#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 0.05 -2.25 0.99 5.85 -1.95 -1.60 115.31 116.40 2jwp h LEU 6 Ca 0.00 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2jwp h LEU 6 Cb 0.00 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 2jwp h LEU 6 CO 0.00 0.35 -0.04 0.00 -0.34 0.00 0.00 178.44 178.41 2jwp h ALA 7 N 1.66 1.52 0.14 1.25 0.00 -1.68 -2.17 119.26 119.98 2jwp h ALA 7 Ca 0.01 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.57 2jwp h ALA 7 Cb 0.54 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2jwp h ALA 7 CO 0.04 0.05 -1.54 0.22 0.00 0.00 0.00 179.25 178.02 2jwp h ASP 8 N 0.00 0.47 0.54 0.00 3.58 -1.60 -3.36 116.42 116.06 2jwp h ASP 8 Ca -0.00 -0.63 0.00 0.00 0.42 0.00 0.00 57.03 56.82 2jwp h ASP 8 Cb 0.10 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.99 2jwp h ASP 8 CO 0.01 1.52 -0.56 0.29 -2.88 0.00 0.00 179.24 177.61 2jwp n LYS 9 N -3.50 0.06 -1.73 0.28 4.76 -1.00 -4.87 118.16 112.16 2jwp n LYS 9 Ca -0.17 0.01 -0.42 0.00 -2.87 0.00 0.00 58.31 54.86 2jwp n LYS 9 Cb 1.05 -1.53 -0.02 0.00 -1.84 0.00 0.00 35.03 32.69 2jwp n LYS 9 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 2jwp n VAL 10 N -1.62 0.56 -0.08 -0.18 3.14 -0.85 0.91 118.33 120.21 2jwp n VAL 10 Ca 0.05 -0.14 -0.10 0.00 -2.96 0.00 0.00 64.34 61.19 2jwp n VAL 10 Cb 0.36 -1.93 -0.08 0.00 -1.06 0.00 0.00 33.84 31.13 2jwp n VAL 10 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2jwp n ILE 11 N 2.93 0.90 -3.61 1.55 3.06 -1.08 -4.79 119.36 118.32 2jwp n ILE 11 Ca 0.12 -0.38 -0.12 0.00 -2.50 0.00 0.00 62.75 59.88 2jwp n ILE 11 Cb 0.35 -1.00 -0.06 0.00 0.54 0.00 0.00 39.64 39.47 2jwp n ILE 11 CO 0.00 0.00 0.00 0.86 -2.50 0.00 0.00 176.55 174.91 2jwp s TRP 12 N -2.31 -0.54 -0.23 9.51 -0.00 -1.06 -5.00 118.94 119.30 2jwp s TRP 12 Ca -0.19 1.20 -0.18 0.00 -0.00 0.00 0.00 56.10 56.93 2jwp s TRP 12 Cb 0.05 0.37 0.06 0.00 -0.00 0.00 0.00 33.47 33.96 2jwp s TRP 12 CO 0.39 -0.34 0.60 0.00 -0.00 0.00 0.00 176.95 177.60 2jwp s ALA 13 N -0.24 -1.53 -0.22 5.86 0.00 -1.26 -0.89 121.76 123.48 2jwp s ALA 13 Ca -0.01 1.87 -0.04 0.00 0.00 0.00 0.00 51.96 53.79 2jwp s ALA 13 Cb -0.03 -1.10 0.07 0.00 0.00 0.00 0.00 23.12 22.06 2jwp s ALA 13 CO -0.01 -0.31 0.08 0.08 0.00 0.00 0.00 175.76 175.61 2jwp s VAL 14 N 0.84 0.24 -1.10 0.00 1.01 0.11 -0.06 120.40 121.44 2jwp s VAL 14 Ca -0.04 -0.58 -0.21 0.00 0.00 0.00 0.00 61.98 61.15 2jwp s VAL 14 Cb -0.05 -0.95 0.07 0.00 0.00 0.00 0.00 36.38 35.44 2jwp s VAL 14 CO -0.07 -0.40 1.51 0.21 0.00 0.00 0.00 175.10 176.35 2jwp s ASN 15 N 1.97 6.64 -0.47 3.32 3.04 -1.26 -0.89 114.94 127.29 2jwp s ASN 15 Ca 0.03 -1.87 -0.27 0.00 0.04 0.00 0.00 52.86 50.79 2jwp s ASN 15 Cb -0.17 -2.55 -0.03 0.00 -1.54 0.00 0.00 41.25 36.96 2jwp s ASN 15 CO -0.17 -1.34 1.98 0.00 -3.04 0.00 0.00 177.10 174.53 2jwp s ALA 16 N 4.41 2.32 0.00 1.71 0.00 0.15 -3.43 121.76 126.92 2jwp s ALA 16 Ca 0.47 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.31 2jwp s ALA 16 Cb 0.01 -4.20 0.00 0.00 0.00 0.00 0.00 23.12 18.92 2jwp s ALA 16 CO -0.04 -3.53 0.00 0.41 0.00 0.00 0.00 175.76 172.60 2jwp n GLY 17 N 5.68 0.67 0.00 0.00 0.00 -1.15 -2.27 105.19 108.11 2jwp n GLY 17 Ca 0.25 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 5.50 3.50 -0.02 0.00 -1.22 -3.90 105.19 109.05 2jwp n GLY 18 Ca 0.00 -1.17 -0.25 0.00 0.00 0.00 0.00 46.02 44.60 2jwp n GLY 18 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2jwp s GLU 19 N 4.62 1.78 0.00 1.61 1.03 -1.26 -1.82 118.70 124.66 2jwp s GLU 19 Ca 0.00 -1.58 0.00 0.00 0.03 0.00 0.00 54.97 53.42 2jwp s GLU 19 Cb 0.00 -1.90 0.00 0.00 -0.80 0.00 0.00 34.13 31.43 2jwp s GLU 19 CO 0.00 0.37 0.00 0.43 -1.33 0.00 0.00 175.26 174.73 2jwp n SER 20 N -0.33 0.00 -3.73 0.83 7.64 -1.25 -4.61 113.62 112.17 2jwp n SER 20 Ca -0.08 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.59 2jwp n SER 20 Cb 0.58 0.00 -0.18 0.00 -1.01 0.00 0.00 64.21 63.61 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 0.30 -0.18 1.43 2.46 -0.77 -4.86 115.29 113.67 2jwp s HIS 21 Ca 0.00 0.07 -0.24 0.00 0.47 0.00 0.00 55.06 55.36 2jwp s HIS 21 Cb 0.00 -0.57 -0.02 0.00 -0.13 0.00 0.00 32.58 31.86 2jwp s HIS 21 CO 0.00 -0.23 0.80 0.08 -2.47 0.00 0.00 174.74 172.92 2jwp s VAL 22 N 1.91 4.90 0.44 0.89 1.01 -1.25 -0.49 120.40 127.81 2jwp s VAL 22 Ca 0.03 1.55 0.08 0.00 0.00 0.00 0.00 61.98 63.63 2jwp s VAL 22 Cb -0.12 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.17 2jwp s VAL 22 CO -0.04 0.03 0.55 1.51 0.00 0.00 0.00 175.10 177.16 2jwp s ASP 23 N 1.18 5.44 0.63 3.32 -4.77 0.25 -4.89 116.67 117.83 2jwp s ASP 23 Ca 0.36 -0.56 0.33 0.00 -3.30 0.00 0.00 52.55 49.38 2jwp s ASP 23 Cb -0.16 -0.50 1.83 0.00 -1.09 0.00 0.00 42.92 43.00 2jwp s ASP 23 CO 0.12 -0.82 2.11 -0.37 0.70 0.00 0.00 175.17 176.91 2jwp h VAL 24 N 0.67 0.24 0.00 2.11 -1.51 -1.91 0.88 116.25 116.74 2jwp h VAL 24 Ca -0.39 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 2jwp h VAL 24 Cb 1.28 0.83 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 2jwp h VAL 24 CO 0.47 0.00 0.00 1.41 -1.23 0.00 0.00 177.57 178.22 2jwp n HIS 25 N -3.41 0.12 -1.11 5.19 8.25 -1.26 -4.86 115.22 118.13 2jwp n HIS 25 Ca -0.00 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2jwp n HIS 25 Cb 0.29 -0.56 0.00 0.00 1.12 0.00 0.00 29.99 30.84 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 1.05 0.93 3.45 -1.41 0.00 0.31 -2.88 105.19 106.64 2jwp n GLY 26 Ca 0.06 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.10 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 4.94 -0.38 -0.61 -1.09 -1.14 -4.12 121.20 116.80 2jwp s ILE 27 Ca 0.00 -0.56 -0.19 0.00 -2.23 0.00 0.00 60.65 57.67 2jwp s ILE 27 Cb 0.00 -3.65 0.01 0.00 -1.58 0.00 0.00 42.46 37.23 2jwp s ILE 27 CO 0.00 -0.14 0.53 -2.28 -1.23 0.00 0.00 174.94 171.82 2jwp s HIS 28 N 1.64 3.15 0.09 3.97 5.65 -1.26 -0.58 115.29 127.96 2jwp s HIS 28 Ca 0.04 0.05 -0.16 0.00 0.25 0.00 0.00 55.06 55.24 2jwp s HIS 28 Cb -0.18 -3.02 -0.07 0.00 -1.18 0.00 0.00 32.58 28.13 2jwp s HIS 28 CO 0.08 -0.64 0.53 1.52 -0.65 0.00 0.00 174.74 175.58 2jwp s TYR 29 N 2.46 3.70 -1.06 3.88 -0.85 0.36 -4.39 117.35 121.45 2jwp s TYR 29 Ca 0.19 1.12 -0.03 0.00 -0.52 0.00 0.00 57.07 57.82 2jwp s TYR 29 Cb -0.15 -2.40 0.31 0.00 0.38 0.00 0.00 41.96 40.10 2jwp s TYR 29 CO 0.15 0.52 1.49 2.89 -1.52 0.00 0.00 175.55 179.08 2jwp n ARG 30 N 1.30 4.49 0.00 -3.49 -4.01 0.92 -1.85 116.66 114.01 2jwp n ARG 30 Ca -0.09 -4.57 0.00 0.00 -1.04 0.00 0.00 57.85 52.15 2jwp n ARG 30 Cb 0.51 -2.50 0.00 0.00 -3.04 0.00 0.00 32.46 27.44 2jwp n ARG 30 CO 0.00 0.00 0.00 1.17 -3.04 0.00 0.00 177.63 175.76 2jwp n LYS 31 N 1.19 0.00 -3.43 2.89 4.81 -1.26 -4.31 118.16 118.05 2jwp n LYS 31 Ca 0.28 0.00 -0.44 0.00 -0.87 0.00 0.00 58.31 57.27 2jwp n LYS 31 Cb 0.33 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.34 2jwp n LYS 31 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 2jwp s ASP 32 N -4.00 6.45 0.00 3.14 -4.77 -0.76 -4.49 116.67 112.24 2jwp s ASP 32 Ca 0.00 -2.85 0.00 0.00 -3.30 0.00 0.00 52.55 46.40 2jwp s ASP 32 Cb 0.00 -2.12 0.00 0.00 -1.09 0.00 0.00 42.92 39.71 2jwp s ASP 32 CO 0.00 -0.49 0.00 -0.81 0.70 0.00 0.00 175.17 174.57 2jwp n PRO 33 N 3.69 0.00 0.00 2.11 -0.04 -1.26 -4.78 135.00 134.72 2jwp n PRO 33 Ca 0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.60 2jwp n PRO 33 Cb 0.44 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.90 2jwp n PRO 33 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2jwp n LEU 34 N 0.00 0.00 -0.12 1.53 4.32 -1.26 -4.71 117.00 116.76 2jwp n LEU 34 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2jwp n LEU 34 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 2jwp n LEU 34 CO 0.00 0.00 -0.04 -0.62 -1.22 0.00 0.00 177.39 175.51 2jwp n GLU 35 N 0.00 -0.32 -0.31 3.23 1.02 -1.26 -4.84 120.64 118.17 2jwp n GLU 35 Ca 0.00 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 2jwp n GLU 35 Cb 0.00 -0.30 0.00 0.00 -0.02 0.00 0.00 31.44 31.12 2jwp n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jwp n GLY 36 N -1.54 2.06 1.65 0.62 0.00 -1.26 -4.73 105.19 101.98 2jwp n GLY 36 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 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 0.27 -3.96 1.61 1.74 -1.26 -5.11 116.66 107.95 2jwp n ARG 37 Ca 0.00 -2.23 -0.21 0.00 -0.77 0.00 0.00 57.85 54.64 2jwp n ARG 37 Cb 0.00 -0.25 -0.03 0.00 -1.02 0.00 0.00 32.46 31.16 2jwp n ARG 37 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2jwp s VAL 38 N -0.58 4.42 0.00 1.55 -7.23 -1.26 -4.72 120.40 112.58 2jwp s VAL 38 Ca 0.33 -1.26 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 2jwp s VAL 38 Cb 0.38 -3.46 0.00 0.00 0.56 0.00 0.00 36.38 33.86 2jwp s VAL 38 CO -0.15 -0.29 0.00 0.61 -0.31 0.00 0.00 175.10 174.96 2jwp n GLY 39 N -1.31 3.46 3.30 2.32 0.00 -1.26 -5.05 105.19 106.64 2jwp n GLY 39 Ca -0.06 -0.63 -0.45 0.00 0.00 0.00 0.00 46.02 44.88 2jwp n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jwp s ARG 40 N 0.00 2.87 -0.13 1.61 0.52 -1.26 -4.87 118.95 117.69 2jwp s ARG 40 Ca 0.00 -1.66 -0.08 0.00 -0.52 0.00 0.00 55.73 53.47 2jwp s ARG 40 Cb 0.00 -4.18 -0.03 0.00 0.52 0.00 0.00 34.95 31.26 2jwp s ARG 40 CO 0.00 -1.25 -0.16 0.00 0.02 0.00 0.00 175.30 173.91 2jwp h ALA 41 N 8.76 0.00 -4.24 2.13 0.00 -1.92 -3.39 119.26 120.61 2jwp h ALA 41 Ca -0.28 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2jwp h ALA 41 Cb 1.10 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2jwp h ALA 41 CO 0.97 0.46 -0.14 0.45 0.00 0.00 0.00 179.25 180.99 2jwp n SER 42 N -4.49 -5.16 -0.13 0.00 2.88 -1.25 -4.65 113.62 100.82 2jwp n SER 42 Ca -0.06 0.14 0.13 0.00 -1.33 0.00 0.00 58.87 57.74 2jwp n SER 42 Cb 0.24 -3.34 0.35 0.00 -0.75 0.00 0.00 64.21 60.71 2jwp n SER 42 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2jwp n ASP 43 N -0.87 0.74 -1.93 -3.46 5.75 -1.26 -4.34 116.55 111.17 2jwp n ASP 43 Ca 0.03 -0.56 -0.11 0.00 -0.01 0.00 0.00 54.79 54.14 2jwp n ASP 43 Cb 0.37 0.15 -0.12 0.00 -1.03 0.00 0.00 41.12 40.48 2jwp n ASP 43 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 2jwp n TYR 44 N -1.04 0.19 -2.67 2.11 4.01 -1.26 -3.37 117.16 115.12 2jwp n TYR 44 Ca 0.09 -1.45 -0.05 0.00 -0.16 0.00 0.00 57.90 56.34 2jwp n TYR 44 Cb 0.34 -1.33 0.03 0.00 -0.31 0.00 0.00 39.34 38.07 2jwp n TYR 44 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jwp n GLY 45 N 2.08 -0.05 0.39 2.72 0.00 -1.26 -5.04 105.19 104.02 2jwp n GLY 45 Ca 0.34 -0.03 -0.15 0.00 0.00 0.00 0.00 46.02 46.18 2jwp n GLY 45 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2jwp h MET 46 N 1.48 -0.91 0.00 1.61 2.86 -1.89 -3.47 114.93 114.61 2jwp h MET 46 Ca -0.47 0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.23 2jwp h MET 46 Cb 1.26 0.21 0.00 0.00 0.06 0.00 0.00 31.60 33.13 2jwp h MET 46 CO -0.16 -0.61 0.00 0.36 1.06 0.00 0.00 176.91 177.56 2jwp n LYS 47 N -4.67 0.00 -3.44 1.72 2.85 -1.26 -4.74 118.16 108.62 2jwp n LYS 47 Ca -0.12 0.00 -0.17 0.00 -1.05 0.00 0.00 58.31 56.97 2jwp n LYS 47 Cb 0.38 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.77 2jwp n LYS 47 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2jwp n LEU 48 N 0.00 -0.62 -4.51 -5.58 7.99 -1.26 -4.65 117.00 108.38 2jwp n LEU 48 Ca 0.00 -0.57 -0.44 0.00 -0.01 0.00 0.00 56.01 54.99 2jwp n LEU 48 Cb 0.00 -0.82 -0.06 0.00 -0.11 0.00 0.00 43.42 42.42 2jwp n LEU 48 CO 0.00 0.29 1.93 -2.65 -1.51 0.00 0.00 177.39 175.46 2jwp n PRO 49 N -2.14 1.08 -1.58 3.23 -0.02 -1.26 -4.84 135.00 129.47 2jwp n PRO 49 Ca -0.13 0.21 -0.45 0.00 -2.02 0.00 0.00 63.50 61.11 2jwp n PRO 49 Cb 0.34 -2.77 -0.04 0.00 -0.02 0.00 0.00 33.50 31.01 2jwp n PRO 49 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2jwp n ILE 50 N 7.58 0.37 0.37 4.25 -0.00 -1.26 -4.82 119.36 125.86 2jwp n ILE 50 Ca 0.41 -0.36 0.11 0.00 -0.00 0.00 0.00 62.75 62.92 2jwp n ILE 50 Cb 0.34 -2.29 0.49 0.00 -0.00 0.00 0.00 39.64 38.17 2jwp n ILE 50 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2jwp n LEU 51 N 10.50 0.62 -1.94 1.39 4.32 -1.26 -2.60 117.00 128.02 2jwp n LEU 51 Ca 0.31 0.67 -0.02 0.00 -0.02 0.00 0.00 56.01 56.94 2jwp n LEU 51 Cb 0.38 -0.60 0.32 0.00 -1.62 0.00 0.00 43.42 41.91 2jwp n LEU 51 CO 0.69 -0.58 0.97 0.54 -1.22 0.00 0.00 177.39 177.78 2jwp n ARG 52 N -2.20 3.97 -3.96 3.23 5.12 -1.26 -4.95 116.66 116.62 2jwp n ARG 52 Ca 0.02 -2.97 -0.09 0.00 -1.93 0.00 0.00 57.85 52.88 2jwp n ARG 52 Cb 0.20 -2.20 -0.06 0.00 -1.16 0.00 0.00 32.46 29.24 2jwp n ARG 52 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2jwp s SER 53 N -0.87 -0.06 -0.05 0.55 0.15 -1.07 -4.89 113.70 107.45 2jwp s SER 53 Ca 0.53 -0.88 -0.12 0.00 0.70 0.00 0.00 55.95 56.18 2jwp s SER 53 Cb 0.42 0.53 -0.05 0.00 -1.71 0.00 0.00 66.02 65.20 2jwp s SER 53 CO 0.14 -1.03 0.32 0.21 1.20 0.00 0.00 173.24 174.07 2jwp s ASN 54 N -2.99 6.66 0.19 5.45 2.47 -1.26 -4.77 114.94 120.68 2jwp s ASN 54 Ca 0.20 0.78 -0.16 0.00 0.42 0.00 0.00 52.86 54.10 2jwp s ASN 54 Cb 0.01 -2.19 0.18 0.00 -1.45 0.00 0.00 41.25 37.79 2jwp s ASN 54 CO 0.05 0.33 1.29 -2.65 -3.72 0.00 0.00 177.10 172.40 2jwp n PRO 55 N 2.01 -0.21 0.11 0.43 -0.01 -1.26 0.15 135.00 136.21 2jwp n PRO 55 Ca -0.16 1.28 -0.02 0.00 -0.01 0.00 0.00 63.50 64.59 2jwp n PRO 55 Cb 0.53 -1.90 0.03 0.00 -0.01 0.00 0.00 33.50 32.15 2jwp n PRO 55 CO 0.00 0.00 0.00 1.05 -0.01 0.00 0.00 175.50 176.54 2jwp h GLU 56 N 0.00 0.00 0.00 -0.52 9.09 -2.00 -2.56 114.58 118.59 2jwp h GLU 56 Ca 0.27 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.68 2jwp h GLU 56 Cb 0.48 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.58 2jwp h GLU 56 CO -0.82 0.74 -0.53 -0.40 0.05 0.00 0.00 179.01 178.05 2jwp n ASP 57 N -3.47 0.52 -0.07 3.06 5.75 0.11 -2.84 116.55 119.62 2jwp n ASP 57 Ca 0.00 -0.17 -0.12 0.00 -0.01 0.00 0.00 54.79 54.49 2jwp n ASP 57 Cb 0.77 0.24 -0.05 0.00 -1.03 0.00 0.00 41.12 41.05 2jwp n ASP 57 CO 0.00 0.00 0.00 -0.61 -0.11 0.00 0.00 177.20 176.48 2jwp h GLN 58 N 0.00 0.38 -0.84 0.11 4.15 0.16 0.10 115.11 119.17 2jwp h GLN 58 Ca 0.00 -0.14 -0.04 0.00 0.77 0.00 0.00 58.65 59.24 2jwp h GLN 58 Cb 0.55 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.18 2jwp h GLN 58 CO 0.00 0.62 0.38 -0.24 -1.93 0.00 0.00 178.83 177.65 2jwp h VAL 59 N 0.11 1.26 0.00 2.39 3.04 -1.49 0.22 116.25 121.79 2jwp h VAL 59 Ca 0.05 -0.77 -0.00 0.00 -1.01 0.00 0.00 66.70 64.97 2jwp h VAL 59 Cb 0.47 0.22 -0.00 0.00 -2.01 0.00 0.00 31.29 29.96 2jwp h VAL 59 CO 0.02 0.33 -0.01 0.25 -1.01 0.00 0.00 177.57 177.15 2jwp h LEU 60 N 1.20 0.00 -1.41 3.16 5.85 -1.34 -1.00 115.31 121.77 2jwp h LEU 60 Ca 0.28 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.00 2jwp h LEU 60 Cb 0.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.19 2jwp h LEU 60 CO -0.03 0.01 -0.19 -1.22 -0.34 0.00 0.00 178.44 176.66 2jwp n TYR 61 N -3.30 0.00 0.00 1.25 4.02 -0.00 -4.63 117.16 114.49 2jwp n TYR 61 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 2jwp n TYR 61 Cb 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.41 2jwp n TYR 61 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 2jwp n GLN 62 N 0.60 0.00 -2.09 -0.72 7.27 0.62 -4.63 117.38 118.42 2jwp n GLN 62 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.17 2jwp n GLN 62 Cb 0.47 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.12 2jwp n GLN 62 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 2jwp n THR 63 N 0.00 -0.54 -3.22 1.69 -1.04 -1.17 -4.21 114.28 105.79 2jwp n THR 63 Ca 0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.62 2jwp n THR 63 Cb 0.00 -1.67 -0.06 0.00 -1.82 0.00 0.00 70.33 66.78 2jwp n THR 63 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 2jwp s GLU 64 N 0.00 4.28 0.72 -2.82 -1.05 -1.26 -2.94 118.70 115.64 2jwp s GLU 64 Ca 0.00 0.75 0.00 0.00 -0.15 0.00 0.00 54.97 55.57 2jwp s GLU 64 Cb 0.00 -3.30 0.13 0.00 -0.44 0.00 0.00 34.13 30.52 2jwp s GLU 64 CO 0.00 0.47 0.99 0.50 0.95 0.00 0.00 175.26 178.18 2jwp s ARG 65 N -0.56 1.65 -0.42 -4.83 3.52 -0.96 -4.44 118.95 112.90 2jwp s ARG 65 Ca 0.30 -1.22 -0.12 0.00 -0.13 0.00 0.00 55.73 54.57 2jwp s ARG 65 Cb -0.19 -2.35 0.06 0.00 -1.56 0.00 0.00 34.95 30.91 2jwp s ARG 65 CO 0.18 -1.46 0.29 0.71 -0.81 0.00 0.00 175.30 174.20 2jwp s TYR 66 N -3.13 3.28 -0.27 5.12 2.02 -1.26 -4.95 117.35 118.17 2jwp s TYR 66 Ca 0.67 -1.18 -0.29 0.00 -0.37 0.00 0.00 57.07 55.90 2jwp s TYR 66 Cb -0.05 -2.87 0.18 0.00 -0.40 0.00 0.00 41.96 38.83 2jwp s TYR 66 CO 0.44 -0.77 1.32 -0.80 -1.57 0.00 0.00 175.55 174.17 2jwp s ASN 67 N 2.09 -0.09 -0.20 2.29 0.02 -1.26 -5.05 114.94 112.74 2jwp s ASN 67 Ca 0.03 0.11 0.18 0.00 -1.02 0.00 0.00 52.86 52.16 2jwp s ASN 67 Cb -0.22 0.09 0.46 0.00 0.02 0.00 0.00 41.25 41.60 2jwp s ASN 67 CO 0.05 -0.08 1.16 -1.84 0.02 0.00 0.00 177.10 176.42 2jwp n GLU 68 N 0.74 1.75 -0.93 -0.60 0.28 -1.26 -3.86 120.64 116.75 2jwp n GLU 68 Ca -0.03 -3.27 0.00 0.00 -0.16 0.00 0.00 57.16 53.70 2jwp n GLU 68 Cb 0.58 -1.39 0.00 0.00 1.43 0.00 0.00 31.44 32.07 2jwp n GLU 68 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2jwp n ASP 69 N -0.45 0.00 -4.56 -1.84 2.03 -1.26 -4.48 116.55 105.99 2jwp n ASP 69 Ca 0.18 -0.50 -0.20 0.00 0.52 0.00 0.00 54.79 54.79 2jwp n ASP 69 Cb 0.91 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 41.25 2jwp n ASP 69 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2jwp s SER 70 N 0.07 4.30 -0.78 1.67 0.15 -1.26 -4.23 113.70 113.62 2jwp s SER 70 Ca 0.00 0.01 -0.25 0.00 0.70 0.00 0.00 55.95 56.40 2jwp s SER 70 Cb 0.00 -2.55 -0.02 0.00 -1.71 0.00 0.00 66.02 61.74 2jwp s SER 70 CO 0.00 -3.44 1.83 -0.36 1.20 0.00 0.00 173.24 172.47 2jwp s PHE 71 N 13.17 1.83 -0.35 3.44 0.40 -0.96 -4.88 117.98 130.63 2jwp s PHE 71 Ca 0.87 0.54 -0.09 0.00 -0.60 0.00 0.00 56.93 57.64 2jwp s PHE 71 Cb -0.12 -4.15 0.02 0.00 0.51 0.00 0.00 43.02 39.28 2jwp s PHE 71 CO 0.08 -2.02 0.17 0.20 0.70 0.00 0.00 175.22 174.35 2jwp s GLY 72 N 7.54 1.89 0.09 4.36 0.00 -1.25 -2.34 107.32 117.61 2jwp s GLY 72 Ca 0.65 -1.63 0.02 0.00 0.00 0.00 0.00 44.72 43.75 2jwp s GLY 72 CO 0.08 0.78 0.17 -0.19 0.00 0.00 0.00 173.10 173.94 2jwp s TYR 73 N 1.53 3.36 -0.27 1.90 1.51 0.56 -4.60 117.35 121.34 2jwp s TYR 73 Ca 0.02 0.14 -0.01 0.00 -1.01 0.00 0.00 57.07 56.20 2jwp s TYR 73 Cb -0.19 -1.67 0.04 0.00 -0.11 0.00 0.00 41.96 40.03 2jwp s TYR 73 CO 0.05 0.55 -0.04 0.16 -1.11 0.00 0.00 175.55 175.16 2jwp s ASP 74 N -2.64 4.54 -0.68 2.29 -4.77 -1.26 -1.97 116.67 112.17 2jwp s ASP 74 Ca 0.32 -1.05 -0.11 0.00 -3.30 0.00 0.00 52.55 48.41 2jwp s ASP 74 Cb -0.12 -1.68 0.18 0.00 -1.09 0.00 0.00 42.92 40.21 2jwp s ASP 74 CO 0.25 -0.18 0.59 -0.63 0.70 0.00 0.00 175.17 175.90 2jwp s ILE 75 N 1.29 4.95 -0.06 2.11 1.09 0.97 -4.93 121.20 126.61 2jwp s ILE 75 Ca -0.02 -2.30 -0.30 0.00 -1.10 0.00 0.00 60.65 56.93 2jwp s ILE 75 Cb -0.18 -4.13 -0.06 0.00 -1.06 0.00 0.00 42.46 37.03 2jwp s ILE 75 CO -0.03 -0.93 1.72 -2.16 -0.10 0.00 0.00 174.94 173.44 2jwp s PRO 76 N 0.55 4.12 -0.09 2.79 0.04 -1.26 0.18 135.00 141.33 2jwp s PRO 76 Ca 0.13 2.22 0.03 0.00 0.04 0.00 0.00 61.00 63.42 2jwp s PRO 76 Cb -0.18 -4.03 -0.01 0.00 0.04 0.00 0.00 34.50 30.32 2jwp s PRO 76 CO -0.05 -0.93 -0.21 0.42 0.04 0.00 0.00 177.00 176.27 2jwp s ILE 77 N 4.32 2.40 0.00 0.56 1.01 -1.24 -4.93 121.20 123.32 2jwp s ILE 77 Ca 0.77 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 60.50 2jwp s ILE 77 Cb -0.34 -1.93 0.00 0.00 0.01 0.00 0.00 42.46 40.19 2jwp s ILE 77 CO 0.32 0.56 0.56 2.29 0.00 0.00 0.00 174.94 178.67 2jwp n LYS 78 N 3.27 0.76 -4.38 2.79 2.85 -1.26 -4.74 118.16 117.45 2jwp n LYS 78 Ca -0.18 -0.72 -0.21 0.00 -1.05 0.00 0.00 58.31 56.15 2jwp n LYS 78 Cb 0.53 -0.73 -0.09 0.00 -0.65 0.00 0.00 35.03 34.09 2jwp n LYS 78 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2jwp s GLU 79 N -0.31 1.74 0.24 -1.58 2.02 -1.26 -5.17 118.70 114.39 2jwp s GLU 79 Ca 0.00 -2.02 0.11 0.00 0.02 0.00 0.00 54.97 53.08 2jwp s GLU 79 Cb 0.00 -0.16 -0.05 0.00 0.10 0.00 0.00 34.13 34.02 2jwp s GLU 79 CO 0.00 -0.51 -0.19 -1.21 0.02 0.00 0.00 175.26 173.38 2jwp s GLU 80 N -3.70 1.54 0.00 1.61 2.02 -1.26 -4.97 118.70 113.94 2jwp s GLU 80 Ca 0.33 -1.67 0.00 0.00 0.02 0.00 0.00 54.97 53.65 2jwp s GLU 80 Cb 0.04 -1.57 0.00 0.00 0.10 0.00 0.00 34.13 32.69 2jwp s GLU 80 CO 0.19 0.29 0.00 0.41 0.02 0.00 0.00 175.26 176.17 2jwp n GLY 81 N -0.40 0.32 3.21 -1.39 0.00 -0.56 -4.94 105.19 101.44 2jwp n GLY 81 Ca -0.07 -1.43 -0.37 0.00 0.00 0.00 0.00 46.02 44.15 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 -2.00 2.43 -0.20 1.61 2.02 -1.10 -1.45 118.70 120.00 2jwp s GLU 82 Ca 0.00 -1.41 -0.15 0.00 0.02 0.00 0.00 54.97 53.42 2jwp s GLU 82 Cb 0.00 -3.50 -0.04 0.00 0.10 0.00 0.00 34.13 30.69 2jwp s GLU 82 CO 0.00 -0.82 0.38 0.71 0.02 0.00 0.00 175.26 175.55 2jwp s TYR 83 N 1.31 3.37 -0.39 1.61 1.51 -0.52 -0.02 117.35 124.23 2jwp s TYR 83 Ca 0.01 0.59 -0.07 0.00 -1.01 0.00 0.00 57.07 56.59 2jwp s TYR 83 Cb -0.21 -2.50 0.07 0.00 -0.11 0.00 0.00 41.96 39.20 2jwp s TYR 83 CO 0.00 0.00 0.19 0.08 -1.11 0.00 0.00 175.55 174.72 2jwp s VAL 84 N 1.27 3.93 -0.49 0.71 1.01 0.63 0.07 120.40 127.53 2jwp s VAL 84 Ca 0.18 -1.40 -0.17 0.00 0.00 0.00 0.00 61.98 60.60 2jwp s VAL 84 Cb -0.15 -3.38 0.07 0.00 0.00 0.00 0.00 36.38 32.93 2jwp s VAL 84 CO 0.08 -0.41 0.49 -0.22 0.00 0.00 0.00 175.10 175.03 2jwp s LEU 85 N 1.38 5.41 -0.33 3.92 0.20 0.39 -1.00 118.68 128.64 2jwp s LEU 85 Ca 0.02 -1.20 -0.01 0.00 0.69 0.00 0.00 54.13 53.62 2jwp s LEU 85 Cb -0.22 -2.28 0.07 0.00 -0.43 0.00 0.00 46.19 43.34 2jwp s LEU 85 CO 0.01 -0.75 0.06 0.54 -0.29 0.00 0.00 176.35 175.92 2jwp s VAL 86 N 2.01 2.97 -0.15 1.68 0.11 0.45 -0.18 120.40 127.29 2jwp s VAL 86 Ca 0.08 -1.70 -0.07 0.00 -2.93 0.00 0.00 61.98 57.36 2jwp s VAL 86 Cb -0.23 -2.86 -0.04 0.00 -1.53 0.00 0.00 36.38 31.72 2jwp s VAL 86 CO 0.08 -0.33 0.11 -1.48 -3.33 0.00 0.00 175.10 170.15 2jwp s LEU 87 N 1.18 4.13 -0.35 2.54 0.05 -0.95 -2.15 118.68 123.13 2jwp s LEU 87 Ca 0.00 0.28 -0.14 0.00 0.05 0.00 0.00 54.13 54.33 2jwp s LEU 87 Cb -0.21 -2.03 -0.01 0.00 -2.05 0.00 0.00 46.19 41.89 2jwp s LEU 87 CO -0.03 0.29 0.30 -0.75 -0.55 0.00 0.00 176.35 175.61 2jwp s LYS 88 N -0.31 3.49 0.03 1.48 2.47 -1.12 -2.15 119.74 123.63 2jwp s LYS 88 Ca 0.10 -0.57 0.02 0.00 -1.56 0.00 0.00 55.97 53.96 2jwp s LYS 88 Cb -0.12 -3.82 -0.04 0.00 -1.46 0.00 0.00 37.83 32.40 2jwp s LYS 88 CO 0.01 -0.51 0.04 -0.06 0.16 0.00 0.00 175.35 175.00 2jwp s PHE 89 N 1.86 3.14 -0.03 4.03 0.08 0.16 -0.11 117.98 127.11 2jwp s PHE 89 Ca 0.09 0.10 0.01 0.00 0.12 0.00 0.00 56.93 57.24 2jwp s PHE 89 Cb -0.17 -1.66 0.03 0.00 -0.57 0.00 0.00 43.02 40.65 2jwp s PHE 89 CO 0.11 0.50 -0.01 0.00 -0.10 0.00 0.00 175.22 175.72 2jwp s ALA 90 N -1.21 0.38 -0.18 5.36 0.00 -1.10 -0.25 121.76 124.76 2jwp s ALA 90 Ca 0.23 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.33 2jwp s ALA 90 Cb -0.12 -0.33 0.03 0.00 0.00 0.00 0.00 23.12 22.70 2jwp s ALA 90 CO 0.15 -0.05 -0.16 -2.00 0.00 0.00 0.00 175.76 173.69 2jwp s GLU 91 N 0.98 2.61 -0.05 0.00 -6.30 -1.26 -2.09 118.70 112.59 2jwp s GLU 91 Ca -0.10 -0.83 0.23 0.00 -2.50 0.00 0.00 54.97 51.77 2jwp s GLU 91 Cb -0.14 -2.48 0.43 0.00 0.00 0.00 0.00 34.13 31.95 2jwp s GLU 91 CO -0.01 -0.29 1.18 1.33 0.02 0.00 0.00 175.26 177.49 2jwp n VAL 92 N 4.64 0.45 -0.04 3.70 0.24 -1.26 -4.27 118.33 121.80 2jwp n VAL 92 Ca -0.18 -1.49 -0.08 0.00 -2.04 0.00 0.00 64.34 60.54 2jwp n VAL 92 Cb 0.49 0.78 -0.03 0.00 -1.47 0.00 0.00 33.84 33.60 2jwp n VAL 92 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jwp n TYR 93 N 0.17 0.00 -3.65 6.34 9.36 -1.26 -4.99 117.16 123.12 2jwp n TYR 93 Ca 0.09 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 61.04 2jwp n TYR 93 Cb 1.06 -0.32 -0.17 0.00 -0.63 0.00 0.00 39.34 39.28 2jwp n TYR 93 CO 0.00 0.00 0.00 0.12 0.22 0.00 0.00 176.86 177.20 2jwp s PHE 94 N -2.16 0.55 -0.87 2.98 5.36 -1.26 -5.08 117.98 117.48 2jwp s PHE 94 Ca -0.12 -0.59 -0.16 0.00 -0.96 0.00 0.00 56.93 55.10 2jwp s PHE 94 Cb 0.04 -0.86 0.17 0.00 -0.34 0.00 0.00 43.02 42.04 2jwp s PHE 94 CO 0.17 -0.58 0.94 0.00 -1.46 0.00 0.00 175.22 174.29 2jwp s ALA 95 N 2.02 3.72 -0.18 11.12 0.00 -1.26 -4.87 121.76 132.30 2jwp s ALA 95 Ca 0.02 -3.03 -0.27 0.00 0.00 0.00 0.00 51.96 48.67 2jwp s ALA 95 Cb -0.16 -3.78 0.07 0.00 0.00 0.00 0.00 23.12 19.25 2jwp s ALA 95 CO -0.11 -2.63 0.71 -1.14 0.00 0.00 0.00 175.76 172.59 2jwp s GLN 96 N 1.46 0.92 0.03 0.00 2.00 -1.26 -5.13 119.66 117.67 2jwp s GLN 96 Ca 0.25 0.70 -0.03 0.00 -2.00 0.00 0.00 55.36 54.28 2jwp s GLN 96 Cb -0.08 0.44 -0.04 0.00 0.80 0.00 0.00 33.01 34.13 2jwp s GLN 96 CO -0.09 -0.19 0.23 -1.12 -0.50 0.00 0.00 175.29 173.62 2jwp s SER 97 N -0.25 6.40 -1.37 6.67 0.01 -1.26 -4.13 113.70 119.78 2jwp s SER 97 Ca -0.04 0.39 -0.06 0.00 1.31 0.00 0.00 55.95 57.55 2jwp s SER 97 Cb -0.03 -2.02 0.01 0.00 0.21 0.00 0.00 66.02 64.19 2jwp s SER 97 CO 0.04 0.21 0.78 0.00 0.41 0.00 0.00 173.24 174.69 2jwp n GLN 98 N 0.71 -5.70 0.00 12.44 3.00 -1.26 -4.82 117.38 121.75 2jwp n GLN 98 Ca -0.08 0.81 0.00 0.00 -0.01 0.00 0.00 57.00 57.72 2jwp n GLN 98 Cb 0.52 -5.59 0.00 0.00 0.00 0.00 0.00 30.24 25.17 2jwp n GLN 98 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.06 178.00 2jwp n GLN 99 N -4.14 0.00 -3.26 -1.09 -0.06 -1.26 -4.95 117.38 102.62 2jwp n GLN 99 Ca -0.06 0.00 -0.42 0.00 -2.00 0.00 0.00 57.00 54.52 2jwp n GLN 99 Cb 0.59 -0.14 -0.01 0.00 -4.06 0.00 0.00 30.24 26.62 2jwp n GLN 99 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 2jwp n LYS 100 N -2.20 3.74 -3.94 3.69 4.81 -1.26 -4.85 118.16 118.15 2jwp n LYS 100 Ca 0.00 -4.51 -0.35 0.00 -0.87 0.00 0.00 58.31 52.58 2jwp n LYS 100 Cb 0.00 -2.50 -0.12 0.00 0.02 0.00 0.00 35.03 32.43 2jwp n LYS 100 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 2jwp s VAL 101 N -1.93 4.24 0.39 3.15 -7.23 -1.26 -3.35 120.40 114.41 2jwp s VAL 101 Ca 0.31 -0.21 0.08 0.00 -1.81 0.00 0.00 61.98 60.35 2jwp s VAL 101 Cb -0.03 -2.94 -0.05 0.00 0.56 0.00 0.00 36.38 33.91 2jwp s VAL 101 CO -0.01 0.40 0.13 -0.36 -0.31 0.00 0.00 175.10 174.95 2jwp s PHE 102 N 1.13 2.60 -0.10 2.82 0.08 -0.93 -4.48 117.98 119.10 2jwp s PHE 102 Ca 0.04 -0.55 -0.02 0.00 0.12 0.00 0.00 56.93 56.51 2jwp s PHE 102 Cb -0.14 -1.83 -0.03 0.00 -0.57 0.00 0.00 43.02 40.44 2jwp s PHE 102 CO 0.02 0.27 -0.00 -0.51 -0.10 0.00 0.00 175.22 174.91 2jwp s ASP 103 N -3.85 5.17 -0.15 1.36 1.01 -1.12 0.13 116.67 119.22 2jwp s ASP 103 Ca 0.39 0.09 -0.03 0.00 0.71 0.00 0.00 52.55 53.72 2jwp s ASP 103 Cb 0.03 -1.53 0.05 0.00 1.01 0.00 0.00 42.92 42.49 2jwp s ASP 103 CO 0.22 0.34 0.04 -0.69 0.21 0.00 0.00 175.17 175.28 2jwp s VAL 104 N -0.63 0.32 -0.04 -1.27 1.01 0.91 -0.33 120.40 120.35 2jwp s VAL 104 Ca 0.10 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.87 2jwp s VAL 104 Cb -0.12 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 2jwp s VAL 104 CO 0.02 -0.07 -0.08 -0.13 0.00 0.00 0.00 175.10 174.84 2jwp s ARG 105 N 1.97 2.66 -0.51 2.72 0.52 0.28 -0.65 118.95 125.94 2jwp s ARG 105 Ca 0.02 -0.62 -0.05 0.00 -0.52 0.00 0.00 55.73 54.56 2jwp s ARG 105 Cb -0.15 -2.54 0.13 0.00 0.52 0.00 0.00 34.95 32.91 2jwp s ARG 105 CO -0.07 0.64 0.34 0.14 0.02 0.00 0.00 175.30 176.37 2jwp s VAL 106 N -0.87 3.77 -1.12 3.52 -7.23 0.12 -2.22 120.40 116.37 2jwp s VAL 106 Ca 0.14 -2.28 -0.11 0.00 -1.81 0.00 0.00 61.98 57.92 2jwp s VAL 106 Cb -0.11 -3.50 -0.03 0.00 0.56 0.00 0.00 36.38 33.30 2jwp s VAL 106 CO 0.03 -0.79 0.84 -3.20 -0.31 0.00 0.00 175.10 171.68 2jwp n ASN 107 N 4.32 -5.32 0.00 4.85 4.05 0.17 -2.26 115.26 121.07 2jwp n ASN 107 Ca 0.00 -0.85 0.00 0.00 0.45 0.00 0.00 54.58 54.18 2jwp n ASN 107 Cb 0.40 -4.31 0.00 0.00 1.23 0.00 0.00 39.78 37.10 2jwp n ASN 107 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2jwp n GLY 108 N -1.46 2.89 3.51 8.20 0.00 -1.17 -4.76 105.19 112.41 2jwp n GLY 108 Ca -0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.35 2.61 -0.81 1.61 3.76 -0.96 -4.89 115.29 115.26 2jwp s HIS 109 Ca 0.00 -0.67 -0.25 0.00 -0.15 0.00 0.00 55.06 53.99 2jwp s HIS 109 Cb 0.00 -4.51 -0.05 0.00 1.11 0.00 0.00 32.58 29.13 2jwp s HIS 109 CO 0.00 -1.82 1.98 0.99 -0.85 0.00 0.00 174.74 175.03 2jwp s THR 110 N 4.53 3.38 0.12 1.30 2.01 -1.25 0.13 115.64 125.85 2jwp s THR 110 Ca 0.35 -0.19 -0.08 0.00 0.31 0.00 0.00 61.69 62.08 2jwp s THR 110 Cb -0.07 -3.88 -0.17 0.00 0.01 0.00 0.00 72.50 68.40 2jwp s THR 110 CO 0.02 -0.83 1.32 -0.37 -0.69 0.00 0.00 174.62 174.06 2jwp h VAL 111 N 7.22 1.34 -3.32 3.82 -1.51 -1.24 -3.39 116.25 119.16 2jwp h VAL 111 Ca -0.01 -2.20 -0.64 0.00 -1.23 0.00 0.00 66.70 62.63 2jwp h VAL 111 Cb 1.05 2.21 -0.41 0.00 -2.13 0.00 0.00 31.29 32.01 2jwp h VAL 111 CO 1.19 0.67 -0.64 -0.69 -1.23 0.00 0.00 177.57 176.88 2jwp s VAL 112 N -3.50 2.50 -0.95 7.19 1.01 -1.05 -4.98 120.40 120.63 2jwp s VAL 112 Ca -0.08 -3.33 -0.02 0.00 0.00 0.00 0.00 61.98 58.55 2jwp s VAL 112 Cb 0.09 -2.73 0.27 0.00 0.00 0.00 0.00 36.38 34.00 2jwp s VAL 112 CO 0.88 -0.82 1.10 1.17 0.00 0.00 0.00 175.10 177.43 2jwp n LYS 113 N 3.06 3.48 0.00 2.72 0.00 -1.26 -0.06 118.16 126.09 2jwp n LYS 113 Ca 0.06 -4.55 0.00 0.00 0.00 0.00 0.00 58.31 53.82 2jwp n LYS 113 Cb 0.32 -2.44 0.00 0.00 0.00 0.00 0.00 35.03 32.92 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 1.64 0.00 -4.58 3.14 5.75 0.85 -4.92 116.55 118.43 2jwp n ASP 114 Ca 0.26 0.00 -0.30 0.00 -0.01 0.00 0.00 54.79 54.74 2jwp n ASP 114 Cb 0.36 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.40 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 3.15 -0.65 -2.12 0.20 0.12 -4.46 118.68 114.92 2jwp s LEU 115 Ca 0.00 -1.75 -0.21 0.00 0.69 0.00 0.00 54.13 52.86 2jwp s LEU 115 Cb 0.00 -2.59 0.09 0.00 -0.43 0.00 0.00 46.19 43.26 2jwp s LEU 115 CO 0.00 -2.83 0.88 -0.62 -0.29 0.00 0.00 176.35 173.49 2jwp s ASP 116 N 6.23 6.20 0.30 3.68 -1.08 -1.21 -2.18 116.67 128.60 2jwp s ASP 116 Ca 0.66 -1.21 0.00 0.00 -0.52 0.00 0.00 52.55 51.49 2jwp s ASP 116 Cb -0.00 -2.38 0.46 0.00 -1.46 0.00 0.00 42.92 39.54 2jwp s ASP 116 CO 0.12 -1.31 1.85 0.40 0.52 0.00 0.00 175.17 176.75 2jwp h ILE 117 N 5.94 1.22 -0.28 4.11 2.04 -1.89 -2.03 117.51 126.62 2jwp h ILE 117 Ca -0.26 -0.78 -0.09 0.00 1.00 0.00 0.00 64.86 64.72 2jwp h ILE 117 Cb 1.07 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 2jwp h ILE 117 CO 1.15 0.29 -0.23 0.15 0.00 0.00 0.00 178.15 179.51 2jwp h PHE 118 N 0.73 0.58 -0.42 1.37 3.57 -1.84 -2.05 116.94 118.88 2jwp h PHE 118 Ca 0.16 -0.12 -0.11 0.00 3.53 0.00 0.00 57.97 61.43 2jwp h PHE 118 Cb 0.29 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 2jwp h PHE 118 CO 0.02 0.71 -0.19 0.22 -2.23 0.00 0.00 178.31 176.84 2jwp h ASP 119 N 0.46 0.83 0.03 0.41 3.58 -1.67 -0.65 116.42 119.41 2jwp h ASP 119 Ca 0.07 -0.29 -0.09 0.00 0.42 0.00 0.00 57.03 57.14 2jwp h ASP 119 Cb 0.65 -0.23 0.01 0.00 1.72 0.00 0.00 39.33 41.48 2jwp h ASP 119 CO 0.05 1.00 -0.38 0.03 -2.88 0.00 0.00 179.24 177.06 2jwp h ARG 120 N 0.72 0.21 0.00 0.28 2.47 -0.85 -3.38 114.38 113.83 2jwp h ARG 120 Ca 0.10 -0.26 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 2jwp h ARG 120 Cb 0.71 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.11 2jwp h ARG 120 CO 0.05 1.02 -1.02 1.33 0.56 0.00 0.00 179.97 181.91 2jwp n VAL 121 N -4.40 0.00 0.00 2.04 0.24 -0.82 -5.12 118.33 110.28 2jwp n VAL 121 Ca -0.11 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 61.98 2jwp n VAL 121 Cb 0.59 0.54 0.00 0.00 -1.47 0.00 0.00 33.84 33.50 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 1.82 0.34 3.64 7.63 0.00 -0.25 -4.92 105.19 113.44 2jwp n GLY 122 Ca -0.01 -1.79 -0.43 0.00 0.00 0.00 0.00 46.02 43.79 2jwp n GLY 122 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2jwp s HIS 123 N 0.00 3.13 0.00 1.61 -3.43 -1.26 -4.29 115.29 111.06 2jwp s HIS 123 Ca 0.00 1.16 0.00 0.00 -0.80 0.00 0.00 55.06 55.42 2jwp s HIS 123 Cb 0.00 -3.71 0.00 0.00 -1.43 0.00 0.00 32.58 27.44 2jwp s HIS 123 CO 0.00 -0.79 0.00 0.45 -2.00 0.00 0.00 174.74 172.40 2jwp n SER 124 N 6.90 0.00 -1.25 7.38 2.88 -1.26 -5.01 113.62 123.26 2jwp n SER 124 Ca 0.12 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.83 2jwp n SER 124 Cb 0.47 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.89 2jwp n SER 124 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2jwp n THR 125 N 0.00 0.00 -3.42 2.46 -2.24 -1.26 -4.80 114.28 105.02 2jwp n THR 125 Ca 0.00 0.05 -0.37 0.00 -2.27 0.00 0.00 64.05 61.45 2jwp n THR 125 Cb 0.00 -0.47 -0.07 0.00 -2.10 0.00 0.00 70.33 67.69 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 -2.17 3.54 0.01 6.98 0.00 -1.26 -4.63 121.76 124.24 2jwp s ALA 126 Ca 0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 51.96 51.55 2jwp s ALA 126 Cb 0.00 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.52 2jwp s ALA 126 CO 0.00 -0.08 0.15 -1.58 0.00 0.00 0.00 175.76 174.25 2jwp s HIS 127 N 0.83 3.44 -0.06 0.00 5.04 0.65 -4.91 115.29 120.29 2jwp s HIS 127 Ca 0.20 0.28 -0.04 0.00 -1.54 0.00 0.00 55.06 53.96 2jwp s HIS 127 Cb -0.14 -1.78 0.02 0.00 0.04 0.00 0.00 32.58 30.72 2jwp s HIS 127 CO 0.07 0.60 0.15 0.16 -2.34 0.00 0.00 174.74 173.38 2jwp s ASP 128 N -2.00 -0.14 -0.29 9.88 1.47 -1.26 0.36 116.67 124.70 2jwp s ASP 128 Ca 0.27 0.29 -0.06 0.00 1.18 0.00 0.00 52.55 54.24 2jwp s ASP 128 Cb -0.12 0.27 0.01 0.00 -0.34 0.00 0.00 42.92 42.74 2jwp s ASP 128 CO 0.19 -0.07 0.05 -1.61 0.68 0.00 0.00 175.17 174.40 2jwp s GLU 129 N 0.34 3.00 -0.45 2.11 0.41 -0.91 -4.94 118.70 118.26 2jwp s GLU 129 Ca -0.02 -0.90 -0.16 0.00 -0.41 0.00 0.00 54.97 53.47 2jwp s GLU 129 Cb -0.03 -3.29 0.04 0.00 -1.78 0.00 0.00 34.13 29.07 2jwp s GLU 129 CO -0.01 -0.44 0.42 0.42 -0.49 0.00 0.00 175.26 175.16 2jwp s ILE 130 N 1.45 5.14 -0.37 -1.63 1.01 -1.26 -2.23 121.20 123.31 2jwp s ILE 130 Ca 0.02 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 59.99 2jwp s ILE 130 Cb -0.17 -4.09 0.10 0.00 0.01 0.00 0.00 42.46 38.31 2jwp s ILE 130 CO 0.01 -0.52 0.11 -0.63 0.00 0.00 0.00 174.94 173.91 2jwp s ILE 131 N 1.95 2.79 -0.20 2.92 -1.09 0.75 -4.94 121.20 123.37 2jwp s ILE 131 Ca 0.08 -2.12 -0.28 0.00 -2.23 0.00 0.00 60.65 56.10 2jwp s ILE 131 Cb -0.20 -2.94 -0.00 0.00 -1.58 0.00 0.00 42.46 37.74 2jwp s ILE 131 CO 0.10 -0.59 0.96 -2.84 -1.23 0.00 0.00 174.94 171.35 2jwp s PRO 132 N 1.04 4.28 0.24 2.79 0.02 -1.26 -0.46 135.00 141.65 2jwp s PRO 132 Ca 0.08 1.24 0.08 0.00 0.02 0.00 0.00 61.00 62.42 2jwp s PRO 132 Cb -0.21 -3.61 -0.04 0.00 0.02 0.00 0.00 34.50 30.66 2jwp s PRO 132 CO -0.06 -0.50 0.05 0.96 -0.33 0.00 0.00 177.00 177.12 2jwp s ILE 133 N 2.75 3.78 -0.26 2.83 -4.36 0.11 -4.39 121.20 121.66 2jwp s ILE 133 Ca 0.42 -1.66 0.01 0.00 -0.26 0.00 0.00 60.65 59.17 2jwp s ILE 133 Cb -0.16 -3.00 0.07 0.00 1.25 0.00 0.00 42.46 40.62 2jwp s ILE 133 CO 0.09 -0.30 -0.02 -0.94 0.24 0.00 0.00 174.94 174.01 2jwp s SER 134 N -3.53 4.11 -0.23 4.36 1.04 0.81 -1.44 113.70 118.81 2jwp s SER 134 Ca 0.31 -1.43 -0.08 0.00 0.48 0.00 0.00 55.95 55.23 2jwp s SER 134 Cb -0.08 -1.27 -0.04 0.00 0.10 0.00 0.00 66.02 64.74 2jwp s SER 134 CO 0.21 -0.28 0.09 -0.63 0.98 0.00 0.00 173.24 173.62 2jwp s ILE 135 N 1.30 4.73 -0.16 -1.02 1.01 -0.53 -0.61 121.20 125.91 2jwp s ILE 135 Ca -0.01 -0.04 -0.14 0.00 0.00 0.00 0.00 60.65 60.46 2jwp s ILE 135 Cb -0.19 -3.19 0.04 0.00 0.01 0.00 0.00 42.46 39.14 2jwp s ILE 135 CO -0.09 0.37 0.41 -0.54 0.00 0.00 0.00 174.94 175.10 2jwp s LYS 136 N 1.13 0.47 -1.52 2.79 -0.14 0.23 -1.49 119.74 121.21 2jwp s LYS 136 Ca 0.05 0.61 -0.01 0.00 -1.36 0.00 0.00 55.97 55.25 2jwp s LYS 136 Cb -0.14 0.20 0.00 0.00 -1.68 0.00 0.00 37.83 36.21 2jwp s LYS 136 CO 0.04 -0.07 0.17 1.63 -0.76 0.00 0.00 175.35 176.35 2jwp n LYS 137 N 3.07 -2.38 -1.48 1.68 4.76 -1.26 -1.26 118.16 121.29 2jwp n LYS 137 Ca -0.15 0.87 -0.10 0.00 -2.87 0.00 0.00 58.31 56.06 2jwp n LYS 137 Cb 0.57 -5.43 -0.04 0.00 -1.84 0.00 0.00 35.03 28.29 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 -1.15 0.93 3.32 0.72 0.00 -1.26 -4.97 105.19 102.78 2jwp n GLY 138 Ca -0.18 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 44.99 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 -3.21 2.42 -0.25 1.61 1.02 -0.39 -0.26 119.74 120.68 2jwp s LYS 139 Ca 0.00 -0.87 -0.03 0.00 0.02 0.00 0.00 55.97 55.10 2jwp s LYS 139 Cb 0.00 -2.18 0.02 0.00 -0.52 0.00 0.00 37.83 35.15 2jwp s LYS 139 CO 0.00 0.48 -0.05 -1.17 -0.92 0.00 0.00 175.35 173.69 2jwp s LEU 140 N -0.40 3.16 -0.12 3.17 0.20 0.63 -0.60 118.68 124.72 2jwp s LEU 140 Ca 0.04 -0.75 -0.01 0.00 0.69 0.00 0.00 54.13 54.10 2jwp s LEU 140 Cb -0.12 -1.70 -0.02 0.00 -0.43 0.00 0.00 46.19 43.92 2jwp s LEU 140 CO 0.01 -0.11 -0.08 -0.55 -0.29 0.00 0.00 176.35 175.34 2jwp s SER 141 N 1.38 4.47 -0.29 3.68 0.15 0.22 -1.37 113.70 121.93 2jwp s SER 141 Ca 0.02 -0.17 0.01 0.00 0.70 0.00 0.00 55.95 56.51 2jwp s SER 141 Cb -0.16 -1.53 0.08 0.00 -1.71 0.00 0.00 66.02 62.71 2jwp s SER 141 CO -0.04 0.22 0.02 -0.69 1.20 0.00 0.00 173.24 173.96 2jwp s VAL 142 N 0.01 1.58 0.00 4.45 1.01 0.89 -0.14 120.40 128.21 2jwp s VAL 142 Ca -0.01 -1.63 0.00 0.00 0.00 0.00 0.00 61.98 60.33 2jwp s VAL 142 Cb -0.14 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.20 2jwp s VAL 142 CO 0.03 -0.42 0.00 0.00 0.00 0.00 0.00 175.10 174.71 2jwp n GLN 143 N 4.59 0.00 -0.22 2.72 3.00 -1.26 -1.10 117.38 125.11 2jwp n GLN 143 Ca -0.04 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.01 2jwp n GLN 143 Cb 0.43 0.00 0.16 0.00 0.00 0.00 0.00 30.24 30.83 2jwp n GLN 143 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jwp n GLY 144 N 0.00 3.49 2.89 1.08 0.00 -1.26 -4.91 105.19 106.49 2jwp n GLY 144 Ca 0.00 -0.62 -0.28 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.83 1.45 -0.18 1.61 2.02 -0.26 -5.12 118.70 116.40 2jwp s GLU 145 Ca 0.26 -0.45 -0.06 0.00 0.02 0.00 0.00 54.97 54.74 2jwp s GLU 145 Cb 0.19 -1.90 -0.04 0.00 0.10 0.00 0.00 34.13 32.48 2jwp s GLU 145 CO 0.09 -0.39 0.03 0.54 0.02 0.00 0.00 175.26 175.55 2jwp s VAL 146 N 1.66 4.54 0.27 2.63 0.11 -1.26 -0.08 120.40 128.26 2jwp s VAL 146 Ca 0.02 -0.13 0.03 0.00 -2.93 0.00 0.00 61.98 58.97 2jwp s VAL 146 Cb -0.15 -3.03 -0.01 0.00 -1.53 0.00 0.00 36.38 31.66 2jwp s VAL 146 CO -0.08 0.47 0.30 -1.20 -3.33 0.00 0.00 175.10 171.26 2jwp n SER 147 N 3.54 -0.80 -4.85 3.54 7.64 -0.47 -4.98 113.62 117.23 2jwp n SER 147 Ca -0.17 -2.62 -0.37 0.00 1.01 0.00 0.00 58.87 56.72 2jwp n SER 147 Cb 0.52 1.64 -0.06 0.00 -1.01 0.00 0.00 64.21 65.31 2jwp n SER 147 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2jwp s THR 148 N -2.91 5.37 0.13 0.44 -4.23 -1.26 -0.27 115.64 112.91 2jwp s THR 148 Ca 0.27 0.39 -0.30 0.00 -1.18 0.00 0.00 61.69 60.87 2jwp s THR 148 Cb 0.00 -3.50 -0.06 0.00 1.34 0.00 0.00 72.50 70.28 2jwp s THR 148 CO 0.20 0.59 0.97 0.12 -0.54 0.00 0.00 174.62 175.96 2jwp s PHE 149 N -0.89 3.82 -0.29 3.99 5.36 0.64 -4.58 117.98 126.03 2jwp s PHE 149 Ca 0.17 1.80 -0.01 0.00 -0.96 0.00 0.00 56.93 57.93 2jwp s PHE 149 Cb -0.13 -3.07 0.09 0.00 -0.34 0.00 0.00 43.02 39.57 2jwp s PHE 149 CO 0.06 0.16 0.08 -0.08 -1.46 0.00 0.00 175.22 173.98 2jwp s THR 150 N -0.18 0.84 0.00 0.12 -1.32 -1.26 -4.81 115.64 109.03 2jwp s THR 150 Ca 0.46 -1.23 0.00 0.00 -1.21 0.00 0.00 61.69 59.71 2jwp s THR 150 Cb -0.24 -1.55 0.00 0.00 -1.51 0.00 0.00 72.50 69.19 2jwp s THR 150 CO 0.31 -0.56 0.00 0.61 -2.21 0.00 0.00 174.62 172.76 2jwp n GLY 151 N 4.88 1.91 3.69 6.08 0.00 -1.26 -4.76 105.19 115.73 2jwp n GLY 151 Ca -0.04 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 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 1.60 -0.06 1.61 0.00 -1.26 -3.66 119.74 117.96 2jwp s LYS 152 Ca 0.00 -0.88 -0.29 0.00 0.00 0.00 0.00 55.97 54.80 2jwp s LYS 152 Cb 0.00 0.58 -0.02 0.00 0.00 0.00 0.00 37.83 38.39 2jwp s LYS 152 CO 0.00 -0.71 0.96 -1.17 0.00 0.00 0.00 175.35 174.42 2jwp s LEU 153 N -2.88 4.30 -0.39 2.77 0.20 0.13 -4.81 118.68 117.99 2jwp s LEU 153 Ca 0.09 1.53 -0.04 0.00 0.69 0.00 0.00 54.13 56.40 2jwp s LEU 153 Cb -0.04 -3.50 0.09 0.00 -0.43 0.00 0.00 46.19 42.32 2jwp s LEU 153 CO 0.01 -0.34 0.17 -0.94 -0.29 0.00 0.00 176.35 174.96 2jwp s SER 154 N 1.04 5.24 -0.45 3.68 1.04 -1.26 -0.02 113.70 122.97 2jwp s SER 154 Ca 0.48 -1.79 -0.21 0.00 0.48 0.00 0.00 55.95 54.92 2jwp s SER 154 Cb -0.19 -1.83 0.03 0.00 0.10 0.00 0.00 66.02 64.13 2jwp s SER 154 CO 0.22 -0.48 0.66 -0.69 0.98 0.00 0.00 173.24 173.92 2jwp s VAL 155 N 1.21 4.81 -0.24 5.02 1.01 -0.83 0.43 120.40 131.80 2jwp s VAL 155 Ca 0.05 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.12 2jwp s VAL 155 Cb -0.22 -4.24 0.05 0.00 0.00 0.00 0.00 36.38 31.98 2jwp s VAL 155 CO -0.03 -0.65 -0.13 -1.61 0.00 0.00 0.00 175.10 172.69 2jwp s GLU 156 N 2.87 2.36 -0.35 2.72 2.02 -0.94 -0.32 118.70 127.05 2jwp s GLU 156 Ca 0.22 -1.22 -0.13 0.00 0.02 0.00 0.00 54.97 53.85 2jwp s GLU 156 Cb -0.14 -2.81 -0.01 0.00 0.10 0.00 0.00 34.13 31.27 2jwp s GLU 156 CO 0.18 -0.50 0.26 -0.59 0.02 0.00 0.00 175.26 174.64 2jwp s PHE 157 N 1.15 3.23 0.26 1.61 -0.71 -0.99 -0.55 117.98 121.98 2jwp s PHE 157 Ca -0.06 -0.25 -0.22 0.00 -1.04 0.00 0.00 56.93 55.36 2jwp s PHE 157 Cb -0.19 -2.52 -0.09 0.00 -1.21 0.00 0.00 43.02 39.02 2jwp s PHE 157 CO -0.07 -0.41 0.80 0.08 -1.34 0.00 0.00 175.22 174.29 2jwp s VAL 158 N 1.75 4.45 0.23 -2.49 1.01 0.55 -2.27 120.40 123.63 2jwp s VAL 158 Ca 0.06 1.45 -0.31 0.00 0.00 0.00 0.00 61.98 63.19 2jwp s VAL 158 Cb -0.18 -3.90 -0.11 0.00 0.00 0.00 0.00 36.38 32.20 2jwp s VAL 158 CO 0.11 0.17 1.56 -1.59 0.00 0.00 0.00 175.10 175.34 2jwp s LYS 159 N -2.04 4.20 0.00 2.72 -2.85 -1.26 -2.78 119.74 117.72 2jwp s LYS 159 Ca 0.46 2.43 0.00 0.00 -1.00 0.00 0.00 55.97 57.86 2jwp s LYS 159 Cb -0.17 -3.10 0.00 0.00 -2.06 0.00 0.00 37.83 32.50 2jwp s LYS 159 CO 0.22 -0.58 0.00 0.41 0.10 0.00 0.00 175.35 175.50 2jwp n GLY 160 N 2.91 0.61 2.80 0.59 0.00 -1.26 -4.86 105.19 105.97 2jwp n GLY 160 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 2jwp n GLY 160 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2jwp n TYR 161 N 0.00 3.54 -0.87 1.61 4.01 -1.26 -5.04 117.16 119.15 2jwp n TYR 161 Ca 0.00 -3.36 0.06 0.00 -0.16 0.00 0.00 57.90 54.43 2jwp n TYR 161 Cb 0.00 -0.70 -0.03 0.00 -0.31 0.00 0.00 39.34 38.30 2jwp n TYR 161 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2jwp n TYR 162 N -0.24 -2.35 -3.53 -0.72 4.02 -1.26 -4.92 117.16 108.17 2jwp n TYR 162 Ca 0.38 1.29 -0.17 0.00 -0.01 0.00 0.00 57.90 59.38 2jwp n TYR 162 Cb 0.37 -2.15 0.01 0.00 -0.02 0.00 0.00 39.34 37.54 2jwp n TYR 162 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2jwp n ASP 163 N -2.80 -5.95 -4.71 7.72 -0.08 -1.26 -4.85 116.55 104.62 2jwp n ASP 163 Ca -0.03 -0.67 -0.43 0.00 -1.51 0.00 0.00 54.79 52.15 2jwp n ASP 163 Cb 0.34 -3.20 -0.02 0.00 2.34 0.00 0.00 41.12 40.58 2jwp n ASP 163 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2jwp n ASN 164 N -2.32 3.38 0.00 1.67 4.13 -1.25 -3.66 115.26 117.21 2jwp n ASN 164 Ca -0.17 1.15 0.00 0.00 1.68 0.00 0.00 54.58 57.24 2jwp n ASN 164 Cb 0.61 -1.52 0.00 0.00 -1.54 0.00 0.00 39.78 37.32 2jwp n ASN 164 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 2jwp n PRO 165 N 2.06 0.00 0.00 3.52 -0.02 -1.26 -4.68 135.00 134.62 2jwp n PRO 165 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 2jwp n PRO 165 Cb 0.35 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.83 2jwp n PRO 165 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2jwp n LYS 166 N 0.00 0.00 -3.42 -0.52 0.00 -1.24 -4.02 118.16 108.95 2jwp n LYS 166 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 58.31 57.93 2jwp n LYS 166 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 34.97 2jwp n LYS 166 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2jwp s VAL 167 N 0.00 5.15 -0.54 3.15 1.01 -0.89 -3.89 120.40 124.41 2jwp s VAL 167 Ca 0.00 0.84 0.06 0.00 0.00 0.00 0.00 61.98 62.87 2jwp s VAL 167 Cb 0.00 -3.74 0.21 0.00 0.00 0.00 0.00 36.38 32.85 2jwp s VAL 167 CO 0.00 0.43 0.54 0.00 0.00 0.00 0.00 175.10 176.07 2jwp n ALA 169 N 1.68 3.43 -1.64 0.00 0.00 0.85 0.31 120.51 125.14 2jwp n ALA 169 Ca 0.25 -0.02 -0.50 0.00 0.00 0.00 0.00 53.44 53.18 2jwp n ALA 169 Cb 0.45 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.84 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 1.10 3.05 -4.11 0.00 7.94 -0.07 -2.78 117.00 122.12 2jwp n LEU 170 Ca 0.00 0.82 -0.29 0.00 -1.11 0.00 0.00 56.01 55.43 2jwp n LEU 170 Cb 0.50 -1.33 -0.17 0.00 0.53 0.00 0.00 43.42 42.95 2jwp n LEU 170 CO 0.00 -0.28 -0.51 0.12 -1.11 0.00 0.00 177.39 175.61 2jwp s PHE 171 N 4.97 2.11 -0.09 1.96 5.36 -0.91 0.03 117.98 131.41 2jwp s PHE 171 Ca 0.97 -0.92 0.04 0.00 -0.96 0.00 0.00 56.93 56.06 2jwp s PHE 171 Cb -0.75 -1.47 -0.01 0.00 -0.34 0.00 0.00 43.02 40.46 2jwp s PHE 171 CO 0.52 -0.43 -0.23 -1.50 -1.46 0.00 0.00 175.22 172.12 2jwp s ILE 172 N 0.70 2.20 0.26 3.12 2.07 -0.07 -0.41 121.20 129.08 2jwp s ILE 172 Ca -0.12 -0.98 0.11 0.00 -1.41 0.00 0.00 60.65 58.25 2jwp s ILE 172 Cb -0.16 -1.84 -0.05 0.00 0.13 0.00 0.00 42.46 40.54 2jwp s ILE 172 CO 0.03 0.56 -0.19 0.00 -1.91 0.00 0.00 174.94 173.43 2jwp s MET 173 N 0.18 1.61 0.11 3.50 0.23 -0.17 -2.56 119.30 122.19 2jwp s MET 173 Ca -0.13 -1.73 0.07 0.00 -1.03 0.00 0.00 55.69 52.87 2jwp s MET 173 Cb -0.16 -1.64 -0.04 0.00 -1.53 0.00 0.00 34.83 31.46 2jwp s MET 173 CO 0.07 0.30 -0.11 -1.59 -2.03 0.00 0.00 175.02 171.67 2jwp s LYS 174 N -3.53 2.10 0.00 3.16 -2.85 0.26 -0.27 119.74 118.61 2jwp s LYS 174 Ca 0.28 -1.04 0.00 0.00 -1.00 0.00 0.00 55.97 54.21 2jwp s LYS 174 Cb -0.04 -2.29 0.00 0.00 -2.06 0.00 0.00 37.83 33.44 2jwp s LYS 174 CO 0.13 0.50 0.00 0.41 0.10 0.00 0.00 175.35 176.50 2jwp n GLY 175 N 0.70 2.68 3.61 0.59 0.00 0.98 -4.77 105.19 108.98 2jwp n GLY 175 Ca -0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.19 0.00 -0.98 2.61 -4.23 0.74 -2.71 115.64 108.88 2jwp s THR 176 Ca 0.00 -0.03 0.27 0.00 -1.18 0.00 0.00 61.69 60.75 2jwp s THR 176 Cb 0.00 -1.22 0.11 0.00 1.34 0.00 0.00 72.50 72.73 2jwp s THR 176 CO 0.00 0.00 1.63 0.00 -0.54 0.00 0.00 174.62 175.71 2jwp n ALA 177 N -0.15 2.98 1.92 3.99 0.00 -1.26 -4.60 120.51 123.39 2jwp n ALA 177 Ca 0.00 -0.23 0.16 0.00 0.00 0.00 0.00 53.44 53.37 2jwp n ALA 177 Cb 0.59 -1.28 0.88 0.00 0.00 0.00 0.00 19.45 19.64 2jwp n ALA 177 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25