#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pnz s LEU 10 N 0.00 3.88 0.45 -0.35 1.43 -1.26 -5.09 118.68 117.74 2pnz s LEU 10 Ca 0.00 -1.42 0.29 0.00 -1.03 0.00 0.00 54.13 51.97 2pnz s LEU 10 Cb 0.00 -1.66 0.97 0.00 0.03 0.00 0.00 46.19 45.54 2pnz s LEU 10 CO 0.00 -0.26 1.82 0.16 0.23 0.00 0.00 176.35 178.30 2pnz h ILE 11 N 6.57 0.00 -3.34 -0.59 3.07 -1.97 -3.40 117.51 117.85 2pnz h ILE 11 Ca -0.19 -0.60 -0.54 0.00 1.55 0.00 0.00 64.86 65.08 2pnz h ILE 11 Cb 1.05 1.57 -0.39 0.00 -0.27 0.00 0.00 36.82 38.78 2pnz h ILE 11 CO 0.52 0.00 -0.78 -1.81 -1.05 0.00 0.00 178.15 175.03 2pnz s ASP 12 N -5.52 2.86 0.00 2.16 1.01 -1.26 -3.93 116.67 111.98 2pnz s ASP 12 Ca 0.04 -0.72 0.00 0.00 0.71 0.00 0.00 52.55 52.58 2pnz s ASP 12 Cb 0.08 -0.80 0.00 0.00 1.01 0.00 0.00 42.92 43.21 2pnz s ASP 12 CO 0.56 -0.23 0.00 -0.62 0.21 0.00 0.00 175.17 175.09 2pnz n GLU 13 N 4.93 0.00 -3.21 8.23 4.71 0.15 -4.89 120.64 130.56 2pnz n GLU 13 Ca -0.10 0.00 -0.00 0.00 -0.01 0.00 0.00 57.16 57.04 2pnz n GLU 13 Cb 0.47 0.00 -0.02 0.00 -1.01 0.00 0.00 31.44 30.88 2pnz n GLU 13 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 2pnz s ASN 14 N 0.00 -1.07 -0.59 1.62 3.84 -1.26 -4.26 114.94 113.22 2pnz s ASN 14 Ca 0.00 -0.27 -0.04 0.00 0.21 0.00 0.00 52.86 52.76 2pnz s ASN 14 Cb 0.00 1.76 0.11 0.00 -0.55 0.00 0.00 41.25 42.57 2pnz s ASN 14 CO 0.00 -0.27 2.62 0.61 -2.79 0.00 0.00 177.10 177.27 2pnz n GLY 15 N 5.08 4.62 3.83 1.21 0.00 -1.26 -5.08 105.19 113.59 2pnz n GLY 15 Ca 0.06 -2.00 -0.37 0.00 0.00 0.00 0.00 46.02 43.71 2pnz n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2pnz s ARG 16 N -2.05 4.04 0.74 1.61 0.52 -1.26 -3.99 118.95 118.55 2pnz s ARG 16 Ca 0.57 0.55 0.00 0.00 -0.52 0.00 0.00 55.73 56.33 2pnz s ARG 16 Cb 0.37 -3.11 0.14 0.00 0.52 0.00 0.00 34.95 32.88 2pnz s ARG 16 CO -0.24 0.59 1.02 1.03 0.02 0.00 0.00 175.30 177.72 2pnz s ARG 17 N -1.46 1.55 0.38 3.54 0.52 0.22 0.32 118.95 124.01 2pnz s ARG 17 Ca 0.31 -1.27 0.05 0.00 -0.52 0.00 0.00 55.73 54.31 2pnz s ARG 17 Cb -0.17 -2.34 0.76 0.00 0.52 0.00 0.00 34.95 33.73 2pnz s ARG 17 CO 0.18 -1.55 2.02 0.82 0.02 0.00 0.00 175.30 176.80 2pnz h ILE 18 N -0.58 1.11 -0.01 1.52 2.04 -1.87 0.20 117.51 119.92 2pnz h ILE 18 Ca -0.34 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2pnz h ILE 18 Cb 1.26 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2pnz h ILE 18 CO 0.37 0.13 -0.22 -0.90 0.00 0.00 0.00 178.15 177.53 2pnz n ASP 19 N -4.46 1.14 0.00 1.72 5.68 -1.26 -4.92 116.55 114.45 2pnz n ASP 19 Ca 0.06 -1.01 0.00 0.00 -0.50 0.00 0.00 54.79 53.33 2pnz n ASP 19 Cb 0.09 0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 2pnz n ASP 19 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2pnz n GLY 20 N 1.31 0.73 3.76 6.12 0.00 0.69 -5.08 105.19 112.72 2pnz n GLY 20 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2pnz n GLY 20 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2pnz s ARG 21 N -0.54 4.63 1.01 1.61 1.70 -1.25 -4.51 118.95 121.59 2pnz s ARG 21 Ca 0.00 1.56 -0.12 0.00 -0.47 0.00 0.00 55.73 56.70 2pnz s ARG 21 Cb 0.00 -3.05 0.19 0.00 -0.57 0.00 0.00 34.95 31.52 2pnz s ARG 21 CO 0.00 0.28 1.08 0.15 -1.08 0.00 0.00 175.30 175.73 2pnz s LYS 22 N -1.63 0.37 0.35 3.89 1.02 -1.26 0.69 119.74 123.17 2pnz s LYS 22 Ca 0.46 0.64 0.10 0.00 0.02 0.00 0.00 55.97 57.19 2pnz s LYS 22 Cb -0.26 -1.72 0.85 0.00 -0.52 0.00 0.00 37.83 36.18 2pnz s LYS 22 CO 0.33 -2.80 1.83 0.87 -0.92 0.00 0.00 175.35 174.65 2pnz h LYS 23 N -1.95 0.64 -0.27 1.68 1.57 -1.96 -2.85 116.57 113.43 2pnz h LYS 23 Ca -0.55 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.14 2pnz h LYS 23 Cb 1.32 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.45 2pnz h LYS 23 CO 0.56 0.42 -0.02 0.66 -0.57 0.00 0.00 179.45 180.50 2pnz n TYR 24 N -4.62 0.92 -3.51 -1.35 4.01 -1.26 -1.00 117.16 110.34 2pnz n TYR 24 Ca 0.20 -1.11 -0.34 0.00 -0.16 0.00 0.00 57.90 56.50 2pnz n TYR 24 Cb 0.57 -0.36 -0.05 0.00 -0.31 0.00 0.00 39.34 39.19 2pnz n TYR 24 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2pnz s GLU 25 N -2.96 3.80 0.17 -0.72 2.12 -1.08 -4.88 118.70 115.15 2pnz s GLU 25 Ca 0.42 0.23 -0.02 0.00 0.36 0.00 0.00 54.97 55.96 2pnz s GLU 25 Cb 0.36 -2.90 -0.05 0.00 0.26 0.00 0.00 34.13 31.80 2pnz s GLU 25 CO 0.06 0.48 0.36 -0.51 -0.54 0.00 0.00 175.26 175.11 2pnz s LEU 26 N -2.19 4.26 0.73 2.70 1.43 -1.26 -4.71 118.68 119.64 2pnz s LEU 26 Ca 0.38 0.43 -0.14 0.00 -1.03 0.00 0.00 54.13 53.77 2pnz s LEU 26 Cb -0.13 -3.18 0.04 0.00 0.03 0.00 0.00 46.19 42.95 2pnz s LEU 26 CO 0.20 0.01 1.17 -0.13 0.23 0.00 0.00 176.35 177.83 2pnz s ARG 27 N -3.03 2.20 0.18 1.70 0.52 -1.26 -4.90 118.95 114.36 2pnz s ARG 27 Ca 0.39 1.60 -0.33 0.00 -0.52 0.00 0.00 55.73 56.86 2pnz s ARG 27 Cb -0.12 -1.86 -0.13 0.00 0.52 0.00 0.00 34.95 33.36 2pnz s ARG 27 CO 0.28 -1.75 1.63 -2.30 0.02 0.00 0.00 175.30 173.17 2pnz n PRO 28 N -2.86 2.36 -4.48 3.54 -0.02 -1.26 -4.64 135.00 127.64 2pnz n PRO 28 Ca 0.12 0.85 -0.31 0.00 -2.02 0.00 0.00 63.50 62.15 2pnz n PRO 28 Cb 0.51 -2.65 -0.17 0.00 -0.02 0.00 0.00 33.50 31.18 2pnz n PRO 28 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2pnz s ILE 29 N 1.01 1.78 -0.01 4.25 1.01 -1.26 -1.10 121.20 126.88 2pnz s ILE 29 Ca 0.78 -0.81 0.08 0.00 0.00 0.00 0.00 60.65 60.70 2pnz s ILE 29 Cb -0.62 -1.61 -0.02 0.00 0.01 0.00 0.00 42.46 40.22 2pnz s ILE 29 CO 0.36 0.50 -0.26 -0.54 0.00 0.00 0.00 174.94 175.00 2pnz s LYS 30 N 0.99 2.03 -0.01 2.79 1.02 0.92 -5.00 119.74 122.48 2pnz s LYS 30 Ca -0.05 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 54.99 2pnz s LYS 30 Cb -0.15 -2.00 0.02 0.00 -0.52 0.00 0.00 37.83 35.17 2pnz s LYS 30 CO -0.04 0.54 0.02 0.00 -0.92 0.00 0.00 175.35 174.96 2pnz s MET 31 N -0.72 -0.02 0.00 1.68 0.23 -1.26 -1.39 119.30 117.82 2pnz s MET 31 Ca 0.10 0.10 0.05 0.00 -1.03 0.00 0.00 55.69 54.91 2pnz s MET 31 Cb -0.10 -0.14 -0.02 0.00 -1.53 0.00 0.00 34.83 33.05 2pnz s MET 31 CO -0.00 -0.09 -0.16 -2.00 -2.03 0.00 0.00 175.02 170.73 2pnz s GLU 32 N 0.57 1.26 0.13 3.16 2.12 -0.60 -4.79 118.70 120.56 2pnz s GLU 32 Ca -0.05 -0.65 0.07 0.00 0.36 0.00 0.00 54.97 54.71 2pnz s GLU 32 Cb -0.07 -1.25 -0.04 0.00 0.26 0.00 0.00 34.13 33.03 2pnz s GLU 32 CO -0.02 0.34 -0.08 0.08 -0.54 0.00 0.00 175.26 175.04 2pnz s VAL 33 N -0.50 3.42 -0.23 3.70 1.01 -1.26 0.39 120.40 126.93 2pnz s VAL 33 Ca 0.06 -1.36 -0.00 0.00 0.00 0.00 0.00 61.98 60.67 2pnz s VAL 33 Cb -0.07 -2.64 -0.00 0.00 0.00 0.00 0.00 36.38 33.67 2pnz s VAL 33 CO -0.00 0.03 0.20 0.61 0.00 0.00 0.00 175.10 175.94 2pnz n GLY 34 N 0.43 0.35 0.52 4.51 0.00 0.58 -4.93 105.19 106.65 2pnz n GLY 34 Ca -0.12 -0.28 0.09 0.00 0.00 0.00 0.00 46.02 45.71 2pnz n GLY 34 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2pnz n VAL 35 N -1.70 0.00 -4.38 1.61 0.24 -1.26 -4.98 118.33 107.87 2pnz n VAL 35 Ca -0.04 -0.38 -0.20 0.00 -2.04 0.00 0.00 64.34 61.67 2pnz n VAL 35 Cb 0.53 1.27 -0.13 0.00 -1.47 0.00 0.00 33.84 34.04 2pnz n VAL 35 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2pnz s LEU 36 N -1.92 2.16 -0.11 1.34 1.43 -1.26 -5.05 118.68 115.27 2pnz s LEU 36 Ca 0.17 -0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 52.64 2pnz s LEU 36 Cb 0.15 -0.62 -0.27 0.00 0.03 0.00 0.00 46.19 45.48 2pnz s LEU 36 CO 0.36 0.04 0.58 0.50 0.23 0.00 0.00 176.35 178.07 2pnz h LYS 37 N 4.98 0.20 -0.01 1.70 3.64 -2.00 -3.39 116.57 121.68 2pnz h LYS 37 Ca -0.38 -0.33 -0.01 0.00 -1.27 0.00 0.00 60.65 58.66 2pnz h LYS 37 Cb 1.18 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2pnz h LYS 37 CO 0.44 1.16 -0.02 -0.91 -2.27 0.00 0.00 179.45 177.85 2pnz h ASN 38 N -0.47 0.04 -2.79 4.20 2.35 -2.00 -3.45 115.58 113.46 2pnz h ASN 38 Ca -0.26 -0.57 -0.59 0.00 -0.55 0.00 0.00 56.30 54.34 2pnz h ASN 38 Cb 1.61 -0.01 0.14 0.00 0.05 0.00 0.00 38.32 40.11 2pnz h ASN 38 CO 0.03 0.60 -0.10 0.00 -1.65 0.00 0.00 177.43 176.31 2pnz n ALA 39 N -2.39 -0.60 -0.23 -0.83 0.00 -1.26 -4.90 120.51 110.30 2pnz n ALA 39 Ca -0.09 0.17 -0.07 0.00 0.00 0.00 0.00 53.44 53.46 2pnz n ALA 39 Cb 0.30 -1.94 0.04 0.00 0.00 0.00 0.00 19.45 17.85 2pnz n ALA 39 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2pnz h ASN 40 N 1.07 0.92 -5.17 0.00 4.21 -0.04 -3.45 115.58 113.12 2pnz h ASN 40 Ca -0.43 -0.19 -0.12 0.00 1.21 0.00 0.00 56.30 56.77 2pnz h ASN 40 Cb 1.37 -0.24 -0.16 0.00 -1.12 0.00 0.00 38.32 38.17 2pnz h ASN 40 CO 0.54 0.86 -0.62 -0.83 -1.29 0.00 0.00 177.43 176.08 2pnz s GLY 41 N -3.24 0.35 0.11 2.83 0.00 -0.88 -4.15 107.32 102.32 2pnz s GLY 41 Ca -0.13 -0.95 -0.25 0.00 0.00 0.00 0.00 44.72 43.40 2pnz s GLY 41 CO 0.81 -1.06 0.64 -1.35 0.00 0.00 0.00 173.10 172.14 2pnz s SER 42 N -2.57 -0.57 0.07 1.64 1.04 -1.26 0.19 113.70 112.24 2pnz s SER 42 Ca 0.02 0.13 -0.15 0.00 0.48 0.00 0.00 55.95 56.42 2pnz s SER 42 Cb 0.04 0.57 0.03 0.00 0.10 0.00 0.00 66.02 66.75 2pnz s SER 42 CO -0.08 -0.88 0.36 0.00 0.98 0.00 0.00 173.24 173.62 2pnz s ALA 43 N -3.24 -0.82 0.00 5.32 0.00 -0.24 -0.30 121.76 122.48 2pnz s ALA 43 Ca -0.01 0.04 0.05 0.00 0.00 0.00 0.00 51.96 52.04 2pnz s ALA 43 Cb -0.01 0.45 -0.02 0.00 0.00 0.00 0.00 23.12 23.55 2pnz s ALA 43 CO -0.09 -0.50 -0.16 -0.47 0.00 0.00 0.00 175.76 174.55 2pnz s TYR 44 N -3.00 1.39 -0.03 0.00 5.04 0.16 -0.83 117.35 120.09 2pnz s TYR 44 Ca -0.02 -0.29 0.01 0.00 -2.44 0.00 0.00 57.07 54.33 2pnz s TYR 44 Cb 0.00 -0.87 0.01 0.00 0.35 0.00 0.00 41.96 41.46 2pnz s TYR 44 CO -0.06 0.00 -0.04 -1.50 -1.34 0.00 0.00 175.55 172.61 2pnz s ILE 45 N -0.50 0.44 -0.32 3.14 2.07 0.13 -1.55 121.20 124.60 2pnz s ILE 45 Ca 0.05 -0.13 -0.04 0.00 -1.41 0.00 0.00 60.65 59.12 2pnz s ILE 45 Cb -0.07 -0.44 0.04 0.00 0.13 0.00 0.00 42.46 42.12 2pnz s ILE 45 CO 0.00 0.18 0.05 -1.61 -1.91 0.00 0.00 174.94 171.65 2pnz s GLU 46 N 0.56 2.55 -0.42 3.50 2.02 -0.49 -0.67 118.70 125.74 2pnz s GLU 46 Ca -0.07 -1.21 0.02 0.00 0.02 0.00 0.00 54.97 53.74 2pnz s GLU 46 Cb -0.10 -3.32 0.12 0.00 0.10 0.00 0.00 34.13 30.93 2pnz s GLU 46 CO -0.00 -0.63 0.19 -0.46 0.02 0.00 0.00 175.26 174.37 2pnz s TRP 47 N 1.34 2.54 0.00 1.61 -0.11 -0.91 -0.06 118.94 123.35 2pnz s TRP 47 Ca -0.03 -2.60 0.00 0.00 1.22 0.00 0.00 56.10 54.69 2pnz s TRP 47 Cb -0.19 -2.27 0.00 0.00 -1.50 0.00 0.00 33.47 29.50 2pnz s TRP 47 CO 0.01 -0.82 0.00 0.41 -4.62 0.00 0.00 176.95 171.93 2pnz n GLY 48 N 3.77 -0.11 0.00 5.86 0.00 -0.26 -1.75 105.19 112.70 2pnz n GLY 48 Ca 0.05 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.99 2pnz n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2pnz n LYS 49 N 4.40 0.00 -1.84 1.61 5.02 -1.26 -4.84 118.16 121.25 2pnz n LYS 49 Ca 0.00 0.39 -0.41 0.00 -2.02 0.00 0.00 58.31 56.27 2pnz n LYS 49 Cb 0.00 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.50 2pnz n LYS 49 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2pnz s ASN 50 N -2.80 6.42 -0.20 4.39 0.01 -0.72 -4.07 114.94 117.99 2pnz s ASN 50 Ca 0.00 2.96 -0.05 0.00 -0.71 0.00 0.00 52.86 55.06 2pnz s ASN 50 Cb 0.00 -2.65 0.07 0.00 0.41 0.00 0.00 41.25 39.08 2pnz s ASN 50 CO 0.01 -0.84 0.10 -0.54 -1.51 0.00 0.00 177.10 174.32 2pnz s LYS 51 N -1.47 0.12 -0.03 -0.60 1.02 -0.46 -2.14 119.74 116.17 2pnz s LYS 51 Ca 0.56 -0.19 0.03 0.00 0.02 0.00 0.00 55.97 56.39 2pnz s LYS 51 Cb -0.46 -1.71 0.00 0.00 -0.52 0.00 0.00 37.83 35.15 2pnz s LYS 51 CO 0.56 -0.74 -0.12 0.42 -0.92 0.00 0.00 175.35 174.54 2pnz s ILE 52 N 2.12 1.06 -0.06 2.17 1.01 0.15 -0.25 121.20 127.40 2pnz s ILE 52 Ca 0.03 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.21 2pnz s ILE 52 Cb -0.16 -0.93 -0.02 0.00 0.01 0.00 0.00 42.46 41.36 2pnz s ILE 52 CO -0.15 0.32 -0.16 -0.51 0.00 0.00 0.00 174.94 174.44 2pnz s ILE 53 N 0.13 2.91 -0.05 2.92 2.07 -0.01 0.17 121.20 129.34 2pnz s ILE 53 Ca -0.03 -0.77 0.04 0.00 -1.41 0.00 0.00 60.65 58.48 2pnz s ILE 53 Cb -0.10 -2.14 -0.00 0.00 0.13 0.00 0.00 42.46 40.35 2pnz s ILE 53 CO 0.01 0.58 -0.17 0.00 -1.91 0.00 0.00 174.94 173.45 2pnz s ALA 54 N -0.53 1.52 0.05 1.50 0.00 -0.01 -0.33 121.76 123.96 2pnz s ALA 54 Ca 0.07 -0.67 0.06 0.00 0.00 0.00 0.00 51.96 51.43 2pnz s ALA 54 Cb -0.12 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 2pnz s ALA 54 CO 0.01 0.26 -0.17 0.00 0.00 0.00 0.00 175.76 175.85 2pnz s ALA 55 N 0.13 1.47 -0.03 0.00 0.00 -0.40 -1.08 121.76 121.85 2pnz s ALA 55 Ca -0.06 -0.98 0.05 0.00 0.00 0.00 0.00 51.96 50.97 2pnz s ALA 55 Cb -0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 2pnz s ALA 55 CO 0.03 0.30 -0.18 0.08 0.00 0.00 0.00 175.76 175.99 2pnz s VAL 56 N -0.90 1.45 -0.04 0.00 1.01 0.13 -0.72 120.40 121.32 2pnz s VAL 56 Ca 0.04 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.31 2pnz s VAL 56 Cb -0.09 -1.23 0.00 0.00 0.00 0.00 0.00 36.38 35.07 2pnz s VAL 56 CO 0.02 0.41 -0.14 -0.31 0.00 0.00 0.00 175.10 175.08 2pnz s TYR 57 N -0.14 1.49 0.00 5.22 1.51 -0.31 0.71 117.35 125.82 2pnz s TYR 57 Ca 0.00 -0.44 0.00 0.00 -1.01 0.00 0.00 57.07 55.62 2pnz s TYR 57 Cb -0.10 -1.03 0.00 0.00 -0.11 0.00 0.00 41.96 40.72 2pnz s TYR 57 CO 0.01 -0.18 0.00 0.41 -1.11 0.00 0.00 175.55 174.69 2pnz n GLY 58 N 3.32 0.12 3.75 0.71 0.00 -1.26 0.20 105.19 112.04 2pnz n GLY 58 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 2pnz n GLY 58 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2pnz s PRO 59 N -0.28 4.31 0.09 1.61 0.02 -1.26 -4.90 135.00 134.59 2pnz s PRO 59 Ca 0.00 2.24 -0.00 0.00 0.02 0.00 0.00 61.00 63.26 2pnz s PRO 59 Cb 0.00 -3.11 -0.04 0.00 0.02 0.00 0.00 34.50 31.37 2pnz s PRO 59 CO 0.00 -0.33 -0.01 -0.98 -0.33 0.00 0.00 177.00 175.35 2pnz s ARG 60 N -0.74 0.79 -0.64 5.54 1.70 -0.07 -4.91 118.95 120.62 2pnz s ARG 60 Ca 0.56 -1.33 -0.31 0.00 -0.47 0.00 0.00 55.73 54.17 2pnz s ARG 60 Cb -0.40 0.07 -0.17 0.00 -0.57 0.00 0.00 34.95 33.87 2pnz s ARG 60 CO 0.45 -0.13 2.04 0.39 -1.08 0.00 0.00 175.30 176.98 2pnz n GLU 61 N -0.01 0.00 -1.98 3.89 -0.58 -1.26 -0.47 120.64 120.22 2pnz n GLU 61 Ca -0.11 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.21 2pnz n GLU 61 Cb 0.62 -1.26 -0.03 0.00 -0.57 0.00 0.00 31.44 30.20 2pnz n GLU 61 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2pnz s LEU 62 N 6.34 4.11 0.20 -4.62 0.20 -1.25 -4.74 118.68 118.92 2pnz s LEU 62 Ca 1.08 2.03 -0.13 0.00 0.69 0.00 0.00 54.13 57.79 2pnz s LEU 62 Cb -1.15 -3.53 -0.07 0.00 -0.43 0.00 0.00 46.19 41.00 2pnz s LEU 62 CO 0.48 -1.14 0.59 -1.00 -0.29 0.00 0.00 176.35 174.99 2pnz s HIS 63 N 4.83 3.52 0.38 5.38 0.09 -1.26 -4.10 115.29 124.12 2pnz s HIS 63 Ca 0.76 1.05 -0.01 0.00 -0.00 0.00 0.00 55.06 56.86 2pnz s HIS 63 Cb -0.31 -2.38 -0.03 0.00 -0.00 0.00 0.00 32.58 29.86 2pnz s HIS 63 CO 0.31 0.32 0.60 -1.25 -0.00 0.00 0.00 174.74 174.72 2pnz s PRO 64 N -2.38 3.49 0.27 8.40 0.04 -1.26 -5.01 135.00 138.55 2pnz s PRO 64 Ca 0.44 -0.23 -0.03 0.00 0.04 0.00 0.00 61.00 61.22 2pnz s PRO 64 Cb -0.13 -2.60 0.59 0.00 0.04 0.00 0.00 34.50 32.39 2pnz s PRO 64 CO 0.20 0.07 1.61 0.87 0.04 0.00 0.00 177.00 179.79 2pnz h LYS 65 N 0.64 0.08 0.00 4.56 1.57 -2.00 0.21 116.57 121.63 2pnz h LYS 65 Ca -0.49 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2pnz h LYS 65 Cb 1.22 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2pnz h LYS 65 CO 0.61 0.05 0.00 -2.39 -0.57 0.00 0.00 179.45 177.15 2pnz n HIS 66 N -5.39 0.00 0.28 -1.35 1.44 -1.26 0.40 115.22 109.34 2pnz n HIS 66 Ca 0.18 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 56.00 2pnz n HIS 66 Cb 0.60 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.71 2pnz n HIS 66 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2pnz n LEU 67 N -0.99 0.62 -4.75 2.39 4.77 0.06 -4.95 117.00 114.15 2pnz n LEU 67 Ca 0.03 0.15 -0.37 0.00 -0.03 0.00 0.00 56.01 55.79 2pnz n LEU 67 Cb 0.01 -0.07 0.04 0.00 -2.33 0.00 0.00 43.42 41.07 2pnz n LEU 67 CO 0.02 -0.07 0.89 -1.10 -1.33 0.00 0.00 177.39 175.81 2pnz s GLN 68 N -3.32 3.05 -0.14 3.23 -0.21 1.33 -4.98 119.66 118.63 2pnz s GLN 68 Ca 0.00 1.98 -0.04 0.00 0.02 0.00 0.00 55.36 57.32 2pnz s GLN 68 Cb 0.12 -2.07 -0.03 0.00 1.00 0.00 0.00 33.01 32.03 2pnz s GLN 68 CO 0.81 -1.18 -0.02 1.03 -2.12 0.00 0.00 175.29 173.81 2pnz s ARG 69 N -3.13 3.51 0.48 2.91 0.52 -1.26 -4.99 118.95 116.99 2pnz s ARG 69 Ca 0.75 -0.47 0.26 0.00 -0.52 0.00 0.00 55.73 55.74 2pnz s ARG 69 Cb -0.34 -2.91 1.16 0.00 0.52 0.00 0.00 34.95 33.38 2pnz s ARG 69 CO 0.38 0.37 1.94 -1.35 0.02 0.00 0.00 175.30 176.67 2pnz h PRO 70 N 6.27 0.00 0.00 3.54 0.11 -1.96 -1.05 132.00 138.90 2pnz h PRO 70 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2pnz h PRO 70 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2pnz h PRO 70 CO 0.62 0.18 -0.93 -0.40 -0.21 0.00 0.00 178.00 177.26 2pnz n ASP 71 N -3.50 1.35 -3.70 -2.05 3.85 -1.26 -4.57 116.55 106.67 2pnz n ASP 71 Ca -0.01 -0.43 -0.14 0.00 -0.71 0.00 0.00 54.79 53.50 2pnz n ASP 71 Cb 0.34 1.21 -0.08 0.00 -1.35 0.00 0.00 41.12 41.25 2pnz n ASP 71 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2pnz s ARG 72 N -2.33 0.74 0.70 0.11 1.70 -1.20 -4.20 118.95 114.48 2pnz s ARG 72 Ca 0.01 0.03 -0.16 0.00 -0.47 0.00 0.00 55.73 55.13 2pnz s ARG 72 Cb 0.08 0.34 -0.03 0.00 -0.57 0.00 0.00 34.95 34.77 2pnz s ARG 72 CO 0.45 -0.20 0.70 0.00 -1.08 0.00 0.00 175.30 175.16 2pnz n ALA 73 N 1.39 -0.97 -2.80 7.88 0.00 0.12 -2.87 120.51 123.26 2pnz n ALA 73 Ca -0.20 -0.19 -0.28 0.00 0.00 0.00 0.00 53.44 52.78 2pnz n ALA 73 Cb 0.56 -1.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.01 2pnz n ALA 73 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2pnz s ILE 74 N -1.84 4.56 -0.19 0.00 -4.36 0.11 -4.84 121.20 114.64 2pnz s ILE 74 Ca 0.69 -0.95 -0.06 0.00 -0.26 0.00 0.00 60.65 60.07 2pnz s ILE 74 Cb -0.36 -3.28 -0.03 0.00 1.25 0.00 0.00 42.46 40.03 2pnz s ILE 74 CO 0.54 -0.03 0.04 -0.22 0.24 0.00 0.00 174.94 175.51 2pnz s LEU 75 N -2.87 3.58 -0.05 0.37 0.20 -1.26 0.65 118.68 119.30 2pnz s LEU 75 Ca 0.31 -0.04 0.06 0.00 0.69 0.00 0.00 54.13 55.15 2pnz s LEU 75 Cb -0.11 -1.90 -0.01 0.00 -0.43 0.00 0.00 46.19 43.74 2pnz s LEU 75 CO 0.23 0.13 -0.23 -0.13 -0.29 0.00 0.00 176.35 176.06 2pnz s ARG 76 N 0.62 2.34 -0.02 1.98 0.52 0.13 -4.96 118.95 119.56 2pnz s ARG 76 Ca 0.02 -0.84 0.05 0.00 -0.52 0.00 0.00 55.73 54.44 2pnz s ARG 76 Cb -0.13 -2.01 -0.01 0.00 0.52 0.00 0.00 34.95 33.31 2pnz s ARG 76 CO 0.02 0.36 -0.19 0.08 0.02 0.00 0.00 175.30 175.59 2pnz s VAL 77 N -0.15 1.50 -0.16 3.52 1.01 -1.26 0.02 120.40 124.88 2pnz s VAL 77 Ca -0.03 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.14 2pnz s VAL 77 Cb -0.13 -1.26 0.05 0.00 0.00 0.00 0.00 36.38 35.04 2pnz s VAL 77 CO 0.03 0.43 0.02 -0.60 0.00 0.00 0.00 175.10 174.98 2pnz s ARG 78 N -0.29 0.69 -0.17 2.72 3.00 0.47 -4.79 118.95 120.57 2pnz s ARG 78 Ca 0.04 -0.28 -0.12 0.00 -1.00 0.00 0.00 55.73 54.37 2pnz s ARG 78 Cb -0.09 -1.80 -0.05 0.00 0.00 0.00 0.00 34.95 33.02 2pnz s ARG 78 CO 0.00 -0.53 0.22 -0.47 0.00 0.00 0.00 175.30 174.52 2pnz s TYR 79 N 1.88 3.45 -0.07 5.12 5.04 -1.26 0.59 117.35 132.10 2pnz s TYR 79 Ca 0.01 0.48 -0.12 0.00 -2.44 0.00 0.00 57.07 55.00 2pnz s TYR 79 Cb -0.16 -2.24 0.02 0.00 0.35 0.00 0.00 41.96 39.94 2pnz s TYR 79 CO -0.07 0.29 0.29 1.21 -1.34 0.00 0.00 175.55 175.93 2pnz s ASN 80 N 0.32 -0.24 -0.13 4.32 2.47 0.00 -4.77 114.94 116.91 2pnz s ASN 80 Ca 0.13 0.35 -0.04 0.00 0.42 0.00 0.00 52.86 53.72 2pnz s ASN 80 Cb -0.12 0.48 -0.03 0.00 -1.45 0.00 0.00 41.25 40.12 2pnz s ASN 80 CO 0.01 -0.25 0.00 -0.04 -3.72 0.00 0.00 177.10 173.11 2pnz s MET 81 N -0.51 3.44 0.46 0.43 -1.94 -1.26 -0.13 119.30 119.79 2pnz s MET 81 Ca -0.06 -0.42 -0.23 0.00 -1.71 0.00 0.00 55.69 53.27 2pnz s MET 81 Cb -0.04 -2.93 -0.07 0.00 2.01 0.00 0.00 34.83 33.80 2pnz s MET 81 CO 0.02 0.46 1.15 0.00 -0.01 0.00 0.00 175.02 176.63 2pnz s ALA 82 N -0.20 2.96 0.43 3.03 0.00 -0.39 -4.79 121.76 122.80 2pnz s ALA 82 Ca 0.05 0.89 0.25 0.00 0.00 0.00 0.00 51.96 53.15 2pnz s ALA 82 Cb -0.12 -3.37 1.28 0.00 0.00 0.00 0.00 23.12 20.91 2pnz s ALA 82 CO 0.02 -0.61 1.73 -1.35 0.00 0.00 0.00 175.76 175.55 2pnz h PRO 83 N 2.00 0.23 -0.50 0.00 0.11 -1.90 -0.45 132.00 131.50 2pnz h PRO 83 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2pnz h PRO 83 Cb 1.24 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2pnz h PRO 83 CO 0.60 0.15 0.00 1.97 -0.21 0.00 0.00 178.00 180.51 2pnz n PHE 84 N -4.57 0.66 0.06 0.65 -1.74 -1.26 -1.68 117.46 109.59 2pnz n PHE 84 Ca 0.29 -0.33 -0.01 0.00 -0.56 0.00 0.00 57.45 56.84 2pnz n PHE 84 Cb 1.12 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 42.06 2pnz n PHE 84 CO 0.00 0.00 0.00 0.66 -0.56 0.00 0.00 176.76 176.86 2pnz h SER 85 N 3.22 0.00 -2.12 5.98 4.64 -1.20 -3.46 113.55 120.61 2pnz h SER 85 Ca 0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 2pnz h SER 85 Cb 0.73 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.81 2pnz h SER 85 CO 0.00 0.67 -0.43 0.68 -0.87 0.00 0.00 176.83 176.88 2pnz s VAL 86 N -2.86 4.87 0.16 0.95 -7.23 -1.26 -1.53 120.40 113.50 2pnz s VAL 86 Ca -0.00 -1.08 -0.14 0.00 -1.81 0.00 0.00 61.98 58.95 2pnz s VAL 86 Cb 0.08 -3.69 0.05 0.00 0.56 0.00 0.00 36.38 33.39 2pnz s VAL 86 CO 0.79 -0.30 1.78 -0.08 -0.31 0.00 0.00 175.10 176.99 2pnz h GLU 87 N 1.18 0.71 -5.39 4.82 4.81 -1.90 -3.38 114.58 115.43 2pnz h GLU 87 Ca -0.50 -0.08 -0.62 0.00 -0.13 0.00 0.00 59.36 58.03 2pnz h GLU 87 Cb 1.24 -0.14 -0.13 0.00 0.63 0.00 0.00 28.75 30.35 2pnz h GLU 87 CO 0.60 0.54 0.04 -1.21 -0.73 0.00 0.00 179.01 178.24 2pnz s GLU 88 N -5.90 3.99 -0.01 1.92 0.41 -1.26 -5.01 118.70 112.85 2pnz s GLU 88 Ca -0.13 0.30 -0.37 0.00 -0.41 0.00 0.00 54.97 54.36 2pnz s GLU 88 Cb 0.12 -3.68 -0.15 0.00 -1.78 0.00 0.00 34.13 28.63 2pnz s GLU 88 CO 0.75 -0.43 1.56 -2.13 -0.49 0.00 0.00 175.26 174.52 2pnz n ARG 89 N 5.65 1.52 -3.49 1.61 0.00 -1.26 -4.89 116.66 115.79 2pnz n ARG 89 Ca -0.03 0.55 -0.37 0.00 -0.00 0.00 0.00 57.85 58.00 2pnz n ARG 89 Cb 0.49 -2.26 -0.08 0.00 0.00 0.00 0.00 32.46 30.62 2pnz n ARG 89 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 2pnz s LYS 90 N 1.78 4.20 0.15 -0.14 2.20 -0.67 -5.04 119.74 122.21 2pnz s LYS 90 Ca 0.88 0.08 -0.34 0.00 -0.36 0.00 0.00 55.97 56.23 2pnz s LYS 90 Cb -0.88 -3.49 -0.15 0.00 -1.51 0.00 0.00 37.83 31.80 2pnz s LYS 90 CO 0.50 0.10 1.49 1.17 -0.36 0.00 0.00 175.35 178.24 2pnz n LYS 91 N 4.06 1.87 -1.28 4.03 4.81 -1.26 -4.00 118.16 126.38 2pnz n LYS 91 Ca -0.11 0.67 -0.35 0.00 -0.87 0.00 0.00 58.31 57.65 2pnz n LYS 91 Cb 0.52 -2.39 0.09 0.00 0.02 0.00 0.00 35.03 33.27 2pnz n LYS 91 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2pnz n PRO 92 N 2.97 0.39 0.00 1.64 -0.02 -1.26 -4.88 135.00 133.85 2pnz n PRO 92 Ca 0.17 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2pnz n PRO 92 Cb 0.27 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 2pnz n PRO 92 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pnz n GLY 93 N 1.14 2.60 3.79 -1.23 0.00 -1.26 -5.03 105.19 105.19 2pnz n GLY 93 Ca 0.12 -1.83 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 2pnz n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2pnz s PRO 94 N -3.52 1.45 0.26 1.61 0.04 -1.26 -4.96 135.00 128.62 2pnz s PRO 94 Ca 0.00 0.44 0.02 0.00 0.04 0.00 0.00 61.00 61.50 2pnz s PRO 94 Cb 0.00 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 2pnz s PRO 94 CO 0.00 -2.02 0.20 0.16 0.04 0.00 0.00 177.00 175.38 2pnz s ASP 95 N -3.94 0.78 0.15 6.66 3.84 -1.26 -5.03 116.67 117.88 2pnz s ASP 95 Ca 0.63 -1.54 -0.17 0.00 -0.00 0.00 0.00 52.55 51.47 2pnz s ASP 95 Cb -0.15 0.46 0.04 0.00 -1.38 0.00 0.00 42.92 41.89 2pnz s ASP 95 CO 0.54 -0.94 1.75 0.03 -0.00 0.00 0.00 175.17 176.55 2pnz h ARG 96 N 2.41 0.26 -0.15 2.11 3.08 -1.98 -1.30 114.38 118.81 2pnz h ARG 96 Ca -0.31 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 59.76 2pnz h ARG 96 Cb 1.24 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 31.19 2pnz h ARG 96 CO 0.46 0.17 -0.13 -0.09 -1.07 0.00 0.00 179.97 179.32 2pnz h ARG 97 N 0.27 -0.13 0.00 0.04 2.43 -1.99 -1.02 114.38 113.97 2pnz h ARG 97 Ca 0.15 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 2pnz h ARG 97 Cb 0.11 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2pnz h ARG 97 CO -0.14 -0.09 -0.13 0.77 -1.51 0.00 0.00 179.97 178.87 2pnz h SER 98 N -0.14 0.00 0.44 -3.80 0.02 -1.74 -1.55 113.55 106.77 2pnz h SER 98 Ca 0.10 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.74 2pnz h SER 98 Cb 0.28 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.83 2pnz h SER 98 CO -0.23 0.13 -1.47 0.40 -1.14 0.00 0.00 176.83 174.51 2pnz h ILE 99 N 0.00 1.24 -0.22 3.27 2.04 -0.50 -1.28 117.51 122.06 2pnz h ILE 99 Ca -0.00 -2.82 -0.09 0.00 1.00 0.00 0.00 64.86 62.95 2pnz h ILE 99 Cb 0.32 2.86 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 2pnz h ILE 99 CO 0.02 0.84 -0.27 -0.08 0.00 0.00 0.00 178.15 178.66 2pnz h GLU 100 N 0.09 0.41 -0.29 2.37 4.81 -1.02 -2.13 114.58 118.82 2pnz h GLU 100 Ca -0.23 -0.15 -0.08 0.00 -0.13 0.00 0.00 59.36 58.77 2pnz h GLU 100 Cb 2.04 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 31.39 2pnz h GLU 100 CO 0.20 0.65 -0.11 0.82 -0.73 0.00 0.00 179.01 179.83 2pnz h ILE 101 N 0.37 1.29 -0.56 2.32 2.04 -1.25 -0.55 117.51 121.17 2pnz h ILE 101 Ca 0.05 -1.18 0.09 0.00 1.00 0.00 0.00 64.86 64.81 2pnz h ILE 101 Cb 0.66 1.45 -0.07 0.00 -0.74 0.00 0.00 36.82 38.12 2pnz h ILE 101 CO 0.05 0.38 0.19 0.28 0.00 0.00 0.00 178.15 179.05 2pnz h SER 102 N 0.35 0.18 -0.16 1.72 0.02 -1.16 0.59 113.55 115.08 2pnz h SER 102 Ca 0.07 0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2pnz h SER 102 Cb 0.62 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 2pnz h SER 102 CO 0.04 0.12 0.09 0.50 -1.14 0.00 0.00 176.83 176.43 2pnz h LYS 103 N 0.37 0.22 -0.01 3.45 3.64 -0.88 -0.56 116.57 122.81 2pnz h LYS 103 Ca 0.28 -0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.49 2pnz h LYS 103 Cb 0.34 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 2pnz h LYS 103 CO -0.29 0.22 -0.68 -0.24 -2.27 0.00 0.00 179.45 176.18 2pnz h VAL 104 N 0.17 1.48 -0.12 2.00 3.04 -0.85 -1.51 116.25 120.46 2pnz h VAL 104 Ca 0.06 -2.31 -0.21 0.00 -1.01 0.00 0.00 66.70 63.22 2pnz h VAL 104 Cb 0.06 2.24 0.00 0.00 -2.01 0.00 0.00 31.29 31.59 2pnz h VAL 104 CO -0.01 0.66 -0.77 0.40 -1.01 0.00 0.00 177.57 176.84 2pnz h ILE 105 N 0.02 1.31 -0.42 3.17 2.04 -0.78 -0.87 117.51 121.99 2pnz h ILE 105 Ca -0.01 -2.05 0.08 0.00 1.00 0.00 0.00 64.86 63.88 2pnz h ILE 105 Cb 1.21 2.04 -0.07 0.00 -0.74 0.00 0.00 36.82 39.26 2pnz h ILE 105 CO 0.09 0.64 -0.02 0.50 0.00 0.00 0.00 178.15 179.36 2pnz h LYS 106 N 0.44 0.09 0.00 2.37 3.64 -0.92 0.13 116.57 122.32 2pnz h LYS 106 Ca -0.05 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2pnz h LYS 106 Cb 1.38 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 2pnz h LYS 106 CO 0.15 0.06 0.00 0.41 -2.27 0.00 0.00 179.45 177.80 2pnz n GLY 107 N -1.28 -1.28 0.12 5.01 0.00 -0.58 -1.13 105.19 106.05 2pnz n GLY 107 Ca 0.03 0.04 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 2pnz n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pnz h ALA 108 N 2.36 0.42 0.03 4.61 0.00 0.54 -3.39 119.26 123.82 2pnz h ALA 108 Ca 0.00 -1.30 -0.31 0.00 0.00 0.00 0.00 54.91 53.30 2pnz h ALA 108 Cb 0.39 0.53 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 2pnz h ALA 108 CO 0.00 1.28 -1.77 1.28 0.00 0.00 0.00 179.25 180.04 2pnz n LEU 109 N -3.41 1.26 -0.18 0.00 4.77 0.24 -4.48 117.00 115.20 2pnz n LEU 109 Ca -0.24 0.37 -0.02 0.00 -0.03 0.00 0.00 56.01 56.09 2pnz n LEU 109 Cb 1.05 -0.11 0.08 0.00 -2.33 0.00 0.00 43.42 42.11 2pnz n LEU 109 CO 0.46 0.49 0.99 -0.08 -1.33 0.00 0.00 177.39 177.92 2pnz h GLU 110 N 0.02 0.41 0.00 3.23 4.81 -1.32 0.07 114.58 121.80 2pnz h GLU 110 Ca -0.31 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 2pnz h GLU 110 Cb 2.02 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 31.31 2pnz h GLU 110 CO 0.08 0.27 0.00 -1.00 -0.73 0.00 0.00 179.01 177.63 2pnz h PRO 111 N 0.42 0.00 0.00 0.92 0.13 -1.79 -0.99 132.00 130.69 2pnz h PRO 111 Ca 0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.39 2pnz h PRO 111 Cb 0.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.39 2pnz h PRO 111 CO -0.24 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 177.53 2pnz h ALA 112 N 2.10 1.00 -2.67 -0.56 0.00 -1.23 -3.45 119.26 114.45 2pnz h ALA 112 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 2pnz h ALA 112 Cb 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 2pnz h ALA 112 CO 0.00 0.00 -0.27 -0.51 0.00 0.00 0.00 179.25 178.47 2pnz s LEU 113 N -5.77 4.44 -0.97 0.00 1.43 -0.38 -0.08 118.68 117.35 2pnz s LEU 113 Ca 0.07 0.84 -0.15 0.00 -1.03 0.00 0.00 54.13 53.86 2pnz s LEU 113 Cb 0.07 -2.52 0.19 0.00 0.03 0.00 0.00 46.19 43.96 2pnz s LEU 113 CO 0.62 0.33 1.07 -0.63 0.23 0.00 0.00 176.35 177.96 2pnz s ILE 114 N -1.11 5.25 -0.20 -0.59 1.09 -1.08 -4.87 121.20 119.68 2pnz s ILE 114 Ca 0.23 -2.32 0.19 0.00 -1.10 0.00 0.00 60.65 57.66 2pnz s ILE 114 Cb -0.15 -4.68 0.19 0.00 -1.06 0.00 0.00 42.46 36.75 2pnz s ILE 114 CO 0.12 -1.33 1.57 -0.07 -0.10 0.00 0.00 174.94 175.13 2pnz h LEU 115 N 8.91 0.00 -0.19 2.97 3.38 -1.89 -2.74 115.31 125.75 2pnz h LEU 115 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2pnz h LEU 115 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 2pnz h LEU 115 CO 1.00 0.28 0.00 -0.62 0.09 0.00 0.00 178.44 179.20 2pnz n GLU 116 N -3.20 0.05 0.27 1.13 4.71 -1.26 0.12 120.64 122.47 2pnz n GLU 116 Ca 0.02 0.29 0.16 0.00 -0.01 0.00 0.00 57.16 57.62 2pnz n GLU 116 Cb 0.61 -1.60 0.73 0.00 -1.01 0.00 0.00 31.44 30.17 2pnz n GLU 116 CO 0.00 0.00 0.00 0.52 0.09 0.00 0.00 177.13 177.74 2pnz h MET 117 N 0.00 0.00 -2.08 3.49 2.86 -1.74 -3.35 114.93 114.11 2pnz h MET 117 Ca 0.00 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.11 2pnz h MET 117 Cb 0.29 0.00 -0.40 0.00 0.06 0.00 0.00 31.60 31.55 2pnz h MET 117 CO 0.00 0.06 -1.01 1.19 1.06 0.00 0.00 176.91 178.21 2pnz n PHE 118 N -3.23 1.15 -1.70 -0.22 3.01 -0.89 -5.01 117.46 110.57 2pnz n PHE 118 Ca -0.00 -3.83 -0.37 0.00 1.01 0.00 0.00 57.45 54.25 2pnz n PHE 118 Cb 0.28 -0.43 0.06 0.00 -0.01 0.00 0.00 39.48 39.38 2pnz n PHE 118 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 2pnz n PRO 119 N 0.50 1.16 -0.87 -1.08 -0.02 -1.26 -1.71 135.00 131.72 2pnz n PRO 119 Ca 0.26 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2pnz n PRO 119 Cb 0.55 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 2pnz n PRO 119 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2pnz n ARG 120 N -1.54 -0.19 -3.44 -0.52 1.74 -0.40 -4.70 116.66 107.61 2pnz n ARG 120 Ca 0.14 0.05 -0.20 0.00 -0.77 0.00 0.00 57.85 57.08 2pnz n ARG 120 Cb 0.47 -3.33 -0.02 0.00 -1.02 0.00 0.00 32.46 28.56 2pnz n ARG 120 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2pnz s THR 121 N -2.59 3.13 -0.00 0.55 -4.23 -1.10 -3.94 115.64 107.44 2pnz s THR 121 Ca 0.00 -1.20 0.04 0.00 -1.18 0.00 0.00 61.69 59.35 2pnz s THR 121 Cb 0.00 -3.09 -0.03 0.00 1.34 0.00 0.00 72.50 70.71 2pnz s THR 121 CO 0.00 -0.06 -0.11 0.00 -0.54 0.00 0.00 174.62 173.92 2pnz s ALA 122 N -2.36 2.85 -0.25 3.99 0.00 0.38 -0.72 121.76 125.66 2pnz s ALA 122 Ca 0.48 -1.04 -0.07 0.00 0.00 0.00 0.00 51.96 51.33 2pnz s ALA 122 Cb -0.07 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.01 2pnz s ALA 122 CO 0.29 0.59 0.06 0.42 0.00 0.00 0.00 175.76 177.12 2pnz s ILE 123 N -0.92 4.20 -0.27 0.00 1.01 0.21 -0.89 121.20 124.54 2pnz s ILE 123 Ca 0.15 -0.21 -0.06 0.00 0.00 0.00 0.00 60.65 60.54 2pnz s ILE 123 Cb -0.11 -2.96 0.00 0.00 0.01 0.00 0.00 42.46 39.40 2pnz s ILE 123 CO 0.05 0.35 0.04 -1.81 0.00 0.00 0.00 174.94 173.57 2pnz s ASP 124 N 1.60 4.87 -0.30 3.58 -0.00 0.55 -0.69 116.67 126.27 2pnz s ASP 124 Ca 0.06 -0.59 -0.11 0.00 -0.00 0.00 0.00 52.55 51.92 2pnz s ASP 124 Cb -0.15 -1.83 -0.03 0.00 -0.00 0.00 0.00 42.92 40.91 2pnz s ASP 124 CO 0.03 -0.13 0.19 -0.69 -0.00 0.00 0.00 175.17 174.58 2pnz s VAL 125 N 1.49 5.11 -0.16 -1.27 1.01 0.10 -1.17 120.40 125.52 2pnz s VAL 125 Ca 0.04 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 2pnz s VAL 125 Cb -0.16 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 2pnz s VAL 125 CO 0.01 0.13 -0.02 -0.36 0.00 0.00 0.00 175.10 174.86 2pnz s PHE 126 N 1.71 3.07 -0.20 5.22 0.40 0.10 -0.40 117.98 127.89 2pnz s PHE 126 Ca 0.06 -0.23 0.01 0.00 -0.60 0.00 0.00 56.93 56.17 2pnz s PHE 126 Cb -0.17 -1.98 0.04 0.00 0.51 0.00 0.00 43.02 41.42 2pnz s PHE 126 CO 0.10 0.00 -0.14 0.42 0.70 0.00 0.00 175.22 176.30 2pnz s ILE 127 N 0.36 1.83 -0.23 0.64 1.01 0.20 -1.27 121.20 123.74 2pnz s ILE 127 Ca -0.03 -1.03 -0.05 0.00 0.00 0.00 0.00 60.65 59.54 2pnz s ILE 127 Cb -0.14 -1.81 -0.02 0.00 0.01 0.00 0.00 42.46 40.50 2pnz s ILE 127 CO 0.02 0.28 0.00 -1.61 0.00 0.00 0.00 174.94 173.64 2pnz s GLU 128 N 1.33 3.51 -0.41 2.79 0.41 0.55 -0.82 118.70 126.07 2pnz s GLU 128 Ca 0.00 -0.56 -0.21 0.00 -0.41 0.00 0.00 54.97 53.79 2pnz s GLU 128 Cb -0.15 -3.13 0.02 0.00 -1.78 0.00 0.00 34.13 29.08 2pnz s GLU 128 CO -0.09 -0.17 0.69 0.14 -0.49 0.00 0.00 175.26 175.34 2pnz s VAL 129 N 1.46 4.79 0.03 2.63 -7.23 0.82 -0.83 120.40 122.08 2pnz s VAL 129 Ca 0.05 0.39 0.05 0.00 -1.81 0.00 0.00 61.98 60.66 2pnz s VAL 129 Cb -0.15 -4.20 -0.24 0.00 0.56 0.00 0.00 36.38 32.35 2pnz s VAL 129 CO -0.00 -0.54 0.95 -0.07 -0.31 0.00 0.00 175.10 175.13 2pnz h LEU 130 N 9.73 0.15 -7.52 1.32 3.38 -0.95 -1.01 115.31 120.41 2pnz h LEU 130 Ca -0.25 -0.21 -0.15 0.00 0.09 0.00 0.00 57.88 57.35 2pnz h LEU 130 Cb 1.10 -0.05 -0.24 0.00 0.09 0.00 0.00 40.66 41.56 2pnz h LEU 130 CO 0.90 1.17 -0.41 -1.58 0.09 0.00 0.00 178.44 178.61 2pnz s GLN 131 N -2.64 0.38 -0.04 1.13 0.74 -0.58 -3.98 119.66 114.68 2pnz s GLN 131 Ca -0.04 0.15 0.04 0.00 0.05 0.00 0.00 55.36 55.56 2pnz s GLN 131 Cb 0.08 0.18 -0.00 0.00 1.10 0.00 0.00 33.01 34.36 2pnz s GLN 131 CO 0.83 -0.07 -0.16 0.00 -0.55 0.00 0.00 175.29 175.34 2pnz s ALA 132 N -0.33 1.44 -0.33 1.58 0.00 -0.58 -1.36 121.76 122.18 2pnz s ALA 132 Ca -0.04 -0.67 0.14 0.00 0.00 0.00 0.00 51.96 51.39 2pnz s ALA 132 Cb -0.03 -0.46 0.42 0.00 0.00 0.00 0.00 23.12 23.05 2pnz s ALA 132 CO 0.01 0.28 1.47 -3.47 0.00 0.00 0.00 175.76 174.05 2pnz n ASP 133 N 3.06 -1.07 -1.04 0.00 2.03 -1.26 -4.73 116.55 113.55 2pnz n ASP 133 Ca -0.17 -2.22 0.00 0.00 0.52 0.00 0.00 54.79 52.92 2pnz n ASP 133 Cb 0.53 0.54 0.00 0.00 -0.72 0.00 0.00 41.12 41.48 2pnz n ASP 133 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2pnz n ALA 134 N -1.35 -1.74 -1.42 -1.67 0.00 -1.26 -1.67 120.51 111.40 2pnz n ALA 134 Ca -0.13 0.30 -0.01 0.00 0.00 0.00 0.00 53.44 53.60 2pnz n ALA 134 Cb 0.87 -1.10 -0.00 0.00 0.00 0.00 0.00 19.45 19.21 2pnz n ALA 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pnz n GLY 135 N -1.12 0.40 0.24 0.00 0.00 -1.26 -4.78 105.19 98.66 2pnz n GLY 135 Ca 0.00 -0.98 0.10 0.00 0.00 0.00 0.00 46.02 45.14 2pnz n GLY 135 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2pnz h THR 136 N 0.00 0.71 0.15 2.61 1.35 -1.97 -1.22 112.91 114.54 2pnz h THR 136 Ca -0.02 -0.78 -0.20 0.00 -0.55 0.00 0.00 66.41 64.87 2pnz h THR 136 Cb 0.43 1.48 0.02 0.00 -1.73 0.00 0.00 68.15 68.36 2pnz h THR 136 CO 0.02 0.18 -0.89 0.08 -0.25 0.00 0.00 175.52 174.66 2pnz h ARG 137 N 0.00 0.31 -0.10 4.72 0.11 -1.98 0.22 114.38 117.67 2pnz h ARG 137 Ca -0.00 -0.53 0.00 0.00 0.10 0.00 0.00 59.98 59.55 2pnz h ARG 137 Cb 0.47 0.20 -0.01 0.00 1.11 0.00 0.00 29.97 31.74 2pnz h ARG 137 CO 0.02 1.25 0.06 -0.39 0.10 0.00 0.00 179.97 181.02 2pnz h VAL 138 N -0.34 1.02 -0.75 0.08 -1.51 -1.91 0.69 116.25 113.53 2pnz h VAL 138 Ca -0.16 -0.04 0.13 0.00 -1.23 0.00 0.00 66.70 65.40 2pnz h VAL 138 Cb 1.68 0.89 -0.09 0.00 -2.13 0.00 0.00 31.29 31.64 2pnz h VAL 138 CO 0.15 0.02 0.32 0.00 -1.23 0.00 0.00 177.57 176.84 2pnz h ALA 139 N 1.04 1.06 -0.36 5.19 0.00 -1.25 -1.33 119.26 123.60 2pnz h ALA 139 Ca 0.04 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2pnz h ALA 139 Cb -0.01 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2pnz h ALA 139 CO -0.01 -0.16 0.11 0.78 0.00 0.00 0.00 179.25 179.96 2pnz h GLY 140 N 0.49 0.60 0.73 0.00 0.00 -0.17 -1.30 103.07 103.43 2pnz h GLY 140 Ca 0.40 -0.36 0.06 0.00 0.00 0.00 0.00 47.33 47.43 2pnz h GLY 140 CO -0.37 0.33 0.47 -2.22 0.00 0.00 0.00 176.54 174.75 2pnz h ILE 141 N 0.42 1.03 -0.39 2.60 2.04 -0.72 0.35 117.51 122.84 2pnz h ILE 141 Ca 0.11 -0.30 -0.09 0.00 1.00 0.00 0.00 64.86 65.59 2pnz h ILE 141 Cb 0.26 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 2pnz h ILE 141 CO -0.00 0.16 -0.13 0.74 0.00 0.00 0.00 178.15 178.91 2pnz h THR 142 N 0.86 1.26 0.00 -0.27 2.02 -0.60 -0.87 112.91 115.31 2pnz h THR 142 Ca 0.34 -1.17 -0.21 0.00 0.77 0.00 0.00 66.41 66.13 2pnz h THR 142 Cb 0.15 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 2pnz h THR 142 CO -0.16 0.39 -1.04 0.00 0.37 0.00 0.00 175.52 175.07 2pnz h ALA 143 N 1.22 0.41 0.60 6.16 0.00 -0.56 -3.04 119.26 124.05 2pnz h ALA 143 Ca 0.11 -0.94 -0.03 0.00 0.00 0.00 0.00 54.91 54.05 2pnz h ALA 143 Cb 0.59 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.30 2pnz h ALA 143 CO 0.04 1.25 -0.29 0.00 0.00 0.00 0.00 179.25 180.25 2pnz h ALA 144 N 1.03 -0.81 -0.93 0.00 0.00 0.26 0.43 119.26 119.24 2pnz h ALA 144 Ca -0.04 -0.19 0.26 0.00 0.00 0.00 0.00 54.91 54.94 2pnz h ALA 144 Cb 1.77 0.31 -0.16 0.00 0.00 0.00 0.00 17.79 19.71 2pnz h ALA 144 CO 0.12 -0.90 0.14 0.77 0.00 0.00 0.00 179.25 179.38 2pnz h SER 145 N -0.91 -0.24 0.41 0.00 0.02 -1.27 0.51 113.55 112.07 2pnz h SER 145 Ca -0.08 0.24 -0.11 0.00 -0.84 0.00 0.00 61.79 61.00 2pnz h SER 145 Cb 0.65 0.38 -0.01 0.00 0.14 0.00 0.00 62.40 63.56 2pnz h SER 145 CO 0.14 -0.28 -0.50 -0.07 -1.14 0.00 0.00 176.83 174.97 2pnz h LEU 146 N 0.08 0.11 -0.25 5.07 3.38 -1.36 0.71 115.31 123.05 2pnz h LEU 146 Ca 0.59 -0.05 -0.20 0.00 0.09 0.00 0.00 57.88 58.30 2pnz h LEU 146 Cb 1.23 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2pnz h LEU 146 CO -0.80 0.60 -0.90 0.00 0.09 0.00 0.00 178.44 177.43 2pnz h ALA 147 N 1.41 0.50 0.09 1.53 0.00 0.14 0.10 119.26 123.03 2pnz h ALA 147 Ca 0.00 -0.75 -0.00 0.00 0.00 0.00 0.00 54.91 54.16 2pnz h ALA 147 Cb 0.92 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2pnz h ALA 147 CO 0.07 0.95 -0.05 -0.07 0.00 0.00 0.00 179.25 180.16 2pnz h LEU 148 N 0.08 -0.11 -0.71 0.00 3.38 0.38 0.33 115.31 118.66 2pnz h LEU 148 Ca -0.04 -0.24 0.10 0.00 0.09 0.00 0.00 57.88 57.79 2pnz h LEU 148 Cb 1.54 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 42.25 2pnz h LEU 148 CO 0.13 0.18 0.35 0.00 0.09 0.00 0.00 178.44 179.19 2pnz h ALA 149 N 0.47 0.99 -0.41 1.53 0.00 -0.86 -0.79 119.26 120.19 2pnz h ALA 149 Ca -0.01 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2pnz h ALA 149 Cb 0.34 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2pnz h ALA 149 CO 0.02 -0.07 0.27 0.22 0.00 0.00 0.00 179.25 179.70 2pnz h ASP 150 N 0.58 0.28 0.59 0.00 -0.00 -0.47 -1.56 116.42 115.85 2pnz h ASP 150 Ca 0.36 -0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.39 2pnz h ASP 150 Cb 0.40 -0.06 0.00 0.00 -0.00 0.00 0.00 39.33 39.67 2pnz h ASP 150 CO -0.29 0.19 0.00 0.00 -0.00 0.00 0.00 179.24 179.14 2pnz n ALA 151 N -2.52 2.29 -1.31 -0.78 0.00 0.08 -4.59 120.51 113.68 2pnz n ALA 151 Ca 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 53.44 53.36 2pnz n ALA 151 Cb 0.24 -1.43 -0.00 0.00 0.00 0.00 0.00 19.45 18.26 2pnz n ALA 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pnz n GLY 152 N 1.01 0.43 3.66 0.00 0.00 -0.59 -4.82 105.19 104.88 2pnz n GLY 152 Ca 0.11 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 2pnz n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pnz s ILE 153 N -2.05 4.80 0.18 -0.61 1.01 -1.11 -4.99 121.20 118.43 2pnz s ILE 153 Ca 0.00 1.74 -0.33 0.00 0.00 0.00 0.00 60.65 62.07 2pnz s ILE 153 Cb 0.00 -4.19 -0.13 0.00 0.01 0.00 0.00 42.46 38.15 2pnz s ILE 153 CO 0.00 -0.07 1.67 -2.65 0.00 0.00 0.00 174.94 173.89 2pnz n PRO 154 N 5.83 2.50 -4.18 2.79 -0.02 -1.26 -4.61 135.00 136.05 2pnz n PRO 154 Ca 0.07 0.90 -0.18 0.00 -2.02 0.00 0.00 63.50 62.27 2pnz n PRO 154 Cb 0.47 -2.72 -0.12 0.00 -0.02 0.00 0.00 33.50 31.12 2pnz n PRO 154 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2pnz s MET 155 N 1.21 0.81 0.11 -0.52 -1.94 -1.26 -2.65 119.30 115.07 2pnz s MET 155 Ca 0.77 -0.92 0.09 0.00 -1.71 0.00 0.00 55.69 53.92 2pnz s MET 155 Cb -0.58 -0.81 -0.18 0.00 2.01 0.00 0.00 34.83 35.27 2pnz s MET 155 CO 0.35 0.18 1.21 0.00 -0.01 0.00 0.00 175.02 176.75 2pnz h ARG 156 N 4.38 0.00 -3.05 2.03 3.08 -0.80 -3.47 114.38 116.56 2pnz h ARG 156 Ca -0.40 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.62 2pnz h ARG 156 Cb 1.19 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.12 2pnz h ARG 156 CO 0.41 0.86 0.16 0.34 -1.07 0.00 0.00 179.97 180.67 2pnz s ASP 157 N -6.58 -0.51 0.83 7.04 -1.08 -1.26 -5.02 116.67 110.09 2pnz s ASP 157 Ca 0.00 -0.04 -0.11 0.00 -0.52 0.00 0.00 52.55 51.88 2pnz s ASP 157 Cb 0.09 0.57 0.09 0.00 -1.46 0.00 0.00 42.92 42.22 2pnz s ASP 157 CO 0.81 -0.94 1.13 -0.76 0.52 0.00 0.00 175.17 175.94 2pnz s LEU 158 N -2.72 3.01 -0.17 -1.34 1.43 -1.26 -4.78 118.68 112.85 2pnz s LEU 158 Ca 0.01 2.08 -0.03 0.00 -1.03 0.00 0.00 54.13 55.16 2pnz s LEU 158 Cb -0.00 -4.55 -0.02 0.00 0.03 0.00 0.00 46.19 41.64 2pnz s LEU 158 CO -0.12 -2.55 -0.06 -0.69 0.23 0.00 0.00 176.35 173.16 2pnz s VAL 159 N -2.62 3.45 0.18 -1.59 1.01 -1.26 -4.20 120.40 115.37 2pnz s VAL 159 Ca 0.66 -0.50 0.11 0.00 0.00 0.00 0.00 61.98 62.26 2pnz s VAL 159 Cb -0.22 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 2pnz s VAL 159 CO 0.55 0.47 -0.23 0.00 0.00 0.00 0.00 175.10 175.89 2pnz s ALA 160 N 0.80 2.56 0.12 5.51 0.00 0.11 -4.41 121.76 126.46 2pnz s ALA 160 Ca -0.02 -1.61 -0.07 0.00 0.00 0.00 0.00 51.96 50.26 2pnz s ALA 160 Cb -0.15 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 2pnz s ALA 160 CO 0.01 0.45 0.20 0.00 0.00 0.00 0.00 175.76 176.42 2pnz s ALA 161 N -1.61 0.02 0.00 0.00 0.00 -1.26 -0.24 121.76 118.68 2pnz s ALA 161 Ca 0.20 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.31 2pnz s ALA 161 Cb -0.08 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.70 2pnz s ALA 161 CO 0.10 -0.55 0.00 0.00 0.00 0.00 0.00 175.76 175.31 2pnz s ALA 163 N -1.70 3.05 0.49 0.00 0.00 -1.26 -1.37 121.76 120.98 2pnz s ALA 163 Ca 0.00 -1.17 0.03 0.00 0.00 0.00 0.00 51.96 50.81 2pnz s ALA 163 Cb 0.00 -1.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.09 2pnz s ALA 163 CO 0.00 0.65 0.06 0.00 0.00 0.00 0.00 175.76 176.47 2pnz s ALA 164 N -1.20 3.98 0.12 0.00 0.00 0.94 -0.75 121.76 124.85 2pnz s ALA 164 Ca 0.22 -0.85 -0.25 0.00 0.00 0.00 0.00 51.96 51.07 2pnz s ALA 164 Cb -0.11 -0.05 0.08 0.00 0.00 0.00 0.00 23.12 23.03 2pnz s ALA 164 CO 0.14 -0.09 1.06 0.20 0.00 0.00 0.00 175.76 177.07 2pnz s GLY 165 N -3.90 -0.18 -0.17 0.00 0.00 0.12 0.63 107.32 103.82 2pnz s GLY 165 Ca 0.15 0.12 0.01 0.00 0.00 0.00 0.00 44.72 45.00 2pnz s GLY 165 CO 0.08 0.77 -0.18 1.25 0.00 0.00 0.00 173.10 175.03 2pnz s LYS 166 N -2.80 2.70 -0.01 2.90 2.20 -0.61 0.79 119.74 124.91 2pnz s LYS 166 Ca 0.15 -0.72 0.03 0.00 -0.36 0.00 0.00 55.97 55.08 2pnz s LYS 166 Cb -0.00 -2.38 -0.01 0.00 -1.51 0.00 0.00 37.83 33.92 2pnz s LYS 166 CO 0.02 -0.22 -0.11 0.96 -0.36 0.00 0.00 175.35 175.63 2pnz s ILE 167 N 1.37 0.87 -1.55 5.43 -4.36 0.46 0.12 121.20 123.54 2pnz s ILE 167 Ca 0.05 -0.51 -0.03 0.00 -0.26 0.00 0.00 60.65 59.91 2pnz s ILE 167 Cb -0.13 -0.74 0.03 0.00 1.25 0.00 0.00 42.46 42.87 2pnz s ILE 167 CO -0.12 0.22 0.06 -0.62 0.24 0.00 0.00 174.94 174.73 2pnz n GLU 168 N 2.74 -0.92 -0.55 0.37 1.02 -1.26 -0.07 120.64 121.98 2pnz n GLU 168 Ca -0.14 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 2pnz n GLU 168 Cb 0.56 -3.63 0.00 0.00 -0.02 0.00 0.00 31.44 28.35 2pnz n GLU 168 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pnz n GLY 169 N -2.39 1.33 3.20 0.62 0.00 -1.26 -4.99 105.19 101.70 2pnz n GLY 169 Ca -0.27 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 2pnz n GLY 169 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pnz s GLU 170 N -0.22 1.55 -0.22 1.61 2.02 0.91 -5.09 118.70 119.26 2pnz s GLU 170 Ca 0.00 -0.72 -0.29 0.00 0.02 0.00 0.00 54.97 53.98 2pnz s GLU 170 Cb 0.00 -1.51 0.01 0.00 0.10 0.00 0.00 34.13 32.72 2pnz s GLU 170 CO 0.00 0.41 1.08 0.42 0.02 0.00 0.00 175.26 177.19 2pnz s ILE 171 N -0.49 4.61 0.19 -1.63 -1.09 -1.26 -0.40 121.20 121.13 2pnz s ILE 171 Ca 0.07 1.95 0.06 0.00 -2.23 0.00 0.00 60.65 60.50 2pnz s ILE 171 Cb -0.08 -4.26 -0.05 0.00 -1.58 0.00 0.00 42.46 36.50 2pnz s ILE 171 CO -0.00 -0.17 -0.11 0.68 -1.23 0.00 0.00 174.94 174.11 2pnz s VAL 172 N 3.22 1.46 -0.07 2.92 -7.23 0.24 -4.93 120.40 116.00 2pnz s VAL 172 Ca 0.46 -2.13 -0.14 0.00 -1.81 0.00 0.00 61.98 58.36 2pnz s VAL 172 Cb -0.16 -2.03 -0.05 0.00 0.56 0.00 0.00 36.38 34.70 2pnz s VAL 172 CO 0.08 -0.60 0.34 -0.22 -0.31 0.00 0.00 175.10 174.39 2pnz s LEU 173 N -3.27 4.38 -0.79 1.32 2.96 -0.17 0.15 118.68 123.26 2pnz s LEU 173 Ca 0.21 0.75 -0.03 0.00 -0.22 0.00 0.00 54.13 54.84 2pnz s LEU 173 Cb 0.01 -2.46 -0.04 0.00 0.50 0.00 0.00 46.19 44.21 2pnz s LEU 173 CO 0.05 0.24 0.71 -0.67 -1.32 0.00 0.00 176.35 175.36 2pnz n ASP 174 N 2.51 -6.30 -4.51 3.68 4.64 0.07 -4.69 116.55 111.95 2pnz n ASP 174 Ca -0.14 -0.40 -0.46 0.00 -1.38 0.00 0.00 54.79 52.42 2pnz n ASP 174 Cb 0.53 -4.55 -0.02 0.00 -1.04 0.00 0.00 41.12 36.04 2pnz n ASP 174 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 2pnz n LEU 175 N -2.48 0.54 -5.02 -2.67 4.77 -1.26 -4.73 117.00 106.15 2pnz n LEU 175 Ca -0.04 1.14 -0.20 0.00 -0.03 0.00 0.00 56.01 56.88 2pnz n LEU 175 Cb 0.56 -1.15 0.07 0.00 -2.33 0.00 0.00 43.42 40.57 2pnz n LEU 175 CO 0.48 -2.09 0.37 0.54 -1.33 0.00 0.00 177.39 175.36 2pnz s ASN 176 N -0.75 4.99 0.11 -1.43 2.20 -1.26 -4.54 114.94 114.26 2pnz s ASN 176 Ca 0.61 -0.68 -0.27 0.00 -0.94 0.00 0.00 52.86 51.58 2pnz s ASN 176 Cb -0.78 0.10 -0.09 0.00 -2.00 0.00 0.00 41.25 38.49 2pnz s ASN 176 CO 0.58 -1.40 1.64 0.50 -2.94 0.00 0.00 177.10 175.48 2pnz h LYS 177 N 0.06 -0.47 -0.76 3.55 3.64 -1.62 0.16 116.57 121.13 2pnz h LYS 177 Ca -0.33 0.03 0.17 0.00 -1.27 0.00 0.00 60.65 59.26 2pnz h LYS 177 Cb 1.28 0.11 -0.13 0.00 -0.41 0.00 0.00 32.23 33.08 2pnz h LYS 177 CO 0.41 -0.31 0.05 0.93 -2.27 0.00 0.00 179.45 178.26 2pnz h GLU 178 N -0.48 0.13 0.03 1.90 3.07 -1.96 0.83 114.58 118.08 2pnz h GLU 178 Ca 0.03 -0.01 -0.23 0.00 -0.50 0.00 0.00 59.36 58.66 2pnz h GLU 178 Cb 0.51 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.37 2pnz h GLU 178 CO -0.15 0.08 -1.06 0.93 -1.40 0.00 0.00 179.01 177.42 2pnz h GLU 179 N 0.13 0.06 -0.15 2.33 5.08 -1.80 0.12 114.58 120.36 2pnz h GLU 179 Ca 0.42 -0.11 -0.12 0.00 -1.00 0.00 0.00 59.36 58.55 2pnz h GLU 179 Cb 0.75 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.05 2pnz h GLU 179 CO -0.64 1.05 -0.38 0.22 -1.00 0.00 0.00 179.01 178.26 2pnz h ASP 180 N 0.02 0.59 -0.74 1.42 3.58 -0.43 0.05 116.42 120.91 2pnz h ASP 180 Ca -0.04 -0.58 0.11 0.00 0.42 0.00 0.00 57.03 56.94 2pnz h ASP 180 Cb 1.82 -0.17 -0.08 0.00 1.72 0.00 0.00 39.33 42.62 2pnz h ASP 180 CO 0.15 1.07 0.37 0.78 -2.88 0.00 0.00 179.24 178.72 2pnz h ASN 181 N 0.15 0.47 -0.29 2.28 4.21 0.88 -2.76 115.58 120.52 2pnz h ASN 181 Ca -0.01 0.07 0.00 0.00 1.21 0.00 0.00 56.30 57.57 2pnz h ASN 181 Cb 0.99 -0.01 0.00 0.00 -1.12 0.00 0.00 38.32 38.18 2pnz h ASN 181 CO 0.08 0.25 0.00 -1.22 -1.29 0.00 0.00 177.43 175.25 2pnz n TYR 182 N -4.87 0.37 -1.99 1.19 4.01 0.01 -5.00 117.16 110.89 2pnz n TYR 182 Ca 0.12 -0.19 -0.29 0.00 -0.16 0.00 0.00 57.90 57.39 2pnz n TYR 182 Cb 0.31 0.00 0.15 0.00 -0.31 0.00 0.00 39.34 39.49 2pnz n TYR 182 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2pnz s GLY 183 N -1.56 1.72 0.00 2.72 0.00 0.00 -4.77 107.32 105.44 2pnz s GLY 183 Ca 0.36 -1.07 0.16 0.00 0.00 0.00 0.00 44.72 44.16 2pnz s GLY 183 CO 0.30 -0.42 0.68 1.18 0.00 0.00 0.00 173.10 174.84 2pnz n GLU 184 N -3.53 1.84 -3.60 2.90 1.02 0.33 -4.98 120.64 114.62 2pnz n GLU 184 Ca 0.13 -0.08 -0.07 0.00 -0.02 0.00 0.00 57.16 57.12 2pnz n GLU 184 Cb 0.60 -1.24 -0.05 0.00 -0.02 0.00 0.00 31.44 30.73 2pnz n GLU 184 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2pnz s ALA 185 N -2.41 -2.01 -0.02 0.62 0.00 -1.21 -1.77 121.76 114.95 2pnz s ALA 185 Ca 0.07 1.71 0.01 0.00 0.00 0.00 0.00 51.96 53.74 2pnz s ALA 185 Cb 0.12 -1.02 0.02 0.00 0.00 0.00 0.00 23.12 22.24 2pnz s ALA 185 CO 0.62 -0.29 -0.02 0.34 0.00 0.00 0.00 175.76 176.40 2pnz s ASP 186 N -1.10 0.54 -0.44 0.00 3.68 0.32 -1.57 116.67 118.10 2pnz s ASP 186 Ca 0.03 -0.06 0.03 0.00 2.13 0.00 0.00 52.55 54.67 2pnz s ASP 186 Cb -0.01 -0.21 0.15 0.00 -1.45 0.00 0.00 42.92 41.40 2pnz s ASP 186 CO -0.02 -0.04 0.30 -0.69 0.13 0.00 0.00 175.17 174.85 2pnz s VAL 187 N 0.62 0.86 0.50 1.11 1.01 0.20 -1.08 120.40 123.62 2pnz s VAL 187 Ca -0.07 -2.58 -0.19 0.00 0.00 0.00 0.00 61.98 59.14 2pnz s VAL 187 Cb -0.10 -1.60 -0.08 0.00 0.00 0.00 0.00 36.38 34.60 2pnz s VAL 187 CO -0.01 -1.06 1.03 -2.16 0.00 0.00 0.00 175.10 172.90 2pnz s PRO 188 N 0.21 3.77 -0.08 2.72 0.04 -1.20 -0.04 135.00 140.42 2pnz s PRO 188 Ca 0.24 1.28 -0.07 0.00 0.04 0.00 0.00 61.00 62.50 2pnz s PRO 188 Cb -0.11 -2.10 0.02 0.00 0.04 0.00 0.00 34.50 32.36 2pnz s PRO 188 CO -0.09 -0.44 0.20 0.08 0.04 0.00 0.00 177.00 176.79 2pnz s VAL 189 N -2.12 -0.01 0.04 -0.36 1.01 -0.47 -2.35 120.40 116.15 2pnz s VAL 189 Ca 0.66 0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.72 2pnz s VAL 189 Cb -0.15 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.91 2pnz s VAL 189 CO 0.23 0.01 -0.17 0.00 0.00 0.00 0.00 175.10 175.16 2pnz s ALA 190 N 0.24 1.47 0.05 5.51 0.00 -0.26 -1.07 121.76 127.69 2pnz s ALA 190 Ca -0.01 -0.94 -0.00 0.00 0.00 0.00 0.00 51.96 51.00 2pnz s ALA 190 Cb -0.03 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 2pnz s ALA 190 CO -0.01 0.31 -0.04 0.96 0.00 0.00 0.00 175.76 176.98 2pnz s ILE 191 N -0.83 0.26 -0.51 0.00 -0.00 0.67 -0.30 121.20 120.49 2pnz s ILE 191 Ca 0.05 -1.50 -0.19 0.00 -0.00 0.00 0.00 60.65 59.01 2pnz s ILE 191 Cb -0.08 -1.09 0.06 0.00 -0.00 0.00 0.00 42.46 41.35 2pnz s ILE 191 CO 0.02 -0.79 0.64 -0.04 -0.00 0.00 0.00 174.94 174.76 2pnz s MET 192 N -2.99 3.12 0.51 0.37 -1.94 0.10 -0.72 119.30 117.76 2pnz s MET 192 Ca -0.01 -0.90 0.23 0.00 -1.71 0.00 0.00 55.69 53.31 2pnz s MET 192 Cb 0.01 -4.11 1.35 0.00 2.01 0.00 0.00 34.83 34.09 2pnz s MET 192 CO -0.06 -1.24 2.07 -1.35 -0.01 0.00 0.00 175.02 174.43 2pnz h PRO 193 N 9.01 0.00 -0.85 2.03 0.11 -1.86 -0.91 132.00 139.53 2pnz h PRO 193 Ca -0.28 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.83 2pnz h PRO 193 Cb 1.09 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 2pnz h PRO 193 CO 0.97 0.13 0.53 -0.07 -0.21 0.00 0.00 178.00 179.35 2pnz h LEU 194 N 0.00 1.01 -2.15 2.35 3.38 -1.93 -2.81 115.31 115.16 2pnz h LEU 194 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2pnz h LEU 194 Cb 0.29 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2pnz h LEU 194 CO 0.02 0.77 0.00 0.29 0.09 0.00 0.00 178.44 179.61 2pnz n LYS 195 N -4.44 1.78 -3.67 1.13 4.01 -1.15 -4.99 118.16 110.83 2pnz n LYS 195 Ca 0.09 -1.69 -0.23 0.00 -0.51 0.00 0.00 58.31 55.97 2pnz n LYS 195 Cb 0.05 -1.28 0.05 0.00 -0.51 0.00 0.00 35.03 33.34 2pnz n LYS 195 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2pnz n ASN 196 N 0.71 -3.22 -4.63 4.39 3.02 -0.45 -4.93 115.26 110.15 2pnz n ASN 196 Ca 0.10 -0.71 -0.39 0.00 -0.03 0.00 0.00 54.58 53.56 2pnz n ASN 196 Cb 0.39 -4.46 -0.09 0.00 -0.61 0.00 0.00 39.78 35.01 2pnz n ASN 196 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2pnz s ASP 197 N -3.92 6.28 -0.34 6.41 1.01 -0.62 -4.91 116.67 120.59 2pnz s ASP 197 Ca 0.27 0.32 -0.22 0.00 0.71 0.00 0.00 52.55 53.63 2pnz s ASP 197 Cb -0.13 -2.20 0.00 0.00 1.01 0.00 0.00 42.92 41.60 2pnz s ASP 197 CO 0.78 -0.12 0.73 -0.63 0.21 0.00 0.00 175.17 176.14 2pnz s ILE 198 N 1.75 4.81 -0.60 0.77 1.01 -1.26 -0.72 121.20 126.96 2pnz s ILE 198 Ca 0.15 0.88 0.18 0.00 0.00 0.00 0.00 60.65 61.86 2pnz s ILE 198 Cb -0.15 -4.13 -0.23 0.00 0.01 0.00 0.00 42.46 37.95 2pnz s ILE 198 CO 0.09 -0.32 0.66 0.35 0.00 0.00 0.00 174.94 175.72 2pnz n THR 199 N 5.63 0.00 -4.09 2.92 -2.24 0.58 -4.89 114.28 112.19 2pnz n THR 199 Ca 0.02 -0.18 -0.15 0.00 -2.27 0.00 0.00 64.05 61.46 2pnz n THR 199 Cb 0.48 0.71 -0.15 0.00 -2.10 0.00 0.00 70.33 69.28 2pnz n THR 199 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2pnz s LEU 200 N -3.32 1.91 -0.25 3.22 0.20 -0.98 -3.86 118.68 115.60 2pnz s LEU 200 Ca 0.03 -0.07 -0.07 0.00 0.69 0.00 0.00 54.13 54.71 2pnz s LEU 200 Cb 0.13 -0.22 0.12 0.00 -0.43 0.00 0.00 46.19 45.79 2pnz s LEU 200 CO 0.76 0.03 0.51 -0.22 -0.29 0.00 0.00 176.35 177.14 2pnz s LEU 201 N 0.04 -0.89 0.08 -0.68 0.20 -1.26 -1.10 118.68 115.06 2pnz s LEU 201 Ca -0.00 1.08 0.03 0.00 0.69 0.00 0.00 54.13 55.93 2pnz s LEU 201 Cb -0.03 1.73 -0.03 0.00 -0.43 0.00 0.00 46.19 47.42 2pnz s LEU 201 CO -0.00 -0.24 -0.10 -1.10 -0.29 0.00 0.00 176.35 174.62 2pnz s GLN 202 N 2.73 0.75 -0.15 1.98 -0.21 -0.99 -5.04 119.66 118.73 2pnz s GLN 202 Ca 0.01 -1.02 -0.04 0.00 0.02 0.00 0.00 55.36 54.33 2pnz s GLN 202 Cb -0.13 -0.48 0.07 0.00 1.00 0.00 0.00 33.01 33.47 2pnz s GLN 202 CO -0.16 0.08 0.24 1.41 -2.12 0.00 0.00 175.29 174.74 2pnz s MET 203 N -2.36 0.16 -0.17 2.91 1.75 -1.26 -3.27 119.30 117.07 2pnz s MET 203 Ca 0.00 0.56 -0.02 0.00 -1.25 0.00 0.00 55.69 54.98 2pnz s MET 203 Cb -0.05 -0.43 -0.01 0.00 2.84 0.00 0.00 34.83 37.18 2pnz s MET 203 CO 0.00 -0.41 -0.09 0.34 -0.65 0.00 0.00 175.02 174.21 2pnz s ASP 204 N 2.38 4.21 0.00 1.11 -1.08 -0.24 -5.00 116.67 118.05 2pnz s ASP 204 Ca 0.04 -0.33 0.00 0.00 -0.52 0.00 0.00 52.55 51.73 2pnz s ASP 204 Cb -0.13 -1.68 0.00 0.00 -1.46 0.00 0.00 42.92 39.65 2pnz s ASP 204 CO -0.10 0.09 0.00 0.61 0.52 0.00 0.00 175.17 176.29 2pnz n GLY 205 N 4.04 0.56 3.12 2.66 0.00 -1.26 -0.53 105.19 113.79 2pnz n GLY 205 Ca -0.18 -1.85 -0.12 0.00 0.00 0.00 0.00 46.02 43.87 2pnz n GLY 205 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2pnz s TYR 206 N -2.05 -0.49 -0.04 1.61 5.04 -0.73 -4.98 117.35 115.72 2pnz s TYR 206 Ca 0.00 1.07 -0.23 0.00 -2.44 0.00 0.00 57.07 55.47 2pnz s TYR 206 Cb 0.00 0.11 0.05 0.00 0.35 0.00 0.00 41.96 42.47 2pnz s TYR 206 CO 0.00 -0.33 0.50 -0.51 -1.34 0.00 0.00 175.55 173.87 2pnz s LEU 207 N 1.84 0.08 0.82 6.97 1.43 -1.26 -4.67 118.68 123.88 2pnz s LEU 207 Ca -0.05 0.42 -0.12 0.00 -1.03 0.00 0.00 54.13 53.35 2pnz s LEU 207 Cb -0.11 1.92 0.08 0.00 0.03 0.00 0.00 46.19 48.11 2pnz s LEU 207 CO -0.10 -0.52 1.16 0.42 0.23 0.00 0.00 176.35 177.54 2pnz s THR 208 N -1.23 2.18 0.16 5.49 -4.23 -1.26 -4.85 115.64 111.90 2pnz s THR 208 Ca -0.12 0.06 -0.16 0.00 -1.18 0.00 0.00 61.69 60.29 2pnz s THR 208 Cb -0.03 -3.01 0.02 0.00 1.34 0.00 0.00 72.50 70.83 2pnz s THR 208 CO 0.07 -0.08 1.78 0.50 -0.54 0.00 0.00 174.62 176.35 2pnz h LYS 209 N -1.09 0.38 0.00 3.99 3.64 -2.01 0.22 116.57 121.70 2pnz h LYS 209 Ca -0.47 -0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 58.73 2pnz h LYS 209 Cb 1.32 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 33.03 2pnz h LYS 209 CO 0.65 0.25 -0.78 -0.44 -2.27 0.00 0.00 179.45 176.85 2pnz h ASP 210 N 0.39 0.00 -0.36 4.20 3.32 -1.99 -0.21 116.42 121.78 2pnz h ASP 210 Ca 0.16 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.13 2pnz h ASP 210 Cb 0.07 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2pnz h ASP 210 CO -0.12 0.78 -0.07 -0.33 -1.72 0.00 0.00 179.24 177.78 2pnz h GLU 211 N 0.00 0.78 -0.03 3.56 5.08 -1.89 -1.75 114.58 120.32 2pnz h GLU 211 Ca -0.01 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.07 2pnz h GLU 211 Cb 1.40 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.58 2pnz h GLU 211 CO 0.10 0.83 -0.15 0.35 -1.00 0.00 0.00 179.01 179.15 2pnz h PHE 212 N 0.71 0.21 -0.46 4.33 3.04 -0.02 -2.54 116.94 122.21 2pnz h PHE 212 Ca 0.13 -0.09 0.05 0.00 3.98 0.00 0.00 57.97 62.03 2pnz h PHE 212 Cb 0.54 -0.03 -0.04 0.00 2.56 0.00 0.00 35.95 38.98 2pnz h PHE 212 CO 0.03 0.79 0.21 0.82 -2.02 0.00 0.00 178.31 178.14 2pnz h ILE 213 N -0.43 0.93 -0.97 1.41 1.08 -1.10 -1.32 117.51 117.11 2pnz h ILE 213 Ca -0.01 -0.14 0.03 0.00 -0.39 0.00 0.00 64.86 64.35 2pnz h ILE 213 Cb 0.81 0.47 -0.05 0.00 -3.07 0.00 0.00 36.82 34.98 2pnz h ILE 213 CO 0.03 0.08 0.63 -0.33 -0.69 0.00 0.00 178.15 177.87 2pnz h GLU 214 N 0.42 1.20 0.35 2.37 4.39 -1.38 0.64 114.58 122.58 2pnz h GLU 214 Ca 0.21 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.82 2pnz h GLU 214 Cb 0.15 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 28.52 2pnz h GLU 214 CO -0.17 0.80 -0.19 0.00 -1.16 0.00 0.00 179.01 178.29 2pnz h ALA 215 N 1.39 -0.50 -0.10 3.43 0.00 -1.00 0.25 119.26 122.73 2pnz h ALA 215 Ca 0.38 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.23 2pnz h ALA 215 Cb -0.03 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 2pnz h ALA 215 CO -0.11 -0.78 -0.31 0.28 0.00 0.00 0.00 179.25 178.32 2pnz h VAL 216 N -0.50 0.30 -0.35 0.00 2.07 -0.93 0.86 116.25 117.70 2pnz h VAL 216 Ca -0.04 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.54 2pnz h VAL 216 Cb 0.40 0.30 -0.06 0.00 -1.52 0.00 0.00 31.29 30.41 2pnz h VAL 216 CO 0.07 0.00 -0.02 0.11 0.02 0.00 0.00 177.57 177.74 2pnz h LYS 217 N -0.40 0.07 -0.51 1.57 1.57 -0.72 -1.52 116.57 116.62 2pnz h LYS 217 Ca 0.09 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2pnz h LYS 217 Cb 0.54 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 2pnz h LYS 217 CO -0.33 0.04 0.31 1.25 -0.57 0.00 0.00 179.45 180.15 2pnz h LEU 218 N 0.07 0.62 -1.36 2.94 5.85 -0.34 -1.92 115.31 121.17 2pnz h LEU 218 Ca 0.17 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 2pnz h LEU 218 Cb 0.24 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2pnz h LEU 218 CO -0.30 0.49 -0.25 0.00 -0.34 0.00 0.00 178.44 178.03 2pnz h ALA 219 N 1.15 1.16 -0.12 1.25 0.00 -0.59 0.03 119.26 122.15 2pnz h ALA 219 Ca 0.18 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2pnz h ALA 219 Cb -0.01 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2pnz h ALA 219 CO -0.03 0.32 -0.14 0.82 0.00 0.00 0.00 179.25 180.21 2pnz h ILE 220 N 0.00 1.36 -0.71 0.00 2.04 -0.65 0.16 117.51 119.71 2pnz h ILE 220 Ca -0.00 -1.33 0.06 0.00 1.00 0.00 0.00 64.86 64.58 2pnz h ILE 220 Cb 0.63 1.98 -0.04 0.00 -0.74 0.00 0.00 36.82 38.64 2pnz h ILE 220 CO 0.03 0.38 0.47 0.11 0.00 0.00 0.00 178.15 179.14 2pnz h LYS 221 N -0.11 0.74 -0.49 2.37 1.57 -0.65 0.33 116.57 120.32 2pnz h LYS 221 Ca 0.02 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 2pnz h LYS 221 Cb 0.68 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 2pnz h LYS 221 CO 0.03 0.49 0.08 0.78 -0.57 0.00 0.00 179.45 180.26 2pnz h GLY 222 N 0.76 0.87 0.93 3.86 0.00 -0.89 -1.38 103.07 107.23 2pnz h GLY 222 Ca 0.30 -0.58 0.03 0.00 0.00 0.00 0.00 47.33 47.08 2pnz h GLY 222 CO -0.10 0.54 0.65 0.00 0.00 0.00 0.00 176.54 177.63 2pnz h ALA 223 N 0.96 1.35 -0.24 3.60 0.00 0.64 0.13 119.26 125.71 2pnz h ALA 223 Ca 0.15 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2pnz h ALA 223 Cb 0.39 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2pnz h ALA 223 CO 0.01 0.57 -0.04 0.87 0.00 0.00 0.00 179.25 180.66 2pnz h LYS 224 N 1.26 0.44 -0.79 0.00 1.57 -0.29 -0.16 116.57 118.61 2pnz h LYS 224 Ca 0.38 -0.16 0.18 0.00 -1.87 0.00 0.00 60.65 59.18 2pnz h LYS 224 Cb -0.03 -0.03 -0.12 0.00 0.08 0.00 0.00 32.23 32.13 2pnz h LYS 224 CO -0.11 0.66 0.23 0.00 -0.57 0.00 0.00 179.45 179.65 2pnz h ALA 225 N 0.77 1.09 -0.39 3.86 0.00 -1.15 -2.11 119.26 121.34 2pnz h ALA 225 Ca 0.06 0.17 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 2pnz h ALA 225 Cb 0.48 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2pnz h ALA 225 CO 0.02 -0.35 -0.26 0.28 0.00 0.00 0.00 179.25 178.94 2pnz h VAL 226 N 0.29 1.27 -0.66 0.00 2.07 -0.37 -2.82 116.25 116.04 2pnz h VAL 226 Ca 0.46 -1.40 0.04 0.00 0.82 0.00 0.00 66.70 66.62 2pnz h VAL 226 Cb 0.83 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 2pnz h VAL 226 CO -0.53 0.47 0.43 0.22 0.02 0.00 0.00 177.57 178.18 2pnz h TYR 227 N 0.70 0.74 -0.33 1.57 3.20 -0.77 0.20 116.97 122.28 2pnz h TYR 227 Ca 0.09 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.84 2pnz h TYR 227 Cb 0.80 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 2pnz h TYR 227 CO 0.04 0.42 -0.33 1.96 -1.64 0.00 0.00 178.16 178.62 2pnz h GLN 228 N 0.76 0.73 -0.67 1.82 1.08 -1.14 -1.35 115.11 116.35 2pnz h GLN 228 Ca 0.27 -0.34 -0.01 0.00 -1.45 0.00 0.00 58.65 57.11 2pnz h GLN 228 Cb 0.11 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.50 2pnz h GLN 228 CO -0.08 0.95 0.36 0.87 -0.95 0.00 0.00 178.83 179.99 2pnz h LYS 229 N 0.62 0.94 -0.40 1.46 1.57 -1.01 -2.33 116.57 117.41 2pnz h LYS 229 Ca 0.07 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2pnz h LYS 229 Cb 0.85 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.95 2pnz h LYS 229 CO 0.07 0.71 0.23 1.96 -0.57 0.00 0.00 179.45 181.85 2pnz h GLN 230 N 0.91 0.45 -0.28 3.15 4.20 0.02 -0.64 115.11 122.92 2pnz h GLN 230 Ca 0.23 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.85 2pnz h GLN 230 Cb 0.05 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 2pnz h GLN 230 CO -0.04 0.30 -0.10 0.00 -0.67 0.00 0.00 178.83 178.32 2pnz h ARG 231 N 0.46 0.47 -0.16 1.46 3.08 -1.15 -1.94 114.38 116.59 2pnz h ARG 231 Ca 0.16 -0.12 -0.16 0.00 0.07 0.00 0.00 59.98 59.93 2pnz h ARG 231 Cb 0.02 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2pnz h ARG 231 CO -0.08 0.57 -0.58 1.49 -1.07 0.00 0.00 179.97 180.30 2pnz h GLU 232 N 0.44 0.52 -0.16 0.04 4.57 -0.82 0.48 114.58 119.65 2pnz h GLU 232 Ca 0.09 -0.34 -0.07 0.00 -1.18 0.00 0.00 59.36 57.85 2pnz h GLU 232 Cb 0.44 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 2pnz h GLU 232 CO 0.02 0.95 -0.22 0.00 -1.18 0.00 0.00 179.01 178.59 2pnz h ALA 233 N 0.98 1.34 0.01 2.92 0.00 -0.66 -0.02 119.26 123.82 2pnz h ALA 233 Ca 0.00 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 2pnz h ALA 233 Cb 1.12 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.83 2pnz h ALA 233 CO 0.11 0.45 -0.42 -0.07 0.00 0.00 0.00 179.25 179.32 2pnz h LEU 234 N 0.26 0.34 -0.24 0.00 3.38 -0.79 -2.67 115.31 115.58 2pnz h LEU 234 Ca 0.04 -0.80 0.05 0.00 0.09 0.00 0.00 57.88 57.26 2pnz h LEU 234 Cb 0.53 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.10 2pnz h LEU 234 CO 0.04 1.10 -0.49 0.50 0.09 0.00 0.00 178.44 179.68 2pnz h LYS 235 N -0.38 -0.45 -0.67 1.13 3.64 0.06 0.26 116.57 120.15 2pnz h LYS 235 Ca -0.06 0.03 0.14 0.00 -1.27 0.00 0.00 60.65 59.49 2pnz h LYS 235 Cb 1.18 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 33.06 2pnz h LYS 235 CO 0.08 -0.30 0.45 1.49 -2.27 0.00 0.00 179.45 178.90 2pnz h GLU 236 N -0.47 0.32 -0.24 1.90 4.57 -1.11 0.20 114.58 119.75 2pnz h GLU 236 Ca 0.08 -0.02 -0.18 0.00 -1.18 0.00 0.00 59.36 58.06 2pnz h GLU 236 Cb 0.63 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.15 2pnz h GLU 236 CO -0.49 0.21 -0.55 -0.22 -1.18 0.00 0.00 179.01 176.78 2pnz h LYS 237 N 0.33 0.74 0.00 1.92 3.64 -0.75 -1.83 116.57 120.62 2pnz h LYS 237 Ca 0.32 -0.47 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2pnz h LYS 237 Cb 0.80 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 2pnz h LYS 237 CO -0.08 1.09 0.00 0.66 -2.27 0.00 0.00 179.45 178.85 2pnz n TYR 238 N -3.98 0.00 -0.12 1.91 0.53 0.74 -0.77 117.16 115.47 2pnz n TYR 238 Ca -0.04 0.00 -0.19 0.00 -1.02 0.00 0.00 57.90 56.65 2pnz n TYR 238 Cb 0.62 -0.08 -0.12 0.00 -1.03 0.00 0.00 39.34 38.73 2pnz n TYR 238 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 2pnz n LEU 239 N -1.08 2.85 -0.28 7.72 4.77 -0.10 -4.06 117.00 126.82 2pnz n LEU 239 Ca 0.20 -0.06 -0.04 0.00 -0.03 0.00 0.00 56.01 56.08 2pnz n LEU 239 Cb 0.14 -0.92 0.11 0.00 -2.33 0.00 0.00 43.42 40.41 2pnz n LEU 239 CO 0.18 0.89 1.10 0.50 -1.33 0.00 0.00 177.39 178.74 2pnz h LYS 240 N -0.09 1.15 -0.55 3.23 3.64 -1.01 -2.42 116.57 120.51 2pnz h LYS 240 Ca -0.57 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 58.60 2pnz h LYS 240 Cb 1.88 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 33.48 2pnz h LYS 240 CO -0.10 0.89 0.22 -0.84 -2.27 0.00 0.00 179.45 177.35 2pnz h ILE 241 N 1.13 1.22 0.00 2.00 -0.00 -1.18 -3.32 117.51 117.37 2pnz h ILE 241 Ca 0.27 -0.70 0.00 0.00 -0.00 0.00 0.00 64.86 64.43 2pnz h ILE 241 Cb 0.13 0.65 0.00 0.00 -0.00 0.00 0.00 36.82 37.60 2pnz h ILE 241 CO -0.03 0.27 0.00 0.00 -0.00 0.00 0.00 178.15 178.39 2pnz n ALA 242 N -2.36 1.63 -3.50 0.16 0.00 -0.91 -4.10 120.51 111.44 2pnz n ALA 242 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.24 2pnz n ALA 242 Cb 0.16 -1.84 -0.13 0.00 0.00 0.00 0.00 19.45 17.65 2pnz n ALA 242 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2pnz s GLN 243 N 1.78 0.21 0.00 0.00 -0.21 -1.25 -5.04 119.66 115.15 2pnz s GLN 243 Ca 0.00 -0.17 0.25 0.00 0.02 0.00 0.00 55.36 55.46 2pnz s GLN 243 Cb 0.00 -1.12 0.40 0.00 1.00 0.00 0.00 33.01 33.29 2pnz s GLN 243 CO 0.00 -0.88 1.38 0.39 -2.12 0.00 0.00 175.29 174.05