#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ave s SER 5 N 8.54 4.41 0.50 0.00 0.15 -1.26 -4.82 113.70 121.22 1ave s SER 5 Ca 1.06 -0.57 0.17 0.00 0.70 0.00 0.00 55.95 57.31 1ave s SER 5 Cb -0.58 -1.74 1.22 0.00 -1.71 0.00 0.00 66.02 63.21 1ave s SER 5 CO 0.40 -0.07 2.07 -0.07 1.20 0.00 0.00 173.24 176.77 1ave h LEU 6 N 8.10 0.11 -9.35 3.45 -0.00 -1.95 -3.43 115.31 112.25 1ave h LEU 6 Ca -0.38 -0.00 -0.65 0.00 -0.00 0.00 0.00 57.88 56.85 1ave h LEU 6 Cb 1.14 -0.02 0.06 0.00 -0.00 0.00 0.00 40.66 41.84 1ave h LEU 6 CO 0.60 0.07 0.51 0.41 -0.00 0.00 0.00 178.44 180.03 1ave n THR 7 N -4.48 0.18 0.00 0.22 -1.04 -1.26 -4.71 114.28 103.19 1ave n THR 7 Ca 0.03 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1ave n THR 7 Cb 0.26 -1.01 0.00 0.00 -1.82 0.00 0.00 70.33 67.76 1ave n THR 7 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ave n GLY 8 N 2.62 0.59 3.09 3.41 0.00 0.66 -4.96 105.19 110.60 1ave n GLY 8 Ca 0.17 -1.88 -0.27 0.00 0.00 0.00 0.00 46.02 44.04 1ave n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ave s LYS 9 N -1.06 2.12 0.20 1.61 1.02 -1.26 0.11 119.74 122.48 1ave s LYS 9 Ca 0.00 -0.57 0.07 0.00 0.02 0.00 0.00 55.97 55.49 1ave s LYS 9 Cb 0.00 -1.69 -0.05 0.00 -0.52 0.00 0.00 37.83 35.57 1ave s LYS 9 CO 0.00 0.09 -0.13 -1.58 -0.92 0.00 0.00 175.35 172.81 1ave s TRP 10 N 0.52 1.65 0.17 3.18 0.52 0.19 -2.92 118.94 122.25 1ave s TRP 10 Ca -0.15 -0.62 0.05 0.00 0.02 0.00 0.00 56.10 55.39 1ave s TRP 10 Cb -0.16 -0.80 -0.05 0.00 -1.15 0.00 0.00 33.47 31.32 1ave s TRP 10 CO 0.05 0.30 -0.09 -0.08 0.02 0.00 0.00 176.95 177.15 1ave s THR 11 N -3.05 1.24 0.45 2.01 -1.32 0.66 -0.54 115.64 115.10 1ave s THR 11 Ca 0.22 -2.08 0.07 0.00 -1.21 0.00 0.00 61.69 58.69 1ave s THR 11 Cb 0.00 -1.96 -0.01 0.00 -1.51 0.00 0.00 72.50 69.02 1ave s THR 11 CO 0.06 -0.65 0.34 0.20 -2.21 0.00 0.00 174.62 172.36 1ave s ASN 12 N -3.22 4.77 0.48 8.08 -0.87 0.37 -0.95 114.94 123.61 1ave s ASN 12 Ca 0.19 -0.97 0.27 0.00 -1.57 0.00 0.00 52.86 50.79 1ave s ASN 12 Cb 0.03 -0.27 0.79 0.00 -0.02 0.00 0.00 41.25 41.77 1ave s ASN 12 CO 0.03 -0.76 1.77 -2.24 -2.57 0.00 0.00 177.10 173.33 1ave h ASP 13 N 1.04 0.00 -0.02 -1.22 2.03 -1.78 0.04 116.42 116.51 1ave h ASP 13 Ca -0.40 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.90 1ave h ASP 13 Cb 1.27 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.77 1ave h ASP 13 CO 0.60 0.02 -0.01 0.18 -1.03 0.00 0.00 179.24 179.00 1ave n LEU 14 N -3.11 2.57 0.00 0.15 4.77 -1.26 -4.89 117.00 115.23 1ave n LEU 14 Ca 0.02 -0.86 0.00 0.00 -0.03 0.00 0.00 56.01 55.15 1ave n LEU 14 Cb 0.44 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1ave n LEU 14 CO 0.31 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 1ave n GLY 15 N 1.30 0.80 3.82 -0.72 0.00 0.00 -4.76 105.19 105.64 1ave n GLY 15 Ca 0.15 -0.24 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 1ave n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ave s SER 16 N -2.21 6.85 0.15 1.61 0.01 -1.26 -4.55 113.70 114.30 1ave s SER 16 Ca 0.00 1.73 0.11 0.00 1.31 0.00 0.00 55.95 59.10 1ave s SER 16 Cb 0.00 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 1ave s SER 16 CO 0.00 -0.42 -0.25 0.20 0.41 0.00 0.00 173.24 173.18 1ave s ASN 17 N -2.13 3.23 -0.14 2.44 0.01 -0.29 -0.48 114.94 117.58 1ave s ASN 17 Ca 0.63 -0.78 -0.12 0.00 -0.71 0.00 0.00 52.86 51.88 1ave s ASN 17 Cb -0.10 -0.22 0.04 0.00 0.41 0.00 0.00 41.25 41.38 1ave s ASN 17 CO 0.14 0.14 0.36 0.00 -1.51 0.00 0.00 177.10 176.23 1ave s MET 18 N -2.26 0.40 -0.16 -0.60 0.23 0.30 -0.75 119.30 116.47 1ave s MET 18 Ca 0.15 0.55 0.01 0.00 -1.03 0.00 0.00 55.69 55.37 1ave s MET 18 Cb -0.09 0.15 0.01 0.00 -1.53 0.00 0.00 34.83 33.36 1ave s MET 18 CO 0.07 -0.07 -0.18 0.99 -2.03 0.00 0.00 175.02 173.79 1ave s THR 19 N 0.44 2.33 -0.17 3.16 2.01 0.20 -0.64 115.64 122.98 1ave s THR 19 Ca -0.02 -0.88 0.01 0.00 0.31 0.00 0.00 61.69 61.11 1ave s THR 19 Cb -0.04 -1.97 0.01 0.00 0.01 0.00 0.00 72.50 70.51 1ave s THR 19 CO -0.02 0.53 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.63 1ave s ILE 20 N 0.96 2.31 0.00 1.82 1.01 0.29 0.13 121.20 127.72 1ave s ILE 20 Ca -0.03 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 59.75 1ave s ILE 20 Cb -0.15 -1.97 0.00 0.00 0.01 0.00 0.00 42.46 40.35 1ave s ILE 20 CO -0.04 0.53 0.00 0.61 0.00 0.00 0.00 174.94 176.04 1ave n GLY 21 N 4.36 -2.56 3.76 6.18 0.00 0.22 -0.24 105.19 116.90 1ave n GLY 21 Ca -0.20 -0.85 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 1ave n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ave s ALA 22 N -2.20 3.52 0.33 4.61 0.00 -1.26 -4.15 121.76 122.60 1ave s ALA 22 Ca 0.00 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.06 1ave s ALA 22 Cb 0.00 -1.51 -0.03 0.00 0.00 0.00 0.00 23.12 21.58 1ave s ALA 22 CO 0.00 0.69 0.51 0.08 0.00 0.00 0.00 175.76 177.05 1ave s VAL 23 N -1.21 5.13 0.00 0.00 1.01 -1.24 -4.42 120.40 119.67 1ave s VAL 23 Ca 0.23 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.67 1ave s VAL 23 Cb -0.12 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.40 1ave s VAL 23 CO 0.15 -0.51 0.00 0.59 0.00 0.00 0.00 175.10 175.32 1ave n ASN 24 N -1.70 0.85 0.02 3.32 5.03 -0.70 -4.86 115.26 117.22 1ave n ASN 24 Ca -0.05 -0.90 -0.08 0.00 0.87 0.00 0.00 54.58 54.42 1ave n ASN 24 Cb 0.56 0.00 0.08 0.00 -1.02 0.00 0.00 39.78 39.41 1ave n ASN 24 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1ave h SER 25 N 0.00 0.53 -0.08 6.41 0.02 -2.00 -1.15 113.55 117.28 1ave h SER 25 Ca 0.00 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1ave h SER 25 Cb 0.00 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1ave h SER 25 CO 0.00 0.96 0.00 0.54 -1.14 0.00 0.00 176.83 177.19 1ave n ARG 26 N -3.96 1.33 -1.52 3.45 3.00 -1.26 -4.91 116.66 112.79 1ave n ARG 26 Ca -0.03 -0.50 -0.13 0.00 -0.01 0.00 0.00 57.85 57.18 1ave n ARG 26 Cb 0.58 -1.32 -0.05 0.00 0.00 0.00 0.00 32.46 31.67 1ave n ARG 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ave n GLY 27 N 0.93 1.14 3.87 -0.13 0.00 -0.44 -4.73 105.19 105.84 1ave n GLY 27 Ca 0.14 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 1ave n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ave s GLU 28 N -3.36 3.70 0.15 1.61 2.02 -1.26 0.64 118.70 122.20 1ave s GLU 28 Ca 0.00 0.58 -0.25 0.00 0.02 0.00 0.00 54.97 55.33 1ave s GLU 28 Cb 0.00 -2.25 0.06 0.00 0.10 0.00 0.00 34.13 32.05 1ave s GLU 28 CO 0.00 -0.28 0.87 -0.59 0.02 0.00 0.00 175.26 175.28 1ave s PHE 29 N -2.75 -0.22 0.26 1.61 -0.12 -1.26 -1.72 117.98 113.78 1ave s PHE 29 Ca 0.53 -0.08 -0.14 0.00 -0.05 0.00 0.00 56.93 57.19 1ave s PHE 29 Cb -0.10 0.63 -0.00 0.00 -0.63 0.00 0.00 43.02 42.91 1ave s PHE 29 CO 0.41 -0.86 0.51 0.95 -0.05 0.00 0.00 175.22 176.19 1ave s THR 30 N -3.42 0.00 -1.74 -4.49 -4.23 -1.26 -2.31 115.64 98.19 1ave s THR 30 Ca 0.10 -1.35 0.00 0.00 -1.18 0.00 0.00 61.69 59.25 1ave s THR 30 Cb -0.02 -2.20 0.00 0.00 1.34 0.00 0.00 72.50 71.62 1ave s THR 30 CO -0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1ave n GLY 31 N -0.40 -0.75 3.05 3.99 0.00 -1.03 0.73 105.19 110.78 1ave n GLY 31 Ca -0.02 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 1ave n GLY 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ave s THR 32 N -3.00 0.28 -0.05 2.61 -4.23 0.34 -2.69 115.64 108.90 1ave s THR 32 Ca 0.00 -1.38 0.04 0.00 -1.18 0.00 0.00 61.69 59.18 1ave s THR 32 Cb 0.00 -0.93 -0.00 0.00 1.34 0.00 0.00 72.50 72.91 1ave s THR 32 CO 0.00 -0.71 -0.19 -0.47 -0.54 0.00 0.00 174.62 172.72 1ave s TYR 33 N -2.58 1.88 -0.30 3.99 6.14 0.26 0.58 117.35 127.32 1ave s TYR 33 Ca -0.04 -0.57 0.02 0.00 0.64 0.00 0.00 57.07 57.12 1ave s TYR 33 Cb -0.02 -1.26 0.09 0.00 0.42 0.00 0.00 41.96 41.19 1ave s TYR 33 CO -0.04 -0.20 0.03 0.99 0.64 0.00 0.00 175.55 176.97 1ave s THR 34 N 0.05 1.70 0.03 4.34 2.01 0.07 -0.94 115.64 122.90 1ave s THR 34 Ca -0.05 -1.78 -0.26 0.00 0.31 0.00 0.00 61.69 59.91 1ave s THR 34 Cb -0.12 -2.17 -0.05 0.00 0.01 0.00 0.00 72.50 70.17 1ave s THR 34 CO 0.03 -0.47 0.82 0.28 -0.69 0.00 0.00 174.62 174.58 1ave s THR 35 N 1.23 4.77 0.30 -0.82 -1.32 -1.26 -1.14 115.64 117.40 1ave s THR 35 Ca 0.06 1.74 0.04 0.00 -1.21 0.00 0.00 61.69 62.31 1ave s THR 35 Cb -0.19 -4.17 0.09 0.00 -1.51 0.00 0.00 72.50 66.72 1ave s THR 35 CO -0.12 0.30 1.76 0.00 -2.21 0.00 0.00 174.62 174.35 1ave h ALA 36 N 6.03 1.18 -2.31 11.08 0.00 -1.86 -3.45 119.26 129.93 1ave h ALA 36 Ca -0.43 -0.32 -0.43 0.00 0.00 0.00 0.00 54.91 53.74 1ave h ALA 36 Cb 1.21 -0.12 -0.15 0.00 0.00 0.00 0.00 17.79 18.73 1ave h ALA 36 CO 0.72 0.52 -0.73 0.14 0.00 0.00 0.00 179.25 179.90 1ave s VAL 37 N -4.54 1.61 0.07 0.00 -7.23 -1.26 -5.04 120.40 104.02 1ave s VAL 37 Ca -0.06 -2.13 -0.02 0.00 -1.81 0.00 0.00 61.98 57.96 1ave s VAL 37 Cb 0.14 -1.96 -0.04 0.00 0.56 0.00 0.00 36.38 35.09 1ave s VAL 37 CO 0.78 -0.59 0.01 0.42 -0.31 0.00 0.00 175.10 175.40 1ave s THR 38 N -2.92 0.19 -1.15 5.32 -4.23 -1.26 -5.03 115.64 106.55 1ave s THR 38 Ca 0.20 -1.78 0.13 0.00 -1.18 0.00 0.00 61.69 59.06 1ave s THR 38 Cb -0.01 -1.62 -0.01 0.00 1.34 0.00 0.00 72.50 72.20 1ave s THR 38 CO 0.05 -0.85 0.73 0.00 -0.54 0.00 0.00 174.62 174.02 1ave n ALA 39 N 0.05 3.04 -2.66 3.99 0.00 -1.26 -4.95 120.51 118.71 1ave n ALA 39 Ca -0.12 -0.48 -0.32 0.00 0.00 0.00 0.00 53.44 52.52 1ave n ALA 39 Cb 0.62 -0.46 -0.09 0.00 0.00 0.00 0.00 19.45 19.52 1ave n ALA 39 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ave s THR 40 N -1.65 4.04 -1.02 0.00 2.01 -1.26 -5.04 115.64 112.71 1ave s THR 40 Ca 0.10 -0.67 -0.23 0.00 0.31 0.00 0.00 61.69 61.21 1ave s THR 40 Cb 0.10 -2.80 0.05 0.00 0.01 0.00 0.00 72.50 69.86 1ave s THR 40 CO 0.34 0.36 1.44 -0.94 -0.69 0.00 0.00 174.62 175.13 1ave s SER 41 N -1.59 6.52 -0.30 3.53 1.04 -1.26 -4.86 113.70 116.78 1ave s SER 41 Ca 0.20 -1.51 -0.16 0.00 0.48 0.00 0.00 55.95 54.96 1ave s SER 41 Cb -0.11 -2.56 0.18 0.00 0.10 0.00 0.00 66.02 63.62 1ave s SER 41 CO 0.10 -1.48 1.15 0.21 0.98 0.00 0.00 173.24 174.20 1ave s ASN 42 N 4.89 -0.27 -0.32 7.02 3.04 -1.26 -5.11 114.94 122.94 1ave s ASN 42 Ca 0.46 0.20 -0.12 0.00 0.04 0.00 0.00 52.86 53.44 1ave s ASN 42 Cb -0.00 1.24 -0.07 0.00 -1.54 0.00 0.00 41.25 40.87 1ave s ASN 42 CO -0.09 -0.05 0.91 1.21 -3.04 0.00 0.00 177.10 176.03 1ave n GLU 43 N 5.34 0.00 -1.57 0.43 2.13 -1.26 -4.85 120.64 120.85 1ave n GLU 43 Ca -0.08 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.32 1ave n GLU 43 Cb 0.54 -0.53 0.01 0.00 0.27 0.00 0.00 31.44 31.73 1ave n GLU 43 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1ave n ILE 44 N 2.56 2.23 -4.14 6.31 5.41 -1.26 -4.87 119.36 125.60 1ave n ILE 44 Ca 0.22 -0.50 -0.09 0.00 1.00 0.00 0.00 62.75 63.38 1ave n ILE 44 Cb 0.01 -0.97 -0.10 0.00 -0.71 0.00 0.00 39.64 37.86 1ave n ILE 44 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1ave s LYS 45 N -1.83 0.86 0.06 0.38 1.02 -1.26 -5.09 119.74 113.88 1ave s LYS 45 Ca 0.63 -1.39 -0.30 0.00 0.02 0.00 0.00 55.97 54.93 1ave s LYS 45 Cb -0.60 0.19 -0.05 0.00 -0.52 0.00 0.00 37.83 36.85 1ave s LYS 45 CO 0.57 -0.21 1.12 -2.00 -0.92 0.00 0.00 175.35 173.92 1ave s GLU 46 N -4.00 4.50 0.14 1.68 2.12 -1.26 -4.65 118.70 117.23 1ave s GLU 46 Ca 0.19 1.66 0.05 0.00 0.36 0.00 0.00 54.97 57.23 1ave s GLU 46 Cb 0.07 -3.37 -0.04 0.00 0.26 0.00 0.00 34.13 31.06 1ave s GLU 46 CO -0.01 -0.14 -0.11 -1.12 -0.54 0.00 0.00 175.26 173.34 1ave s SER 47 N 0.83 1.82 0.48 -1.70 0.01 -0.12 -4.75 113.70 110.28 1ave s SER 47 Ca 0.55 -0.94 -0.17 0.00 1.31 0.00 0.00 55.95 56.70 1ave s SER 47 Cb -0.27 -0.03 -0.09 0.00 0.21 0.00 0.00 66.02 65.85 1ave s SER 47 CO 0.30 -0.28 0.95 -2.16 0.41 0.00 0.00 173.24 172.46 1ave s PRO 48 N -3.39 4.00 0.04 12.44 0.04 -1.26 0.90 135.00 147.77 1ave s PRO 48 Ca 0.14 0.94 0.01 0.00 0.04 0.00 0.00 61.00 62.13 1ave s PRO 48 Cb 0.00 -2.18 -0.02 0.00 0.04 0.00 0.00 34.50 32.34 1ave s PRO 48 CO 0.01 -0.18 -0.05 -0.48 0.04 0.00 0.00 177.00 176.34 1ave s LEU 49 N -3.80 2.28 -0.05 -3.56 0.05 -1.10 -1.72 118.68 110.79 1ave s LEU 49 Ca 0.59 -0.58 -0.00 0.00 0.05 0.00 0.00 54.13 54.18 1ave s LEU 49 Cb -0.10 -0.01 0.03 0.00 -2.05 0.00 0.00 46.19 44.06 1ave s LEU 49 CO 0.26 -0.29 -0.00 -2.28 -0.55 0.00 0.00 176.35 173.49 1ave s HIS 50 N -1.73 0.51 0.00 3.48 2.46 -0.85 -2.48 115.29 116.69 1ave s HIS 50 Ca -0.10 -0.08 0.00 0.00 0.47 0.00 0.00 55.06 55.34 1ave s HIS 50 Cb -0.08 -0.61 0.00 0.00 -0.13 0.00 0.00 32.58 31.76 1ave s HIS 50 CO -0.01 -0.22 0.00 0.41 -2.47 0.00 0.00 174.74 172.45 1ave n GLY 51 N 4.59 5.35 3.64 1.59 0.00 -0.98 -1.49 105.19 117.89 1ave n GLY 51 Ca -0.17 -1.41 -0.03 0.00 0.00 0.00 0.00 46.02 44.41 1ave n GLY 51 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ave s THR 52 N 1.28 0.00 -0.03 2.61 -1.32 -1.09 -4.27 115.64 112.82 1ave s THR 52 Ca 0.00 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.47 1ave s THR 52 Cb 0.00 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 70.02 1ave s THR 52 CO 0.00 0.00 0.05 -0.70 -2.21 0.00 0.00 174.62 171.76 1ave s GLU 53 N -0.61 -0.06 0.31 7.08 2.12 0.21 -2.59 118.70 125.16 1ave s GLU 53 Ca 0.08 0.30 -0.29 0.00 0.36 0.00 0.00 54.97 55.42 1ave s GLU 53 Cb -0.02 -0.39 -0.12 0.00 0.26 0.00 0.00 34.13 33.85 1ave s GLU 53 CO -0.10 -0.26 1.40 -1.71 -0.54 0.00 0.00 175.26 174.04 1ave n ASN 54 N 4.81 3.08 -0.05 -1.70 5.15 -1.17 -4.32 115.26 121.05 1ave n ASN 54 Ca -0.14 1.18 -0.19 0.00 -0.60 0.00 0.00 54.58 54.83 1ave n ASN 54 Cb 0.50 -1.51 -0.13 0.00 -0.53 0.00 0.00 39.78 38.11 1ave n ASN 54 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1ave n THR 55 N 1.07 1.65 -1.43 -0.44 -2.24 -1.26 -4.78 114.28 106.84 1ave n THR 55 Ca 0.07 -0.63 -0.41 0.00 -2.27 0.00 0.00 64.05 60.81 1ave n THR 55 Cb 0.35 -1.54 0.01 0.00 -2.10 0.00 0.00 70.33 67.06 1ave n THR 55 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1ave n ILE 56 N -3.35 1.61 -1.52 2.28 -0.00 -1.26 -4.73 119.36 112.39 1ave n ILE 56 Ca -0.37 -0.50 -0.23 0.00 -0.00 0.00 0.00 62.75 61.65 1ave n ILE 56 Cb 1.03 -0.48 -0.16 0.00 -0.00 0.00 0.00 39.64 40.03 1ave n ILE 56 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 1ave n ASN 57 N 1.31 -0.04 -0.04 4.38 5.03 -1.26 -3.74 115.26 120.91 1ave n ASN 57 Ca 0.11 -0.72 0.00 0.00 0.87 0.00 0.00 54.58 54.84 1ave n ASN 57 Cb 0.42 -0.98 0.00 0.00 -1.02 0.00 0.00 39.78 38.20 1ave n ASN 57 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 1ave n LYS 58 N 7.09 0.00 0.00 3.52 3.00 -1.26 -5.08 118.16 125.43 1ave n LYS 58 Ca 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.91 1ave n LYS 58 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.27 1ave n LYS 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1ave n ARG 59 N 0.00 0.00 0.00 1.64 1.74 -1.25 -2.70 116.66 116.10 1ave n ARG 59 Ca 0.00 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 1ave n ARG 59 Cb 0.06 -0.03 0.00 0.00 -1.02 0.00 0.00 32.46 31.47 1ave n ARG 59 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1ave n THR 60 N -0.28 0.00 -3.73 0.55 -1.04 -1.26 -2.95 114.28 105.57 1ave n THR 60 Ca 0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 1ave n THR 60 Cb 0.00 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.37 1ave n THR 60 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1ave s GLN 61 N -4.46 0.84 0.40 -2.82 -0.21 -1.10 -2.30 119.66 110.01 1ave s GLN 61 Ca 0.00 -1.29 -0.02 0.00 0.02 0.00 0.00 55.36 54.07 1ave s GLN 61 Cb 0.00 -2.07 -0.04 0.00 1.00 0.00 0.00 33.01 31.91 1ave s GLN 61 CO 0.00 -1.03 0.65 -1.25 -2.12 0.00 0.00 175.29 171.54 1ave s PRO 62 N 1.33 3.52 0.55 2.91 0.04 -1.15 -4.76 135.00 137.44 1ave s PRO 62 Ca 0.12 -0.09 0.01 0.00 0.04 0.00 0.00 61.00 61.08 1ave s PRO 62 Cb -0.19 -2.54 0.03 0.00 0.04 0.00 0.00 34.50 31.84 1ave s PRO 62 CO -0.19 0.01 0.77 0.95 0.04 0.00 0.00 177.00 178.58 1ave s THR 63 N -2.48 2.75 0.15 1.26 -4.23 -1.26 -1.00 115.64 110.84 1ave s THR 63 Ca 0.43 -0.64 -0.17 0.00 -1.18 0.00 0.00 61.69 60.13 1ave s THR 63 Cb -0.10 -3.04 0.06 0.00 1.34 0.00 0.00 72.50 70.77 1ave s THR 63 CO 0.39 -0.03 0.83 2.22 -0.54 0.00 0.00 174.62 177.50 1ave n PHE 64 N -2.34 -1.23 -3.65 3.99 1.16 -0.18 -3.03 117.46 112.18 1ave n PHE 64 Ca 0.08 -1.04 -0.04 0.00 -1.87 0.00 0.00 57.45 54.57 1ave n PHE 64 Cb 0.60 0.51 -0.07 0.00 -1.61 0.00 0.00 39.48 38.91 1ave n PHE 64 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 1ave s GLY 65 N -3.14 0.26 0.28 4.97 0.00 -1.07 -1.09 107.32 107.53 1ave s GLY 65 Ca 0.18 3.36 0.02 0.00 0.00 0.00 0.00 44.72 48.29 1ave s GLY 65 CO 0.05 2.01 0.08 -0.11 0.00 0.00 0.00 173.10 175.13 1ave s PHE 66 N 0.20 1.66 0.02 1.90 -0.12 -0.52 -2.65 117.98 118.47 1ave s PHE 66 Ca 0.05 -1.11 0.05 0.00 -0.05 0.00 0.00 56.93 55.87 1ave s PHE 66 Cb -0.05 -1.01 -0.02 0.00 -0.63 0.00 0.00 43.02 41.32 1ave s PHE 66 CO -0.13 -0.23 -0.16 0.99 -0.05 0.00 0.00 175.22 175.64 1ave s THR 67 N -3.62 1.30 -0.12 -4.49 2.01 -0.56 -1.34 115.64 108.83 1ave s THR 67 Ca 0.37 -0.93 0.01 0.00 0.31 0.00 0.00 61.69 61.45 1ave s THR 67 Cb 0.08 -1.13 0.02 0.00 0.01 0.00 0.00 72.50 71.48 1ave s THR 67 CO 0.14 0.18 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.42 1ave s VAL 68 N -0.66 1.46 -1.00 3.82 1.01 -0.71 -2.01 120.40 122.31 1ave s VAL 68 Ca 0.05 -0.60 -0.14 0.00 0.00 0.00 0.00 61.98 61.28 1ave s VAL 68 Cb -0.07 -1.35 0.20 0.00 0.00 0.00 0.00 36.38 35.15 1ave s VAL 68 CO 0.01 0.44 1.08 0.21 0.00 0.00 0.00 175.10 176.83 1ave s ASN 69 N 1.15 6.92 -0.17 3.32 3.04 -0.70 -2.99 114.94 125.53 1ave s ASN 69 Ca -0.03 -2.80 -0.39 0.00 0.04 0.00 0.00 52.86 49.68 1ave s ASN 69 Cb -0.14 -2.30 -0.16 0.00 -1.54 0.00 0.00 41.25 37.11 1ave s ASN 69 CO -0.04 -0.67 1.63 0.79 -3.04 0.00 0.00 177.10 175.77 1ave n TRP 70 N 4.70 1.90 0.98 0.43 7.02 -1.25 -4.22 117.44 127.01 1ave n TRP 70 Ca 0.24 0.55 0.13 0.00 -1.02 0.00 0.00 57.50 57.40 1ave n TRP 70 Cb 0.45 -2.43 0.42 0.00 -2.42 0.00 0.00 31.31 27.33 1ave n TRP 70 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1ave n LYS 71 N 4.56 0.01 -0.40 -0.99 4.76 -1.26 -4.10 118.16 120.74 1ave n LYS 71 Ca 0.24 0.01 0.07 0.00 -2.87 0.00 0.00 58.31 55.76 1ave n LYS 71 Cb 0.15 -1.51 0.14 0.00 -1.84 0.00 0.00 35.03 31.97 1ave n LYS 71 CO 0.00 0.00 0.00 1.97 -1.37 0.00 0.00 177.40 178.00 1ave n PHE 72 N -1.53 0.00 -3.78 2.13 -1.74 -1.26 -5.03 117.46 106.25 1ave n PHE 72 Ca 0.06 -1.01 -0.04 0.00 -0.56 0.00 0.00 57.45 55.91 1ave n PHE 72 Cb 0.34 -0.17 -0.01 0.00 1.52 0.00 0.00 39.48 41.16 1ave n PHE 72 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 1ave s SER 73 N -2.72 -0.15 0.00 5.98 0.15 -1.26 -4.83 113.70 110.88 1ave s SER 73 Ca 0.30 -0.47 0.20 0.00 0.70 0.00 0.00 55.95 56.69 1ave s SER 73 Cb 0.29 0.50 0.63 0.00 -1.71 0.00 0.00 66.02 65.73 1ave s SER 73 CO -0.02 -0.94 1.48 -0.62 1.20 0.00 0.00 173.24 174.34 1ave n GLU 74 N -0.50 1.90 -3.01 5.44 1.02 -1.26 -4.77 120.64 119.46 1ave n GLU 74 Ca -0.06 -1.36 -0.18 0.00 -0.02 0.00 0.00 57.16 55.54 1ave n GLU 74 Cb 0.60 -1.40 0.02 0.00 -0.02 0.00 0.00 31.44 30.65 1ave n GLU 74 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1ave s SER 75 N -1.47 5.50 0.04 1.62 0.01 -1.26 -4.43 113.70 113.71 1ave s SER 75 Ca 0.33 -0.52 0.04 0.00 1.31 0.00 0.00 55.95 57.10 1ave s SER 75 Cb 0.18 -0.42 -0.02 0.00 0.21 0.00 0.00 66.02 65.97 1ave s SER 75 CO 0.26 -0.92 -0.11 -0.89 0.41 0.00 0.00 173.24 171.99 1ave s THR 76 N -2.44 0.83 0.06 1.44 2.01 -0.99 -3.77 115.64 112.78 1ave s THR 76 Ca 0.57 -0.96 0.06 0.00 0.31 0.00 0.00 61.69 61.67 1ave s THR 76 Cb -0.09 -0.80 -0.03 0.00 0.01 0.00 0.00 72.50 71.60 1ave s THR 76 CO 0.35 -0.14 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.08 1ave s THR 77 N -0.98 1.39 -0.02 -0.82 2.01 -1.16 -0.04 115.64 116.02 1ave s THR 77 Ca -0.03 -1.22 0.03 0.00 0.31 0.00 0.00 61.69 60.78 1ave s THR 77 Cb -0.08 -1.25 -0.00 0.00 0.01 0.00 0.00 72.50 71.17 1ave s THR 77 CO 0.01 0.00 -0.10 0.68 -0.69 0.00 0.00 174.62 174.52 1ave s VAL 78 N -0.97 0.85 0.15 3.82 -7.23 -0.01 -1.74 120.40 115.27 1ave s VAL 78 Ca 0.04 -0.43 0.11 0.00 -1.81 0.00 0.00 61.98 59.88 1ave s VAL 78 Cb -0.09 -0.72 -0.04 0.00 0.56 0.00 0.00 36.38 36.08 1ave s VAL 78 CO 0.02 0.25 -0.25 -0.36 -0.31 0.00 0.00 175.10 174.45 1ave s PHE 79 N -0.07 2.32 -0.14 2.82 0.40 -0.45 -1.48 117.98 121.39 1ave s PHE 79 Ca 0.01 -0.36 -0.26 0.00 -0.60 0.00 0.00 56.93 55.72 1ave s PHE 79 Cb -0.06 -1.21 0.06 0.00 0.51 0.00 0.00 43.02 42.32 1ave s PHE 79 CO 0.00 0.41 0.64 -0.08 0.70 0.00 0.00 175.22 176.89 1ave s THR 80 N -1.31 0.00 -0.90 0.64 -1.32 -1.07 -1.44 115.64 110.25 1ave s THR 80 Ca 0.17 -0.04 0.00 0.00 -1.21 0.00 0.00 61.69 60.61 1ave s THR 80 Cb -0.09 -0.93 0.00 0.00 -1.51 0.00 0.00 72.50 69.97 1ave s THR 80 CO 0.08 -0.02 0.00 0.61 -2.21 0.00 0.00 174.62 173.08 1ave n GLY 81 N 1.75 -0.58 3.13 6.08 0.00 -0.25 -2.37 105.19 112.96 1ave n GLY 81 Ca -0.17 -0.63 -0.20 0.00 0.00 0.00 0.00 46.02 45.01 1ave n GLY 81 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ave s GLN 82 N -0.36 0.96 -0.37 1.61 0.74 -0.18 -1.02 119.66 121.05 1ave s GLN 82 Ca 0.00 -0.68 -0.22 0.00 0.05 0.00 0.00 55.36 54.51 1ave s GLN 82 Cb 0.00 -0.96 0.01 0.00 1.10 0.00 0.00 33.01 33.16 1ave s GLN 82 CO 0.00 0.24 0.73 0.00 -0.55 0.00 0.00 175.29 175.71 1ave s PHE 84 N 2.96 2.86 -0.37 0.00 0.08 0.64 -3.88 117.98 120.27 1ave s PHE 84 Ca 0.28 -0.22 0.00 0.00 0.12 0.00 0.00 56.93 57.12 1ave s PHE 84 Cb -0.14 -1.40 0.13 0.00 -0.57 0.00 0.00 43.02 41.04 1ave s PHE 84 CO 0.17 0.50 0.19 0.42 -0.10 0.00 0.00 175.22 176.39 1ave s ILE 85 N -2.28 0.79 0.17 0.64 1.01 -1.25 0.16 121.20 120.44 1ave s ILE 85 Ca 0.34 -1.88 -0.26 0.00 0.00 0.00 0.00 60.65 58.85 1ave s ILE 85 Cb -0.06 -1.57 0.03 0.00 0.01 0.00 0.00 42.46 40.87 1ave s ILE 85 CO 0.23 -0.86 1.56 -2.24 0.00 0.00 0.00 174.94 173.63 1ave h ASP 86 N 7.28 -1.65 0.00 3.58 3.04 -1.83 -3.46 116.42 123.39 1ave h ASP 86 Ca -0.04 0.27 0.00 0.00 -3.24 0.00 0.00 57.03 54.02 1ave h ASP 86 Cb 0.97 0.75 0.00 0.00 -1.04 0.00 0.00 39.33 40.01 1ave h ASP 86 CO 0.41 -0.32 0.00 -1.14 -2.04 0.00 0.00 179.24 176.16 1ave n ARG 87 N -5.38 0.00 -0.24 4.15 0.63 -1.26 -4.95 116.66 109.61 1ave n ARG 87 Ca 0.02 0.00 0.23 0.00 -0.92 0.00 0.00 57.85 57.19 1ave n ARG 87 Cb 0.34 0.00 0.42 0.00 0.45 0.00 0.00 32.46 33.67 1ave n ARG 87 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1ave n ASN 88 N -2.92 0.24 0.00 6.15 3.02 -1.26 -4.59 115.26 115.89 1ave n ASN 88 Ca 0.00 1.16 0.00 0.00 -0.03 0.00 0.00 54.58 55.71 1ave n ASN 88 Cb 0.00 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 38.60 1ave n ASN 88 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ave n GLY 89 N -1.20 1.50 3.68 7.41 0.00 -1.26 -5.07 105.19 110.24 1ave n GLY 89 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.88 1ave n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ave s LYS 90 N -0.01 4.33 0.17 1.61 -0.14 -1.26 -4.98 119.74 119.46 1ave s LYS 90 Ca 0.00 1.01 -0.09 0.00 -1.36 0.00 0.00 55.97 55.53 1ave s LYS 90 Cb 0.00 -3.55 -0.07 0.00 -1.68 0.00 0.00 37.83 32.53 1ave s LYS 90 CO 0.00 -0.26 0.48 -1.21 -0.76 0.00 0.00 175.35 173.60 1ave s GLU 91 N 1.90 3.77 -0.06 1.68 2.02 -1.25 -2.22 118.70 124.54 1ave s GLU 91 Ca 0.39 0.20 -0.03 0.00 0.02 0.00 0.00 54.97 55.55 1ave s GLU 91 Cb -0.17 -2.79 0.03 0.00 0.10 0.00 0.00 34.13 31.31 1ave s GLU 91 CO 0.14 0.41 0.14 0.08 0.02 0.00 0.00 175.26 176.05 1ave s VAL 92 N -1.67 -0.04 -0.21 2.63 1.01 0.12 -4.55 120.40 117.70 1ave s VAL 92 Ca 0.42 0.16 -0.12 0.00 0.00 0.00 0.00 61.98 62.44 1ave s VAL 92 Cb -0.12 -0.22 -0.05 0.00 0.00 0.00 0.00 36.38 35.99 1ave s VAL 92 CO 0.21 0.06 0.24 -0.76 0.00 0.00 0.00 175.10 174.86 1ave s LEU 93 N 1.00 4.17 -0.26 3.92 1.02 0.32 -0.26 118.68 128.58 1ave s LEU 93 Ca -0.08 0.31 -0.02 0.00 0.02 0.00 0.00 54.13 54.36 1ave s LEU 93 Cb -0.10 -2.26 0.03 0.00 0.02 0.00 0.00 46.19 43.88 1ave s LEU 93 CO -0.05 0.06 -0.03 -0.54 0.02 0.00 0.00 176.35 175.81 1ave s LYS 94 N 0.87 2.76 0.13 1.70 1.02 0.04 -1.72 119.74 124.54 1ave s LYS 94 Ca 0.12 -1.03 0.04 0.00 0.02 0.00 0.00 55.97 55.12 1ave s LYS 94 Cb -0.13 -3.07 -0.04 0.00 -0.52 0.00 0.00 37.83 34.07 1ave s LYS 94 CO 0.04 -0.46 -0.11 0.95 -0.92 0.00 0.00 175.35 174.86 1ave s THR 95 N 1.32 1.12 -0.00 2.17 -4.23 -0.48 -1.01 115.64 114.54 1ave s THR 95 Ca -0.01 -1.88 0.02 0.00 -1.18 0.00 0.00 61.69 58.64 1ave s THR 95 Cb -0.17 -1.65 -0.01 0.00 1.34 0.00 0.00 72.50 72.01 1ave s THR 95 CO -0.03 -0.64 -0.05 -0.32 -0.54 0.00 0.00 174.62 173.04 1ave s MET 96 N -3.29 0.44 0.14 3.99 1.75 -1.00 -1.25 119.30 120.09 1ave s MET 96 Ca 0.12 -0.22 -0.02 0.00 -1.25 0.00 0.00 55.69 54.32 1ave s MET 96 Cb -0.00 -0.42 -0.04 0.00 2.84 0.00 0.00 34.83 37.21 1ave s MET 96 CO 0.01 0.11 0.10 1.67 -0.65 0.00 0.00 175.02 176.26 1ave s TRP 97 N -0.18 0.83 -0.14 4.11 1.48 0.38 -2.61 118.94 122.82 1ave s TRP 97 Ca 0.02 -1.19 0.00 0.00 -1.06 0.00 0.00 56.10 53.87 1ave s TRP 97 Cb -0.02 -0.43 0.02 0.00 -1.16 0.00 0.00 33.47 31.88 1ave s TRP 97 CO -0.00 -0.56 -0.13 -0.51 -4.06 0.00 0.00 176.95 171.69 1ave s LEU 98 N -3.05 1.56 -0.27 -4.66 1.43 -0.55 -1.51 118.68 111.63 1ave s LEU 98 Ca 0.25 -0.43 -0.05 0.00 -1.03 0.00 0.00 54.13 52.86 1ave s LEU 98 Cb 0.07 -1.08 0.01 0.00 0.03 0.00 0.00 46.19 45.21 1ave s LEU 98 CO 0.03 -0.06 0.04 -0.22 0.23 0.00 0.00 176.35 176.36 1ave s LEU 99 N 1.49 3.58 -0.22 1.79 2.96 -0.35 -0.83 118.68 127.11 1ave s LEU 99 Ca 0.04 -0.68 -0.10 0.00 -0.22 0.00 0.00 54.13 53.17 1ave s LEU 99 Cb -0.13 -1.82 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 1ave s LEU 99 CO -0.09 -0.15 0.13 -0.60 -1.32 0.00 0.00 176.35 174.32 1ave s ARG 100 N 1.47 4.08 0.27 1.98 6.06 0.94 -2.50 118.95 131.25 1ave s ARG 100 Ca 0.03 -0.27 0.06 0.00 -2.50 0.00 0.00 55.73 53.04 1ave s ARG 100 Cb -0.17 -3.44 -0.02 0.00 0.06 0.00 0.00 34.95 31.38 1ave s ARG 100 CO 0.00 0.17 0.38 -1.12 -2.50 0.00 0.00 175.30 172.23 1ave s SER 101 N 0.73 6.11 0.06 -2.12 0.01 -0.74 -2.34 113.70 115.41 1ave s SER 101 Ca 0.07 -0.06 -0.21 0.00 1.31 0.00 0.00 55.95 57.06 1ave s SER 101 Cb -0.13 -1.60 -0.06 0.00 0.21 0.00 0.00 66.02 64.44 1ave s SER 101 CO 0.02 -0.19 0.63 -0.55 0.41 0.00 0.00 173.24 173.56 1ave s SER 102 N -4.03 7.10 0.19 2.44 0.15 -1.26 -4.87 113.70 113.42 1ave s SER 102 Ca 0.37 1.31 0.09 0.00 0.70 0.00 0.00 55.95 58.42 1ave s SER 102 Cb -0.09 -2.40 -0.04 0.00 -1.71 0.00 0.00 66.02 61.78 1ave s SER 102 CO 0.29 0.17 -0.18 0.68 1.20 0.00 0.00 173.24 175.40 1ave s VAL 103 N -0.65 1.91 -1.09 4.45 -7.23 -1.26 -5.08 120.40 111.44 1ave s VAL 103 Ca 0.32 -2.05 0.24 0.00 -1.81 0.00 0.00 61.98 58.68 1ave s VAL 103 Cb -0.20 -1.96 -0.05 0.00 0.56 0.00 0.00 36.38 34.73 1ave s VAL 103 CO 0.20 -0.38 1.25 0.59 -0.31 0.00 0.00 175.10 176.45 1ave n ASN 104 N 0.03 0.75 -3.77 4.85 4.13 -1.26 -4.90 115.26 115.09 1ave n ASN 104 Ca -0.11 -0.58 -0.13 0.00 1.68 0.00 0.00 54.58 55.44 1ave n ASN 104 Cb 0.58 0.49 -0.13 0.00 -1.54 0.00 0.00 39.78 39.18 1ave n ASN 104 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1ave s ASP 105 N -2.95 -0.19 0.56 6.41 -1.08 -1.26 -5.03 116.67 113.14 1ave s ASP 105 Ca 0.11 0.39 0.47 0.00 -0.52 0.00 0.00 52.55 53.00 1ave s ASP 105 Cb 0.17 0.34 1.66 0.00 -1.46 0.00 0.00 42.92 43.63 1ave s ASP 105 CO 0.74 -0.11 1.59 0.40 0.52 0.00 0.00 175.17 178.31 1ave h ILE 106 N 5.41 0.07 -0.60 4.11 5.03 -2.02 0.55 117.51 130.05 1ave h ILE 106 Ca -0.34 0.00 0.17 0.00 -0.12 0.00 0.00 64.86 64.58 1ave h ILE 106 Cb 1.17 0.07 -0.02 0.00 -3.03 0.00 0.00 36.82 35.01 1ave h ILE 106 CO 0.40 0.00 0.44 1.23 -0.68 0.00 0.00 178.15 179.53 1ave h GLY 107 N 0.00 0.00 1.04 5.37 0.00 -2.00 0.20 103.07 107.69 1ave h GLY 107 Ca 0.85 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.18 1ave h GLY 107 CO -0.01 0.00 -0.88 -0.55 0.00 0.00 0.00 176.54 175.10 1ave h ASP 108 N 0.00 0.00 -0.65 0.19 3.32 -1.31 -3.40 116.42 114.58 1ave h ASP 108 Ca 0.29 -0.08 0.27 0.00 0.02 0.00 0.00 57.03 57.52 1ave h ASP 108 Cb 1.16 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.60 1ave h ASP 108 CO -0.00 0.04 0.36 -0.67 -1.72 0.00 0.00 179.24 177.24 1ave n ASP 109 N -2.50 0.21 -0.34 6.45 2.03 0.72 -1.39 116.55 121.74 1ave n ASP 109 Ca 0.01 1.03 0.24 0.00 0.52 0.00 0.00 54.79 56.59 1ave n ASP 109 Cb 0.51 -0.50 0.48 0.00 -0.72 0.00 0.00 41.12 40.89 1ave n ASP 109 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 1ave h TRP 110 N 0.00 0.93 -0.44 -0.67 5.08 -1.78 -1.09 115.95 117.98 1ave h TRP 110 Ca 0.53 0.04 0.00 0.00 1.08 0.00 0.00 58.89 60.54 1ave h TRP 110 Cb 1.44 -0.25 0.00 0.00 -3.00 0.00 0.00 29.16 27.36 1ave h TRP 110 CO -0.01 -0.17 0.00 0.36 -1.28 0.00 0.00 178.44 177.34 1ave n LYS 111 N -5.04 3.65 -0.08 0.12 2.85 -0.48 -4.59 118.16 114.59 1ave n LYS 111 Ca 0.32 -2.86 0.10 0.00 -1.05 0.00 0.00 58.31 54.82 1ave n LYS 111 Cb 0.99 -1.91 0.37 0.00 -0.65 0.00 0.00 35.03 33.83 1ave n LYS 111 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ave n ALA 112 N 0.27 2.52 -3.79 0.58 0.00 -0.41 -4.85 120.51 114.83 1ave n ALA 112 Ca 0.23 -0.52 -0.29 0.00 0.00 0.00 0.00 53.44 52.86 1ave n ALA 112 Cb 0.93 -1.09 -0.17 0.00 0.00 0.00 0.00 19.45 19.12 1ave n ALA 112 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ave s THR 113 N -1.79 1.51 0.15 0.00 2.01 -1.26 -1.79 115.64 114.47 1ave s THR 113 Ca 0.32 -0.63 0.06 0.00 0.31 0.00 0.00 61.69 61.75 1ave s THR 113 Cb 0.17 -1.40 -0.04 0.00 0.01 0.00 0.00 72.50 71.25 1ave s THR 113 CO 0.26 0.45 0.04 -0.13 -0.69 0.00 0.00 174.62 174.55 1ave s ARG 114 N 1.19 2.60 0.19 4.92 0.52 -1.04 -4.98 118.95 122.34 1ave s ARG 114 Ca -0.02 -0.95 0.00 0.00 -0.52 0.00 0.00 55.73 54.24 1ave s ARG 114 Cb -0.14 -2.50 -0.04 0.00 0.52 0.00 0.00 34.95 32.79 1ave s ARG 114 CO -0.05 0.49 0.07 0.54 0.02 0.00 0.00 175.30 176.37 1ave s VAL 115 N -1.61 0.36 -4.58 3.52 0.11 -1.26 -1.21 120.40 115.73 1ave s VAL 115 Ca 0.28 -1.97 0.00 0.00 -2.93 0.00 0.00 61.98 57.36 1ave s VAL 115 Cb -0.10 -2.32 0.00 0.00 -1.53 0.00 0.00 36.38 32.43 1ave s VAL 115 CO 0.20 -0.25 0.00 0.61 -3.33 0.00 0.00 175.10 172.33 1ave n GLY 116 N -0.27 -1.42 1.77 6.54 0.00 -0.57 -4.98 105.19 106.27 1ave n GLY 116 Ca -0.03 -1.20 -0.15 0.00 0.00 0.00 0.00 46.02 44.64 1ave n GLY 116 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ave n ILE 117 N 7.98 0.00 -3.65 -0.61 -0.00 -1.26 -0.47 119.36 121.35 1ave n ILE 117 Ca 0.00 -1.14 -0.03 0.00 -0.00 0.00 0.00 62.75 61.58 1ave n ILE 117 Cb 0.00 0.14 -0.07 0.00 -0.00 0.00 0.00 39.64 39.72 1ave n ILE 117 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.55 176.75 1ave s ASN 118 N -2.39 -0.21 -0.13 7.28 0.02 -0.38 -4.84 114.94 114.29 1ave s ASN 118 Ca 0.03 0.38 -0.00 0.00 -1.02 0.00 0.00 52.86 52.24 1ave s ASN 118 Cb -0.00 0.66 -0.01 0.00 0.02 0.00 0.00 41.25 41.92 1ave s ASN 118 CO 0.02 -0.06 -0.13 -0.63 0.02 0.00 0.00 177.10 176.31 1ave s ILE 119 N 0.52 3.02 -0.06 0.60 1.01 -1.26 -1.38 121.20 123.65 1ave s ILE 119 Ca 0.00 -0.67 0.05 0.00 0.00 0.00 0.00 60.65 60.03 1ave s ILE 119 Cb -0.04 -2.27 -0.00 0.00 0.01 0.00 0.00 42.46 40.16 1ave s ILE 119 CO -0.12 0.52 -0.20 -0.36 0.00 0.00 0.00 174.94 174.78 1ave s PHE 120 N 0.37 2.04 0.14 3.97 0.40 -0.70 -2.25 117.98 121.94 1ave s PHE 120 Ca -0.11 -0.64 0.01 0.00 -0.60 0.00 0.00 56.93 55.59 1ave s PHE 120 Cb -0.16 -1.36 -0.04 0.00 0.51 0.00 0.00 43.02 41.96 1ave s PHE 120 CO 0.06 -0.23 -0.01 0.95 0.70 0.00 0.00 175.22 176.69 1ave s THR 121 N 0.06 0.55 0.43 0.64 -4.23 -0.13 -0.52 115.64 112.44 1ave s THR 121 Ca -0.07 -1.94 -0.05 0.00 -1.18 0.00 0.00 61.69 58.45 1ave s THR 121 Cb -0.13 -1.94 -0.04 0.00 1.34 0.00 0.00 72.50 71.72 1ave s THR 121 CO 0.04 -0.63 0.72 0.00 -0.54 0.00 0.00 174.62 174.21 1ave s ARG 122 N -3.91 3.58 -0.26 3.99 1.70 -1.26 -0.25 118.95 122.54 1ave s ARG 122 Ca 0.19 0.14 -0.24 0.00 -0.47 0.00 0.00 55.73 55.35 1ave s ARG 122 Cb 0.06 -2.45 -0.01 0.00 -0.57 0.00 0.00 34.95 31.98 1ave s ARG 122 CO 0.00 -0.08 0.79 -0.51 -1.08 0.00 0.00 175.30 174.43 1ave s LEU 123 N -4.40 4.08 1.20 -1.89 1.43 -1.15 -4.89 118.68 113.06 1ave s LEU 123 Ca 0.46 0.89 -0.13 0.00 -1.03 0.00 0.00 54.13 54.32 1ave s LEU 123 Cb -0.10 -3.11 0.30 0.00 0.03 0.00 0.00 46.19 43.31 1ave s LEU 123 CO 0.40 -0.52 0.98 -2.11 0.23 0.00 0.00 176.35 175.32 1ave n ARG 124 N 6.03 -2.66 -0.54 1.70 1.85 -1.26 -4.93 116.66 116.84 1ave n ARG 124 Ca 0.04 -0.75 0.00 0.00 -1.00 0.00 0.00 57.85 56.14 1ave n ARG 124 Cb 0.48 -2.14 0.00 0.00 -1.05 0.00 0.00 32.46 29.75 1ave n ARG 124 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87