jwy s VAL 45 Ca 0.72 -1.27 -0.17 0.00 -1.81 0.00 0.00 61.98 59.45 2jwy s VAL 45 Cb -0.04 -0.85 0.10 0.00 0.56 0.00 0.00 36.38 36.14 2jwy s VAL 45 CO 0.51 -0.49 0.51 -0.31 -0.31 0.00 0.00 175.10 175.02 2jwy s TYR 46 N -1.87 3.18 -0.38 2.82 1.51 -1.26 -0.49 117.35 120.85 2jwy s TYR 46 Ca -0.05 -1.01 -0.24 0.00 -1.01 0.00 0.00 57.07 54.76 2jwy s TYR 46 Cb -0.07 -3.58 0.01 0.00 -0.11 0.00 0.00 41.96 38.22 2jwy s TYR 46 CO -0.01 -0.99 0.83 -0.51 -1.11 0.00 0.00 175.55 173.77 2jwy s LEU 47 N 1.92 4.09 -0.35 -1.29 1.43 0.19 -4.78 118.68 119.89 2jwy s LEU 47 Ca 0.06 0.34 -0.21 0.00 -1.03 0.00 0.00 54.13 53.29 2jwy s LEU 47 Cb -0.26 -3.10 0.00 0.00 0.03 0.00 0.00 46.19 42.87 2jwy s LEU 47 CO 0.06 -0.82 0.69 -0.76 0.23 0.00 0.00 176.35 175.75 2jwy s LEU 48 N 3.28 4.20 0.00 1.79 1.02 -1.26 -0.02 118.68 127.69 2jwy s LEU 48 Ca 0.33 0.26 0.00 0.00 0.02 0.00 0.00 54.13 54.74 2jwy s LEU 48 Cb -0.12 -2.88 0.00 0.00 0.02 0.00 0.00 46.19 43.21 2jwy s LEU 48 CO 0.19 -0.63 0.21 -0.81 0.02 0.00 0.00 176.35 175.32 2jwy n PRO 49 N 6.17 0.22 -0.00 1.29 -0.04 -1.26 -1.16 135.00 140.22 2jwy n PRO 49 Ca 0.00 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.53 2jwy n PRO 49 Cb 0.48 -1.02 -0.07 0.00 -0.04 0.00 0.00 33.50 32.85 2jwy n PRO 49 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2jwy n GLY 50 N -0.18 -0.24 3.51 0.55 0.00 -1.26 -4.98 105.19 102.59 2jwy n GLY 50 Ca 0.00 -0.36 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.26 3.10 -1.25 4.61 0.00 -0.31 -4.89 121.76 120.75 2jwy s ALA 51 Ca 0.04 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.13 2jwy s ALA 51 Cb 0.10 -1.72 0.00 0.00 0.00 0.00 0.00 23.12 21.49 2jwy s ALA 51 CO 0.53 0.06 0.60 0.36 0.00 0.00 0.00 175.76 177.31 2jwy n LYS 52 N 3.83 0.96 -3.91 0.00 2.85 -1.26 -4.76 118.16 115.88 2jwy n LYS 52 Ca -0.17 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 56.76 2jwy n LYS 52 Cb 0.52 -1.36 -0.05 0.00 -0.65 0.00 0.00 35.03 33.50 2jwy n LYS 52 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 2jwy s THR 53 N -1.25 5.42 0.61 0.58 -4.23 -1.26 -4.99 115.64 110.52 2jwy s THR 53 Ca 0.00 -0.21 -0.06 0.00 -1.18 0.00 0.00 61.69 60.24 2jwy s THR 53 Cb 0.00 -3.56 0.01 0.00 1.34 0.00 0.00 72.50 70.29 2jwy s THR 53 CO 0.00 0.28 0.92 -2.16 -0.54 0.00 0.00 174.62 173.12 2jwy s PRO 54 N -2.08 2.88 -0.02 3.99 0.04 -1.26 -4.61 135.00 133.94 2jwy s PRO 54 Ca 0.29 0.03 -0.01 0.00 0.04 0.00 0.00 61.00 61.35 2jwy s PRO 54 Cb -0.13 -2.24 0.02 0.00 0.04 0.00 0.00 34.50 32.19 2jwy s PRO 54 CO 0.21 -0.76 0.04 0.00 0.04 0.00 0.00 177.00 176.53 2jwy s ALA 55 N -3.04 -0.01 -0.24 8.56 0.00 0.20 -4.98 121.76 122.25 2jwy s ALA 55 Ca 0.55 0.25 -0.13 0.00 0.00 0.00 0.00 51.96 52.62 2jwy s ALA 55 Cb -0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 2jwy s ALA 55 CO 0.46 -0.08 0.30 0.50 0.00 0.00 0.00 175.76 176.94 2jwy s ARG 56 N 0.67 4.07 0.27 0.00 3.52 -1.26 -0.73 118.95 125.48 2jwy s ARG 56 Ca -0.05 -0.04 0.12 0.00 -0.13 0.00 0.00 55.73 55.62 2jwy s ARG 56 Cb -0.08 -3.59 -0.05 0.00 -1.56 0.00 0.00 34.95 29.67 2jwy s ARG 56 CO -0.02 -0.11 -0.20 -0.48 -0.81 0.00 0.00 175.30 173.68 2jwy s LEU 57 N 1.55 2.57 -0.47 -0.88 0.05 -0.55 -4.95 118.68 115.99 2jwy s LEU 57 Ca 0.13 -1.02 -0.17 0.00 0.05 0.00 0.00 54.13 53.12 2jwy s LEU 57 Cb -0.15 -1.06 0.05 0.00 -2.05 0.00 0.00 46.19 42.98 2jwy s LEU 57 CO 0.08 0.02 0.50 -0.70 -0.55 0.00 0.00 176.35 175.70 2jwy s GLU 58 N -3.46 3.06 0.58 1.48 2.12 -0.07 -2.11 118.70 120.30 2jwy s GLU 58 Ca 0.28 -1.02 0.09 0.00 0.36 0.00 0.00 54.97 54.69 2jwy s GLU 58 Cb -0.05 -4.08 0.09 0.00 0.26 0.00 0.00 34.13 30.35 2jwy s GLU 58 CO 0.14 -1.06 0.80 -1.54 -0.54 0.00 0.00 175.26 173.06 2jwy s SER 59 N 2.43 5.08 0.00 -1.70 1.04 0.29 -4.55 113.70 116.29 2jwy s SER 59 Ca 0.10 -0.83 0.25 0.00 0.48 0.00 0.00 55.95 55.96 2jwy s SER 59 Cb -0.20 0.28 1.52 0.00 0.10 0.00 0.00 66.02 67.72 2jwy s SER 59 CO 0.10 -1.36 1.90 0.00 0.98 0.00 0.00 173.24 174.86 2jwy n GLN 60 N -2.26 0.84 -0.00 4.02 6.02 -0.59 -2.13 117.38 123.28 2jwy n GLN 60 Ca 0.16 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.19 2jwy n GLN 60 Cb 0.62 -1.47 -0.06 0.00 1.02 0.00 0.00 30.24 30.35 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 -0.97 0.00 0.00 5.09 -5.35 -1.26 -4.82 119.36 112.05 2jwy n ILE 61 Ca 0.19 -0.26 0.00 0.00 -0.27 0.00 0.00 62.75 62.41 2jwy n ILE 61 Cb 0.09 0.73 0.00 0.00 -1.74 0.00 0.00 39.64 38.71 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 1.51 0.82 3.71 3.28 0.00 -0.91 -5.07 105.19 108.54 2jwy n GLY 62 Ca 0.00 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 2jwy n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jwy s THR 63 N -2.14 4.31 -0.01 2.61 -4.23 -1.26 -0.55 115.64 114.37 2jwy s THR 63 Ca 0.00 1.66 -0.01 0.00 -1.18 0.00 0.00 61.69 62.16 2jwy s THR 63 Cb 0.00 -4.06 0.01 0.00 1.34 0.00 0.00 72.50 69.79 2jwy s THR 63 CO 0.00 0.12 0.03 -1.48 -0.54 0.00 0.00 174.62 172.75 2jwy s LEU 64 N 1.13 1.76 -0.34 4.79 0.05 -0.90 -3.74 118.68 121.43 2jwy s LEU 64 Ca 0.56 0.06 -0.14 0.00 0.05 0.00 0.00 54.13 54.67 2jwy s LEU 64 Cb -0.26 0.08 -0.02 0.00 -2.05 0.00 0.00 46.19 43.94 2jwy s LEU 64 CO 0.28 -0.03 0.29 -0.60 -0.55 0.00 0.00 176.35 175.74 2jwy s ARG 65 N 0.18 3.52 0.17 1.48 3.52 0.11 -1.49 118.95 126.45 2jwy s ARG 65 Ca -0.01 -0.55 0.07 0.00 -0.13 0.00 0.00 55.73 55.10 2jwy s ARG 65 Cb -0.02 -3.81 -0.04 0.00 -1.56 0.00 0.00 34.95 29.52 2jwy s ARG 65 CO -0.01 -0.48 0.02 -1.64 -0.81 0.00 0.00 175.30 172.38 2jwy s MET 66 N 1.84 2.47 0.07 5.12 -1.94 0.09 -0.48 119.30 126.46 2jwy s MET 66 Ca 0.08 -1.07 -0.26 0.00 -1.71 0.00 0.00 55.69 52.73 2jwy s MET 66 Cb -0.17 -2.40 0.07 0.00 2.01 0.00 0.00 34.83 34.34 2jwy s MET 66 CO 0.11 0.46 0.62 0.45 -0.01 0.00 0.00 175.02 176.65 2jwy s SER 67 N -2.94 -0.59 -0.40 3.03 0.15 -1.04 -0.63 113.70 111.27 2jwy s SER 67 Ca 0.28 0.28 -0.08 0.00 0.70 0.00 0.00 55.95 57.12 2jwy s SER 67 Cb -0.09 0.57 0.07 0.00 -1.71 0.00 0.00 66.02 64.85 2jwy s SER 67 CO 0.19 -0.81 0.23 -0.76 1.20 0.00 0.00 173.24 173.29 2jwy s LEU 68 N -2.11 4.99 0.31 3.45 1.43 -1.26 -1.69 118.68 123.81 2jwy s LEU 68 Ca -0.04 -1.44 0.10 0.00 -1.03 0.00 0.00 54.13 51.72 2jwy s LEU 68 Cb -0.01 -1.96 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 2jwy s LEU 68 CO -0.03 -0.49 -0.03 0.68 0.23 0.00 0.00 176.35 176.70 2jwy s VAL 69 N 1.41 2.81 -1.57 -1.59 -7.23 -0.36 -4.77 120.40 109.11 2jwy s VAL 69 Ca 0.02 -2.03 -0.04 0.00 -1.81 0.00 0.00 61.98 58.12 2jwy s VAL 69 Cb -0.22 -2.72 0.00 0.00 0.56 0.00 0.00 36.38 34.00 2jwy s VAL 69 CO 0.02 -0.28 0.48 0.59 -0.31 0.00 0.00 175.10 175.60 2jwy n ASN 70 N -0.88 -6.00 -4.59 4.85 3.02 -1.26 -0.59 115.26 109.80 2jwy n ASN 70 Ca -0.05 -0.23 -0.42 0.00 -0.03 0.00 0.00 54.58 53.85 2jwy n ASN 70 Cb 0.61 -4.85 -0.02 0.00 -0.61 0.00 0.00 39.78 34.90 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 -3.14 3.77 0.05 2.41 1.01 -1.26 -4.45 121.20 119.60 2jwy s ILE 71 Ca 0.24 0.75 0.03 0.00 0.00 0.00 0.00 60.65 61.66 2jwy s ILE 71 Cb -0.10 -4.15 -0.03 0.00 0.01 0.00 0.00 42.46 38.19 2jwy s ILE 71 CO 0.29 -0.81 -0.10 0.42 0.00 0.00 0.00 174.94 174.75 2jwy s THR 72 N 6.03 0.71 0.50 2.92 -4.23 -0.37 -5.01 115.64 116.20 2jwy s THR 72 Ca 0.63 -1.20 -0.22 0.00 -1.18 0.00 0.00 61.69 59.72 2jwy s THR 72 Cb -0.14 -0.80 -0.06 0.00 1.34 0.00 0.00 72.50 72.83 2jwy s THR 72 CO 0.30 -0.37 1.23 -2.16 -0.54 0.00 0.00 174.62 173.09 2jwy s PRO 73 N -1.76 3.47 0.42 3.99 0.04 -1.26 -0.77 135.00 139.13 2jwy s PRO 73 Ca -0.06 1.92 0.07 0.00 0.04 0.00 0.00 61.00 62.97 2jwy s PRO 73 Cb -0.09 -2.30 -0.06 0.00 0.04 0.00 0.00 34.50 32.09 2jwy s PRO 73 CO 0.01 -0.83 0.14 0.34 0.04 0.00 0.00 177.00 176.70 2jwy s ASP 74 N -1.26 4.30 0.10 6.66 2.15 0.42 -4.63 116.67 124.40 2jwy s ASP 74 Ca 0.68 -1.17 -0.28 0.00 0.43 0.00 0.00 52.55 52.21 2jwy s ASP 74 Cb -0.32 -0.41 -0.11 0.00 -0.30 0.00 0.00 42.92 41.78 2jwy s ASP 74 CO 0.39 -0.55 1.64 0.00 -0.17 0.00 0.00 175.17 176.48 2jwy h ALA 75 N 1.48 -0.54 0.08 3.66 0.00 -1.99 -3.32 119.26 118.63 2jwy h ALA 75 Ca -0.43 -0.07 -0.22 0.00 0.00 0.00 0.00 54.91 54.18 2jwy h ALA 75 Cb 1.25 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 2jwy h ALA 75 CO 0.72 -0.84 -1.15 0.22 0.00 0.00 0.00 179.25 178.20 2jwy h ASP 76 N -0.55 0.25 0.00 0.00 3.58 -1.97 -3.50 116.42 114.24 2jwy h ASP 76 Ca 0.00 -0.81 0.00 0.00 0.42 0.00 0.00 57.03 56.64 2jwy h ASP 76 Cb 0.52 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.49 2jwy h ASP 76 CO -0.08 1.49 0.00 0.61 -2.88 0.00 0.00 179.24 178.38 2jwy n GLY 77 N 1.66 3.33 3.06 -0.78 0.00 -1.25 -3.71 105.19 107.50 2jwy n GLY 77 Ca -0.24 -0.46 -0.13 0.00 0.00 0.00 0.00 46.02 45.20 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 2.13 -0.01 -0.20 2.61 2.01 -0.09 -0.44 115.64 121.64 2jwy s THR 78 Ca 0.00 0.05 -0.05 0.00 0.31 0.00 0.00 61.69 62.00 2jwy s THR 78 Cb 0.00 -0.31 -0.03 0.00 0.01 0.00 0.00 72.50 72.18 2jwy s THR 78 CO 0.00 0.02 0.01 0.42 -0.69 0.00 0.00 174.62 174.38 2jwy s THR 79 N 0.49 4.04 0.24 -0.82 -4.23 0.05 0.12 115.64 115.53 2jwy s THR 79 Ca -0.03 -0.28 0.02 0.00 -1.18 0.00 0.00 61.69 60.22 2jwy s THR 79 Cb -0.05 -2.83 -0.05 0.00 1.34 0.00 0.00 72.50 70.91 2jwy s THR 79 CO -0.02 0.42 0.05 -1.48 -0.54 0.00 0.00 174.62 173.05 2jwy s LEU 80 N 1.03 1.88 -0.25 4.79 0.05 -0.09 -1.24 118.68 124.84 2jwy s LEU 80 Ca 0.02 -1.30 -0.03 0.00 0.05 0.00 0.00 54.13 52.87 2jwy s LEU 80 Cb -0.14 -0.07 0.01 0.00 -2.05 0.00 0.00 46.19 43.94 2jwy s LEU 80 CO 0.02 -0.65 -0.03 -0.89 -0.55 0.00 0.00 176.35 174.25 2jwy s THR 81 N -3.65 3.19 -0.42 5.48 2.01 0.24 -0.11 115.64 122.38 2jwy s THR 81 Ca 0.33 -0.81 -0.19 0.00 0.31 0.00 0.00 61.69 61.32 2jwy s THR 81 Cb 0.07 -2.57 0.02 0.00 0.01 0.00 0.00 72.50 70.03 2jwy s THR 81 CO 0.10 0.25 0.56 -0.22 -0.69 0.00 0.00 174.62 174.63 2jwy s LEU 82 N 1.40 4.61 -0.34 4.42 1.98 0.41 -1.22 118.68 129.94 2jwy s LEU 82 Ca 0.02 -0.42 -0.13 0.00 -2.89 0.00 0.00 54.13 50.72 2jwy s LEU 82 Cb -0.16 -2.60 -0.02 0.00 0.66 0.00 0.00 46.19 44.07 2jwy s LEU 82 CO -0.03 -0.69 0.24 -0.13 -1.89 0.00 0.00 176.35 173.85 2jwy s ARG 83 N 2.55 3.52 0.10 1.98 0.52 -0.68 -1.17 118.95 125.77 2jwy s ARG 83 Ca 0.19 -0.63 -0.07 0.00 -0.52 0.00 0.00 55.73 54.70 2jwy s ARG 83 Cb -0.15 -3.79 -0.05 0.00 0.52 0.00 0.00 34.95 31.47 2jwy s ARG 83 CO 0.17 -0.43 0.37 0.42 0.02 0.00 0.00 175.30 175.84 2jwy s ILE 84 N 1.72 5.16 -0.24 1.52 1.09 0.14 -2.51 121.20 128.08 2jwy s ILE 84 Ca 0.06 0.20 -0.03 0.00 -1.10 0.00 0.00 60.65 59.78 2jwy s ILE 84 Cb -0.17 -3.62 0.11 0.00 -1.06 0.00 0.00 42.46 37.72 2jwy s ILE 84 CO 0.10 0.18 0.25 -1.58 -0.10 0.00 0.00 174.94 173.79 2jwy s GLN 85 N -2.26 0.24 0.00 2.79 0.74 0.36 -1.22 119.66 120.32 2jwy s GLN 85 Ca 0.36 0.09 0.00 0.00 0.05 0.00 0.00 55.36 55.87 2jwy s GLN 85 Cb -0.13 -0.98 0.00 0.00 1.10 0.00 0.00 33.01 33.00 2jwy s GLN 85 CO 0.21 -0.78 0.58 0.41 -0.55 0.00 0.00 175.29 175.16 2jwy n GLY 86 N 5.32 1.25 5.00 2.59 0.00 -0.19 0.09 105.19 119.25 2jwy n GLY 86 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2jwy n GLY 86 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jwy n GLU 87 N 0.54 0.00 -1.85 1.61 2.13 -1.25 -4.67 120.64 117.15 2jwy n GLU 87 Ca 0.00 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.43 2jwy n GLU 87 Cb 0.29 0.00 0.02 0.00 0.27 0.00 0.00 31.44 32.03 2jwy n GLU 87 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2jwy s SER 88 N 0.00 5.67 0.33 4.31 0.01 -1.26 -4.94 113.70 117.82 2jwy s SER 88 Ca 0.00 2.78 0.16 0.00 1.31 0.00 0.00 55.95 60.20 2jwy s SER 88 Cb 0.00 -2.64 0.46 0.00 0.21 0.00 0.00 66.02 64.05 2jwy s SER 88 CO 0.00 -1.30 1.63 0.78 0.41 0.00 0.00 173.24 174.76 2jwy h ASN 89 N 1.95 0.00 -2.59 2.44 2.35 -1.95 -3.34 115.58 114.44 2jwy h ASN 89 Ca -0.51 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 54.68 2jwy h ASN 89 Cb 1.28 0.00 0.07 0.00 0.05 0.00 0.00 38.32 39.71 2jwy h ASN 89 CO 0.59 0.47 0.83 0.47 -1.65 0.00 0.00 177.43 178.14 2jwy n ASP 90 N -3.48 3.36 -4.63 5.81 9.92 -1.26 -3.26 116.55 123.00 2jwy n ASP 90 Ca 0.00 1.10 -0.42 0.00 -0.53 0.00 0.00 54.79 54.93 2jwy n ASP 90 Cb 0.60 -1.49 -0.03 0.00 -0.64 0.00 0.00 41.12 39.56 2jwy n ASP 90 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2jwy s PRO 91 N 0.52 3.72 0.25 -0.24 0.04 -1.26 -4.43 135.00 133.60 2jwy s PRO 91 Ca 0.74 2.32 -0.07 0.00 0.04 0.00 0.00 61.00 64.03 2jwy s PRO 91 Cb -0.60 -4.24 -0.06 0.00 0.04 0.00 0.00 34.50 29.63 2jwy s PRO 91 CO 0.40 -1.43 0.54 -0.51 0.04 0.00 0.00 177.00 176.04 2jwy s LEU 92 N 6.04 4.12 1.22 -3.56 1.43 -1.21 -4.89 118.68 121.83 2jwy s LEU 92 Ca 0.92 0.82 -0.19 0.00 -1.03 0.00 0.00 54.13 54.65 2jwy s LEU 92 Cb -0.38 -3.60 0.29 0.00 0.03 0.00 0.00 46.19 42.53 2jwy s LEU 92 CO 0.38 -0.12 1.07 -2.16 0.23 0.00 0.00 176.35 175.75 2jwy s PRO 93 N -3.12 -1.33 0.88 1.29 0.04 -1.26 -1.42 135.00 130.07 2jwy s PRO 93 Ca 0.46 0.10 -0.11 0.00 0.04 0.00 0.00 61.00 61.48 2jwy s PRO 93 Cb -0.11 -1.57 0.12 0.00 0.04 0.00 0.00 34.50 32.98 2jwy s PRO 93 CO 0.25 -3.82 1.09 0.00 0.04 0.00 0.00 177.00 174.57 2jwy s ALA 94 N -2.83 1.62 -0.07 8.56 0.00 -1.23 -4.39 121.76 123.42 2jwy s ALA 94 Ca 0.70 0.10 -0.28 0.00 0.00 0.00 0.00 51.96 52.48 2jwy s ALA 94 Cb -0.13 -3.25 0.06 0.00 0.00 0.00 0.00 23.12 19.81 2jwy s ALA 94 CO 0.57 -2.32 0.63 -0.59 0.00 0.00 0.00 175.76 174.04 2jwy s PHE 95 N -2.86 -0.60 0.31 0.00 -0.71 -1.16 -0.66 117.98 112.30 2jwy s PHE 95 Ca 0.63 1.09 0.04 0.00 -1.04 0.00 0.00 56.93 57.66 2jwy s PHE 95 Cb -0.19 0.35 -0.06 0.00 -1.21 0.00 0.00 43.02 41.91 2jwy s PHE 95 CO 0.57 -0.55 0.03 -1.54 -1.34 0.00 0.00 175.22 172.40 2jwy s SER 96 N -1.02 2.47 -0.01 1.98 1.04 0.07 -1.26 113.70 116.97 2jwy s SER 96 Ca -0.10 -1.33 -0.30 0.00 0.48 0.00 0.00 55.95 54.70 2jwy s SER 96 Cb -0.01 -0.11 0.11 0.00 0.10 0.00 0.00 66.02 66.11 2jwy s SER 96 CO 0.08 -0.54 1.18 -0.83 0.98 0.00 0.00 173.24 174.11 2jwy s GLY 97 N -3.47 -0.36 -0.32 7.32 0.00 -0.71 -0.39 107.32 109.39 2jwy s GLY 97 Ca 0.34 0.75 -0.13 0.00 0.00 0.00 0.00 44.72 45.69 2jwy s GLY 97 CO 0.14 0.18 0.26 -1.59 0.00 0.00 0.00 173.10 172.09 2jwy s THR 98 N -2.65 5.27 -0.30 0.90 2.01 0.22 -1.45 115.64 119.62 2jwy s THR 98 Ca 0.12 -0.02 -0.06 0.00 0.31 0.00 0.00 61.69 62.04 2jwy s THR 98 Cb 0.02 -3.68 0.02 0.00 0.01 0.00 0.00 72.50 68.87 2jwy s THR 98 CO -0.03 0.06 0.07 0.68 -0.69 0.00 0.00 174.62 174.70 2jwy s VAL 99 N 1.80 3.74 -0.41 3.82 -7.23 -0.00 -2.04 120.40 120.08 2jwy s VAL 99 Ca 0.08 -0.90 -0.17 0.00 -1.81 0.00 0.00 61.98 59.18 2jwy s VAL 99 Cb -0.17 -3.00 0.02 0.00 0.56 0.00 0.00 36.38 33.79 2jwy s VAL 99 CO 0.11 0.00 0.42 -1.61 -0.31 0.00 0.00 175.10 173.71 2jwy s GLU 100 N 1.44 3.16 -0.10 4.82 2.02 -0.30 -0.37 118.70 129.37 2jwy s GLU 100 Ca 0.01 -0.73 -0.02 0.00 0.02 0.00 0.00 54.97 54.24 2jwy s GLU 100 Cb -0.18 -3.94 -0.03 0.00 0.10 0.00 0.00 34.13 30.07 2jwy s GLU 100 CO 0.02 -0.80 0.01 1.52 0.02 0.00 0.00 175.26 176.03 2jwy s TYR 101 N 2.08 3.16 0.00 1.61 1.13 -0.17 -0.43 117.35 124.73 2jwy s TYR 101 Ca 0.11 0.15 0.00 0.00 -1.41 0.00 0.00 57.07 55.93 2jwy s TYR 101 Cb -0.17 -1.83 0.00 0.00 -1.10 0.00 0.00 41.96 38.86 2jwy s TYR 101 CO 0.13 0.41 0.00 0.41 -2.51 0.00 0.00 175.55 173.99 2jwy n GLY 102 N 2.35 1.44 3.81 5.49 0.00 -1.09 -1.15 105.19 116.04 2jwy n GLY 102 Ca -0.18 -0.77 -0.24 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.38 2.91 0.02 1.61 -0.21 0.45 -0.46 119.66 123.61 2jwy s GLN 103 Ca 0.00 -0.96 0.08 0.00 0.02 0.00 0.00 55.36 54.50 2jwy s GLN 103 Cb 0.00 -2.60 -0.02 0.00 1.00 0.00 0.00 33.01 31.38 2jwy s GLN 103 CO 0.00 0.44 -0.24 0.42 -2.12 0.00 0.00 175.29 173.79 2jwy s ILE 104 N -1.94 1.93 -0.26 1.08 1.01 -1.26 -0.76 121.20 121.00 2jwy s ILE 104 Ca 0.32 -1.19 -0.04 0.00 0.00 0.00 0.00 60.65 59.73 2jwy s ILE 104 Cb -0.09 -1.63 0.09 0.00 0.01 0.00 0.00 42.46 40.83 2jwy s ILE 104 CO 0.24 0.40 0.11 0.00 0.00 0.00 0.00 174.94 175.69 2jwy s GLN 105 N -0.95 0.24 0.00 2.79 -2.07 -0.72 -4.96 119.66 113.99 2jwy s GLN 105 Ca 0.10 -0.46 0.00 0.00 -1.82 0.00 0.00 55.36 53.17 2jwy s GLN 105 Cb -0.09 -1.46 0.00 0.00 -1.09 0.00 0.00 33.01 30.36 2jwy s GLN 105 CO 0.01 -0.91 0.00 0.41 -1.32 0.00 0.00 175.29 173.48 2jwy n GLY 106 N 5.21 -0.35 3.32 2.60 0.00 -1.26 -1.56 105.19 113.15 2jwy n GLY 106 Ca -0.06 -1.32 -0.20 0.00 0.00 0.00 0.00 46.02 44.44 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 9.00 0.00 0.25 2.61 -2.24 -0.01 -4.79 114.28 119.11 2jwy n THR 107 Ca 0.00 -1.80 0.09 0.00 -2.27 0.00 0.00 64.05 60.08 2jwy n THR 107 Cb 0.00 -0.29 0.66 0.00 -2.10 0.00 0.00 70.33 68.60 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 0.42 0.85 0.00 2.28 1.08 -1.99 -2.42 117.51 117.73 2jwy h ILE 108 Ca -0.27 -0.39 -0.02 0.00 -0.39 0.00 0.00 64.86 63.79 2jwy h ILE 108 Cb 1.09 1.23 -0.00 0.00 -3.07 0.00 0.00 36.82 36.06 2jwy h ILE 108 CO 0.42 0.10 -0.14 -0.78 -0.69 0.00 0.00 178.15 177.06 2jwy h ASP 109 N 0.00 0.00 -3.65 1.72 1.82 -2.01 -3.43 116.42 110.87 2jwy h ASP 109 Ca -0.00 -0.37 -0.65 0.00 -0.39 0.00 0.00 57.03 55.62 2jwy h ASP 109 Cb 0.22 0.00 -0.40 0.00 0.68 0.00 0.00 39.33 39.83 2jwy h ASP 109 CO 0.01 0.76 -0.50 0.54 -1.61 0.00 0.00 179.24 178.45 2jwy s ASN 110 N -5.88 4.89 -0.21 2.28 4.22 -1.17 -5.06 114.94 114.00 2jwy s ASN 110 Ca -0.10 -3.47 -0.06 0.00 -2.14 0.00 0.00 52.86 47.09 2jwy s ASN 110 Cb -0.00 -1.70 -0.03 0.00 1.28 0.00 0.00 41.25 40.80 2jwy s ASN 110 CO 0.29 -0.17 0.02 0.72 -2.04 0.00 0.00 177.10 175.92 2jwy s PHE 111 N -0.93 3.06 -0.30 1.54 -0.71 -0.92 -0.83 117.98 118.88 2jwy s PHE 111 Ca 0.22 -0.44 -0.17 0.00 -1.04 0.00 0.00 56.93 55.50 2jwy s PHE 111 Cb -0.13 -2.12 -0.02 0.00 -1.21 0.00 0.00 43.02 39.54 2jwy s PHE 111 CO -0.09 -0.26 0.44 -0.65 -1.34 0.00 0.00 175.22 173.32 2jwy s GLN 112 N 1.12 3.85 -0.65 1.99 -0.21 -0.60 -4.91 119.66 120.24 2jwy s GLN 112 Ca 0.03 -0.02 -0.27 0.00 0.02 0.00 0.00 55.36 55.11 2jwy s GLN 112 Cb -0.14 -3.72 0.01 0.00 1.00 0.00 0.00 33.01 30.16 2jwy s GLN 112 CO 0.02 -0.44 1.44 -1.21 -2.12 0.00 0.00 175.29 172.98 2jwy s GLU 113 N 2.21 3.12 0.12 2.91 2.02 -1.26 -1.75 118.70 126.07 2jwy s GLU 113 Ca 0.17 0.18 0.07 0.00 0.02 0.00 0.00 54.97 55.41 2jwy s GLU 113 Cb -0.16 -4.20 -0.04 0.00 0.10 0.00 0.00 34.13 29.83 2jwy s GLU 113 CO 0.11 -2.19 -0.08 0.96 0.02 0.00 0.00 175.26 174.08 2jwy s ILE 114 N 6.51 3.43 -1.39 -1.63 -4.36 0.06 -4.65 121.20 119.16 2jwy s ILE 114 Ca 0.48 -1.31 -0.06 0.00 -0.26 0.00 0.00 60.65 59.50 2jwy s ILE 114 Cb -0.10 -2.63 0.03 0.00 1.25 0.00 0.00 42.46 41.02 2jwy s ILE 114 CO 0.20 0.06 0.46 0.59 0.24 0.00 0.00 174.94 176.49 2jwy n ASN 115 N 0.54 -4.82 -4.73 4.36 3.02 -1.26 -0.41 115.26 111.96 2jwy n ASN 115 Ca -0.13 -0.26 -0.37 0.00 -0.03 0.00 0.00 54.58 53.80 2jwy n ASN 115 Cb 0.53 -3.95 -0.07 0.00 -0.61 0.00 0.00 39.78 35.68 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 -3.00 5.28 0.07 2.41 0.11 -1.26 -4.23 120.40 119.79 2jwy s VAL 116 Ca 0.30 0.62 0.01 0.00 -2.93 0.00 0.00 61.98 59.98 2jwy s VAL 116 Cb -0.15 -3.66 -0.04 0.00 -1.53 0.00 0.00 36.38 31.00 2jwy s VAL 116 CO 0.37 0.38 -0.06 0.00 -3.33 0.00 0.00 175.10 172.45 2jwy s GLN 117 N 0.49 0.70 0.14 1.54 0.00 -0.30 -4.95 119.66 117.27 2jwy s GLN 117 Ca 0.18 -1.13 0.03 0.00 -0.00 0.00 0.00 55.36 54.45 2jwy s GLN 117 Cb -0.13 -0.17 -0.04 0.00 0.00 0.00 0.00 33.01 32.67 2jwy s GLN 117 CO 0.05 -0.01 0.18 0.54 0.00 0.00 0.00 175.29 176.05 2jwy s ASN 118 N -2.55 5.86 0.06 12.60 2.20 -1.26 -1.00 114.94 130.85 2jwy s ASN 118 Ca 0.04 0.02 0.04 0.00 -0.94 0.00 0.00 52.86 52.02 2jwy s ASN 118 Cb 0.01 -1.65 -0.03 0.00 -2.00 0.00 0.00 41.25 37.58 2jwy s ASN 118 CO -0.04 0.09 -0.11 -1.58 -2.94 0.00 0.00 177.10 172.52 2jwy s GLN 119 N -2.97 0.71 -0.23 3.55 0.74 0.50 -4.96 119.66 116.99 2jwy s GLN 119 Ca 0.32 -0.90 -0.15 0.00 0.05 0.00 0.00 55.36 54.68 2jwy s GLN 119 Cb -0.11 -0.58 -0.04 0.00 1.10 0.00 0.00 33.01 33.38 2jwy s GLN 119 CO 0.25 0.12 0.39 -0.51 -0.55 0.00 0.00 175.29 174.99 2jwy s LEU 120 N -1.75 4.11 -0.13 3.68 1.43 -1.26 -0.82 118.68 123.93 2jwy s LEU 120 Ca -0.04 0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 53.41 2jwy s LEU 120 Cb -0.09 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.61 2jwy s LEU 120 CO 0.01 -0.12 0.13 0.27 0.23 0.00 0.00 176.35 176.87 2jwy s ILE 121 N 1.63 5.41 -0.25 -0.59 -4.36 -0.53 -4.96 121.20 117.55 2jwy s ILE 121 Ca 0.17 0.17 -0.02 0.00 -0.26 0.00 0.00 60.65 60.72 2jwy s ILE 121 Cb -0.15 -3.36 0.08 0.00 1.25 0.00 0.00 42.46 40.28 2jwy s ILE 121 CO 0.08 0.60 0.07 0.20 0.24 0.00 0.00 174.94 176.13 2jwy s ASN 122 N -0.87 3.43 -0.02 4.36 -0.87 -1.26 -1.73 114.94 117.97 2jwy s ASN 122 Ca 0.14 -1.19 -0.14 0.00 -1.57 0.00 0.00 52.86 50.11 2jwy s ASN 122 Cb -0.12 -0.69 -0.05 0.00 -0.02 0.00 0.00 41.25 40.37 2jwy s ASN 122 CO 0.03 -0.36 0.37 0.00 -2.57 0.00 0.00 177.10 174.57 2jwy s ALA 123 N 1.78 3.72 0.87 0.60 0.00 -0.39 -5.01 121.76 123.32 2jwy s ALA 123 Ca 0.04 -0.28 -0.11 0.00 0.00 0.00 0.00 51.96 51.61 2jwy s ALA 123 Cb -0.17 -2.33 0.12 0.00 0.00 0.00 0.00 23.12 20.73 2jwy s ALA 123 CO -0.18 0.48 1.16 -2.14 0.00 0.00 0.00 175.76 175.08 2jwy s PRO 124 N -0.99 1.31 0.10 0.00 0.02 -1.26 -2.99 135.00 131.19 2jwy s PRO 124 Ca 0.22 1.59 -0.31 0.00 0.02 0.00 0.00 61.00 62.52 2jwy s PRO 124 Cb -0.16 -1.76 -0.07 0.00 0.02 0.00 0.00 34.50 32.54 2jwy s PRO 124 CO 0.12 -2.42 1.28 0.00 -0.33 0.00 0.00 177.00 175.64 2jwy s ALA 125 N -2.51 3.48 -0.60 -1.55 0.00 -1.26 -4.43 121.76 114.89 2jwy s ALA 125 Ca 0.68 0.98 -0.20 0.00 0.00 0.00 0.00 51.96 53.42 2jwy s ALA 125 Cb -0.24 -3.48 0.08 0.00 0.00 0.00 0.00 23.12 19.48 2jwy s ALA 125 CO 0.55 -0.50 0.79 -1.12 0.00 0.00 0.00 175.76 175.48 2jwy s SER 126 N 0.95 6.19 0.20 0.00 0.01 -0.51 -4.85 113.70 115.68 2jwy s SER 126 Ca 0.60 -1.15 0.21 0.00 1.31 0.00 0.00 55.95 56.92 2jwy s SER 126 Cb -0.33 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.55 2jwy s SER 126 CO 0.31 -1.20 1.05 1.62 0.41 0.00 0.00 173.24 175.43 2jwy h VAL 127 N 5.94 0.12 -1.80 3.43 3.04 -1.90 -3.20 116.25 121.88 2jwy h VAL 127 Ca -0.29 -1.23 -0.45 0.00 -1.01 0.00 0.00 66.70 63.72 2jwy h VAL 127 Cb 1.08 1.67 -0.01 0.00 -2.01 0.00 0.00 31.29 32.02 2jwy h VAL 127 CO 1.11 0.07 -0.37 -0.76 -1.01 0.00 0.00 177.57 176.61 2jwy s LEU 128 N -5.54 3.87 0.07 3.16 1.43 -1.26 -4.83 118.68 115.58 2jwy s LEU 128 Ca -0.00 -0.27 0.07 0.00 -1.03 0.00 0.00 54.13 52.89 2jwy s LEU 128 Cb 0.09 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 2jwy s LEU 128 CO 0.78 -0.42 -0.14 0.00 0.23 0.00 0.00 176.35 176.80 2jwy s ALA 129 N -2.21 2.77 0.74 4.21 0.00 -1.26 -4.28 121.76 121.72 2jwy s ALA 129 Ca 0.44 -1.22 -0.09 0.00 0.00 0.00 0.00 51.96 51.10 2jwy s ALA 129 Cb -0.09 -0.81 0.07 0.00 0.00 0.00 0.00 23.12 22.29 2jwy s ALA 129 CO 0.30 0.60 1.07 -1.25 0.00 0.00 0.00 175.76 176.48 2jwy s PRO 130 N -1.80 2.12 -1.18 0.00 0.04 -1.26 -5.06 135.00 127.86 2jwy s PRO 130 Ca 0.17 -0.12 -0.18 0.00 0.04 0.00 0.00 61.00 60.91 2jwy s PRO 130 Cb -0.11 -2.09 0.10 0.00 0.04 0.00 0.00 34.50 32.44 2jwy s PRO 130 CO 0.09 -1.36 1.54 -1.12 0.04 0.00 0.00 177.00 176.18 2jwy s SER 131 N -4.54 6.81 -0.09 6.66 0.01 -1.20 -4.91 113.70 116.44 2jwy s SER 131 Ca 0.61 -2.36 -0.02 0.00 1.31 0.00 0.00 55.95 55.49 2jwy s SER 131 Cb -0.11 -2.51 0.03 0.00 0.21 0.00 0.00 66.02 63.64 2jwy s SER 131 CO 0.46 -1.11 0.02 1.51 0.41 0.00 0.00 173.24 174.53 2jwy s ASP 132 N 3.94 1.70 0.13 2.44 -4.77 -1.26 -1.02 116.67 117.83 2jwy s ASP 132 Ca 0.47 -0.17 0.10 0.00 -3.30 0.00 0.00 52.55 49.65 2jwy s ASP 132 Cb 0.00 -0.39 -0.04 0.00 -1.09 0.00 0.00 42.92 41.41 2jwy s ASP 132 CO 0.01 -0.23 -0.24 -0.69 0.70 0.00 0.00 175.17 174.72 2jwy s VAL 133 N 2.01 2.04 -0.24 2.11 1.01 -0.35 -4.95 120.40 122.02 2jwy s VAL 133 Ca 0.04 -1.72 0.01 0.00 0.00 0.00 0.00 61.98 60.32 2jwy s VAL 133 Cb -0.13 -1.84 0.06 0.00 0.00 0.00 0.00 36.38 34.47 2jwy s VAL 133 CO -0.05 -0.01 -0.07 1.51 0.00 0.00 0.00 175.10 176.48 2jwy s ASP 134 N -2.10 3.96 -0.09 3.32 -4.77 -1.26 0.24 116.67 115.97 2jwy s ASP 134 Ca 0.12 -1.21 0.01 0.00 -3.30 0.00 0.00 52.55 48.17 2jwy s ASP 134 Cb -0.10 -1.26 -0.02 0.00 -1.09 0.00 0.00 42.92 40.45 2jwy s ASP 134 CO 0.06 -0.22 -0.11 0.27 0.70 0.00 0.00 175.17 175.87 2jwy s ILE 135 N 1.33 3.32 0.34 2.11 -4.36 -0.32 -4.94 121.20 118.69 2jwy s ILE 135 Ca -0.06 -0.60 -0.23 0.00 -0.26 0.00 0.00 60.65 59.49 2jwy s ILE 135 Cb -0.19 -2.36 -0.10 0.00 1.25 0.00 0.00 42.46 41.06 2jwy s ILE 135 CO -0.06 0.57 0.91 -2.16 0.24 0.00 0.00 174.94 174.44 2jwy s PRO 136 N -0.36 4.42 -0.13 0.37 0.04 -1.26 -0.44 135.00 137.64 2jwy s PRO 136 Ca 0.04 1.19 -0.01 0.00 0.04 0.00 0.00 61.00 62.26 2jwy s PRO 136 Cb -0.12 -2.60 0.04 0.00 0.04 0.00 0.00 34.50 31.85 2jwy s PRO 136 CO 0.02 0.19 -0.03 -0.51 0.04 0.00 0.00 177.00 176.72 2jwy s LEU 137 N -2.43 1.10 -0.74 -3.56 1.43 0.85 -4.92 118.68 110.42 2jwy s LEU 137 Ca 0.53 -0.41 -0.17 0.00 -1.03 0.00 0.00 54.13 53.06 2jwy s LEU 137 Cb -0.15 -0.69 0.15 0.00 0.03 0.00 0.00 46.19 45.53 2jwy s LEU 137 CO 0.20 -0.19 0.78 -1.58 0.23 0.00 0.00 176.35 175.79 2jwy s GLN 138 N 1.80 3.35 -0.44 1.70 0.74 -1.26 -0.91 119.66 124.64 2jwy s GLN 138 Ca 0.03 -1.88 -0.29 0.00 0.05 0.00 0.00 55.36 53.27 2jwy s GLN 138 Cb -0.14 -4.46 0.02 0.00 1.10 0.00 0.00 33.01 29.53 2jwy s GLN 138 CO -0.07 -1.47 1.32 -0.51 -0.55 0.00 0.00 175.29 174.01 2jwy s LEU 139 N 1.61 3.60 0.36 3.68 1.43 0.12 -4.88 118.68 124.61 2jwy s LEU 139 Ca 0.17 0.70 -0.17 0.00 -1.03 0.00 0.00 54.13 53.80 2jwy s LEU 139 Cb -0.16 -3.54 -0.09 0.00 0.03 0.00 0.00 46.19 42.42 2jwy s LEU 139 CO -0.03 -1.38 0.81 -0.54 0.23 0.00 0.00 176.35 175.44 2jwy s LYS 140 N 4.78 4.05 -0.36 1.70 1.02 -1.26 -0.92 119.74 128.76 2jwy s LYS 140 Ca 0.57 0.80 0.00 0.00 0.02 0.00 0.00 55.97 57.36 2jwy s LYS 140 Cb -0.11 -2.35 0.00 0.00 -0.52 0.00 0.00 37.83 34.85 2jwy s LYS 140 CO 0.32 0.08 0.00 0.41 -0.92 0.00 0.00 175.35 175.24 2jwy n GLY 141 N -0.54 0.58 2.95 -3.33 0.00 -1.24 -4.90 105.19 98.72 2jwy n GLY 141 Ca 0.05 -0.24 -0.14 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.87 -0.09 0.28 -0.61 2.07 -1.26 -5.01 121.20 114.72 2jwy s ILE 142 Ca 0.00 0.20 -0.20 0.00 -1.41 0.00 0.00 60.65 59.24 2jwy s ILE 142 Cb 0.00 -0.30 -0.09 0.00 0.13 0.00 0.00 42.46 42.20 2jwy s ILE 142 CO 0.00 0.08 0.79 -0.44 -1.91 0.00 0.00 174.94 173.46 2jwy s SER 143 N 1.38 7.03 0.40 4.50 0.01 -1.26 -2.66 113.70 123.10 2jwy s SER 143 Ca -0.07 1.49 0.10 0.00 1.31 0.00 0.00 55.95 58.78 2jwy s SER 143 Cb -0.11 -2.45 0.91 0.00 0.21 0.00 0.00 66.02 64.58 2jwy s SER 143 CO -0.07 -0.08 1.97 1.62 0.41 0.00 0.00 173.24 177.10 2jwy h VAL 144 N 2.46 0.95 -0.33 3.43 3.04 -1.93 0.44 116.25 124.31 2jwy h VAL 144 Ca -0.48 -0.19 0.01 0.00 -1.01 0.00 0.00 66.70 65.04 2jwy h VAL 144 Cb 1.19 0.35 -0.02 0.00 -2.01 0.00 0.00 31.29 30.80 2jwy h VAL 144 CO 0.65 0.10 0.22 -0.78 -1.01 0.00 0.00 177.57 176.75 2jwy h ASP 145 N 0.55 0.34 -0.34 3.17 3.58 -1.99 -2.09 116.42 119.63 2jwy h ASP 145 Ca 0.29 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.73 2jwy h ASP 145 Cb 0.41 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.38 2jwy h ASP 145 CO -0.09 0.24 0.00 0.00 -2.88 0.00 0.00 179.24 176.51 2jwy n GLN 146 N -4.49 2.33 -2.05 0.28 1.13 0.11 -4.85 117.38 109.84 2jwy n GLN 146 Ca 0.02 -2.01 -0.35 0.00 -1.94 0.00 0.00 57.00 52.72 2jwy n GLN 146 Cb 0.10 -1.48 -0.04 0.00 0.11 0.00 0.00 30.24 28.93 2jwy n GLN 146 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2jwy s LEU 147 N -1.49 3.25 0.00 1.08 1.43 -0.79 -4.23 118.68 117.93 2jwy s LEU 147 Ca 0.37 -0.01 -0.17 0.00 -1.03 0.00 0.00 54.13 53.28 2jwy s LEU 147 Cb 0.21 -2.54 -0.34 0.00 0.03 0.00 0.00 46.19 43.55 2jwy s LEU 147 CO 0.30 -2.48 0.95 1.23 0.23 0.00 0.00 176.35 176.58 2jwy h GLY 148 N 16.83 0.54 -3.39 -3.19 0.00 -1.09 -3.43 103.07 109.34 2jwy h GLY 148 Ca -0.14 -1.39 0.00 0.00 0.00 0.00 0.00 47.33 45.80 2jwy h GLY 148 CO 1.22 1.22 0.28 -0.11 0.00 0.00 0.00 176.54 179.15 2jwy s PHE 149 N -2.55 -0.52 -0.32 5.60 -0.71 -1.00 -4.69 117.98 113.78 2jwy s PHE 149 Ca -0.11 0.51 0.03 0.00 -1.04 0.00 0.00 56.93 56.32 2jwy s PHE 149 Cb 0.03 0.51 0.10 0.00 -1.21 0.00 0.00 43.02 42.45 2jwy s PHE 149 CO 0.91 -0.70 0.05 0.08 -1.34 0.00 0.00 175.22 174.21 2jwy s VAL 150 N -2.86 1.89 -0.58 -2.49 1.01 0.96 -2.66 120.40 115.67 2jwy s VAL 150 Ca -0.01 -2.01 -0.26 0.00 0.00 0.00 0.00 61.98 59.70 2jwy s VAL 150 Cb -0.01 -2.37 0.04 0.00 0.00 0.00 0.00 36.38 34.04 2jwy s VAL 150 CO -0.06 -0.56 1.05 -0.60 0.00 0.00 0.00 175.10 174.93 2jwy s ARG 151 N 1.11 3.36 -0.24 2.72 3.52 0.42 -0.64 118.95 129.21 2jwy s ARG 151 Ca 0.09 -0.14 -0.19 0.00 -0.13 0.00 0.00 55.73 55.35 2jwy s ARG 151 Cb -0.19 -4.06 -0.02 0.00 -1.56 0.00 0.00 34.95 29.12 2jwy s ARG 151 CO -0.12 -1.62 0.58 0.42 -0.81 0.00 0.00 175.30 173.75 2jwy s ILE 152 N 4.41 5.04 0.38 4.11 -1.09 0.35 -1.15 121.20 133.25 2jwy s ILE 152 Ca 0.34 1.04 -0.15 0.00 -2.23 0.00 0.00 60.65 59.65 2jwy s ILE 152 Cb -0.11 -3.89 0.05 0.00 -1.58 0.00 0.00 42.46 36.93 2jwy s ILE 152 CO 0.20 0.09 0.77 -1.38 -1.23 0.00 0.00 174.94 173.38 2jwy s HIS 153 N 2.18 0.16 -1.45 3.97 -3.43 -0.87 -1.95 115.29 113.91 2jwy s HIS 153 Ca 0.25 -0.80 0.00 0.00 -0.80 0.00 0.00 55.06 53.71 2jwy s HIS 153 Cb -0.16 0.78 0.00 0.00 -1.43 0.00 0.00 32.58 31.77 2jwy s HIS 153 CO 0.09 -1.53 0.00 -0.25 -2.00 0.00 0.00 174.74 171.06 2jwy n ASP 154 N -1.35 -4.98 -4.62 7.38 8.00 -1.26 -0.61 116.55 119.10 2jwy n ASP 154 Ca -0.08 0.34 -0.43 0.00 0.71 0.00 0.00 54.79 55.34 2jwy n ASP 154 Cb 0.60 -3.68 -0.03 0.00 -0.02 0.00 0.00 41.12 37.99 2jwy n ASP 154 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2jwy s ILE 155 N -2.40 3.22 0.06 0.53 -1.09 -1.25 -4.34 121.20 115.93 2jwy s ILE 155 Ca 0.00 0.24 0.02 0.00 -2.23 0.00 0.00 60.65 58.68 2jwy s ILE 155 Cb 0.00 -3.24 -0.03 0.00 -1.58 0.00 0.00 42.46 37.61 2jwy s ILE 155 CO 0.00 -0.12 -0.07 0.00 -1.23 0.00 0.00 174.94 173.52 2jwy s GLN 156 N 5.49 0.63 0.18 2.79 -2.07 0.47 -1.54 119.66 125.62 2jwy s GLN 156 Ca 0.89 -0.97 -0.30 0.00 -1.82 0.00 0.00 55.36 53.16 2jwy s GLN 156 Cb -0.32 -0.23 -0.08 0.00 -1.09 0.00 0.00 33.01 31.29 2jwy s GLN 156 CO 0.35 0.02 1.19 -1.25 -1.32 0.00 0.00 175.29 174.28 2jwy s PRO 157 N -2.44 4.50 -0.07 9.60 0.04 -1.26 -0.75 135.00 144.61 2jwy s PRO 157 Ca -0.02 1.87 0.03 0.00 0.04 0.00 0.00 61.00 62.92 2jwy s PRO 157 Cb -0.04 -3.24 0.01 0.00 0.04 0.00 0.00 34.50 31.26 2jwy s PRO 157 CO -0.02 -0.08 -0.16 0.54 0.04 0.00 0.00 177.00 177.32 2jwy s VAL 158 N -0.05 1.42 0.00 -0.36 0.11 0.17 -4.86 120.40 116.83 2jwy s VAL 158 Ca 0.53 -0.67 0.00 0.00 -2.93 0.00 0.00 61.98 58.91 2jwy s VAL 158 Cb -0.32 -1.26 0.00 0.00 -1.53 0.00 0.00 36.38 33.27 2jwy s VAL 158 CO 0.36 0.42 0.00 1.15 -3.33 0.00 0.00 175.10 173.70 2jwy n MET 159 N 3.54 0.00 -1.37 1.54 0.00 -1.26 -3.49 117.12 116.08 2jwy n MET 159 Ca -0.21 0.00 -0.32 0.00 0.00 0.00 0.00 57.70 57.18 2jwy n MET 159 Cb 0.52 0.00 0.08 0.00 0.00 0.00 0.00 33.22 33.83 2jwy n MET 159 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 175.97 177.11 2jwy s GLN 160 N -0.74 2.34 -0.36 3.17 -2.07 -1.26 -4.94 119.66 115.80 2jwy s GLN 160 Ca 0.00 1.26 -0.28 0.00 -1.82 0.00 0.00 55.36 54.52 2jwy s GLN 160 Cb 0.00 -1.90 -0.02 0.00 -1.09 0.00 0.00 33.01 30.00 2jwy s GLN 160 CO 0.00 -1.59 1.85 -0.51 -1.32 0.00 0.00 175.29 173.72 2jwy s LEU 161 N -5.66 3.48 0.54 2.60 1.02 -1.26 -4.94 118.68 114.45 2jwy s LEU 161 Ca 0.63 1.23 -0.20 0.00 0.02 0.00 0.00 54.13 55.81 2jwy s LEU 161 Cb -0.18 -3.37 -0.07 0.00 0.02 0.00 0.00 46.19 42.58 2jwy s LEU 161 CO 0.52 -1.83 0.95 -1.84 0.02 0.00 0.00 176.35 174.17 2jwy n GLU 162 N 8.55 1.04 -1.78 1.70 -0.00 -1.26 -4.85 120.64 124.04 2jwy n GLU 162 Ca 0.24 0.39 -0.39 0.00 -0.00 0.00 0.00 57.16 57.40 2jwy n GLU 162 Cb 0.47 -2.10 -0.02 0.00 -0.00 0.00 0.00 31.44 29.80 2jwy n GLU 162 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2jwy n HIS 163 N -1.31 2.48 -4.12 -1.84 8.25 -1.26 -4.76 115.22 112.66 2jwy n HIS 163 Ca 0.12 -2.85 -0.46 0.00 -0.26 0.00 0.00 57.72 54.27 2jwy n HIS 163 Cb 0.45 -1.99 0.01 0.00 1.12 0.00 0.00 29.99 29.58 2jwy n HIS 163 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2jwy n HIS 164 N 2.19 -1.34 0.09 4.41 1.44 -1.26 -4.87 115.22 115.87 2jwy n HIS 164 Ca 0.66 0.09 0.01 0.00 -2.01 0.00 0.00 57.72 56.48 2jwy n HIS 164 Cb 0.26 -2.73 -0.03 0.00 0.12 0.00 0.00 29.99 27.61 2jwy n HIS 164 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2jwy h HIS 165 N -2.57 0.00 -1.39 -1.40 6.17 -2.01 -3.45 115.15 110.49 2jwy h HIS 165 Ca -0.71 0.00 -0.51 0.00 0.71 0.00 0.00 60.37 59.86 2jwy h HIS 165 Cb 1.40 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 31.32 2jwy h HIS 165 CO 0.38 0.55 1.61 -2.39 0.71 0.00 0.00 177.93 178.79 2jwy n HIS 166 N -3.08 1.41 -2.71 5.26 1.44 -1.26 -3.51 115.22 112.77 2jwy n HIS 166 Ca -0.03 0.13 -0.04 0.00 -2.01 0.00 0.00 57.72 55.77 2jwy n HIS 166 Cb 0.78 -2.61 0.01 0.00 0.12 0.00 0.00 29.99 28.29 2jwy n HIS 166 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2jwy n HIS 167 N 13.99 -3.48 0.34 -1.40 -0.00 -1.26 -5.25 115.22 118.16 2jwy n HIS 167 Ca 0.40 1.47 0.03 0.00 -0.00 0.00 0.00 57.72 59.62 2jwy n HIS 167 Cb 0.43 -3.90 0.16 0.00 -0.00 0.00 0.00 29.99 26.68 2jwy n HIS 167 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95