#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1str n GLU 14 N 0.00 0.00 0.13 0.00 1.02 -1.26 -0.75 120.64 119.79 1str n GLU 14 Ca 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.20 1str n GLU 14 Cb 0.00 0.00 0.31 0.00 -0.02 0.00 0.00 31.44 31.73 1str n GLU 14 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1str n ALA 15 N 0.00 0.65 0.13 0.62 0.00 -1.26 -2.37 120.51 118.28 1str n ALA 15 Ca 0.00 0.10 0.09 0.00 0.00 0.00 0.00 53.44 53.63 1str n ALA 15 Cb 0.00 -0.79 0.46 0.00 0.00 0.00 0.00 19.45 19.12 1str n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1str n GLY 16 N -1.28 -0.77 0.26 0.00 0.00 0.07 -1.08 105.19 102.39 1str n GLY 16 Ca -0.01 0.16 -0.07 0.00 0.00 0.00 0.00 46.02 46.10 1str n GLY 16 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1str h ILE 17 N 0.00 1.27 -2.72 -0.61 2.04 -1.69 -3.44 117.51 112.36 1str h ILE 17 Ca 0.00 -1.33 -0.52 0.00 1.00 0.00 0.00 64.86 64.01 1str h ILE 17 Cb 0.06 1.24 0.05 0.00 -0.74 0.00 0.00 36.82 37.43 1str h ILE 17 CO 0.00 0.44 0.97 -0.89 0.00 0.00 0.00 178.15 178.66 1str s THR 18 N -4.58 2.38 -5.00 -0.27 2.01 -0.24 -4.79 115.64 105.15 1str s THR 18 Ca -0.09 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.14 1str s THR 18 Cb 0.13 -3.14 0.00 0.00 0.01 0.00 0.00 72.50 69.50 1str s THR 18 CO 0.83 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 175.38 1str n GLY 19 N 3.91 -0.05 3.27 4.40 0.00 -0.95 -5.02 105.19 110.75 1str n GLY 19 Ca 0.15 -1.44 -0.34 0.00 0.00 0.00 0.00 46.02 44.39 1str n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1str s THR 20 N -2.89 2.98 0.23 2.61 2.01 -1.26 -1.57 115.64 117.75 1str s THR 20 Ca 0.00 -0.63 0.12 0.00 0.31 0.00 0.00 61.69 61.48 1str s THR 20 Cb 0.00 -2.32 -0.05 0.00 0.01 0.00 0.00 72.50 70.14 1str s THR 20 CO 0.00 0.47 -0.22 0.26 -0.69 0.00 0.00 174.62 174.43 1str s TRP 21 N 1.27 2.30 -0.02 4.92 0.52 -0.37 -4.59 118.94 122.97 1str s TRP 21 Ca 0.03 -0.35 0.02 0.00 0.02 0.00 0.00 56.10 55.83 1str s TRP 21 Cb -0.14 -1.08 -0.00 0.00 -1.15 0.00 0.00 33.47 31.10 1str s TRP 21 CO -0.04 0.59 -0.08 0.71 0.02 0.00 0.00 176.95 178.14 1str s TYR 22 N -2.01 0.81 0.70 -1.98 2.02 0.35 -1.27 117.35 115.96 1str s TYR 22 Ca 0.24 -0.17 0.01 0.00 -0.37 0.00 0.00 57.07 56.78 1str s TYR 22 Cb -0.07 -0.56 0.12 0.00 -0.40 0.00 0.00 41.96 41.06 1str s TYR 22 CO 0.12 -0.05 0.96 0.54 -1.57 0.00 0.00 175.55 175.55 1str s ASN 23 N 0.02 4.45 0.00 2.29 4.22 -0.96 -1.33 114.94 123.63 1str s ASN 23 Ca -0.00 -0.45 0.04 0.00 -2.14 0.00 0.00 52.86 50.30 1str s ASN 23 Cb -0.06 0.06 0.17 0.00 1.28 0.00 0.00 41.25 42.70 1str s ASN 23 CO -0.00 -1.79 1.07 0.00 -2.04 0.00 0.00 177.10 174.34 1str n GLN 24 N -2.74 0.02 -0.16 3.55 0.00 -1.24 -1.97 117.38 114.84 1str n GLN 24 Ca 0.15 0.38 0.07 0.00 0.00 0.00 0.00 57.00 57.61 1str n GLN 24 Cb 0.61 -1.50 0.16 0.00 0.00 0.00 0.00 30.24 29.50 1str n GLN 24 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1str n LEU 25 N -1.44 2.89 0.00 2.61 4.77 -1.26 -4.99 117.00 119.58 1str n LEU 25 Ca 0.01 -1.70 0.00 0.00 -0.03 0.00 0.00 56.01 54.29 1str n LEU 25 Cb 0.04 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 1str n LEU 25 CO 0.03 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 1str n GLY 26 N 0.80 0.87 3.77 -0.72 0.00 -0.83 -4.68 105.19 104.40 1str n GLY 26 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1str n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1str s SER 27 N -3.01 6.28 -0.06 1.61 0.01 -1.26 -4.23 113.70 113.04 1str s SER 27 Ca 0.00 2.47 0.01 0.00 1.31 0.00 0.00 55.95 59.74 1str s SER 27 Cb 0.00 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 1str s SER 27 CO 0.00 -0.85 -0.06 -0.89 0.41 0.00 0.00 173.24 171.85 1str s THR 28 N -1.38 3.77 -0.15 1.44 2.01 -0.20 -2.27 115.64 118.85 1str s THR 28 Ca 0.59 -0.48 -0.01 0.00 0.31 0.00 0.00 61.69 62.11 1str s THR 28 Cb -0.33 -2.55 0.04 0.00 0.01 0.00 0.00 72.50 69.66 1str s THR 28 CO 0.42 0.58 -0.05 0.12 -0.69 0.00 0.00 174.62 175.00 1str s PHE 29 N -0.84 1.55 -0.22 4.92 5.36 -0.39 -1.80 117.98 126.56 1str s PHE 29 Ca 0.13 -0.93 -0.06 0.00 -0.96 0.00 0.00 56.93 55.11 1str s PHE 29 Cb -0.11 -1.25 -0.03 0.00 -0.34 0.00 0.00 43.02 41.29 1str s PHE 29 CO 0.02 -0.57 0.03 0.42 -1.46 0.00 0.00 175.22 173.66 1str s ILE 30 N 1.68 4.13 0.08 3.12 1.01 -0.46 -1.24 121.20 129.52 1str s ILE 30 Ca 0.02 -0.24 0.05 0.00 0.00 0.00 0.00 60.65 60.48 1str s ILE 30 Cb -0.14 -2.90 -0.03 0.00 0.01 0.00 0.00 42.46 39.40 1str s ILE 30 CO -0.08 0.39 -0.13 0.68 0.00 0.00 0.00 174.94 175.80 1str s VAL 31 N 1.26 1.12 -0.15 2.92 -7.23 -0.61 -1.96 120.40 115.75 1str s VAL 31 Ca 0.04 -1.42 0.02 0.00 -1.81 0.00 0.00 61.98 58.81 1str s VAL 31 Cb -0.15 -1.18 0.01 0.00 0.56 0.00 0.00 36.38 35.62 1str s VAL 31 CO 0.02 -0.31 -0.21 -0.89 -0.31 0.00 0.00 175.10 173.41 1str s THR 32 N -1.59 2.15 -0.27 5.32 2.01 0.31 -2.23 115.64 121.34 1str s THR 32 Ca 0.01 -0.94 -0.10 0.00 0.31 0.00 0.00 61.69 60.97 1str s THR 32 Cb -0.08 -1.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.51 1str s THR 32 CO 0.02 0.54 0.15 0.00 -0.69 0.00 0.00 174.62 174.64 1str s ALA 33 N 0.90 3.42 0.28 7.40 0.00 -1.26 -2.26 121.76 130.23 1str s ALA 33 Ca -0.05 -1.09 -0.28 0.00 0.00 0.00 0.00 51.96 50.54 1str s ALA 33 Cb -0.15 -2.34 -0.09 0.00 0.00 0.00 0.00 23.12 20.54 1str s ALA 33 CO -0.03 -0.51 0.96 0.20 0.00 0.00 0.00 175.76 176.38 1str s GLY 34 N 1.67 2.99 0.48 0.00 0.00 0.01 -4.95 107.32 107.52 1str s GLY 34 Ca 0.07 0.62 0.30 0.00 0.00 0.00 0.00 44.72 45.71 1str s GLY 34 CO 0.08 1.15 1.76 0.00 0.00 0.00 0.00 173.10 176.09 1str h ALA 35 N 3.72 2.80 -0.58 3.20 0.00 -1.98 -1.09 119.26 125.32 1str h ALA 35 Ca -0.46 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1str h ALA 35 Cb 1.20 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1str h ALA 35 CO 0.67 -1.21 0.00 -0.25 0.00 0.00 0.00 179.25 178.46 1str n ASP 36 N -4.39 4.96 0.00 0.00 8.00 -1.26 -4.83 116.55 119.02 1str n ASP 36 Ca 0.28 -2.63 0.00 0.00 0.71 0.00 0.00 54.79 53.15 1str n ASP 36 Cb 1.18 -0.62 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 1str n ASP 36 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1str n GLY 37 N 0.87 0.95 3.84 0.44 0.00 -0.41 -4.86 105.19 106.02 1str n GLY 37 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 1str n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1str s ALA 38 N -2.00 3.20 -0.07 4.61 0.00 -1.25 -1.84 121.76 124.41 1str s ALA 38 Ca 0.00 0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.09 1str s ALA 38 Cb 0.00 -2.93 0.02 0.00 0.00 0.00 0.00 23.12 20.20 1str s ALA 38 CO 0.00 0.09 -0.08 -0.51 0.00 0.00 0.00 175.76 175.27 1str s LEU 39 N -3.43 1.37 0.01 0.00 1.02 -0.44 -0.81 118.68 116.40 1str s LEU 39 Ca 0.57 -0.22 -0.01 0.00 0.02 0.00 0.00 54.13 54.49 1str s LEU 39 Cb -0.10 -0.66 -0.01 0.00 0.02 0.00 0.00 46.19 45.44 1str s LEU 39 CO 0.22 -0.04 0.01 0.42 0.02 0.00 0.00 176.35 176.97 1str s THR 40 N 1.03 0.08 -3.56 5.49 -4.23 -0.96 -1.37 115.64 112.13 1str s THR 40 Ca -0.09 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 59.75 1str s THR 40 Cb -0.14 -0.24 0.00 0.00 1.34 0.00 0.00 72.50 73.46 1str s THR 40 CO -0.00 -0.37 0.00 0.61 -0.54 0.00 0.00 174.62 174.32 1str n GLY 41 N 1.91 -0.51 3.14 3.99 0.00 -1.19 -0.53 105.19 112.00 1str n GLY 41 Ca -0.21 -0.96 -0.15 0.00 0.00 0.00 0.00 46.02 44.69 1str n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1str s THR 42 N -3.01 0.88 -0.02 2.61 -4.23 -0.83 -2.09 115.64 108.95 1str s THR 42 Ca 0.00 -1.35 0.05 0.00 -1.18 0.00 0.00 61.69 59.21 1str s THR 42 Cb 0.00 -1.03 -0.01 0.00 1.34 0.00 0.00 72.50 72.80 1str s THR 42 CO 0.00 -0.39 -0.18 -0.47 -0.54 0.00 0.00 174.62 173.04 1str s TYR 43 N -1.70 1.70 -0.09 3.99 6.14 -0.18 -1.36 117.35 125.85 1str s TYR 43 Ca -0.02 -0.37 -0.09 0.00 0.64 0.00 0.00 57.07 57.23 1str s TYR 43 Cb -0.08 -1.11 0.02 0.00 0.42 0.00 0.00 41.96 41.22 1str s TYR 43 CO 0.01 -0.07 0.25 -1.83 0.64 0.00 0.00 175.55 174.55 1str s GLU 44 N -0.31 0.30 1.16 4.97 -1.05 -0.74 -1.09 118.70 121.93 1str s GLU 44 Ca 0.04 0.35 -0.15 0.00 -0.15 0.00 0.00 54.97 55.06 1str s GLU 44 Cb -0.08 0.14 0.27 0.00 -0.44 0.00 0.00 34.13 34.02 1str s GLU 44 CO 0.00 -0.04 1.04 -1.12 0.95 0.00 0.00 175.26 176.10 1str s SER 45 N 0.12 1.16 1.30 0.83 0.01 -1.17 -1.04 113.70 114.91 1str s SER 45 Ca -0.00 1.18 -0.20 0.00 1.31 0.00 0.00 55.95 58.24 1str s SER 45 Cb -0.02 -1.82 0.32 0.00 0.21 0.00 0.00 66.02 64.72 1str s SER 45 CO 0.00 -4.04 1.01 0.00 0.41 0.00 0.00 173.24 170.63 1str s ALA 46 N -2.67 -0.14 0.00 1.44 0.00 -1.26 -3.01 121.76 116.11 1str s ALA 46 Ca 0.68 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.84 1str s ALA 46 Cb -0.20 -2.95 0.00 0.00 0.00 0.00 0.00 23.12 19.97 1str s ALA 46 CO 0.61 -4.08 0.00 0.28 0.00 0.00 0.00 175.76 172.56 1str n VAL 47 N -5.18 0.00 -1.19 0.00 0.31 -1.26 -4.67 118.33 106.33 1str n VAL 47 Ca 0.12 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.38 1str n VAL 47 Cb 0.59 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.49 1str n VAL 47 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1str n GLY 48 N 0.00 0.80 3.76 2.92 0.00 -1.17 -4.98 105.19 106.53 1str n GLY 48 Ca 0.00 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 1str n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1str s ASN 49 N -2.48 6.39 0.00 1.61 4.22 -1.26 -4.77 114.94 118.65 1str s ASN 49 Ca 0.00 2.96 0.00 0.00 -2.14 0.00 0.00 52.86 53.68 1str s ASN 49 Cb 0.00 -2.64 0.00 0.00 1.28 0.00 0.00 41.25 39.89 1str s ASN 49 CO 0.00 -0.88 0.69 0.00 -2.04 0.00 0.00 177.10 174.87 1str n ALA 50 N 1.69 0.92 0.00 3.54 0.00 -1.26 -2.98 120.51 122.42 1str n ALA 50 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1str n ALA 50 Cb 0.38 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.64 1str n ALA 50 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1str n GLU 51 N 3.85 0.00 0.00 0.00 4.07 -1.26 -4.79 120.64 122.51 1str n GLU 51 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1str n GLU 51 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1str n GLU 51 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1str n SER 52 N 0.00 0.68 -4.73 4.31 3.41 -1.16 -4.86 113.62 111.28 1str n SER 52 Ca 0.00 -1.31 -0.35 0.00 -0.26 0.00 0.00 58.87 56.95 1str n SER 52 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1str n SER 52 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1str s ARG 53 N -0.31 3.62 0.05 4.33 0.52 -1.26 -3.06 118.95 122.84 1str s ARG 53 Ca 0.00 -0.28 0.03 0.00 -0.52 0.00 0.00 55.73 54.96 1str s ARG 53 Cb 0.00 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 32.31 1str s ARG 53 CO 0.00 0.52 -0.10 0.71 0.02 0.00 0.00 175.30 176.45 1str s TYR 54 N -0.32 0.87 0.28 -0.53 1.51 -0.25 -4.83 117.35 114.08 1str s TYR 54 Ca 0.09 -0.47 -0.28 0.00 -1.01 0.00 0.00 57.07 55.40 1str s TYR 54 Cb -0.12 -0.51 -0.09 0.00 -0.11 0.00 0.00 41.96 41.13 1str s TYR 54 CO 0.01 -0.03 0.96 0.08 -1.11 0.00 0.00 175.55 175.46 1str s VAL 55 N -1.28 4.07 0.07 0.71 1.01 -1.26 -1.01 120.40 122.71 1str s VAL 55 Ca -0.06 1.94 0.04 0.00 0.00 0.00 0.00 61.98 63.89 1str s VAL 55 Cb -0.10 -4.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 1str s VAL 55 CO 0.01 0.35 -0.11 -1.48 0.00 0.00 0.00 175.10 173.87 1str s LEU 56 N -1.54 2.32 0.03 3.92 0.05 -0.89 -4.29 118.68 118.28 1str s LEU 56 Ca 0.45 -0.67 -0.02 0.00 0.05 0.00 0.00 54.13 53.93 1str s LEU 56 Cb -0.24 -0.36 -0.02 0.00 -2.05 0.00 0.00 46.19 43.52 1str s LEU 56 CO 0.30 -0.17 0.02 0.28 -0.55 0.00 0.00 176.35 176.22 1str s THR 57 N -1.73 0.15 0.00 5.48 -1.32 -1.09 -3.17 115.64 113.96 1str s THR 57 Ca -0.01 -1.20 0.00 0.00 -1.21 0.00 0.00 61.69 59.27 1str s THR 57 Cb -0.07 -0.81 0.00 0.00 -1.51 0.00 0.00 72.50 70.10 1str s THR 57 CO 0.01 -0.66 0.00 0.61 -2.21 0.00 0.00 174.62 172.37 1str n GLY 58 N 0.92 1.07 3.09 6.08 0.00 -0.47 -1.33 105.19 114.56 1str n GLY 58 Ca -0.20 -0.84 -0.08 0.00 0.00 0.00 0.00 46.02 44.90 1str n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1str s ARG 59 N -1.54 0.58 0.10 1.61 1.81 -0.94 -1.33 118.95 119.24 1str s ARG 59 Ca 0.00 -0.95 -0.09 0.00 -1.72 0.00 0.00 55.73 52.97 1str s ARG 59 Cb 0.00 0.21 0.00 0.00 -0.45 0.00 0.00 34.95 34.71 1str s ARG 59 CO 0.00 -0.13 0.21 1.52 -0.68 0.00 0.00 175.30 176.22 1str s TYR 60 N -3.11 0.15 -0.33 -0.53 1.13 -0.77 -1.71 117.35 112.17 1str s TYR 60 Ca -0.01 -0.56 -0.29 0.00 -1.41 0.00 0.00 57.07 54.80 1str s TYR 60 Cb 0.02 -0.04 0.01 0.00 -1.10 0.00 0.00 41.96 40.85 1str s TYR 60 CO -0.07 -0.57 1.25 0.34 -2.51 0.00 0.00 175.55 173.99 1str s ASP 61 N -2.86 6.69 0.00 -0.18 2.15 -0.44 -4.56 116.67 117.47 1str s ASP 61 Ca 0.06 1.06 0.30 0.00 0.43 0.00 0.00 52.55 54.39 1str s ASP 61 Cb 0.05 -2.54 1.48 0.00 -0.30 0.00 0.00 42.92 41.61 1str s ASP 61 CO -0.10 -1.09 2.03 -1.54 -0.17 0.00 0.00 175.17 174.30 1str n SER 62 N 7.61 0.00 -3.27 -0.34 3.41 -1.26 -4.19 113.62 115.58 1str n SER 62 Ca 0.14 -0.07 -0.25 0.00 -0.26 0.00 0.00 58.87 58.43 1str n SER 62 Cb 0.47 -0.31 -0.08 0.00 -0.26 0.00 0.00 64.21 64.03 1str n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1str n ALA 63 N -1.31 2.79 -1.14 7.33 0.00 -1.26 -5.00 120.51 121.91 1str n ALA 63 Ca 0.13 -3.64 -0.30 0.00 0.00 0.00 0.00 53.44 49.63 1str n ALA 63 Cb 0.25 -0.83 0.13 0.00 0.00 0.00 0.00 19.45 19.00 1str n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1str s PRO 64 N -1.29 1.55 0.51 0.00 0.04 -1.26 -5.00 135.00 129.55 1str s PRO 64 Ca 0.35 1.04 -0.22 0.00 0.04 0.00 0.00 61.00 62.21 1str s PRO 64 Cb 0.15 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.80 1str s PRO 64 CO -0.10 -2.10 1.27 0.00 0.04 0.00 0.00 177.00 176.10 1str s ALA 65 N -2.87 2.89 -1.40 8.56 0.00 -1.26 -4.96 121.76 122.72 1str s ALA 65 Ca 0.63 1.14 0.29 0.00 0.00 0.00 0.00 51.96 54.02 1str s ALA 65 Cb -0.18 -3.48 1.24 0.00 0.00 0.00 0.00 23.12 20.69 1str s ALA 65 CO 0.57 -1.04 1.88 0.25 0.00 0.00 0.00 175.76 177.43 1str n THR 66 N -0.78 0.00 -1.07 0.00 -2.24 -1.26 -4.55 114.28 104.38 1str n THR 66 Ca 0.09 -0.03 -0.07 0.00 -2.27 0.00 0.00 64.05 61.78 1str n THR 66 Cb 0.46 -0.25 0.05 0.00 -2.10 0.00 0.00 70.33 68.49 1str n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1str n ASP 67 N -1.21 -0.27 -0.61 3.42 5.68 -1.26 -4.87 116.55 117.43 1str n ASP 67 Ca 0.12 -1.00 0.00 0.00 -0.50 0.00 0.00 54.79 53.41 1str n ASP 67 Cb 0.28 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 40.04 1str n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1str n GLY 68 N 2.58 0.97 3.77 6.12 0.00 -1.26 -4.90 105.19 112.46 1str n GLY 68 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1str n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1str s SER 69 N -0.08 6.20 0.89 1.61 0.01 -1.26 -5.07 113.70 116.00 1str s SER 69 Ca 0.00 2.36 -0.12 0.00 1.31 0.00 0.00 55.95 59.50 1str s SER 69 Cb 0.00 -2.61 0.13 0.00 0.21 0.00 0.00 66.02 63.75 1str s SER 69 CO 0.00 -0.90 1.11 -0.83 0.41 0.00 0.00 173.24 173.02 1str s GLY 70 N -1.26 1.60 -0.36 3.44 0.00 -1.26 -4.84 107.32 104.63 1str s GLY 70 Ca 0.62 -0.30 -0.13 0.00 0.00 0.00 0.00 44.72 44.91 1str s GLY 70 CO 0.37 0.22 0.26 -1.59 0.00 0.00 0.00 173.10 172.35 1str s THR 71 N -3.10 5.28 0.28 0.90 2.01 -0.19 -4.84 115.64 115.97 1str s THR 71 Ca 0.63 -0.31 -0.29 0.00 0.31 0.00 0.00 61.69 62.03 1str s THR 71 Cb -0.16 -3.77 -0.10 0.00 0.01 0.00 0.00 72.50 68.48 1str s THR 71 CO 0.55 -0.08 1.36 0.00 -0.69 0.00 0.00 174.62 175.76 1str s ALA 72 N 1.73 3.55 0.23 7.40 0.00 -1.26 -1.61 121.76 131.79 1str s ALA 72 Ca 0.06 1.27 -0.17 0.00 0.00 0.00 0.00 51.96 53.13 1str s ALA 72 Cb -0.18 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.45 1str s ALA 72 CO 0.10 -0.68 0.54 -0.48 0.00 0.00 0.00 175.76 175.25 1str s LEU 73 N -1.02 0.11 -0.03 0.00 -0.00 -0.69 -1.32 118.68 115.73 1str s LEU 73 Ca 0.54 -0.65 -0.29 0.00 -0.00 0.00 0.00 54.13 53.73 1str s LEU 73 Cb -0.40 2.12 0.11 0.00 -0.00 0.00 0.00 46.19 48.02 1str s LEU 73 CO 0.47 -1.13 0.92 -0.83 -0.00 0.00 0.00 176.35 175.78 1str s GLY 74 N -2.93 -0.44 0.18 -3.48 0.00 -0.70 -1.54 107.32 98.42 1str s GLY 74 Ca 0.14 1.16 -0.20 0.00 0.00 0.00 0.00 44.72 45.82 1str s GLY 74 CO 0.03 0.43 0.55 0.66 0.00 0.00 0.00 173.10 174.77 1str s TRP 75 N -2.83 -0.30 0.06 1.90 -2.14 -0.91 -2.21 118.94 112.51 1str s TRP 75 Ca 0.04 -0.01 0.07 0.00 2.66 0.00 0.00 56.10 58.87 1str s TRP 75 Cb -0.01 0.47 -0.03 0.00 -3.10 0.00 0.00 33.47 30.80 1str s TRP 75 CO -0.07 -0.89 -0.21 0.99 -2.66 0.00 0.00 176.95 174.11 1str s THR 76 N -3.82 1.66 -0.08 0.66 2.01 -0.44 -1.24 115.64 114.40 1str s THR 76 Ca 0.05 -1.29 -0.01 0.00 0.31 0.00 0.00 61.69 60.75 1str s THR 76 Cb -0.01 -1.47 0.03 0.00 0.01 0.00 0.00 72.50 71.06 1str s THR 76 CO -0.07 0.12 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.27 1str s VAL 77 N -0.90 0.53 -0.12 3.82 1.01 -0.63 -2.66 120.40 121.44 1str s VAL 77 Ca 0.07 0.02 -0.16 0.00 0.00 0.00 0.00 61.98 61.90 1str s VAL 77 Cb -0.09 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 1str s VAL 77 CO 0.02 0.28 0.40 0.00 0.00 0.00 0.00 175.10 175.80 1str s ALA 78 N 1.83 3.54 -0.97 5.51 0.00 -1.26 -1.15 121.76 129.26 1str s ALA 78 Ca 0.04 -0.29 -0.08 0.00 0.00 0.00 0.00 51.96 51.62 1str s ALA 78 Cb -0.12 -2.52 -0.12 0.00 0.00 0.00 0.00 23.12 20.36 1str s ALA 78 CO -0.05 0.09 3.12 0.91 0.00 0.00 0.00 175.76 179.82 1str n TRP 79 N 3.44 1.57 -4.01 0.00 7.02 -0.22 -4.78 117.44 120.46 1str n TRP 79 Ca -0.10 -2.45 -0.18 0.00 -1.02 0.00 0.00 57.50 53.75 1str n TRP 79 Cb 0.52 -2.05 -0.16 0.00 -2.42 0.00 0.00 31.31 27.19 1str n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1str s LYS 80 N 1.18 0.51 0.00 -0.99 2.20 -1.26 -0.89 119.74 120.49 1str s LYS 80 Ca 0.67 0.01 0.00 0.00 -0.36 0.00 0.00 55.97 56.28 1str s LYS 80 Cb 0.24 -0.63 0.00 0.00 -1.51 0.00 0.00 37.83 35.93 1str s LYS 80 CO -0.05 -0.12 0.00 0.27 -0.36 0.00 0.00 175.35 175.09 1str n ASN 81 N 4.13 0.11 0.08 1.43 0.23 -0.54 -4.79 115.26 115.91 1str n ASN 81 Ca -0.25 -0.03 0.13 0.00 -0.53 0.00 0.00 54.58 53.90 1str n ASN 81 Cb 0.51 0.00 0.46 0.00 -2.08 0.00 0.00 39.78 38.67 1str n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1str n ASN 82 N -0.07 0.56 -0.09 0.53 3.02 -1.26 -4.06 115.26 113.88 1str n ASN 82 Ca 0.00 0.57 -0.15 0.00 -0.03 0.00 0.00 54.58 54.97 1str n ASN 82 Cb 0.00 -0.71 -0.08 0.00 -0.61 0.00 0.00 39.78 38.37 1str n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1str n TYR 83 N -2.04 0.00 -4.13 3.10 4.02 -1.26 -5.05 117.16 111.79 1str n TYR 83 Ca 0.05 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.80 1str n TYR 83 Cb 0.36 -0.72 -0.11 0.00 -0.02 0.00 0.00 39.34 38.85 1str n TYR 83 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1str s ARG 84 N -2.37 0.73 -0.24 -0.72 0.52 -1.26 -5.13 118.95 110.48 1str s ARG 84 Ca -0.26 -0.98 -0.04 0.00 -0.52 0.00 0.00 55.73 53.93 1str s ARG 84 Cb 0.07 -0.49 0.08 0.00 0.52 0.00 0.00 34.95 35.13 1str s ARG 84 CO 0.41 0.09 0.09 1.21 0.02 0.00 0.00 175.30 177.12 1str s ASN 85 N -2.02 3.15 -0.00 0.23 3.84 -1.26 -1.47 114.94 117.41 1str s ASN 85 Ca -0.01 -1.06 0.11 0.00 0.21 0.00 0.00 52.86 52.11 1str s ASN 85 Cb -0.06 -0.46 0.32 0.00 -0.55 0.00 0.00 41.25 40.50 1str s ASN 85 CO 0.00 -0.38 1.27 0.00 -2.79 0.00 0.00 177.10 175.20 1str n ALA 86 N 5.15 2.46 -4.23 1.71 0.00 -0.06 -4.96 120.51 120.57 1str n ALA 86 Ca -0.06 -0.65 -0.37 0.00 0.00 0.00 0.00 53.44 52.36 1str n ALA 86 Cb 0.45 -0.97 -0.05 0.00 0.00 0.00 0.00 19.45 18.87 1str n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1str n HIS 87 N 0.57 -1.29 -3.76 0.00 -0.00 -1.26 -4.90 115.22 104.58 1str n HIS 87 Ca 0.12 0.39 -0.10 0.00 -0.00 0.00 0.00 57.72 58.14 1str n HIS 87 Cb 0.32 -2.76 -0.04 0.00 -0.00 0.00 0.00 29.99 27.51 1str n HIS 87 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1str s SER 88 N -4.06 -0.22 -0.07 0.41 1.04 -1.26 -0.59 113.70 108.94 1str s SER 88 Ca 0.19 -0.52 -0.08 0.00 0.48 0.00 0.00 55.95 56.02 1str s SER 88 Cb -0.10 0.56 0.02 0.00 0.10 0.00 0.00 66.02 66.59 1str s SER 88 CO 0.98 -1.03 0.21 0.00 0.98 0.00 0.00 173.24 174.38 1str s ALA 89 N -3.88 -0.51 -0.07 5.32 0.00 -0.79 -1.05 121.76 120.78 1str s ALA 89 Ca 0.10 0.51 0.05 0.00 0.00 0.00 0.00 51.96 52.62 1str s ALA 89 Cb -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 1str s ALA 89 CO -0.03 -0.12 -0.22 0.99 0.00 0.00 0.00 175.76 176.38 1str s THR 90 N -0.09 2.31 -0.07 0.00 2.01 -0.30 -1.75 115.64 117.75 1str s THR 90 Ca -0.02 -0.97 0.04 0.00 0.31 0.00 0.00 61.69 61.05 1str s THR 90 Cb -0.02 -1.87 -0.01 0.00 0.01 0.00 0.00 72.50 70.61 1str s THR 90 CO 0.01 0.57 -0.22 0.42 -0.69 0.00 0.00 174.62 174.71 1str s THR 91 N -0.17 2.34 -0.08 -0.82 -4.23 -0.69 -1.61 115.64 110.38 1str s THR 91 Ca -0.03 -0.95 0.01 0.00 -1.18 0.00 0.00 61.69 59.55 1str s THR 91 Cb -0.14 -1.89 -0.02 0.00 1.34 0.00 0.00 72.50 71.79 1str s THR 91 CO 0.04 0.56 -0.11 0.26 -0.54 0.00 0.00 174.62 174.83 1str s TRP 92 N -0.07 2.82 -0.05 3.99 0.51 -0.37 -1.84 118.94 123.93 1str s TRP 92 Ca -0.05 -0.22 0.03 0.00 -2.12 0.00 0.00 56.10 53.74 1str s TRP 92 Cb -0.14 -1.72 0.00 0.00 -0.81 0.00 0.00 33.47 30.80 1str s TRP 92 CO 0.04 0.13 -0.13 0.45 -0.51 0.00 0.00 176.95 176.93 1str s SER 93 N -0.44 1.76 0.00 2.95 0.15 -0.67 -2.15 113.70 115.31 1str s SER 93 Ca 0.06 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.42 1str s SER 93 Cb -0.12 -0.59 0.00 0.00 -1.71 0.00 0.00 66.02 63.60 1str s SER 93 CO 0.02 0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.16 1str n GLY 94 N 3.40 1.43 3.29 9.45 0.00 -0.59 -2.38 105.19 119.78 1str n GLY 94 Ca -0.20 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.39 1str n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1str s GLN 95 N 1.96 0.50 0.07 1.61 -2.07 -0.57 -1.70 119.66 119.45 1str s GLN 95 Ca 0.00 0.47 -0.24 0.00 -1.82 0.00 0.00 55.36 53.78 1str s GLN 95 Cb 0.00 0.24 -0.06 0.00 -1.09 0.00 0.00 33.01 32.10 1str s GLN 95 CO 0.00 -0.07 0.71 -0.47 -1.32 0.00 0.00 175.29 174.14 1str s TYR 96 N 0.03 3.78 -0.15 9.60 5.04 -0.64 -1.29 117.35 133.71 1str s TYR 96 Ca -0.02 1.44 -0.01 0.00 -2.44 0.00 0.00 57.07 56.04 1str s TYR 96 Cb -0.03 -2.73 0.04 0.00 0.35 0.00 0.00 41.96 39.59 1str s TYR 96 CO 0.01 0.38 -0.01 0.08 -1.34 0.00 0.00 175.55 174.67 1str s VAL 97 N -0.47 0.78 0.50 3.14 1.01 -0.26 -1.02 120.40 124.07 1str s VAL 97 Ca 0.35 -0.46 -0.06 0.00 0.00 0.00 0.00 61.98 61.82 1str s VAL 97 Cb -0.21 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1str s VAL 97 CO 0.22 0.05 0.82 -0.83 0.00 0.00 0.00 175.10 175.36 1str s GLY 98 N 1.77 1.53 0.00 4.51 0.00 -1.26 -1.88 107.32 111.99 1str s GLY 98 Ca 0.01 -0.44 0.00 0.00 0.00 0.00 0.00 44.72 44.29 1str s GLY 98 CO -0.07 -0.26 0.00 0.61 0.00 0.00 0.00 173.10 173.38 1str n GLY 99 N -2.30 -0.98 0.23 0.20 0.00 -1.26 -4.84 105.19 96.23 1str n GLY 99 Ca 0.01 -1.09 0.11 0.00 0.00 0.00 0.00 46.02 45.05 1str n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1str h ALA 100 N 0.00 1.00 -2.86 4.61 0.00 -2.07 -3.32 119.26 116.63 1str h ALA 100 Ca 0.00 -0.18 -0.61 0.00 0.00 0.00 0.00 54.91 54.12 1str h ALA 100 Cb 0.00 -0.03 -0.41 0.00 0.00 0.00 0.00 17.79 17.35 1str h ALA 100 CO 0.00 0.24 -0.71 -1.83 0.00 0.00 0.00 179.25 176.96 1str s GLU 101 N -3.60 1.91 0.47 0.00 -1.05 -1.26 -5.11 118.70 110.06 1str s GLU 101 Ca 0.01 -2.89 -0.23 0.00 -0.15 0.00 0.00 54.97 51.72 1str s GLU 101 Cb 0.10 -2.75 -0.07 0.00 -0.44 0.00 0.00 34.13 30.97 1str s GLU 101 CO 0.63 -1.31 1.20 0.00 0.95 0.00 0.00 175.26 176.73 1str s ALA 102 N -0.88 2.97 0.18 -0.84 0.00 -1.25 -4.92 121.76 117.01 1str s ALA 102 Ca 0.27 1.00 -0.18 0.00 0.00 0.00 0.00 51.96 53.05 1str s ALA 102 Cb -0.03 -3.41 0.03 0.00 0.00 0.00 0.00 23.12 19.71 1str s ALA 102 CO -0.16 -0.76 0.51 1.03 0.00 0.00 0.00 175.76 176.37 1str s ARG 103 N -2.70 1.31 -0.15 0.00 3.00 -0.79 -4.40 118.95 115.23 1str s ARG 103 Ca 0.64 -0.80 -0.00 0.00 0.00 0.00 0.00 55.73 55.57 1str s ARG 103 Cb -0.31 0.52 0.03 0.00 0.00 0.00 0.00 34.95 35.19 1str s ARG 103 CO 0.37 -0.55 -0.08 0.42 0.00 0.00 0.00 175.30 175.46 1str s ILE 104 N -3.85 1.23 -0.24 1.52 1.01 -0.88 -1.11 121.20 118.88 1str s ILE 104 Ca 0.07 -0.55 -0.09 0.00 0.00 0.00 0.00 60.65 60.08 1str s ILE 104 Cb -0.00 -1.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.14 1str s ILE 104 CO -0.06 0.28 0.11 0.21 0.00 0.00 0.00 174.94 175.49 1str s ASN 105 N 1.61 5.60 0.17 3.58 2.47 -0.42 -1.21 114.94 126.73 1str s ASN 105 Ca 0.03 -0.06 0.01 0.00 0.42 0.00 0.00 52.86 53.26 1str s ASN 105 Cb -0.14 -2.01 -0.04 0.00 -1.45 0.00 0.00 41.25 37.61 1str s ASN 105 CO -0.09 0.01 0.03 0.42 -3.72 0.00 0.00 177.10 173.76 1str s THR 106 N 1.35 0.45 0.09 -5.21 -4.23 -0.40 -1.52 115.64 106.17 1str s THR 106 Ca 0.06 -1.96 0.06 0.00 -1.18 0.00 0.00 61.69 58.67 1str s THR 106 Cb -0.15 -2.16 -0.03 0.00 1.34 0.00 0.00 72.50 71.50 1str s THR 106 CO 0.05 -0.40 -0.15 -1.10 -0.54 0.00 0.00 174.62 172.48 1str s GLN 107 N -3.98 0.93 0.05 3.99 -0.21 -1.00 -1.39 119.66 118.04 1str s GLN 107 Ca 0.26 -1.09 -0.02 0.00 0.02 0.00 0.00 55.36 54.53 1str s GLN 107 Cb 0.07 -0.90 -0.04 0.00 1.00 0.00 0.00 33.01 33.14 1str s GLN 107 CO 0.05 0.19 -0.01 1.67 -2.12 0.00 0.00 175.29 175.06 1str s TRP 108 N -1.64 0.48 -0.13 0.91 1.48 0.66 -1.67 118.94 119.03 1str s TRP 108 Ca 0.03 -1.00 0.00 0.00 -1.06 0.00 0.00 56.10 54.07 1str s TRP 108 Cb -0.08 -0.35 0.02 0.00 -1.16 0.00 0.00 33.47 31.90 1str s TRP 108 CO 0.03 -0.39 -0.12 -0.51 -4.06 0.00 0.00 176.95 171.89 1str s LEU 109 N -2.86 1.55 -0.36 -4.66 1.43 -0.77 -1.94 118.68 111.08 1str s LEU 109 Ca 0.06 -0.41 -0.06 0.00 -1.03 0.00 0.00 54.13 52.69 1str s LEU 109 Cb 0.07 -1.05 0.06 0.00 0.03 0.00 0.00 46.19 45.30 1str s LEU 109 CO -0.10 -0.05 0.13 -0.22 0.23 0.00 0.00 176.35 176.34 1str s LEU 110 N 1.40 4.51 -0.11 1.79 0.20 -0.00 -1.70 118.68 124.77 1str s LEU 110 Ca 0.02 -1.33 -0.04 0.00 0.69 0.00 0.00 54.13 53.47 1str s LEU 110 Cb -0.13 -1.86 -0.04 0.00 -0.43 0.00 0.00 46.19 43.73 1str s LEU 110 CO -0.07 -0.38 0.05 -0.89 -0.29 0.00 0.00 176.35 174.77 1str s THR 111 N 1.35 4.74 0.04 3.68 2.01 -0.71 -1.05 115.64 125.70 1str s THR 111 Ca -0.00 -0.08 0.03 0.00 0.31 0.00 0.00 61.69 61.95 1str s THR 111 Cb -0.21 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 1str s THR 111 CO 0.01 0.59 0.00 -0.44 -0.69 0.00 0.00 174.62 174.10 1str s SER 112 N -0.75 5.08 -0.12 3.53 0.01 -0.87 -1.88 113.70 118.69 1str s SER 112 Ca 0.12 -0.08 -0.29 0.00 1.31 0.00 0.00 55.95 57.00 1str s SER 112 Cb -0.12 -1.28 -0.03 0.00 0.21 0.00 0.00 66.02 64.81 1str s SER 112 CO 0.03 0.23 1.33 -0.83 0.41 0.00 0.00 173.24 174.41 1str s GLY 113 N -1.91 1.69 0.40 3.44 0.00 0.24 -4.92 107.32 106.26 1str s GLY 113 Ca 0.23 0.58 0.04 0.00 0.00 0.00 0.00 44.72 45.57 1str s GLY 113 CO 0.14 2.56 0.05 -0.51 0.00 0.00 0.00 173.10 175.33 1str s THR 114 N 3.37 1.33 0.73 0.90 -4.23 -1.26 -5.01 115.64 111.46 1str s THR 114 Ca 0.59 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 59.01 1str s THR 114 Cb -0.25 -2.66 0.06 0.00 1.34 0.00 0.00 72.50 70.99 1str s THR 114 CO 0.19 0.00 1.06 0.42 -0.54 0.00 0.00 174.62 175.74 1str s THR 115 N -3.03 2.37 0.39 3.99 -4.23 -1.26 -4.91 115.64 108.96 1str s THR 115 Ca 0.28 -0.13 0.13 0.00 -1.18 0.00 0.00 61.69 60.79 1str s THR 115 Cb 0.07 -3.06 0.35 0.00 1.34 0.00 0.00 72.50 71.19 1str s THR 115 CO 0.14 -0.07 1.88 -0.33 -0.54 0.00 0.00 174.62 175.69 1str h GLU 116 N -0.70 0.52 0.00 3.99 4.39 -2.01 -1.91 114.58 118.86 1str h GLU 116 Ca -0.45 -0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.12 1str h GLU 116 Cb 1.31 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 1str h GLU 116 CO 0.62 0.34 -0.45 0.00 -1.16 0.00 0.00 179.01 178.36 1str h ALA 117 N 1.62 1.18 -0.53 3.43 0.00 -2.07 -3.03 119.26 119.86 1str h ALA 117 Ca 0.43 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1str h ALA 117 Cb 0.89 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1str h ALA 117 CO -0.18 0.56 0.00 0.09 0.00 0.00 0.00 179.25 179.73 1str n ASN 118 N -3.89 3.62 -0.14 0.00 3.02 -0.75 -4.59 115.26 112.53 1str n ASN 118 Ca -0.01 -2.12 0.08 0.00 -0.03 0.00 0.00 54.58 52.50 1str n ASN 118 Cb 0.49 -0.39 0.40 0.00 -0.61 0.00 0.00 39.78 39.67 1str n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1str h ALA 119 N 3.16 1.80 0.00 5.41 0.00 -1.35 -2.34 119.26 125.93 1str h ALA 119 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1str h ALA 119 Cb 0.97 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1str h ALA 119 CO 0.04 0.09 -0.10 0.11 0.00 0.00 0.00 179.25 179.39 1str h TRP 120 N 0.64 0.00 -0.58 0.00 5.08 -1.83 -2.39 115.95 116.87 1str h TRP 120 Ca 0.29 0.00 -0.39 0.00 1.08 0.00 0.00 58.89 59.88 1str h TRP 120 Cb 0.33 0.00 -0.25 0.00 -3.00 0.00 0.00 29.16 26.24 1str h TRP 120 CO -0.00 0.10 -0.21 0.36 -1.28 0.00 0.00 178.44 177.41 1str n LYS 121 N -3.64 2.59 0.12 0.12 0.00 -0.88 -4.72 118.16 111.74 1str n LYS 121 Ca -0.02 -3.57 0.00 0.00 -0.00 0.00 0.00 58.31 54.73 1str n LYS 121 Cb 0.22 -2.05 -0.01 0.00 -0.00 0.00 0.00 35.03 33.18 1str n LYS 121 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1str h SER 122 N 1.58 0.00 -3.31 -5.58 4.64 -1.42 -3.47 113.55 105.99 1str h SER 122 Ca 0.33 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.99 1str h SER 122 Cb 1.45 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 63.26 1str h SER 122 CO 0.70 0.62 -0.78 -0.89 -0.87 0.00 0.00 176.83 175.61 1str s THR 123 N -2.90 2.94 0.13 2.95 2.01 -1.26 -2.05 115.64 117.45 1str s THR 123 Ca 0.03 -0.69 0.03 0.00 0.31 0.00 0.00 61.69 61.37 1str s THR 123 Cb 0.08 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.31 1str s THR 123 CO 0.77 0.52 0.21 -0.76 -0.69 0.00 0.00 174.62 174.66 1str s LEU 124 N 0.55 4.16 0.01 4.42 1.43 -0.21 -4.92 118.68 124.11 1str s LEU 124 Ca -0.09 0.10 0.05 0.00 -1.03 0.00 0.00 54.13 53.17 1str s LEU 124 Cb -0.16 -2.76 -0.02 0.00 0.03 0.00 0.00 46.19 43.29 1str s LEU 124 CO 0.04 0.09 -0.16 0.54 0.23 0.00 0.00 176.35 177.10 1str s VAL 125 N -1.65 1.24 0.08 -1.59 0.11 -1.26 -0.82 120.40 116.50 1str s VAL 125 Ca 0.33 -0.81 -0.03 0.00 -2.93 0.00 0.00 61.98 58.54 1str s VAL 125 Cb -0.11 -1.06 0.01 0.00 -1.53 0.00 0.00 36.38 33.69 1str s VAL 125 CO 0.26 0.23 0.16 0.61 -3.33 0.00 0.00 175.10 173.04 1str n GLY 126 N 2.38 1.87 3.07 6.54 0.00 -0.82 -4.96 105.19 113.28 1str n GLY 126 Ca -0.16 -1.09 -0.10 0.00 0.00 0.00 0.00 46.02 44.67 1str n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1str s HIS 127 N -7.29 0.19 -0.01 1.61 -3.43 -1.26 -0.25 115.29 104.85 1str s HIS 127 Ca 0.04 -0.43 -0.06 0.00 -0.80 0.00 0.00 55.06 53.80 1str s HIS 127 Cb -0.01 -0.14 0.00 0.00 -1.43 0.00 0.00 32.58 31.00 1str s HIS 127 CO 0.03 -0.29 0.13 -0.51 -2.00 0.00 0.00 174.74 172.10 1str s ASP 128 N -1.76 -0.00 -0.15 7.38 1.01 -0.49 -4.96 116.67 117.70 1str s ASP 128 Ca -0.10 -0.11 0.00 0.00 0.71 0.00 0.00 52.55 53.05 1str s ASP 128 Cb -0.05 0.22 0.02 0.00 1.01 0.00 0.00 42.92 44.13 1str s ASP 128 CO -0.02 -0.30 -0.14 -0.89 0.21 0.00 0.00 175.17 174.03 1str s THR 129 N -1.07 1.58 -0.18 -1.27 2.01 -1.26 -1.27 115.64 114.18 1str s THR 129 Ca -0.12 -0.67 -0.11 0.00 0.31 0.00 0.00 61.69 61.11 1str s THR 129 Cb -0.06 -1.50 -0.05 0.00 0.01 0.00 0.00 72.50 70.90 1str s THR 129 CO 0.01 0.43 0.19 -0.36 -0.69 0.00 0.00 174.62 174.21 1str s PHE 130 N 1.48 3.44 0.31 4.92 0.40 -0.35 -3.58 117.98 124.60 1str s PHE 130 Ca 0.04 0.45 0.04 0.00 -0.60 0.00 0.00 56.93 56.86 1str s PHE 130 Cb -0.13 -2.22 -0.06 0.00 0.51 0.00 0.00 43.02 41.12 1str s PHE 130 CO -0.11 0.30 0.05 0.95 0.70 0.00 0.00 175.22 177.12 1str s THR 131 N 0.31 1.13 -1.56 0.64 -4.23 -0.44 -2.08 115.64 109.41 1str s THR 131 Ca 0.12 -2.01 0.11 0.00 -1.18 0.00 0.00 61.69 58.73 1str s THR 131 Cb -0.12 -2.74 0.38 0.00 1.34 0.00 0.00 72.50 71.36 1str s THR 131 CO 0.01 -0.03 1.26 0.29 -0.54 0.00 0.00 174.62 175.61 1str n LYS 132 N -0.64 2.30 0.00 3.99 5.02 -1.26 -0.50 118.16 127.07 1str n LYS 132 Ca -0.02 -1.53 0.05 0.00 -2.02 0.00 0.00 58.31 54.79 1str n LYS 132 Cb 0.66 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 34.21 1str n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16