#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jwp h LEU 6 N 0.00 0.78 -1.34 0.99 5.85 -1.98 -1.37 115.31 118.24 2jwp h LEU 6 Ca 0.00 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 2jwp h LEU 6 Cb 0.00 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 2jwp h LEU 6 CO 0.00 0.55 -0.17 0.00 -0.34 0.00 0.00 178.44 178.48 2jwp h ALA 7 N 1.57 1.06 0.00 1.25 0.00 -1.77 -1.62 119.26 119.75 2jwp h ALA 7 Ca 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2jwp h ALA 7 Cb -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2jwp h ALA 7 CO -0.07 0.21 -0.05 -0.44 0.00 0.00 0.00 179.25 178.91 2jwp h ASP 8 N 0.00 0.00 0.00 0.00 3.32 -1.58 -3.28 116.42 114.87 2jwp h ASP 8 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2jwp h ASP 8 Cb 0.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2jwp h ASP 8 CO 0.02 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.84 2jwp n LYS 9 N -2.53 0.07 -1.74 3.56 5.02 -1.11 -5.03 118.16 116.41 2jwp n LYS 9 Ca 0.05 -0.58 -0.42 0.00 -2.02 0.00 0.00 58.31 55.34 2jwp n LYS 9 Cb 0.46 -0.84 -0.01 0.00 -0.02 0.00 0.00 35.03 34.62 2jwp n LYS 9 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2jwp n VAL 10 N -0.10 1.38 -0.01 -0.18 3.14 -0.63 0.11 118.33 122.05 2jwp n VAL 10 Ca 0.00 -0.35 0.01 0.00 -2.96 0.00 0.00 64.34 61.04 2jwp n VAL 10 Cb 0.15 -1.88 -0.04 0.00 -1.06 0.00 0.00 33.84 31.01 2jwp n VAL 10 CO 0.00 0.00 0.00 2.30 -6.46 0.00 0.00 176.83 172.67 2jwp n ILE 11 N 1.46 0.08 -3.63 1.55 -5.35 -1.06 -4.84 119.36 107.58 2jwp n ILE 11 Ca 0.06 -0.13 -0.08 0.00 -0.27 0.00 0.00 62.75 62.34 2jwp n ILE 11 Cb 0.37 0.03 -0.06 0.00 -1.74 0.00 0.00 39.64 38.23 2jwp n ILE 11 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 2jwp s TRP 12 N -2.26 -0.33 -0.28 4.28 -0.00 -1.07 -5.04 118.94 114.23 2jwp s TRP 12 Ca -0.02 0.74 -0.23 0.00 -0.00 0.00 0.00 56.10 56.60 2jwp s TRP 12 Cb 0.02 0.42 0.09 0.00 -0.00 0.00 0.00 33.47 34.00 2jwp s TRP 12 CO 0.19 -0.20 0.79 0.00 -0.00 0.00 0.00 176.95 177.73 2jwp s ALA 13 N -0.24 -1.87 -0.05 5.86 0.00 -1.26 -0.79 121.76 123.41 2jwp s ALA 13 Ca 0.03 2.08 -0.02 0.00 0.00 0.00 0.00 51.96 54.05 2jwp s ALA 13 Cb -0.04 -1.31 0.04 0.00 0.00 0.00 0.00 23.12 21.81 2jwp s ALA 13 CO -0.06 -0.33 0.11 0.08 0.00 0.00 0.00 175.76 175.56 2jwp s VAL 14 N 0.64 -0.12 -0.46 0.00 1.01 0.12 -0.26 120.40 121.33 2jwp s VAL 14 Ca -0.02 0.28 -0.14 0.00 0.00 0.00 0.00 61.98 62.10 2jwp s VAL 14 Cb -0.05 -0.20 0.08 0.00 0.00 0.00 0.00 36.38 36.21 2jwp s VAL 14 CO -0.05 0.12 0.36 0.21 0.00 0.00 0.00 175.10 175.74 2jwp s ASN 15 N 1.61 6.01 -0.88 3.32 2.47 -1.25 -0.03 114.94 126.20 2jwp s ASN 15 Ca -0.04 -1.39 -0.25 0.00 0.42 0.00 0.00 52.86 51.60 2jwp s ASN 15 Cb -0.12 -2.13 -0.09 0.00 -1.45 0.00 0.00 41.25 37.45 2jwp s ASN 15 CO -0.05 -0.63 2.14 0.00 -3.72 0.00 0.00 177.10 174.85 2jwp s ALA 16 N 1.58 1.22 0.03 1.71 0.00 0.14 -3.73 121.76 122.72 2jwp s ALA 16 Ca 0.04 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2jwp s ALA 16 Cb -0.24 -4.58 0.00 0.00 0.00 0.00 0.00 23.12 18.30 2jwp s ALA 16 CO 0.05 -5.38 0.00 0.41 0.00 0.00 0.00 175.76 170.84 2jwp n GLY 17 N 6.76 -1.95 0.00 0.00 0.00 -1.17 -2.87 105.19 105.96 2jwp n GLY 17 Ca 0.43 0.63 0.00 0.00 0.00 0.00 0.00 46.02 47.08 2jwp n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jwp n GLY 18 N -1.42 2.11 2.70 -0.02 0.00 -1.24 -2.53 105.19 104.79 2jwp n GLY 18 Ca 0.00 -0.39 -0.21 0.00 0.00 0.00 0.00 46.02 45.41 2jwp n GLY 18 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jwp s GLU 19 N 4.24 0.18 0.00 1.61 2.12 -1.26 -3.95 118.70 121.64 2jwp s GLU 19 Ca 0.00 0.25 0.00 0.00 0.36 0.00 0.00 54.97 55.58 2jwp s GLU 19 Cb 0.00 -0.76 0.00 0.00 0.26 0.00 0.00 34.13 33.63 2jwp s GLU 19 CO 0.00 -0.34 0.00 0.43 -0.54 0.00 0.00 175.26 174.81 2jwp n SER 20 N 5.24 -0.71 -3.80 -1.70 7.64 -1.25 -4.89 113.62 114.16 2jwp n SER 20 Ca -0.05 0.82 -0.18 0.00 1.01 0.00 0.00 58.87 60.47 2jwp n SER 20 Cb 0.50 -1.23 -0.16 0.00 -1.01 0.00 0.00 64.21 62.30 2jwp n SER 20 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2jwp s HIS 21 N 0.00 0.32 -0.39 1.43 2.46 -0.87 -4.93 115.29 113.31 2jwp s HIS 21 Ca 0.00 0.01 -0.23 0.00 0.47 0.00 0.00 55.06 55.30 2jwp s HIS 21 Cb 0.00 -0.44 0.01 0.00 -0.13 0.00 0.00 32.58 32.02 2jwp s HIS 21 CO 0.00 -0.15 0.78 0.08 -2.47 0.00 0.00 174.74 172.98 2jwp s VAL 22 N 1.17 4.71 0.67 0.89 1.01 -1.26 -0.24 120.40 127.36 2jwp s VAL 22 Ca -0.08 0.74 -0.11 0.00 0.00 0.00 0.00 61.98 62.54 2jwp s VAL 22 Cb -0.13 -4.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.00 2jwp s VAL 22 CO -0.02 -0.51 1.06 1.51 0.00 0.00 0.00 175.10 177.13 2jwp s ASP 23 N 1.93 5.72 0.56 3.32 -4.77 0.75 -4.81 116.67 119.37 2jwp s ASP 23 Ca 0.31 1.40 0.28 0.00 -3.30 0.00 0.00 52.55 51.24 2jwp s ASP 23 Cb -0.13 -2.33 1.47 0.00 -1.09 0.00 0.00 42.92 40.85 2jwp s ASP 23 CO 0.19 -1.20 1.95 -0.37 0.70 0.00 0.00 175.17 176.44 2jwp h VAL 24 N -0.55 0.52 -0.00 2.11 -1.51 -1.96 0.98 116.25 115.84 2jwp h VAL 24 Ca -0.44 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 2jwp h VAL 24 Cb 1.21 0.67 0.00 0.00 -2.13 0.00 0.00 31.29 31.04 2jwp h VAL 24 CO 0.61 0.00 -0.01 1.41 -1.23 0.00 0.00 177.57 178.35 2jwp n HIS 25 N -4.02 0.00 -0.27 5.19 8.25 -1.26 -4.87 115.22 118.24 2jwp n HIS 25 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 2jwp n HIS 25 Cb 0.66 -0.32 0.00 0.00 1.12 0.00 0.00 29.99 31.45 2jwp n HIS 25 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jwp n GLY 26 N 1.33 1.28 3.45 -1.41 0.00 0.34 -3.26 105.19 106.93 2jwp n GLY 26 Ca 0.13 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 2jwp n GLY 26 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jwp s ILE 27 N -2.00 5.22 -0.44 -0.61 -1.09 -1.10 -4.49 121.20 116.70 2jwp s ILE 27 Ca 0.00 -0.67 -0.24 0.00 -2.23 0.00 0.00 60.65 57.51 2jwp s ILE 27 Cb 0.00 -3.99 0.02 0.00 -1.58 0.00 0.00 42.46 36.92 2jwp s ILE 27 CO 0.00 -0.38 0.85 -2.28 -1.23 0.00 0.00 174.94 171.90 2jwp s HIS 28 N 1.77 2.99 0.09 3.97 5.65 -1.26 -0.18 115.29 128.32 2jwp s HIS 28 Ca 0.06 0.35 -0.21 0.00 0.25 0.00 0.00 55.06 55.50 2jwp s HIS 28 Cb -0.19 -3.74 -0.07 0.00 -1.18 0.00 0.00 32.58 27.40 2jwp s HIS 28 CO 0.10 -0.98 0.64 1.52 -0.65 0.00 0.00 174.74 175.37 2jwp s TYR 29 N 3.45 3.82 -0.01 3.88 -0.85 0.67 -4.47 117.35 123.84 2jwp s TYR 29 Ca 0.33 1.38 -0.15 0.00 -0.52 0.00 0.00 57.07 58.11 2jwp s TYR 29 Cb -0.11 -2.61 -0.06 0.00 0.38 0.00 0.00 41.96 39.56 2jwp s TYR 29 CO 0.23 0.52 0.42 -0.98 -1.52 0.00 0.00 175.55 174.23 2jwp s ARG 30 N -0.96 3.99 0.22 -3.49 1.70 0.65 -2.06 118.95 118.99 2jwp s ARG 30 Ca 0.32 0.43 -0.30 0.00 -0.47 0.00 0.00 55.73 55.71 2jwp s ARG 30 Cb -0.20 -3.25 -0.08 0.00 -0.57 0.00 0.00 34.95 30.84 2jwp s ARG 30 CO 0.21 0.62 1.14 -1.59 -1.08 0.00 0.00 175.30 174.60 2jwp s LYS 31 N -0.86 4.56 -0.60 3.89 0.00 -1.26 -4.27 119.74 121.21 2jwp s LYS 31 Ca 0.24 1.82 -0.07 0.00 0.00 0.00 0.00 55.97 57.95 2jwp s LYS 31 Cb -0.17 -3.23 0.01 0.00 0.00 0.00 0.00 37.83 34.44 2jwp s LYS 31 CO 0.13 0.05 0.14 -0.40 0.00 0.00 0.00 175.35 175.27 2jwp n ASP 32 N 2.02 -0.60 -2.01 0.03 5.68 -1.25 -4.82 116.55 115.60 2jwp n ASP 32 Ca 0.02 -0.55 -0.22 0.00 -0.50 0.00 0.00 54.79 53.54 2jwp n ASP 32 Cb 0.45 -0.68 0.08 0.00 -1.14 0.00 0.00 41.12 39.84 2jwp n ASP 32 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.20 175.06 2jwp n PRO 33 N -2.62 2.08 0.07 0.11 -0.04 -1.25 -3.79 135.00 129.56 2jwp n PRO 33 Ca -0.10 -2.25 0.00 0.00 -0.04 0.00 0.00 63.50 61.11 2jwp n PRO 33 Cb 0.27 -1.88 0.00 0.00 -0.04 0.00 0.00 33.50 31.85 2jwp n PRO 33 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2jwp n LEU 34 N -0.38 -0.00 -4.56 1.53 0.00 -1.26 -4.53 117.00 107.79 2jwp n LEU 34 Ca 0.44 0.23 -0.40 0.00 0.00 0.00 0.00 56.01 56.27 2jwp n LEU 34 Cb 0.88 0.16 -0.03 0.00 0.00 0.00 0.00 43.42 44.43 2jwp n LEU 34 CO 0.52 -0.61 1.50 -1.83 0.00 0.00 0.00 177.39 176.96 2jwp s GLU 35 N -2.00 3.55 0.00 1.96 -1.05 -1.26 -2.45 118.70 117.45 2jwp s GLU 35 Ca 0.00 -1.12 0.00 0.00 -0.15 0.00 0.00 54.97 53.70 2jwp s GLU 35 Cb 0.00 -5.35 0.00 0.00 -0.44 0.00 0.00 34.13 28.34 2jwp s GLU 35 CO 0.00 -2.28 0.00 0.41 0.95 0.00 0.00 175.26 174.34 2jwp n GLY 36 N 6.82 2.07 4.64 -3.83 0.00 -1.26 -4.39 105.19 109.24 2jwp n GLY 36 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2jwp n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jwp n ARG 37 N -2.00 0.00 -3.93 1.61 5.12 -1.03 -4.82 116.66 111.61 2jwp n ARG 37 Ca 0.00 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.63 2jwp n ARG 37 Cb 0.00 -1.78 -0.16 0.00 -1.16 0.00 0.00 32.46 29.36 2jwp n ARG 37 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2jwp s VAL 38 N -0.13 1.26 0.00 1.55 1.01 -1.25 -3.81 120.40 119.04 2jwp s VAL 38 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.34 2jwp s VAL 38 Cb 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 35.03 2jwp s VAL 38 CO 0.00 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.94 2jwp n GLY 39 N 4.84 4.77 2.56 4.51 0.00 -1.26 -5.04 105.19 115.57 2jwp n GLY 39 Ca -0.13 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 2jwp n GLY 39 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jwp n ARG 40 N 0.00 0.77 -3.08 1.61 3.00 -1.26 -5.00 116.66 112.70 2jwp n ARG 40 Ca 0.00 -2.25 -0.18 0.00 -0.00 0.00 0.00 57.85 55.42 2jwp n ARG 40 Cb 0.00 -1.37 0.02 0.00 0.00 0.00 0.00 32.46 31.10 2jwp n ARG 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2jwp n ALA 41 N 1.51 -2.75 -1.65 5.13 0.00 -1.26 -4.81 120.51 116.67 2jwp n ALA 41 Ca 0.13 0.76 -0.41 0.00 0.00 0.00 0.00 53.44 53.93 2jwp n ALA 41 Cb 0.60 -2.82 -0.01 0.00 0.00 0.00 0.00 19.45 17.22 2jwp n ALA 41 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2jwp n SER 42 N -0.07 6.32 -3.00 0.00 7.64 -1.05 -4.83 113.62 118.63 2jwp n SER 42 Ca 0.03 -2.79 -0.26 0.00 1.01 0.00 0.00 58.87 56.86 2jwp n SER 42 Cb 0.50 -1.57 -0.05 0.00 -1.01 0.00 0.00 64.21 62.08 2jwp n SER 42 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2jwp n ASP 43 N 4.47 6.22 -4.42 6.43 5.75 -1.07 -3.39 116.55 130.55 2jwp n ASP 43 Ca 0.62 -2.40 -0.34 0.00 -0.01 0.00 0.00 54.79 52.66 2jwp n ASP 43 Cb 0.31 -1.27 -0.13 0.00 -1.03 0.00 0.00 41.12 39.00 2jwp n ASP 43 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2jwp s TYR 44 N 2.52 2.98 0.00 2.11 2.02 -0.92 -4.17 117.35 121.89 2jwp s TYR 44 Ca 0.54 -0.56 0.00 0.00 -0.37 0.00 0.00 57.07 56.68 2jwp s TYR 44 Cb 0.16 -2.02 0.00 0.00 -0.40 0.00 0.00 41.96 39.71 2jwp s TYR 44 CO -0.04 -0.25 0.00 0.41 -1.57 0.00 0.00 175.55 174.10 2jwp n GLY 45 N 4.07 0.81 0.00 0.71 0.00 -1.26 -4.14 105.19 105.38 2jwp n GLY 45 Ca -0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.93 2jwp n GLY 45 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2jwp n MET 46 N -2.23 0.51 -1.73 1.61 0.00 -1.26 -4.32 117.12 109.70 2jwp n MET 46 Ca 0.00 0.01 -0.42 0.00 0.00 0.00 0.00 57.70 57.29 2jwp n MET 46 Cb 0.00 -1.50 -0.00 0.00 0.00 0.00 0.00 33.22 31.72 2jwp n MET 46 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 2jwp n LYS 47 N -1.02 2.89 -2.91 2.12 3.00 -1.26 -4.50 118.16 116.47 2jwp n LYS 47 Ca 0.12 -2.61 -0.12 0.00 -0.00 0.00 0.00 58.31 55.71 2jwp n LYS 47 Cb 0.06 -3.27 -0.00 0.00 0.00 0.00 0.00 35.03 31.82 2jwp n LYS 47 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2jwp n LEU 48 N 6.00 -2.20 -4.65 3.14 -0.00 -1.26 -4.99 117.00 113.04 2jwp n LEU 48 Ca 0.52 -3.59 -0.43 0.00 -0.00 0.00 0.00 56.01 52.51 2jwp n LEU 48 Cb 0.39 0.74 -0.03 0.00 -0.00 0.00 0.00 43.42 44.52 2jwp n LEU 48 CO 0.90 1.98 1.62 -0.81 -0.00 0.00 0.00 177.39 181.08 2jwp n PRO 49 N 2.11 2.65 -2.57 1.96 -0.04 -1.26 -4.82 135.00 133.04 2jwp n PRO 49 Ca 0.16 0.95 -0.41 0.00 -0.04 0.00 0.00 63.50 64.16 2jwp n PRO 49 Cb 0.57 -2.98 -0.03 0.00 -0.04 0.00 0.00 33.50 31.02 2jwp n PRO 49 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2jwp s ILE 50 N 4.90 3.76 0.36 0.52 1.09 -1.26 -4.41 121.20 126.16 2jwp s ILE 50 Ca 0.91 0.31 0.03 0.00 -1.10 0.00 0.00 60.65 60.80 2jwp s ILE 50 Cb -0.46 -4.92 0.24 0.00 -1.06 0.00 0.00 42.46 36.26 2jwp s ILE 50 CO 0.43 -1.85 1.99 0.25 -0.10 0.00 0.00 174.94 175.66 2jwp h LEU 51 N 12.94 0.63 -3.03 2.97 6.46 -1.89 -3.12 115.31 130.27 2jwp h LEU 51 Ca -0.25 -0.04 -0.23 0.00 -0.12 0.00 0.00 57.88 57.23 2jwp h LEU 51 Cb 1.05 -0.16 -0.12 0.00 -0.73 0.00 0.00 40.66 40.70 2jwp h LEU 51 CO 1.28 0.51 0.30 0.54 -0.62 0.00 0.00 178.44 180.45 2jwp n ARG 52 N -4.41 1.57 -4.13 1.25 1.74 -1.26 -4.82 116.66 106.60 2jwp n ARG 52 Ca 0.05 -1.26 -0.11 0.00 -0.77 0.00 0.00 57.85 55.76 2jwp n ARG 52 Cb 0.09 -1.49 -0.09 0.00 -1.02 0.00 0.00 32.46 29.95 2jwp n ARG 52 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2jwp s SER 53 N 0.21 0.14 0.08 0.55 0.15 -1.18 -4.79 113.70 108.86 2jwp s SER 53 Ca 0.24 -1.21 -0.17 0.00 0.70 0.00 0.00 55.95 55.51 2jwp s SER 53 Cb 0.20 0.39 -0.07 0.00 -1.71 0.00 0.00 66.02 64.84 2jwp s SER 53 CO 0.03 -0.86 0.54 0.54 1.20 0.00 0.00 173.24 174.68 2jwp s ASN 54 N -3.09 6.95 0.34 5.45 4.22 -1.26 -4.71 114.94 122.85 2jwp s ASN 54 Ca 0.30 1.16 0.13 0.00 -2.14 0.00 0.00 52.86 52.31 2jwp s ASN 54 Cb 0.06 -2.32 1.09 0.00 1.28 0.00 0.00 41.25 41.35 2jwp s ASN 54 CO 0.07 0.23 1.55 -2.65 -2.04 0.00 0.00 177.10 174.27 2jwp n PRO 55 N 1.47 -0.07 0.01 3.55 -0.02 -1.26 0.12 135.00 138.80 2jwp n PRO 55 Ca -0.09 1.41 -0.18 0.00 -2.02 0.00 0.00 63.50 62.61 2jwp n PRO 55 Cb 0.51 -2.40 -0.12 0.00 -0.02 0.00 0.00 33.50 31.48 2jwp n PRO 55 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2jwp h GLU 56 N 0.00 0.39 0.00 -0.52 4.11 -2.00 -2.62 114.58 113.93 2jwp h GLU 56 Ca 0.74 -0.45 0.00 0.00 0.07 0.00 0.00 59.36 59.72 2jwp h GLU 56 Cb 1.80 0.13 0.00 0.00 0.50 0.00 0.00 28.75 31.19 2jwp h GLU 56 CO -0.83 1.12 -0.11 0.38 0.07 0.00 0.00 179.01 179.65 2jwp h ASP 57 N -0.16 0.00 -0.47 3.06 2.03 -1.10 -2.37 116.42 117.41 2jwp h ASP 57 Ca -0.08 -0.02 0.02 0.00 -0.73 0.00 0.00 57.03 56.22 2jwp h ASP 57 Cb 1.36 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.83 2jwp h ASP 57 CO 0.12 0.01 0.28 -0.61 -1.03 0.00 0.00 179.24 178.01 2jwp h GLN 58 N 0.00 0.54 -0.66 4.15 4.15 0.88 0.77 115.11 124.94 2jwp h GLN 58 Ca 0.00 -0.03 0.08 0.00 0.77 0.00 0.00 58.65 59.47 2jwp h GLN 58 Cb 0.87 -0.12 -0.06 0.00 0.21 0.00 0.00 27.48 28.38 2jwp h GLN 58 CO 0.00 0.36 0.32 0.28 -1.93 0.00 0.00 178.83 177.86 2jwp h VAL 59 N 0.56 0.87 0.00 2.39 2.07 -1.03 0.37 116.25 121.46 2jwp h VAL 59 Ca 0.19 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2jwp h VAL 59 Cb 0.01 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 2jwp h VAL 59 CO -0.09 0.10 0.00 0.25 0.02 0.00 0.00 177.57 177.86 2jwp h LEU 60 N 0.56 0.00 -1.50 2.57 5.85 -1.05 -1.89 115.31 119.85 2jwp h LEU 60 Ca 0.32 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.04 2jwp h LEU 60 Cb 0.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.34 2jwp h LEU 60 CO -0.25 0.00 0.00 -1.22 -0.34 0.00 0.00 178.44 176.63 2jwp n TYR 61 N -2.92 0.04 0.00 1.25 4.01 0.17 -4.50 117.16 115.22 2jwp n TYR 61 Ca -0.01 -0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 2jwp n TYR 61 Cb 0.15 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 2jwp n TYR 61 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 2jwp n GLN 62 N 0.30 0.00 -1.79 -0.72 7.27 0.11 -4.69 117.38 117.86 2jwp n GLN 62 Ca 0.04 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.69 2jwp n GLN 62 Cb 0.18 -0.82 -0.02 0.00 2.41 0.00 0.00 30.24 31.98 2jwp n GLN 62 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 2jwp s THR 63 N -1.81 2.15 0.09 1.69 2.01 -0.75 -4.77 115.64 114.25 2jwp s THR 63 Ca 0.00 0.11 0.10 0.00 0.31 0.00 0.00 61.69 62.21 2jwp s THR 63 Cb 0.00 -3.07 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 2jwp s THR 63 CO 0.00 0.01 -0.26 -0.70 -0.69 0.00 0.00 174.62 172.98 2jwp s GLU 64 N 0.36 1.54 0.03 4.92 2.12 -1.24 -3.03 118.70 123.40 2jwp s GLU 64 Ca 0.68 -1.24 0.00 0.00 0.36 0.00 0.00 54.97 54.78 2jwp s GLU 64 Cb -0.48 -1.90 0.00 0.00 0.26 0.00 0.00 34.13 32.02 2jwp s GLU 64 CO 0.39 0.47 0.03 0.54 -0.54 0.00 0.00 175.26 176.15 2jwp n ARG 65 N 1.26 1.16 -0.03 4.30 1.74 -1.14 -2.16 116.66 121.80 2jwp n ARG 65 Ca -0.18 -0.17 -0.01 0.00 -0.77 0.00 0.00 57.85 56.72 2jwp n ARG 65 Cb 0.53 -0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.96 2jwp n ARG 65 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 2jwp h TYR 66 N 0.20 -0.05 -1.45 -1.55 3.20 -1.77 -3.44 116.97 112.11 2jwp h TYR 66 Ca -0.02 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 2jwp h TYR 66 Cb 0.07 0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.35 2jwp h TYR 66 CO 0.00 0.02 0.00 0.09 -1.64 0.00 0.00 178.16 176.63 2jwp n ASN 67 N -4.81 -4.35 0.00 -2.11 3.02 -1.26 -4.72 115.26 101.04 2jwp n ASN 67 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.54 2jwp n ASN 67 Cb 0.04 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 2jwp n ASN 67 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2jwp n GLU 68 N -0.92 0.00 -3.76 3.52 2.13 -1.26 -4.96 120.64 115.39 2jwp n GLU 68 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 2jwp n GLU 68 Cb 0.00 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 31.61 2jwp n GLU 68 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2jwp s ASP 69 N 2.00 -0.31 -1.07 4.31 2.15 -1.26 -3.88 116.67 118.60 2jwp s ASP 69 Ca 0.00 0.54 -0.20 0.00 0.43 0.00 0.00 52.55 53.32 2jwp s ASP 69 Cb 0.00 0.60 0.01 0.00 -0.30 0.00 0.00 42.92 43.23 2jwp s ASP 69 CO 0.00 -0.19 0.72 -0.24 -0.17 0.00 0.00 175.17 175.29 2jwp n SER 70 N 2.54 -5.07 -4.50 -0.34 2.88 -1.23 -4.94 113.62 102.95 2jwp n SER 70 Ca -0.15 -1.03 -0.35 0.00 -1.33 0.00 0.00 58.87 56.02 2jwp n SER 70 Cb 0.57 -2.67 -0.12 0.00 -0.75 0.00 0.00 64.21 61.24 2jwp n SER 70 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2jwp s PHE 71 N -3.36 3.09 0.03 0.66 -0.71 -1.04 -4.86 117.98 111.79 2jwp s PHE 71 Ca 0.36 -0.29 -0.08 0.00 -1.04 0.00 0.00 56.93 55.88 2jwp s PHE 71 Cb -0.16 -2.07 -0.00 0.00 -1.21 0.00 0.00 43.02 39.58 2jwp s PHE 71 CO 0.89 -0.11 0.15 0.20 -1.34 0.00 0.00 175.22 175.01 2jwp s GLY 72 N 0.77 0.08 0.33 1.99 0.00 -1.26 -2.66 107.32 106.58 2jwp s GLY 72 Ca 0.01 -0.35 0.07 0.00 0.00 0.00 0.00 44.72 44.45 2jwp s GLY 72 CO 0.02 -0.51 0.33 -0.19 0.00 0.00 0.00 173.10 172.75 2jwp s TYR 73 N -2.40 2.96 -0.21 1.90 1.51 -0.61 -4.90 117.35 115.60 2jwp s TYR 73 Ca -0.07 -0.28 -0.02 0.00 -1.01 0.00 0.00 57.07 55.70 2jwp s TYR 73 Cb -0.02 -1.83 0.01 0.00 -0.11 0.00 0.00 41.96 40.01 2jwp s TYR 73 CO -0.03 0.15 -0.10 0.16 -1.11 0.00 0.00 175.55 174.62 2jwp s ASP 74 N -4.03 3.92 -0.74 2.29 -4.77 -1.26 -2.23 116.67 109.85 2jwp s ASP 74 Ca 0.42 -0.60 -0.10 0.00 -3.30 0.00 0.00 52.55 48.97 2jwp s ASP 74 Cb -0.07 -1.63 0.19 0.00 -1.09 0.00 0.00 42.92 40.32 2jwp s ASP 74 CO 0.27 -0.04 0.63 -0.63 0.70 0.00 0.00 175.17 176.11 2jwp s ILE 75 N 1.38 4.90 0.03 2.11 1.09 0.11 -4.94 121.20 125.88 2jwp s ILE 75 Ca 0.04 -2.59 -0.30 0.00 -1.10 0.00 0.00 60.65 56.70 2jwp s ILE 75 Cb -0.14 -4.08 -0.09 0.00 -1.06 0.00 0.00 42.46 37.08 2jwp s ILE 75 CO -0.07 -0.96 1.97 -2.65 -0.10 0.00 0.00 174.94 173.13 2jwp n PRO 76 N 3.88 2.85 -5.26 2.79 -0.02 -1.26 -0.00 135.00 137.97 2jwp n PRO 76 Ca 0.10 1.05 -0.31 0.00 -2.02 0.00 0.00 63.50 62.31 2jwp n PRO 76 Cb 0.43 -3.00 -0.16 0.00 -0.02 0.00 0.00 33.50 30.75 2jwp n PRO 76 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2jwp s ILE 77 N 4.45 2.08 0.00 4.25 1.01 -1.20 -4.91 121.20 126.88 2jwp s ILE 77 Ca 0.89 -1.06 0.00 0.00 0.00 0.00 0.00 60.65 60.48 2jwp s ILE 77 Cb -0.44 -1.74 0.00 0.00 0.01 0.00 0.00 42.46 40.28 2jwp s ILE 77 CO 0.42 0.57 0.61 0.29 0.00 0.00 0.00 174.94 176.84 2jwp n LYS 78 N 2.87 0.94 -4.42 2.79 5.02 -1.26 -4.68 118.16 119.42 2jwp n LYS 78 Ca -0.17 -0.79 -0.22 0.00 -2.02 0.00 0.00 58.31 55.12 2jwp n LYS 78 Cb 0.52 -0.73 -0.09 0.00 -0.02 0.00 0.00 35.03 34.71 2jwp n LYS 78 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2jwp s GLU 79 N -0.35 1.72 0.17 1.97 2.02 -1.26 -5.17 118.70 117.79 2jwp s GLU 79 Ca 0.00 -2.00 0.01 0.00 0.02 0.00 0.00 54.97 53.00 2jwp s GLU 79 Cb 0.00 -0.47 0.01 0.00 0.10 0.00 0.00 34.13 33.77 2jwp s GLU 79 CO 0.00 -0.39 0.09 0.39 0.02 0.00 0.00 175.26 175.37 2jwp n GLU 80 N -0.72 1.35 0.00 1.61 1.02 -1.26 -4.95 120.64 117.69 2jwp n GLU 80 Ca -0.02 -1.09 0.00 0.00 -0.02 0.00 0.00 57.16 56.03 2jwp n GLU 80 Cb 0.65 0.17 0.00 0.00 -0.02 0.00 0.00 31.44 32.24 2jwp n GLU 80 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jwp n GLY 81 N 3.01 0.31 3.39 0.62 0.00 -0.59 -4.78 105.19 107.15 2jwp n GLY 81 Ca -0.02 -2.30 -0.45 0.00 0.00 0.00 0.00 46.02 43.25 2jwp n GLY 81 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jwp s GLU 82 N -0.03 3.03 -0.23 1.61 2.02 -1.14 -1.36 118.70 122.60 2jwp s GLU 82 Ca 0.00 -1.28 -0.15 0.00 0.02 0.00 0.00 54.97 53.56 2jwp s GLU 82 Cb 0.00 -4.18 -0.04 0.00 0.10 0.00 0.00 34.13 30.01 2jwp s GLU 82 CO 0.00 -1.24 0.36 0.71 0.02 0.00 0.00 175.26 175.11 2jwp s TYR 83 N 2.12 3.32 -0.33 1.61 2.02 -0.21 0.26 117.35 126.13 2jwp s TYR 83 Ca 0.08 0.48 -0.02 0.00 -0.37 0.00 0.00 57.07 57.25 2jwp s TYR 83 Cb -0.24 -2.51 0.07 0.00 -0.40 0.00 0.00 41.96 38.88 2jwp s TYR 83 CO 0.07 -0.08 0.06 0.08 -1.57 0.00 0.00 175.55 174.11 2jwp s VAL 84 N 1.56 3.01 -0.56 0.71 1.01 0.06 0.17 120.40 126.36 2jwp s VAL 84 Ca 0.16 -1.63 -0.22 0.00 0.00 0.00 0.00 61.98 60.29 2jwp s VAL 84 Cb -0.15 -2.85 0.05 0.00 0.00 0.00 0.00 36.38 33.43 2jwp s VAL 84 CO 0.08 -0.29 0.86 -0.76 0.00 0.00 0.00 175.10 174.99 2jwp s LEU 85 N 1.20 4.40 -0.50 3.92 1.02 -0.12 -1.84 118.68 126.75 2jwp s LEU 85 Ca -0.01 -0.64 -0.13 0.00 0.02 0.00 0.00 54.13 53.38 2jwp s LEU 85 Cb -0.20 -2.64 0.12 0.00 0.02 0.00 0.00 46.19 43.48 2jwp s LEU 85 CO -0.02 -1.18 0.41 -0.69 0.02 0.00 0.00 176.35 174.88 2jwp s VAL 86 N 3.61 4.72 -0.14 -1.59 1.01 0.78 -0.32 120.40 128.48 2jwp s VAL 86 Ca 0.25 -1.58 -0.03 0.00 0.00 0.00 0.00 61.98 60.62 2jwp s VAL 86 Cb -0.15 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 2jwp s VAL 86 CO 0.15 -0.78 -0.04 -1.48 0.00 0.00 0.00 175.10 172.95 2jwp s LEU 87 N 1.49 3.25 -0.21 3.92 2.34 -1.06 -2.21 118.68 126.19 2jwp s LEU 87 Ca 0.04 -0.10 -0.21 0.00 0.06 0.00 0.00 54.13 53.93 2jwp s LEU 87 Cb -0.28 -1.77 -0.02 0.00 -0.56 0.00 0.00 46.19 43.57 2jwp s LEU 87 CO 0.02 0.21 0.64 -0.54 -1.06 0.00 0.00 176.35 175.62 2jwp s LYS 88 N 0.09 4.19 -0.13 1.48 3.01 -1.13 -1.89 119.74 125.36 2jwp s LYS 88 Ca -0.01 0.62 -0.04 0.00 -1.01 0.00 0.00 55.97 55.53 2jwp s LYS 88 Cb -0.14 -3.59 -0.03 0.00 -1.01 0.00 0.00 37.83 33.06 2jwp s LYS 88 CO 0.03 -0.29 0.02 -0.06 0.51 0.00 0.00 175.35 175.56 2jwp s PHE 89 N 2.07 3.18 -0.13 3.18 0.08 0.20 0.04 117.98 126.59 2jwp s PHE 89 Ca 0.28 0.08 0.01 0.00 0.12 0.00 0.00 56.93 57.42 2jwp s PHE 89 Cb -0.16 -1.91 0.02 0.00 -0.57 0.00 0.00 43.02 40.40 2jwp s PHE 89 CO 0.10 0.30 -0.13 0.00 -0.10 0.00 0.00 175.22 175.38 2jwp s ALA 90 N -0.30 1.71 -0.22 5.36 0.00 -1.08 -1.65 121.76 125.57 2jwp s ALA 90 Ca 0.07 -0.78 -0.27 0.00 0.00 0.00 0.00 51.96 50.98 2jwp s ALA 90 Cb -0.12 -0.95 0.11 0.00 0.00 0.00 0.00 23.12 22.15 2jwp s ALA 90 CO 0.02 -0.28 0.93 -2.00 0.00 0.00 0.00 175.76 174.43 2jwp s GLU 91 N 1.35 0.65 0.00 0.00 2.56 -1.26 -2.93 118.70 119.06 2jwp s GLU 91 Ca 0.01 0.52 0.00 0.00 0.00 0.00 0.00 54.97 55.50 2jwp s GLU 91 Cb -0.13 0.31 0.00 0.00 2.00 0.00 0.00 34.13 36.31 2jwp s GLU 91 CO -0.07 -0.13 0.00 0.28 -0.56 0.00 0.00 175.26 174.78 2jwp n VAL 92 N 1.80 0.00 0.08 3.70 0.31 -1.26 -4.14 118.33 118.83 2jwp n VAL 92 Ca -0.13 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.25 2jwp n VAL 92 Cb 0.56 0.00 0.49 0.00 -0.91 0.00 0.00 33.84 33.98 2jwp n VAL 92 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 2jwp h TYR 93 N 0.00 0.35 -3.28 3.52 3.20 -1.95 -3.00 116.97 115.81 2jwp h TYR 93 Ca 0.00 0.01 -0.77 0.00 3.14 0.00 0.00 58.73 61.11 2jwp h TYR 93 Cb 0.00 -0.12 -0.24 0.00 1.54 0.00 0.00 36.73 37.91 2jwp h TYR 93 CO 0.00 0.22 0.51 -0.06 -1.64 0.00 0.00 178.16 177.19 2jwp s PHE 94 N -5.35 3.80 -0.50 -3.82 0.08 -1.26 -5.00 117.98 105.92 2jwp s PHE 94 Ca -0.07 -2.15 -0.27 0.00 0.12 0.00 0.00 56.93 54.56 2jwp s PHE 94 Cb 0.17 -3.97 -0.03 0.00 -0.57 0.00 0.00 43.02 38.62 2jwp s PHE 94 CO 0.71 -1.11 2.01 0.00 -0.10 0.00 0.00 175.22 176.73 2jwp s ALA 95 N 0.29 2.20 -0.29 5.36 0.00 -1.14 -4.88 121.76 123.30 2jwp s ALA 95 Ca 0.28 -0.22 -0.25 0.00 0.00 0.00 0.00 51.96 51.78 2jwp s ALA 95 Cb -0.08 -4.24 0.14 0.00 0.00 0.00 0.00 23.12 18.94 2jwp s ALA 95 CO -0.07 -3.73 1.14 -1.14 0.00 0.00 0.00 175.76 171.96 2jwp s GLN 96 N 7.04 0.38 0.17 0.00 2.00 -1.26 -5.18 119.66 122.81 2jwp s GLN 96 Ca 0.79 0.46 0.06 0.00 -2.00 0.00 0.00 55.36 54.67 2jwp s GLN 96 Cb -0.17 0.18 -0.05 0.00 0.80 0.00 0.00 33.01 33.78 2jwp s GLN 96 CO 0.25 -0.05 -0.12 -1.54 -0.50 0.00 0.00 175.29 173.34 2jwp s SER 97 N 0.20 2.17 -1.57 6.67 1.04 -1.26 -4.58 113.70 116.38 2jwp s SER 97 Ca 0.04 -1.01 -0.10 0.00 0.48 0.00 0.00 55.95 55.35 2jwp s SER 97 Cb -0.05 -0.07 0.09 0.00 0.10 0.00 0.00 66.02 66.08 2jwp s SER 97 CO -0.09 -0.25 0.65 0.00 0.98 0.00 0.00 173.24 174.53 2jwp n GLN 98 N -0.27 -3.46 0.16 4.02 1.13 -1.26 -4.69 117.38 113.01 2jwp n GLN 98 Ca -0.09 0.41 0.00 0.00 -1.94 0.00 0.00 57.00 55.37 2jwp n GLN 98 Cb 0.60 -4.90 0.00 0.00 0.11 0.00 0.00 30.24 26.06 2jwp n GLN 98 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 2jwp n GLN 99 N -4.43 0.00 -2.82 -1.09 -0.06 -1.26 -5.00 117.38 102.72 2jwp n GLN 99 Ca -0.09 0.00 -0.43 0.00 -2.00 0.00 0.00 57.00 54.48 2jwp n GLN 99 Cb 0.58 0.00 -0.04 0.00 -4.06 0.00 0.00 30.24 26.72 2jwp n GLN 99 CO 0.00 0.00 0.00 -1.59 -0.20 0.00 0.00 177.06 175.27 2jwp s LYS 100 N -1.85 3.21 -0.34 3.69 -2.85 -1.26 -4.99 119.74 115.34 2jwp s LYS 100 Ca 0.00 -0.91 -0.07 0.00 -1.00 0.00 0.00 55.97 53.99 2jwp s LYS 100 Cb 0.00 -4.37 0.04 0.00 -2.06 0.00 0.00 37.83 31.44 2jwp s LYS 100 CO 0.00 -1.87 0.12 0.14 0.10 0.00 0.00 175.35 173.84 2jwp s VAL 101 N 4.11 3.88 0.59 1.79 -7.23 -1.26 -4.23 120.40 118.04 2jwp s VAL 101 Ca 0.26 -1.11 -0.16 0.00 -1.81 0.00 0.00 61.98 59.16 2jwp s VAL 101 Cb -0.13 -3.20 -0.04 0.00 0.56 0.00 0.00 36.38 33.57 2jwp s VAL 101 CO 0.07 -0.19 1.06 -0.36 -0.31 0.00 0.00 175.10 175.37 2jwp s PHE 102 N 1.42 2.96 -0.11 2.82 0.08 0.39 -4.48 117.98 121.06 2jwp s PHE 102 Ca -0.01 1.52 -0.03 0.00 0.12 0.00 0.00 56.93 58.52 2jwp s PHE 102 Cb -0.20 -3.03 -0.03 0.00 -0.57 0.00 0.00 43.02 39.19 2jwp s PHE 102 CO 0.03 -1.15 0.02 -0.51 -0.10 0.00 0.00 175.22 173.52 2jwp s ASP 103 N -2.70 5.40 -0.08 1.36 1.01 -1.12 -0.35 116.67 120.19 2jwp s ASP 103 Ca 0.64 0.16 -0.01 0.00 0.71 0.00 0.00 52.55 54.05 2jwp s ASP 103 Cb -0.17 -1.64 0.03 0.00 1.01 0.00 0.00 42.92 42.15 2jwp s ASP 103 CO 0.36 0.34 -0.01 -0.69 0.21 0.00 0.00 175.17 175.38 2jwp s VAL 104 N -0.63 0.49 0.01 -1.27 1.01 0.93 -1.02 120.40 119.92 2jwp s VAL 104 Ca 0.11 0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.22 2jwp s VAL 104 Cb -0.12 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 2jwp s VAL 104 CO 0.02 0.28 -0.26 -0.13 0.00 0.00 0.00 175.10 175.01 2jwp s ARG 105 N 1.91 1.94 -0.33 2.72 0.52 0.05 -1.04 118.95 124.72 2jwp s ARG 105 Ca 0.05 -1.00 0.02 0.00 -0.52 0.00 0.00 55.73 54.28 2jwp s ARG 105 Cb -0.12 -1.99 0.09 0.00 0.52 0.00 0.00 34.95 33.45 2jwp s ARG 105 CO -0.06 0.53 0.04 0.54 0.02 0.00 0.00 175.30 176.37 2jwp s VAL 106 N -0.69 2.48 -1.25 3.52 0.11 0.10 -2.15 120.40 122.52 2jwp s VAL 106 Ca 0.11 -2.08 -0.02 0.00 -2.93 0.00 0.00 61.98 57.05 2jwp s VAL 106 Cb -0.10 -2.71 -0.01 0.00 -1.53 0.00 0.00 36.38 32.04 2jwp s VAL 106 CO 0.00 -0.46 0.79 -3.20 -3.33 0.00 0.00 175.10 168.90 2jwp n ASN 107 N 4.37 -2.04 0.00 3.54 5.15 0.11 -1.89 115.26 124.51 2jwp n ASN 107 Ca -0.02 -0.78 0.00 0.00 -0.60 0.00 0.00 54.58 53.18 2jwp n ASN 107 Cb 0.42 -4.33 0.00 0.00 -0.53 0.00 0.00 39.78 35.34 2jwp n ASN 107 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jwp n GLY 108 N -1.46 2.87 3.53 8.20 0.00 -1.24 -4.83 105.19 112.25 2jwp n GLY 108 Ca -0.27 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 2jwp n GLY 108 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jwp s HIS 109 N -2.01 2.75 -0.78 1.61 3.76 -0.79 -4.94 115.29 114.90 2jwp s HIS 109 Ca 0.00 0.02 -0.25 0.00 -0.15 0.00 0.00 55.06 54.67 2jwp s HIS 109 Cb 0.00 -4.15 -0.03 0.00 1.11 0.00 0.00 32.58 29.51 2jwp s HIS 109 CO 0.00 -1.41 1.90 0.95 -0.85 0.00 0.00 174.74 175.34 2jwp s THR 110 N 4.11 3.41 -0.11 1.30 -4.23 -1.26 0.02 115.64 118.88 2jwp s THR 110 Ca 0.32 -0.13 -0.28 0.00 -1.18 0.00 0.00 61.69 60.42 2jwp s THR 110 Cb -0.12 -3.99 -0.25 0.00 1.34 0.00 0.00 72.50 69.48 2jwp s THR 110 CO 0.19 -0.94 0.87 0.58 -0.54 0.00 0.00 174.62 174.78 2jwp h VAL 111 N 7.09 1.71 -3.42 2.29 2.07 -1.45 -3.41 116.25 121.13 2jwp h VAL 111 Ca -0.06 -2.14 -0.65 0.00 0.82 0.00 0.00 66.70 64.67 2jwp h VAL 111 Cb 1.07 3.16 -0.40 0.00 -1.52 0.00 0.00 31.29 33.60 2jwp h VAL 111 CO 1.22 0.56 -0.57 -0.69 0.02 0.00 0.00 177.57 178.10 2jwp s VAL 112 N -2.61 2.83 -0.88 2.57 1.01 -1.08 -4.96 120.40 117.29 2jwp s VAL 112 Ca -0.18 -3.25 0.00 0.00 0.00 0.00 0.00 61.98 58.55 2jwp s VAL 112 Cb -0.02 -2.93 0.27 0.00 0.00 0.00 0.00 36.38 33.70 2jwp s VAL 112 CO 0.70 -0.82 1.09 2.29 0.00 0.00 0.00 175.10 178.36 2jwp n LYS 113 N 3.18 3.44 0.00 2.72 0.00 -1.26 -0.05 118.16 126.19 2jwp n LYS 113 Ca 0.06 -4.59 0.00 0.00 -0.00 0.00 0.00 58.31 53.77 2jwp n LYS 113 Cb 0.33 -2.40 0.00 0.00 -0.00 0.00 0.00 35.03 32.97 2jwp n LYS 113 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2jwp n ASP 114 N 1.29 0.00 -4.55 -5.58 5.75 0.12 -4.91 116.55 108.67 2jwp n ASP 114 Ca 0.27 0.00 -0.39 0.00 -0.01 0.00 0.00 54.79 54.66 2jwp n ASP 114 Cb 0.37 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.43 2jwp n ASP 114 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2jwp s LEU 115 N 0.00 3.25 -0.64 -2.12 2.96 0.52 -4.52 118.68 118.13 2jwp s LEU 115 Ca 0.00 0.00 -0.05 0.00 -0.22 0.00 0.00 54.13 53.87 2jwp s LEU 115 Cb 0.00 -2.54 0.17 0.00 0.50 0.00 0.00 46.19 44.31 2jwp s LEU 115 CO 0.00 -2.20 0.47 1.51 -1.32 0.00 0.00 176.35 174.82 2jwp s ASP 116 N 6.61 5.46 0.23 3.68 -4.77 -1.26 -0.46 116.67 126.17 2jwp s ASP 116 Ca 0.56 -2.77 -0.06 0.00 -3.30 0.00 0.00 52.55 46.98 2jwp s ASP 116 Cb -0.11 -1.91 0.40 0.00 -1.09 0.00 0.00 42.92 40.21 2jwp s ASP 116 CO 0.17 -0.41 1.75 0.40 0.70 0.00 0.00 175.17 177.78 2jwp h ILE 117 N 5.27 0.74 -0.98 2.11 1.08 -1.89 -1.48 117.51 122.37 2jwp h ILE 117 Ca -0.01 -0.17 0.07 0.00 -0.39 0.00 0.00 64.86 64.36 2jwp h ILE 117 Cb 0.97 0.19 -0.07 0.00 -3.07 0.00 0.00 36.82 34.85 2jwp h ILE 117 CO 0.72 0.09 0.63 0.15 -0.69 0.00 0.00 178.15 179.06 2jwp h PHE 118 N 0.50 1.15 -0.05 1.37 3.57 -1.81 -0.62 116.94 121.05 2jwp h PHE 118 Ca 0.38 0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.75 2jwp h PHE 118 Cb 0.51 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 2jwp h PHE 118 CO -0.14 0.58 -0.68 0.22 -2.23 0.00 0.00 178.31 176.05 2jwp h ASP 119 N 1.11 0.25 -0.16 0.41 3.58 -1.54 0.24 116.42 120.32 2jwp h ASP 119 Ca 0.43 -0.16 -0.11 0.00 0.42 0.00 0.00 57.03 57.61 2jwp h ASP 119 Cb 0.22 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.20 2jwp h ASP 119 CO -0.18 0.86 -0.32 0.03 -2.88 0.00 0.00 179.24 176.75 2jwp h ARG 120 N 0.15 0.49 0.00 0.28 2.47 -0.78 -3.36 114.38 113.63 2jwp h ARG 120 Ca -0.02 -0.32 -0.39 0.00 -1.26 0.00 0.00 59.98 57.99 2jwp h ARG 120 Cb 1.22 0.04 -0.07 0.00 -1.65 0.00 0.00 29.97 29.51 2jwp h ARG 120 CO 0.10 0.93 -2.47 1.33 0.56 0.00 0.00 179.97 180.42 2jwp n VAL 121 N -4.36 1.50 0.00 2.04 0.24 -0.53 -5.00 118.33 112.22 2jwp n VAL 121 Ca -0.06 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 2jwp n VAL 121 Cb 0.49 -1.44 0.00 0.00 -1.47 0.00 0.00 33.84 31.41 2jwp n VAL 121 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jwp n GLY 122 N 2.22 1.66 3.90 7.63 0.00 0.86 -4.89 105.19 116.57 2jwp n GLY 122 Ca -0.46 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 2jwp n GLY 122 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2jwp s HIS 123 N 0.00 3.56 -0.76 1.61 5.65 -1.26 -4.96 115.29 119.12 2jwp s HIS 123 Ca 0.00 0.38 -0.24 0.00 0.25 0.00 0.00 55.06 55.46 2jwp s HIS 123 Cb 0.00 -1.85 -0.16 0.00 -1.18 0.00 0.00 32.58 29.39 2jwp s HIS 123 CO 0.00 0.66 2.41 0.43 -0.65 0.00 0.00 174.74 177.58 2jwp n SER 124 N 1.06 1.24 -2.00 9.88 7.64 -1.26 -4.80 113.62 125.38 2jwp n SER 124 Ca -0.12 -0.86 -0.07 0.00 1.01 0.00 0.00 58.87 58.83 2jwp n SER 124 Cb 0.53 -1.37 -0.01 0.00 -1.01 0.00 0.00 64.21 62.35 2jwp n SER 124 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2jwp n THR 125 N 7.88 0.00 -2.68 0.44 -2.24 -1.26 -3.73 114.28 112.69 2jwp n THR 125 Ca 0.50 -0.86 -0.43 0.00 -2.27 0.00 0.00 64.05 61.00 2jwp n THR 125 Cb 0.37 0.55 -0.02 0.00 -2.10 0.00 0.00 70.33 69.13 2jwp n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jwp s ALA 126 N -2.10 3.47 -0.01 6.98 0.00 -1.26 -4.71 121.76 124.13 2jwp s ALA 126 Ca 0.14 0.33 -0.00 0.00 0.00 0.00 0.00 51.96 52.43 2jwp s ALA 126 Cb -0.01 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 2jwp s ALA 126 CO 0.10 -0.71 0.07 -1.58 0.00 0.00 0.00 175.76 173.64 2jwp s HIS 127 N 2.30 3.26 -0.09 0.00 5.04 -0.66 -4.98 115.29 120.15 2jwp s HIS 127 Ca 0.47 0.19 -0.08 0.00 -1.54 0.00 0.00 55.06 54.10 2jwp s HIS 127 Cb -0.18 -1.73 0.02 0.00 0.04 0.00 0.00 32.58 30.74 2jwp s HIS 127 CO 0.15 0.54 0.25 0.16 -2.34 0.00 0.00 174.74 173.50 2jwp s ASP 128 N -1.69 -0.26 -0.33 9.88 -4.77 -1.26 0.60 116.67 118.85 2jwp s ASP 128 Ca 0.22 0.49 -0.10 0.00 -3.30 0.00 0.00 52.55 49.86 2jwp s ASP 128 Cb -0.12 0.50 0.00 0.00 -1.09 0.00 0.00 42.92 42.21 2jwp s ASP 128 CO 0.13 -0.09 0.18 -1.61 0.70 0.00 0.00 175.17 174.48 2jwp s GLU 129 N 0.15 3.21 -0.42 2.11 0.41 -0.79 -4.94 118.70 118.42 2jwp s GLU 129 Ca -0.00 -0.82 -0.18 0.00 -0.41 0.00 0.00 54.97 53.56 2jwp s GLU 129 Cb -0.02 -3.64 0.02 0.00 -1.78 0.00 0.00 34.13 28.71 2jwp s GLU 129 CO 0.00 -0.50 0.48 0.42 -0.49 0.00 0.00 175.26 175.17 2jwp s ILE 130 N 1.61 5.03 -0.39 -1.63 1.01 -1.26 -2.58 121.20 123.00 2jwp s ILE 130 Ca 0.04 -0.25 0.04 0.00 0.00 0.00 0.00 60.65 60.47 2jwp s ILE 130 Cb -0.18 -4.07 0.11 0.00 0.01 0.00 0.00 42.46 38.33 2jwp s ILE 130 CO 0.07 -0.46 0.11 -0.63 0.00 0.00 0.00 174.94 174.03 2jwp s ILE 131 N 2.27 2.40 -0.13 2.92 1.01 0.56 -4.94 121.20 125.30 2jwp s ILE 131 Ca 0.14 -2.59 -0.29 0.00 0.00 0.00 0.00 60.65 57.91 2jwp s ILE 131 Cb -0.16 -2.74 -0.01 0.00 0.01 0.00 0.00 42.46 39.55 2jwp s ILE 131 CO 0.15 -0.65 1.07 -2.84 0.00 0.00 0.00 174.94 172.67 2jwp s PRO 132 N 0.60 4.36 0.16 2.79 0.02 -1.26 -0.95 135.00 140.72 2jwp s PRO 132 Ca 0.12 1.46 0.07 0.00 0.02 0.00 0.00 61.00 62.68 2jwp s PRO 132 Cb -0.21 -3.58 -0.04 0.00 0.02 0.00 0.00 34.50 30.69 2jwp s PRO 132 CO -0.06 -0.44 0.01 0.96 -0.33 0.00 0.00 177.00 177.14 2jwp s ILE 133 N 2.44 3.84 -0.25 2.83 -4.36 0.13 -4.09 121.20 121.73 2jwp s ILE 133 Ca 0.49 -1.33 0.02 0.00 -0.26 0.00 0.00 60.65 59.57 2jwp s ILE 133 Cb -0.19 -2.92 0.06 0.00 1.25 0.00 0.00 42.46 40.66 2jwp s ILE 133 CO 0.16 -0.08 -0.06 -0.94 0.24 0.00 0.00 174.94 174.25 2jwp s SER 134 N -2.87 4.08 -0.23 4.36 1.04 0.85 -1.04 113.70 119.88 2jwp s SER 134 Ca 0.28 -1.29 -0.12 0.00 0.48 0.00 0.00 55.95 55.29 2jwp s SER 134 Cb -0.10 -1.31 -0.05 0.00 0.10 0.00 0.00 66.02 64.67 2jwp s SER 134 CO 0.19 -0.23 0.21 -0.63 0.98 0.00 0.00 173.24 173.76 2jwp s ILE 135 N 1.29 5.33 -0.15 -1.02 1.01 -0.46 -0.53 121.20 126.65 2jwp s ILE 135 Ca -0.06 0.29 -0.12 0.00 0.00 0.00 0.00 60.65 60.77 2jwp s ILE 135 Cb -0.19 -3.55 0.05 0.00 0.01 0.00 0.00 42.46 38.78 2jwp s ILE 135 CO -0.06 0.33 0.39 -0.54 0.00 0.00 0.00 174.94 175.06 2jwp s LYS 136 N 1.11 0.42 -1.78 2.79 -0.14 0.04 -1.54 119.74 120.64 2jwp s LYS 136 Ca 0.10 0.64 0.00 0.00 -1.36 0.00 0.00 55.97 55.35 2jwp s LYS 136 Cb -0.14 0.11 0.00 0.00 -1.68 0.00 0.00 37.83 36.12 2jwp s LYS 136 CO 0.05 -0.10 0.00 1.63 -0.76 0.00 0.00 175.35 176.17 2jwp n LYS 137 N 3.48 -1.43 -0.99 1.68 4.76 -1.26 -0.91 118.16 123.50 2jwp n LYS 137 Ca -0.18 1.02 0.00 0.00 -2.87 0.00 0.00 58.31 56.28 2jwp n LYS 137 Cb 0.56 -5.47 0.00 0.00 -1.84 0.00 0.00 35.03 28.28 2jwp n LYS 137 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jwp n GLY 138 N -0.86 0.51 3.54 0.72 0.00 -1.26 -5.00 105.19 102.83 2jwp n GLY 138 Ca -0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 2jwp n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jwp s LYS 139 N -0.01 2.93 -0.29 1.61 1.02 -0.09 0.19 119.74 125.11 2jwp s LYS 139 Ca 0.00 -0.57 -0.06 0.00 0.02 0.00 0.00 55.97 55.36 2jwp s LYS 139 Cb 0.00 -2.63 0.01 0.00 -0.52 0.00 0.00 37.83 34.69 2jwp s LYS 139 CO 0.00 0.55 0.07 -1.17 -0.92 0.00 0.00 175.35 173.88 2jwp s LEU 140 N -0.51 3.76 -0.20 3.17 0.20 0.81 -0.78 118.68 125.12 2jwp s LEU 140 Ca 0.08 -0.68 -0.05 0.00 0.69 0.00 0.00 54.13 54.17 2jwp s LEU 140 Cb -0.12 -1.87 -0.02 0.00 -0.43 0.00 0.00 46.19 43.75 2jwp s LEU 140 CO 0.02 -0.17 -0.00 -0.44 -0.29 0.00 0.00 176.35 175.47 2jwp s SER 141 N 1.50 4.85 -0.51 3.68 0.01 0.31 -1.88 113.70 121.66 2jwp s SER 141 Ca 0.03 -0.19 -0.03 0.00 1.31 0.00 0.00 55.95 57.07 2jwp s SER 141 Cb -0.17 -1.83 0.13 0.00 0.21 0.00 0.00 66.02 64.37 2jwp s SER 141 CO 0.02 0.07 0.31 -0.69 0.41 0.00 0.00 173.24 173.36 2jwp s VAL 142 N 0.94 3.45 0.00 3.43 1.01 0.90 -0.10 120.40 130.03 2jwp s VAL 142 Ca 0.01 -2.50 0.00 0.00 0.00 0.00 0.00 61.98 59.50 2jwp s VAL 142 Cb -0.14 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.92 2jwp s VAL 142 CO 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 175.10 174.34 2jwp n GLN 143 N 4.06 0.00 -0.00 2.72 1.13 -1.26 -0.91 117.38 123.11 2jwp n GLN 143 Ca 0.02 0.00 0.07 0.00 -1.94 0.00 0.00 57.00 55.15 2jwp n GLN 143 Cb 0.39 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.66 2jwp n GLN 143 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2jwp n GLY 144 N 0.00 -0.38 3.91 1.08 0.00 -1.26 -4.98 105.19 103.56 2jwp n GLY 144 Ca 0.00 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 2jwp n GLY 144 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jwp s GLU 145 N -2.40 3.54 -0.07 1.61 2.02 -0.09 -5.10 118.70 118.21 2jwp s GLU 145 Ca 0.05 -0.24 -0.03 0.00 0.02 0.00 0.00 54.97 54.77 2jwp s GLU 145 Cb 0.11 -2.93 0.04 0.00 0.10 0.00 0.00 34.13 31.45 2jwp s GLU 145 CO 0.60 0.53 0.13 0.54 0.02 0.00 0.00 175.26 177.08 2jwp s VAL 146 N -1.59 -0.13 -0.18 2.63 0.11 -1.26 -0.07 120.40 119.90 2jwp s VAL 146 Ca 0.38 0.26 -0.20 0.00 -2.93 0.00 0.00 61.98 59.50 2jwp s VAL 146 Cb -0.12 -0.24 0.05 0.00 -1.53 0.00 0.00 36.38 34.54 2jwp s VAL 146 CO 0.26 0.11 0.55 -0.44 -3.33 0.00 0.00 175.10 172.25 2jwp s SER 147 N 1.63 -0.56 0.40 3.54 0.01 -0.79 -5.01 113.70 112.93 2jwp s SER 147 Ca -0.04 1.00 -0.27 0.00 1.31 0.00 0.00 55.95 57.95 2jwp s SER 147 Cb -0.12 1.01 -0.10 0.00 0.21 0.00 0.00 66.02 67.02 2jwp s SER 147 CO -0.05 -0.25 1.43 0.35 0.41 0.00 0.00 173.24 175.13 2jwp n THR 148 N 2.49 2.26 -3.08 1.44 -2.24 -1.26 -0.13 114.28 113.74 2jwp n THR 148 Ca -0.15 -0.50 -0.39 0.00 -2.27 0.00 0.00 64.05 60.75 2jwp n THR 148 Cb 0.56 -1.86 -0.06 0.00 -2.10 0.00 0.00 70.33 66.87 2jwp n THR 148 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2jwp s PHE 149 N -1.14 3.83 -0.12 4.78 5.36 0.13 -4.62 117.98 126.20 2jwp s PHE 149 Ca 0.56 1.49 -0.04 0.00 -0.96 0.00 0.00 56.93 57.98 2jwp s PHE 149 Cb -0.48 -2.66 0.06 0.00 -0.34 0.00 0.00 43.02 39.59 2jwp s PHE 149 CO 0.62 0.50 0.19 -0.08 -1.46 0.00 0.00 175.22 174.99 2jwp s THR 150 N -1.21 -0.30 0.00 0.12 -1.32 -1.26 -4.83 115.64 106.84 2jwp s THR 150 Ca 0.35 0.24 0.00 0.00 -1.21 0.00 0.00 61.69 61.08 2jwp s THR 150 Cb -0.21 -0.40 0.00 0.00 -1.51 0.00 0.00 72.50 70.38 2jwp s THR 150 CO 0.23 0.07 0.00 0.61 -2.21 0.00 0.00 174.62 173.32 2jwp n GLY 151 N 5.33 2.32 3.83 6.08 0.00 -1.26 -4.82 105.19 116.66 2jwp n GLY 151 Ca -0.05 -0.09 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 2jwp n GLY 151 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jwp s LYS 152 N 0.00 1.75 0.07 1.61 0.00 -1.26 -3.21 119.74 118.69 2jwp s LYS 152 Ca 0.00 -0.97 -0.25 0.00 0.00 0.00 0.00 55.97 54.75 2jwp s LYS 152 Cb 0.00 0.60 -0.06 0.00 0.00 0.00 0.00 37.83 38.38 2jwp s LYS 152 CO 0.00 -0.80 0.78 -1.17 0.00 0.00 0.00 175.35 174.16 2jwp s LEU 153 N -2.91 4.47 -0.26 2.77 0.20 0.99 -4.86 118.68 119.08 2jwp s LEU 153 Ca 0.11 1.50 0.03 0.00 0.69 0.00 0.00 54.13 56.45 2jwp s LEU 153 Cb -0.06 -3.26 0.06 0.00 -0.43 0.00 0.00 46.19 42.51 2jwp s LEU 153 CO 0.06 0.04 -0.08 -0.55 -0.29 0.00 0.00 176.35 175.53 2jwp s SER 154 N -0.21 4.34 -0.64 3.68 0.15 -1.26 0.07 113.70 119.83 2jwp s SER 154 Ca 0.39 -1.42 -0.18 0.00 0.70 0.00 0.00 55.95 55.44 2jwp s SER 154 Cb -0.21 -1.47 0.12 0.00 -1.71 0.00 0.00 66.02 62.75 2jwp s SER 154 CO 0.24 -0.22 0.73 -0.69 1.20 0.00 0.00 173.24 174.50 2jwp s VAL 155 N 1.15 4.92 -0.09 4.45 1.01 -0.95 0.09 120.40 130.99 2jwp s VAL 155 Ca -0.06 -1.24 0.02 0.00 0.00 0.00 0.00 61.98 60.69 2jwp s VAL 155 Cb -0.20 -4.50 -0.02 0.00 0.00 0.00 0.00 36.38 31.66 2jwp s VAL 155 CO -0.06 -1.13 -0.15 -1.61 0.00 0.00 0.00 175.10 172.15 2jwp s GLU 156 N 2.34 2.95 -0.04 2.72 2.02 -0.92 -1.57 118.70 126.21 2jwp s GLU 156 Ca 0.13 -0.72 0.06 0.00 0.02 0.00 0.00 54.97 54.46 2jwp s GLU 156 Cb -0.21 -2.47 -0.01 0.00 0.10 0.00 0.00 34.13 31.53 2jwp s GLU 156 CO 0.03 0.38 -0.21 -0.59 0.02 0.00 0.00 175.26 174.90 2jwp s PHE 157 N -0.11 1.99 -0.00 1.61 -0.71 -1.09 -0.77 117.98 118.89 2jwp s PHE 157 Ca -0.02 -0.52 -0.00 0.00 -1.04 0.00 0.00 56.93 55.35 2jwp s PHE 157 Cb -0.14 -1.31 -0.04 0.00 -1.21 0.00 0.00 43.02 40.33 2jwp s PHE 157 CO 0.04 -0.14 0.08 0.08 -1.34 0.00 0.00 175.22 173.94 2jwp s VAL 158 N -0.19 4.71 0.04 -2.49 1.01 -0.19 -2.51 120.40 120.79 2jwp s VAL 158 Ca -0.00 -0.42 -0.38 0.00 0.00 0.00 0.00 61.98 61.19 2jwp s VAL 158 Cb -0.11 -3.15 -0.17 0.00 0.00 0.00 0.00 36.38 32.95 2jwp s VAL 158 CO 0.02 0.35 1.33 1.17 0.00 0.00 0.00 175.10 177.96 2jwp n LYS 159 N 1.18 0.97 0.00 2.72 4.81 -1.26 -2.81 118.16 123.77 2jwp n LYS 159 Ca -0.13 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.66 2jwp n LYS 159 Cb 0.53 -1.97 0.00 0.00 0.02 0.00 0.00 35.03 33.60 2jwp n LYS 159 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jwp n GLY 160 N 2.49 -0.49 0.00 3.14 0.00 -1.26 -4.78 105.19 104.29 2jwp n GLY 160 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2jwp n GLY 160 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2jwp n TYR 161 N -2.43 0.00 -0.21 1.61 9.36 -1.26 -4.68 117.16 119.55 2jwp n TYR 161 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2jwp n TYR 161 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 2jwp n TYR 161 CO 0.00 0.00 0.00 0.98 0.22 0.00 0.00 176.86 178.06 2jwp n TYR 162 N -0.58 0.00 -1.86 2.98 9.36 -1.26 -4.79 117.16 121.01 2jwp n TYR 162 Ca 0.00 0.00 -0.20 0.00 3.32 0.00 0.00 57.90 61.02 2jwp n TYR 162 Cb 0.00 0.00 0.06 0.00 -0.63 0.00 0.00 39.34 38.77 2jwp n TYR 162 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 2jwp n ASP 163 N -0.25 4.58 0.02 2.98 5.68 -1.26 -4.50 116.55 123.80 2jwp n ASP 163 Ca 0.00 -3.78 -0.12 0.00 -0.50 0.00 0.00 54.79 50.39 2jwp n ASP 163 Cb 0.05 -0.44 -0.08 0.00 -1.14 0.00 0.00 41.12 39.51 2jwp n ASP 163 CO 0.00 0.00 0.00 -1.13 -1.33 0.00 0.00 177.20 174.74 2jwp h ASN 164 N 1.93 0.01 -2.12 -1.12 -1.24 -1.87 -3.39 115.58 107.78 2jwp h ASN 164 Ca 0.33 -0.12 -0.57 0.00 0.71 0.00 0.00 56.30 56.65 2jwp h ASN 164 Cb 1.41 -0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.45 2jwp h ASN 164 CO 0.71 0.13 1.45 -2.84 -1.29 0.00 0.00 177.43 175.59 2jwp s PRO 165 N -5.70 3.05 0.33 6.67 0.02 -1.25 -4.93 135.00 133.18 2jwp s PRO 165 Ca -0.14 1.77 -0.03 0.00 0.02 0.00 0.00 61.00 62.62 2jwp s PRO 165 Cb 0.05 -4.36 -0.00 0.00 0.02 0.00 0.00 34.50 30.21 2jwp s PRO 165 CO 0.67 -2.20 0.45 -1.59 -0.33 0.00 0.00 177.00 174.00 2jwp s LYS 166 N 6.42 1.84 0.22 5.54 -2.85 -1.26 -5.05 119.74 124.60 2jwp s LYS 166 Ca 0.94 -1.70 -0.30 0.00 -1.00 0.00 0.00 55.97 53.91 2jwp s LYS 166 Cb -0.28 0.44 -0.09 0.00 -2.06 0.00 0.00 37.83 35.84 2jwp s LYS 166 CO 0.33 -0.75 1.30 0.08 0.10 0.00 0.00 175.35 176.41 2jwp s VAL 167 N -3.21 3.15 -0.38 1.79 1.01 -1.15 -4.64 120.40 116.97 2jwp s VAL 167 Ca 0.30 0.98 0.02 0.00 0.00 0.00 0.00 61.98 63.28 2jwp s VAL 167 Cb -0.00 -3.63 0.15 0.00 0.00 0.00 0.00 36.38 32.91 2jwp s VAL 167 CO 0.19 0.16 0.30 0.00 0.00 0.00 0.00 175.10 175.75 2jwp n ALA 169 N 3.64 3.11 -1.51 0.00 0.00 0.11 0.26 120.51 126.12 2jwp n ALA 169 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.21 2jwp n ALA 169 Cb 0.42 -1.15 -0.08 0.00 0.00 0.00 0.00 19.45 18.64 2jwp n ALA 169 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2jwp n LEU 170 N 1.31 1.50 -4.33 0.00 7.94 0.96 -2.84 117.00 121.54 2jwp n LEU 170 Ca 0.00 -0.07 -0.33 0.00 -1.11 0.00 0.00 56.01 54.50 2jwp n LEU 170 Cb 0.39 -1.27 -0.15 0.00 0.53 0.00 0.00 43.42 42.93 2jwp n LEU 170 CO 0.00 -1.09 -0.46 0.12 -1.11 0.00 0.00 177.39 174.85 2jwp s PHE 171 N 10.05 2.80 -0.14 1.96 5.36 -0.94 0.12 117.98 137.19 2jwp s PHE 171 Ca 1.15 -0.78 0.02 0.00 -0.96 0.00 0.00 56.93 56.36 2jwp s PHE 171 Cb -0.73 -1.86 0.01 0.00 -0.34 0.00 0.00 43.02 40.10 2jwp s PHE 171 CO 0.39 -0.31 -0.20 -1.50 -1.46 0.00 0.00 175.22 172.14 2jwp s ILE 172 N 0.53 1.94 0.36 3.12 2.07 0.03 -0.15 121.20 129.09 2jwp s ILE 172 Ca -0.09 -0.90 0.08 0.00 -1.41 0.00 0.00 60.65 58.33 2jwp s ILE 172 Cb -0.16 -1.72 -0.05 0.00 0.13 0.00 0.00 42.46 40.66 2jwp s ILE 172 CO 0.04 0.53 0.06 0.00 -1.91 0.00 0.00 174.94 173.65 2jwp s MET 173 N 0.88 2.14 0.11 3.50 0.23 -0.77 -2.56 119.30 122.82 2jwp s MET 173 Ca -0.06 -1.76 0.11 0.00 -1.03 0.00 0.00 55.69 52.94 2jwp s MET 173 Cb -0.15 -1.95 -0.04 0.00 -1.53 0.00 0.00 34.83 31.16 2jwp s MET 173 CO -0.02 0.08 -0.27 -1.59 -2.03 0.00 0.00 175.02 171.19 2jwp s LYS 174 N -3.77 1.48 0.00 3.16 0.00 0.12 -0.76 119.74 119.97 2jwp s LYS 174 Ca 0.36 -1.29 0.00 0.00 0.00 0.00 0.00 55.97 55.04 2jwp s LYS 174 Cb 0.01 -1.90 0.00 0.00 0.00 0.00 0.00 37.83 35.94 2jwp s LYS 174 CO 0.20 0.46 0.00 0.41 0.00 0.00 0.00 175.35 176.42 2jwp n GLY 175 N 1.11 2.63 3.55 0.59 0.00 0.14 -4.80 105.19 108.41 2jwp n GLY 175 Ca -0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 2jwp n GLY 175 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jwp s THR 176 N -2.67 0.00 -0.64 2.61 -4.23 0.39 -2.86 115.64 108.24 2jwp s THR 176 Ca 0.00 0.00 0.25 0.00 -1.18 0.00 0.00 61.69 60.76 2jwp s THR 176 Cb 0.00 -1.00 0.15 0.00 1.34 0.00 0.00 72.50 72.99 2jwp s THR 176 CO 0.00 0.00 1.48 0.00 -0.54 0.00 0.00 174.62 175.56 2jwp h ALA 177 N 2.52 0.74 -0.00 3.99 0.00 -1.95 -3.41 119.26 121.16 2jwp h ALA 177 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2jwp h ALA 177 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2jwp h ALA 177 CO 0.33 0.00 0.00 -3.47 0.00 0.00 0.00 179.25 176.11