#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bgp s TRP 9 N 0.00 1.99 0.26 7.33 0.51 -0.81 -4.98 118.94 123.24 2bgp s TRP 9 Ca 0.00 -0.56 0.08 0.00 -2.12 0.00 0.00 56.10 53.50 2bgp s TRP 9 Cb 0.00 -1.32 -0.04 0.00 -0.81 0.00 0.00 33.47 31.30 2bgp s TRP 9 CO 0.00 -0.17 0.16 0.95 -0.51 0.00 0.00 176.95 177.38 2bgp s THR 10 N -0.10 4.21 -0.33 2.01 -4.23 -1.26 -2.47 115.64 113.47 2bgp s THR 10 Ca -0.02 -1.50 -0.01 0.00 -1.18 0.00 0.00 61.69 58.97 2bgp s THR 10 Cb -0.12 -3.29 0.12 0.00 1.34 0.00 0.00 72.50 70.55 2bgp s THR 10 CO 0.02 -0.35 0.17 -0.31 -0.54 0.00 0.00 174.62 173.62 2bgp s TYR 11 N -2.18 0.85 0.37 3.99 1.51 -0.86 -4.92 117.35 116.10 2bgp s TYR 11 Ca 0.33 -1.47 -0.27 0.00 -1.01 0.00 0.00 57.07 54.65 2bgp s TYR 11 Cb -0.07 -1.12 -0.09 0.00 -0.11 0.00 0.00 41.96 40.57 2bgp s TYR 11 CO 0.24 -0.83 1.18 0.95 -1.11 0.00 0.00 175.55 175.98 2bgp s THR 12 N 1.42 3.13 0.16 -0.71 -4.23 -1.26 -2.28 115.64 111.85 2bgp s THR 12 Ca 0.14 1.01 0.35 0.00 -1.18 0.00 0.00 61.69 62.01 2bgp s THR 12 Cb -0.20 -3.60 0.39 0.00 1.34 0.00 0.00 72.50 70.44 2bgp s THR 12 CO -0.15 0.15 2.03 0.00 -0.54 0.00 0.00 174.62 176.10 2bgp h ALA 13 N 2.98 1.00 -0.03 3.99 0.00 -1.73 -2.64 119.26 122.83 2bgp h ALA 13 Ca -0.48 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.32 2bgp h ALA 13 Cb 1.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2bgp h ALA 13 CO 0.64 0.00 -0.49 0.00 0.00 0.00 0.00 179.25 179.40 2bgp h ALA 14 N 2.01 1.13 -0.75 0.00 0.00 -1.87 -2.87 119.26 116.91 2bgp h ALA 14 Ca 0.00 -0.45 -0.39 0.00 0.00 0.00 0.00 54.91 54.07 2bgp h ALA 14 Cb 0.43 -0.08 -0.23 0.00 0.00 0.00 0.00 17.79 17.91 2bgp h ALA 14 CO 0.00 0.62 0.38 0.43 0.00 0.00 0.00 179.25 180.68 2bgp n SER 15 N -3.96 3.27 -0.95 0.00 7.64 -1.00 -4.96 113.62 113.65 2bgp n SER 15 Ca -0.02 -3.68 0.00 0.00 1.01 0.00 0.00 58.87 56.19 2bgp n SER 15 Cb 0.51 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 62.95 2bgp n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bgp n ALA 16 N -1.13 0.00 -3.72 -0.43 0.00 -1.08 -4.93 120.51 109.22 2bgp n ALA 16 Ca 0.50 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.58 2bgp n ALA 16 Cb 1.44 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.76 2bgp n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2bgp s SER 17 N -0.05 5.09 -0.82 0.00 0.01 -1.01 -5.03 113.70 111.89 2bgp s SER 17 Ca 0.00 -1.72 -0.22 0.00 1.31 0.00 0.00 55.95 55.31 2bgp s SER 17 Cb 0.00 -1.77 0.08 0.00 0.21 0.00 0.00 66.02 64.53 2bgp s SER 17 CO 0.00 -0.42 1.16 -0.63 0.41 0.00 0.00 173.24 173.76 2bgp s ILE 18 N 1.18 4.25 -0.22 1.44 -1.09 -1.26 -2.78 121.20 122.72 2bgp s ILE 18 Ca 0.03 -0.64 -0.29 0.00 -2.23 0.00 0.00 60.65 57.52 2bgp s ILE 18 Cb -0.21 -4.83 0.01 0.00 -1.58 0.00 0.00 42.46 35.85 2bgp s ILE 18 CO -0.03 -1.64 1.04 -0.89 -1.23 0.00 0.00 174.94 172.19 2bgp s THR 19 N 4.17 4.69 0.78 2.92 2.01 -1.03 -4.78 115.64 124.40 2bgp s THR 19 Ca 0.32 2.03 -0.15 0.00 0.31 0.00 0.00 61.69 64.20 2bgp s THR 19 Cb -0.09 -4.31 -0.01 0.00 0.01 0.00 0.00 72.50 68.10 2bgp s THR 19 CO 0.02 -0.16 0.54 0.00 -0.69 0.00 0.00 174.62 174.33 2bgp n ALA 20 N 6.18 -1.66 0.80 7.40 0.00 -1.26 -1.11 120.51 130.85 2bgp n ALA 20 Ca 0.12 -0.33 0.03 0.00 0.00 0.00 0.00 53.44 53.26 2bgp n ALA 20 Cb 0.46 -1.87 0.20 0.00 0.00 0.00 0.00 19.45 18.24 2bgp n ALA 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2bgp n PRO 21 N -1.10 0.40 -1.76 0.00 -0.04 -1.26 -3.06 135.00 128.17 2bgp n PRO 21 Ca 0.09 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.15 2bgp n PRO 21 Cb 0.51 -1.26 0.01 0.00 -0.04 0.00 0.00 33.50 32.72 2bgp n PRO 21 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bgp n ALA 22 N -0.76 2.08 -2.86 0.55 0.00 -0.27 -4.38 120.51 114.87 2bgp n ALA 22 Ca 0.05 0.27 -0.13 0.00 0.00 0.00 0.00 53.44 53.63 2bgp n ALA 22 Cb 0.02 -2.39 -0.13 0.00 0.00 0.00 0.00 19.45 16.95 2bgp n ALA 22 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2bgp s GLN 23 N -2.34 0.34 -0.75 0.00 -0.21 0.16 -4.51 119.66 112.35 2bgp s GLN 23 Ca 0.59 -0.41 -0.19 0.00 0.02 0.00 0.00 55.36 55.37 2bgp s GLN 23 Cb -0.46 -0.18 0.12 0.00 1.00 0.00 0.00 33.01 33.48 2bgp s GLN 23 CO 0.59 0.04 0.93 -1.17 -2.12 0.00 0.00 175.29 173.56 2bgp s LEU 24 N -0.81 5.14 -0.63 2.90 1.98 -1.26 0.13 118.68 126.14 2bgp s LEU 24 Ca -0.06 -1.66 -0.19 0.00 -2.89 0.00 0.00 54.13 49.34 2bgp s LEU 24 Cb -0.06 -2.36 0.11 0.00 0.66 0.00 0.00 46.19 44.55 2bgp s LEU 24 CO -0.00 -1.13 0.74 0.68 -1.89 0.00 0.00 176.35 174.75 2bgp s VAL 25 N 2.80 4.85 -1.02 1.68 -7.23 0.34 -4.52 120.40 117.30 2bgp s VAL 25 Ca 0.22 -1.11 -0.06 0.00 -1.81 0.00 0.00 61.98 59.22 2bgp s VAL 25 Cb -0.14 -4.51 -0.07 0.00 0.56 0.00 0.00 36.38 32.22 2bgp s VAL 25 CO 0.00 -1.15 0.90 0.61 -0.31 0.00 0.00 175.10 175.15 2bgp n GLY 26 N 5.22 -1.12 2.57 2.32 0.00 -1.26 -2.20 105.19 110.73 2bgp n GLY 26 Ca -0.06 0.57 -0.21 0.00 0.00 0.00 0.00 46.02 46.32 2bgp n GLY 26 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2bgp n ASN 27 N -3.19 -5.48 -3.88 1.61 5.15 -1.26 -4.95 115.26 103.26 2bgp n ASN 27 Ca -0.07 0.48 -0.24 0.00 -0.60 0.00 0.00 54.58 54.14 2bgp n ASN 27 Cb 0.62 -4.82 -0.17 0.00 -0.53 0.00 0.00 39.78 34.87 2bgp n ASN 27 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2bgp s VAL 28 N -2.78 0.78 0.52 3.44 1.01 -0.93 -4.18 120.40 118.26 2bgp s VAL 28 Ca 0.00 -0.17 -0.21 0.00 0.00 0.00 0.00 61.98 61.60 2bgp s VAL 28 Cb 0.00 -0.82 -0.06 0.00 0.00 0.00 0.00 36.38 35.50 2bgp s VAL 28 CO 0.00 0.31 1.20 -0.83 0.00 0.00 0.00 175.10 175.78 2bgp s GLY 29 N 1.51 2.76 -0.24 4.51 0.00 0.37 0.13 107.32 116.35 2bgp s GLY 29 Ca -0.00 1.00 -0.03 0.00 0.00 0.00 0.00 44.72 45.69 2bgp s GLY 29 CO -0.04 1.43 0.22 -0.54 0.00 0.00 0.00 173.10 174.17 2bgp s GLU 30 N -2.98 0.22 0.45 2.90 2.02 0.35 0.14 118.70 121.81 2bgp s GLU 30 Ca 0.70 -0.06 -0.04 0.00 0.02 0.00 0.00 54.97 55.58 2bgp s GLU 30 Cb -0.30 -1.07 -0.04 0.00 0.10 0.00 0.00 34.13 32.82 2bgp s GLU 30 CO 0.35 -0.84 0.74 -0.51 0.02 0.00 0.00 175.26 175.01 2bgp s LEU 31 N 2.28 3.72 -0.42 1.80 1.02 -0.39 0.38 118.68 127.07 2bgp s LEU 31 Ca 0.08 0.84 0.06 0.00 0.02 0.00 0.00 54.13 55.13 2bgp s LEU 31 Cb -0.15 -3.78 0.17 0.00 0.02 0.00 0.00 46.19 42.45 2bgp s LEU 31 CO -0.23 -0.51 0.55 -1.10 0.02 0.00 0.00 176.35 175.08 2bgp s GLN 32 N -4.60 0.82 0.00 1.70 1.11 -1.26 -2.91 119.66 114.52 2bgp s GLN 32 Ca 0.46 -0.73 0.00 0.00 0.01 0.00 0.00 55.36 55.10 2bgp s GLN 32 Cb -0.10 -0.30 0.00 0.00 -1.01 0.00 0.00 33.01 31.60 2bgp s GLN 32 CO 0.42 -1.23 0.00 0.41 0.01 0.00 0.00 175.29 174.90 2bgp n GLY 33 N 3.98 -0.34 3.74 3.09 0.00 -1.18 -4.66 105.19 109.81 2bgp n GLY 33 Ca 0.14 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.00 2bgp n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bgp s ALA 34 N -1.49 2.43 0.00 4.61 0.00 -1.26 -3.53 121.76 122.52 2bgp s ALA 34 Ca 0.00 1.00 0.00 0.00 0.00 0.00 0.00 51.96 52.96 2bgp s ALA 34 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2bgp s ALA 34 CO 0.00 -1.39 0.00 0.41 0.00 0.00 0.00 175.76 174.78 2bgp n GLY 35 N 0.51 2.39 3.80 0.00 0.00 0.02 -4.67 105.19 107.24 2bgp n GLY 35 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 2bgp n GLY 35 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bgp s SER 36 N 0.05 6.27 -0.30 1.61 1.04 -1.17 -4.40 113.70 116.80 2bgp s SER 36 Ca 0.00 1.85 -0.09 0.00 0.48 0.00 0.00 55.95 58.19 2bgp s SER 36 Cb 0.00 -2.55 0.18 0.00 0.10 0.00 0.00 66.02 63.76 2bgp s SER 36 CO 0.00 -0.83 0.93 0.00 0.98 0.00 0.00 173.24 174.32 2bgp s ALA 37 N -2.17 -3.26 -0.94 5.32 0.00 -0.94 -0.99 121.76 118.78 2bgp s ALA 37 Ca 0.65 1.46 -0.19 0.00 0.00 0.00 0.00 51.96 53.88 2bgp s ALA 37 Cb -0.15 -2.51 0.13 0.00 0.00 0.00 0.00 23.12 20.59 2bgp s ALA 37 CO 0.25 -1.59 1.15 0.14 0.00 0.00 0.00 175.76 175.70 2bgp s VAL 38 N 2.93 4.72 0.29 0.00 -7.23 0.06 -2.45 120.40 118.71 2bgp s VAL 38 Ca 0.09 -1.59 -0.00 0.00 -1.81 0.00 0.00 61.98 58.67 2bgp s VAL 38 Cb -0.09 -4.79 -0.04 0.00 0.56 0.00 0.00 36.38 32.02 2bgp s VAL 38 CO -0.16 -1.52 0.48 -0.63 -0.31 0.00 0.00 175.10 172.96 2bgp s ILE 39 N 2.71 5.14 0.04 -0.62 -1.09 -1.12 -1.87 121.20 124.40 2bgp s ILE 39 Ca 0.33 -0.42 0.05 0.00 -2.23 0.00 0.00 60.65 58.38 2bgp s ILE 39 Cb -0.05 -3.81 -0.02 0.00 -1.58 0.00 0.00 42.46 37.00 2bgp s ILE 39 CO -0.09 -0.39 -0.13 0.26 -1.23 0.00 0.00 174.94 173.35 2bgp s TRP 40 N -2.12 1.15 -0.34 3.97 0.51 0.16 -2.41 118.94 119.86 2bgp s TRP 40 Ca 0.39 -0.37 -0.09 0.00 -2.12 0.00 0.00 56.10 53.91 2bgp s TRP 40 Cb -0.10 -0.68 0.02 0.00 -0.81 0.00 0.00 33.47 31.90 2bgp s TRP 40 CO 0.32 0.03 0.15 0.54 -0.51 0.00 0.00 176.95 177.49 2bgp s ASN 41 N -1.22 5.51 0.25 2.95 2.20 -1.26 -3.11 114.94 120.25 2bgp s ASN 41 Ca 0.00 -0.89 -0.02 0.00 -0.94 0.00 0.00 52.86 51.01 2bgp s ASN 41 Cb -0.08 -1.96 0.01 0.00 -2.00 0.00 0.00 41.25 37.22 2bgp s ASN 41 CO 0.01 -0.31 0.36 1.33 -2.94 0.00 0.00 177.10 175.56 2bgp n VAL 42 N 4.93 0.00 -3.77 3.54 0.24 -1.25 -5.09 118.33 116.93 2bgp n VAL 42 Ca -0.13 -1.18 -0.13 0.00 -2.04 0.00 0.00 64.34 60.86 2bgp n VAL 42 Cb 0.47 0.76 -0.13 0.00 -1.47 0.00 0.00 33.84 33.47 2bgp n VAL 42 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2bgp s ASP 43 N -2.50 -0.21 0.11 -1.34 1.11 -1.26 -2.84 116.67 109.74 2bgp s ASP 43 Ca 0.19 0.43 -0.31 0.00 0.18 0.00 0.00 52.55 53.04 2bgp s ASP 43 Cb -0.01 0.38 -0.08 0.00 1.07 0.00 0.00 42.92 44.29 2bgp s ASP 43 CO 0.14 -0.11 1.38 -0.69 1.18 0.00 0.00 175.17 177.07 2bgp s VAL 44 N 0.59 3.32 -0.02 -1.27 1.01 0.25 -4.82 120.40 119.47 2bgp s VAL 44 Ca -0.04 0.95 -0.21 0.00 0.00 0.00 0.00 61.98 62.68 2bgp s VAL 44 Cb -0.05 -3.61 -0.25 0.00 0.00 0.00 0.00 36.38 32.46 2bgp s VAL 44 CO -0.03 0.08 1.03 1.55 0.00 0.00 0.00 175.10 177.72 2bgp h PRO 45 N 6.77 0.33 -5.82 2.72 0.13 -1.89 -1.58 132.00 132.67 2bgp h PRO 45 Ca -0.42 -0.40 -0.57 0.00 -0.87 0.00 0.00 66.00 63.74 2bgp h PRO 45 Cb 1.21 0.12 -0.14 0.00 0.13 0.00 0.00 31.00 32.33 2bgp h PRO 45 CO 0.86 1.10 -0.70 0.08 -0.23 0.00 0.00 178.00 179.12 2bgp s VAL 46 N -2.99 2.06 -1.18 1.56 1.01 -1.26 -4.74 120.40 114.86 2bgp s VAL 46 Ca -0.14 -2.22 -0.08 0.00 0.00 0.00 0.00 61.98 59.55 2bgp s VAL 46 Cb 0.02 -2.48 0.24 0.00 0.00 0.00 0.00 36.38 34.16 2bgp s VAL 46 CO 0.81 -0.30 1.59 0.35 0.00 0.00 0.00 175.10 177.55 2bgp n THR 47 N -0.67 4.76 0.00 3.92 -2.24 -1.26 -2.88 114.28 115.91 2bgp n THR 47 Ca -0.05 -5.15 0.00 0.00 -2.27 0.00 0.00 64.05 56.57 2bgp n THR 47 Cb 0.63 -2.28 0.00 0.00 -2.10 0.00 0.00 70.33 66.57 2bgp n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bgp n GLY 48 N 2.34 4.58 3.14 3.38 0.00 -0.79 -4.92 105.19 112.91 2bgp n GLY 48 Ca 0.32 -0.53 -0.17 0.00 0.00 0.00 0.00 46.02 45.65 2bgp n GLY 48 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2bgp s GLU 49 N 4.26 0.74 0.09 1.61 2.12 -1.26 -0.28 118.70 125.98 2bgp s GLU 49 Ca 0.00 -0.87 0.01 0.00 0.36 0.00 0.00 54.97 54.47 2bgp s GLU 49 Cb 0.00 -0.69 -0.04 0.00 0.26 0.00 0.00 34.13 33.66 2bgp s GLU 49 CO 0.00 0.15 -0.04 0.71 -0.54 0.00 0.00 175.26 175.54 2bgp s TYR 50 N -1.24 0.78 -0.19 5.30 2.02 -0.88 -4.34 117.35 118.80 2bgp s TYR 50 Ca -0.04 -1.01 -0.13 0.00 -0.37 0.00 0.00 57.07 55.53 2bgp s TYR 50 Cb -0.10 -0.48 -0.05 0.00 -0.40 0.00 0.00 41.96 40.93 2bgp s TYR 50 CO 0.02 -0.27 0.26 -0.98 -1.57 0.00 0.00 175.55 173.01 2bgp s ARG 51 N -3.89 4.20 0.06 -0.62 1.70 0.21 -2.90 118.95 117.71 2bgp s ARG 51 Ca 0.12 -0.01 -0.02 0.00 -0.47 0.00 0.00 55.73 55.36 2bgp s ARG 51 Cb 0.06 -3.47 -0.04 0.00 -0.57 0.00 0.00 34.95 30.94 2bgp s ARG 51 CO -0.05 0.17 0.24 0.42 -1.08 0.00 0.00 175.30 174.99 2bgp s ILE 52 N 0.71 5.36 -0.15 4.99 1.01 0.35 -2.16 121.20 131.30 2bgp s ILE 52 Ca 0.14 -0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.48 2bgp s ILE 52 Cb -0.13 -3.61 0.07 0.00 0.01 0.00 0.00 42.46 38.80 2bgp s ILE 52 CO 0.04 0.17 0.31 0.21 0.00 0.00 0.00 174.94 175.66 2bgp s ASN 53 N -2.36 0.21 -0.25 3.58 2.47 -0.94 -0.24 114.94 117.41 2bgp s ASN 53 Ca 0.34 0.67 -0.11 0.00 0.42 0.00 0.00 52.86 54.19 2bgp s ASN 53 Cb -0.13 0.88 -0.05 0.00 -1.45 0.00 0.00 41.25 40.51 2bgp s ASN 53 CO 0.25 -0.24 0.18 -0.76 -3.72 0.00 0.00 177.10 172.82 2bgp s LEU 54 N 2.48 4.10 -0.13 3.21 1.43 -0.72 -1.86 118.68 127.19 2bgp s LEU 54 Ca 0.01 0.11 -0.03 0.00 -1.03 0.00 0.00 54.13 53.19 2bgp s LEU 54 Cb -0.12 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 43.93 2bgp s LEU 54 CO -0.10 0.03 -0.02 -0.89 0.23 0.00 0.00 176.35 175.60 2bgp s THR 55 N 1.24 4.11 0.04 5.49 2.01 -1.12 -1.46 115.64 125.95 2bgp s THR 55 Ca 0.08 -0.30 -0.25 0.00 0.31 0.00 0.00 61.69 61.54 2bgp s THR 55 Cb -0.14 -2.77 0.06 0.00 0.01 0.00 0.00 72.50 69.65 2bgp s THR 55 CO 0.06 0.53 0.57 -1.66 -0.69 0.00 0.00 174.62 173.44 2bgp s TRP 56 N -0.11 -0.50 -0.49 4.92 1.48 -1.14 0.48 118.94 123.58 2bgp s TRP 56 Ca 0.03 0.60 0.06 0.00 -1.06 0.00 0.00 56.10 55.73 2bgp s TRP 56 Cb -0.13 0.40 0.19 0.00 -1.16 0.00 0.00 33.47 32.77 2bgp s TRP 56 CO 0.02 -0.67 0.76 -1.12 -4.06 0.00 0.00 176.95 171.88 2bgp s SER 57 N -1.92 -1.33 -0.56 -2.66 0.01 -1.25 -2.83 113.70 103.16 2bgp s SER 57 Ca -0.06 -1.48 0.01 0.00 1.31 0.00 0.00 55.95 55.73 2bgp s SER 57 Cb -0.01 1.73 0.14 0.00 0.21 0.00 0.00 66.02 68.10 2bgp s SER 57 CO -0.01 -0.06 0.34 -0.44 0.41 0.00 0.00 173.24 173.48 2bgp s SER 58 N 1.00 4.77 -0.13 2.44 0.01 1.39 -4.79 113.70 118.39 2bgp s SER 58 Ca 0.28 -2.90 -0.05 0.00 1.31 0.00 0.00 55.95 54.58 2bgp s SER 58 Cb 0.01 -1.74 -0.06 0.00 0.21 0.00 0.00 66.02 64.44 2bgp s SER 58 CO -0.06 -0.30 1.23 -2.65 0.41 0.00 0.00 173.24 171.87 2bgp n PRO 59 N 3.33 0.28 0.00 12.44 -0.02 -1.20 -3.54 135.00 146.29 2bgp n PRO 59 Ca 0.06 -0.71 0.00 0.00 -2.02 0.00 0.00 63.50 60.83 2bgp n PRO 59 Cb 0.35 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 2bgp n PRO 59 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2bgp n TYR 60 N 5.50 0.00 -0.76 6.00 0.18 -1.20 -4.97 117.16 121.91 2bgp n TYR 60 Ca 0.13 0.00 -0.25 0.00 1.88 0.00 0.00 57.90 59.66 2bgp n TYR 60 Cb 0.08 0.00 0.09 0.00 -0.38 0.00 0.00 39.34 39.13 2bgp n TYR 60 CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 2bgp n SER 61 N -0.11 -2.67 -3.15 9.48 7.64 -1.26 -4.76 113.62 118.79 2bgp n SER 61 Ca 0.00 -0.13 0.05 0.00 1.01 0.00 0.00 58.87 59.80 2bgp n SER 61 Cb 0.00 -0.67 -0.01 0.00 -1.01 0.00 0.00 64.21 62.52 2bgp n SER 61 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2bgp s SER 62 N -1.43 -0.46 -0.07 6.43 0.01 -1.26 -1.60 113.70 115.31 2bgp s SER 62 Ca 0.34 0.16 -0.31 0.00 1.31 0.00 0.00 55.95 57.45 2bgp s SER 62 Cb -0.00 1.33 0.12 0.00 0.21 0.00 0.00 66.02 67.68 2bgp s SER 62 CO 0.45 -0.08 1.06 -0.75 0.41 0.00 0.00 173.24 174.33 2bgp s LYS 63 N 2.95 0.60 1.02 12.44 2.47 -1.18 -4.86 119.74 133.18 2bgp s LYS 63 Ca 0.12 -0.24 -0.13 0.00 -1.56 0.00 0.00 55.97 54.16 2bgp s LYS 63 Cb -0.06 0.26 0.14 0.00 -1.46 0.00 0.00 37.83 36.71 2bgp s LYS 63 CO -0.17 -0.26 0.73 0.28 0.16 0.00 0.00 175.35 176.08 2bgp n VAL 64 N -0.21 0.00 -3.49 4.02 0.31 -1.25 -2.55 118.33 115.15 2bgp n VAL 64 Ca -0.05 -0.20 -0.11 0.00 -0.01 0.00 0.00 64.34 63.98 2bgp n VAL 64 Cb 0.60 -0.83 -0.02 0.00 -0.91 0.00 0.00 33.84 32.69 2bgp n VAL 64 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2bgp s ASN 65 N -2.28 -0.50 -0.13 4.52 3.84 -0.68 -3.06 114.94 116.64 2bgp s ASN 65 Ca 0.63 -0.09 -0.06 0.00 0.21 0.00 0.00 52.86 53.55 2bgp s ASN 65 Cb -0.21 0.59 -0.04 0.00 -0.55 0.00 0.00 41.25 41.04 2bgp s ASN 65 CO 0.64 -0.98 0.08 -0.89 -2.79 0.00 0.00 177.10 173.15 2bgp s THR 66 N -3.70 4.95 -0.37 -5.21 2.01 -0.80 -3.03 115.64 109.48 2bgp s THR 66 Ca 0.03 0.00 -0.07 0.00 0.31 0.00 0.00 61.69 61.96 2bgp s THR 66 Cb -0.02 -3.15 0.06 0.00 0.01 0.00 0.00 72.50 69.39 2bgp s THR 66 CO -0.10 0.57 0.17 -0.22 -0.69 0.00 0.00 174.62 174.35 2bgp s LEU 67 N -0.59 4.69 -0.72 4.42 1.98 -1.02 -2.18 118.68 125.26 2bgp s LEU 67 Ca 0.11 -1.31 -0.20 0.00 -2.89 0.00 0.00 54.13 49.84 2bgp s LEU 67 Cb -0.12 -1.92 0.10 0.00 0.66 0.00 0.00 46.19 44.92 2bgp s LEU 67 CO 0.02 -0.42 0.92 -0.69 -1.89 0.00 0.00 176.35 174.30 2bgp s VAL 68 N 1.40 4.64 -0.15 1.68 1.01 -0.72 -1.99 120.40 126.28 2bgp s VAL 68 Ca 0.01 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 2bgp s VAL 68 Cb -0.21 -4.64 0.05 0.00 0.00 0.00 0.00 36.38 31.58 2bgp s VAL 68 CO 0.02 -1.35 -0.00 -0.04 0.00 0.00 0.00 175.10 173.73 2bgp s MET 69 N 3.09 0.91 -0.96 2.72 -1.94 -0.52 1.00 119.30 123.59 2bgp s MET 69 Ca 0.21 -0.32 -0.05 0.00 -1.71 0.00 0.00 55.69 53.82 2bgp s MET 69 Cb -0.16 -1.78 0.01 0.00 2.01 0.00 0.00 34.83 34.91 2bgp s MET 69 CO 0.03 -0.48 0.84 -3.47 -0.01 0.00 0.00 175.02 171.92 2bgp n ASP 70 N 5.02 -4.65 -1.56 3.03 2.03 -1.20 -2.44 116.55 116.77 2bgp n ASP 70 Ca -0.09 -0.40 -0.16 0.00 0.52 0.00 0.00 54.79 54.66 2bgp n ASP 70 Cb 0.48 -3.79 -0.03 0.00 -0.72 0.00 0.00 41.12 37.06 2bgp n ASP 70 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2bgp n GLY 71 N -1.51 0.46 2.95 0.27 0.00 -1.23 -4.99 105.19 101.14 2bgp n GLY 71 Ca -0.03 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 2bgp n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bgp s THR 72 N -2.70 1.13 -0.71 2.61 2.01 -1.02 -5.09 115.64 111.86 2bgp s THR 72 Ca 0.00 -0.39 -0.14 0.00 0.31 0.00 0.00 61.69 61.47 2bgp s THR 72 Cb 0.00 -1.10 0.18 0.00 0.01 0.00 0.00 72.50 71.59 2bgp s THR 72 CO 0.00 0.38 0.65 0.00 -0.69 0.00 0.00 174.62 174.96 2bgp s ALA 73 N 1.38 3.90 -0.08 7.40 0.00 -1.24 -1.44 121.76 131.67 2bgp s ALA 73 Ca -0.01 -3.02 -0.27 0.00 0.00 0.00 0.00 51.96 48.67 2bgp s ALA 73 Cb -0.14 -3.39 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 2bgp s ALA 73 CO -0.05 -2.17 0.86 -0.48 0.00 0.00 0.00 175.76 173.92 2bgp s LEU 74 N 0.70 4.28 -0.18 0.00 0.05 -0.84 -4.79 118.68 117.90 2bgp s LEU 74 Ca 0.12 1.36 -0.29 0.00 0.05 0.00 0.00 54.13 55.37 2bgp s LEU 74 Cb -0.18 -3.33 0.00 0.00 -2.05 0.00 0.00 46.19 40.63 2bgp s LEU 74 CO -0.04 -0.29 1.03 -0.55 -0.55 0.00 0.00 176.35 175.95 2bgp s SER 75 N 1.00 7.15 -0.01 1.48 0.15 -1.26 -2.42 113.70 119.79 2bgp s SER 75 Ca 0.43 1.45 -0.24 0.00 0.70 0.00 0.00 55.95 58.29 2bgp s SER 75 Cb -0.18 -2.55 0.05 0.00 -1.71 0.00 0.00 66.02 61.63 2bgp s SER 75 CO 0.19 -0.58 0.52 -0.47 1.20 0.00 0.00 173.24 174.10 2bgp s TYR 76 N 2.74 -0.44 -0.09 3.44 6.14 -1.17 -5.05 117.35 122.92 2bgp s TYR 76 Ca 0.46 0.68 -0.30 0.00 0.64 0.00 0.00 57.07 58.55 2bgp s TYR 76 Cb -0.16 0.29 -0.02 0.00 0.42 0.00 0.00 41.96 42.49 2bgp s TYR 76 CO 0.11 -0.55 1.03 0.00 0.64 0.00 0.00 175.55 176.78 2bgp s ALA 77 N -1.57 3.39 -0.35 3.97 0.00 -1.26 -1.69 121.76 124.24 2bgp s ALA 77 Ca -0.10 0.42 -0.00 0.00 0.00 0.00 0.00 51.96 52.28 2bgp s ALA 77 Cb -0.02 -3.44 0.12 0.00 0.00 0.00 0.00 23.12 19.78 2bgp s ALA 77 CO 0.05 -0.59 0.17 -0.06 0.00 0.00 0.00 175.76 175.33 2bgp s PHE 78 N 1.94 1.42 -0.03 0.00 0.40 -1.06 -4.87 117.98 115.78 2bgp s PHE 78 Ca 0.50 -1.81 -0.23 0.00 -0.60 0.00 0.00 56.93 54.78 2bgp s PHE 78 Cb -0.19 -1.50 -0.04 0.00 0.51 0.00 0.00 43.02 41.79 2bgp s PHE 78 CO 0.19 -0.83 0.69 0.00 0.70 0.00 0.00 175.22 175.97 2bgp s ALA 79 N 1.19 3.38 -0.84 5.36 0.00 -1.24 -3.11 121.76 126.50 2bgp s ALA 79 Ca 0.14 0.14 -0.18 0.00 0.00 0.00 0.00 51.96 52.05 2bgp s ALA 79 Cb -0.20 -2.91 -0.21 0.00 0.00 0.00 0.00 23.12 19.79 2bgp s ALA 79 CO -0.14 -0.00 2.20 0.39 0.00 0.00 0.00 175.76 178.21 2bgp n GLU 80 N 3.32 0.28 -1.54 0.00 4.71 -0.63 -4.84 120.64 121.94 2bgp n GLU 80 Ca -0.03 -0.57 -0.31 0.00 -0.01 0.00 0.00 57.16 56.25 2bgp n GLU 80 Cb 0.51 -2.57 0.07 0.00 -1.01 0.00 0.00 31.44 28.43 2bgp n GLU 80 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2bgp s ALA 81 N 8.79 2.52 -0.19 0.62 0.00 -1.23 -3.22 121.76 129.04 2bgp s ALA 81 Ca 1.00 0.01 0.10 0.00 0.00 0.00 0.00 51.96 53.06 2bgp s ALA 81 Cb -0.37 -3.16 -0.18 0.00 0.00 0.00 0.00 23.12 19.40 2bgp s ALA 81 CO 0.26 -1.42 -0.04 -2.37 0.00 0.00 0.00 175.76 172.19 2bgp n THR 82 N -3.25 1.20 -2.73 0.00 5.66 -1.26 0.42 114.28 114.32 2bgp n THR 82 Ca 0.07 -0.63 -0.41 0.00 -3.05 0.00 0.00 64.05 60.04 2bgp n THR 82 Cb 0.54 -0.83 -0.05 0.00 -1.55 0.00 0.00 70.33 68.44 2bgp n THR 82 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2bgp s VAL 83 N -2.42 4.37 -0.69 1.08 1.01 -1.26 -4.61 120.40 117.87 2bgp s VAL 83 Ca -0.17 2.07 -0.16 0.00 0.00 0.00 0.00 61.98 63.72 2bgp s VAL 83 Cb 0.06 -4.32 -0.16 0.00 0.00 0.00 0.00 36.38 31.96 2bgp s VAL 83 CO 0.62 0.36 1.83 -2.65 0.00 0.00 0.00 175.10 175.27 2bgp n PRO 84 N 2.43 0.13 -2.98 2.72 -0.02 -1.26 -4.70 135.00 131.33 2bgp n PRO 84 Ca 0.01 -0.82 -0.39 0.00 -2.02 0.00 0.00 63.50 60.28 2bgp n PRO 84 Cb 0.49 -2.63 -0.06 0.00 -0.02 0.00 0.00 33.50 31.28 2bgp n PRO 84 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bgp s VAL 85 N 9.47 4.39 -0.21 -1.45 1.01 -1.13 -4.91 120.40 127.57 2bgp s VAL 85 Ca 0.65 1.71 0.01 0.00 0.00 0.00 0.00 61.98 64.35 2bgp s VAL 85 Cb -0.15 -4.14 0.04 0.00 0.00 0.00 0.00 36.38 32.13 2bgp s VAL 85 CO 0.16 0.51 -0.12 0.42 0.00 0.00 0.00 175.10 176.07 2bgp s THR 86 N -1.05 1.84 -0.51 3.92 -4.23 -1.24 -2.91 115.64 111.47 2bgp s THR 86 Ca 0.36 -1.16 -0.19 0.00 -1.18 0.00 0.00 61.69 59.52 2bgp s THR 86 Cb -0.23 -1.88 0.06 0.00 1.34 0.00 0.00 72.50 71.78 2bgp s THR 86 CO 0.26 0.18 0.64 -0.47 -0.54 0.00 0.00 174.62 174.69 2bgp s TYR 87 N 1.30 3.04 -0.01 3.99 5.04 -0.54 -4.80 117.35 125.37 2bgp s TYR 87 Ca -0.02 -0.49 -0.30 0.00 -2.44 0.00 0.00 57.07 53.81 2bgp s TYR 87 Cb -0.17 -3.56 -0.03 0.00 0.35 0.00 0.00 41.96 38.56 2bgp s TYR 87 CO -0.08 -1.04 0.99 0.08 -1.34 0.00 0.00 175.55 174.15 2bgp s VAL 88 N 2.70 4.85 -0.08 3.14 1.01 -1.26 -1.75 120.40 129.02 2bgp s VAL 88 Ca 0.16 2.05 -0.03 0.00 0.00 0.00 0.00 61.98 64.16 2bgp s VAL 88 Cb -0.19 -4.31 0.04 0.00 0.00 0.00 0.00 36.38 31.92 2bgp s VAL 88 CO 0.12 0.14 0.17 -1.10 0.00 0.00 0.00 175.10 174.44 2bgp s GLN 89 N 1.12 0.11 -0.12 2.72 -0.21 0.66 -4.97 119.66 118.97 2bgp s GLN 89 Ca 0.52 0.45 -0.04 0.00 0.02 0.00 0.00 55.36 56.31 2bgp s GLN 89 Cb -0.21 -0.18 -0.04 0.00 1.00 0.00 0.00 33.01 33.59 2bgp s GLN 89 CO 0.27 -0.20 0.04 0.95 -2.12 0.00 0.00 175.29 174.24 2bgp s THR 90 N 1.45 4.66 0.07 -0.19 -4.23 -1.26 0.13 115.64 116.27 2bgp s THR 90 Ca -0.07 -0.10 -0.26 0.00 -1.18 0.00 0.00 61.69 60.08 2bgp s THR 90 Cb -0.11 -3.01 0.07 0.00 1.34 0.00 0.00 72.50 70.79 2bgp s THR 90 CO -0.07 0.57 0.66 -1.59 -0.54 0.00 0.00 174.62 173.66 2bgp s LYS 91 N -0.58 1.15 -0.06 3.99 0.00 -1.14 -4.99 119.74 118.11 2bgp s LYS 91 Ca 0.10 -0.21 -0.17 0.00 0.00 0.00 0.00 55.97 55.70 2bgp s LYS 91 Cb -0.12 0.54 -0.05 0.00 0.00 0.00 0.00 37.83 38.20 2bgp s LYS 91 CO 0.02 -0.46 0.45 0.95 0.00 0.00 0.00 175.35 176.31 2bgp s THR 92 N -2.81 5.09 0.03 3.79 -4.23 -1.26 -2.07 115.64 114.18 2bgp s THR 92 Ca -0.03 0.92 0.06 0.00 -1.18 0.00 0.00 61.69 61.46 2bgp s THR 92 Cb -0.01 -3.78 -0.02 0.00 1.34 0.00 0.00 72.50 70.03 2bgp s THR 92 CO -0.05 0.44 -0.17 -0.76 -0.54 0.00 0.00 174.62 173.54 2bgp s LEU 93 N -0.17 2.14 -0.04 4.79 2.01 0.62 -4.96 118.68 123.07 2bgp s LEU 93 Ca 0.25 -0.45 -0.03 0.00 0.01 0.00 0.00 54.13 53.91 2bgp s LEU 93 Cb -0.16 -0.79 -0.04 0.00 0.01 0.00 0.00 46.19 45.21 2bgp s LEU 93 CO 0.12 0.11 0.11 -0.94 1.01 0.00 0.00 176.35 176.76 2bgp s SER 94 N -1.02 5.96 -0.17 2.29 1.04 -1.26 -1.89 113.70 118.66 2bgp s SER 94 Ca 0.05 0.27 -0.38 0.00 0.48 0.00 0.00 55.95 56.37 2bgp s SER 94 Cb -0.08 -1.81 -0.15 0.00 0.10 0.00 0.00 66.02 64.09 2bgp s SER 94 CO 0.01 0.31 1.71 0.00 0.98 0.00 0.00 173.24 176.25 2bgp n ALA 95 N 1.42 -0.01 0.00 5.32 0.00 -1.14 -4.47 120.51 121.63 2bgp n ALA 95 Ca -0.15 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2bgp n ALA 95 Cb 0.53 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.72 2bgp n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bgp n GLY 96 N 3.96 0.12 3.72 0.00 0.00 -0.59 -4.89 105.19 107.50 2bgp n GLY 96 Ca 0.24 -1.33 -0.37 0.00 0.00 0.00 0.00 46.02 44.56 2bgp n GLY 96 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bgp s ASN 97 N -4.00 6.50 -0.06 1.61 3.84 -1.26 0.85 114.94 122.41 2bgp s ASN 97 Ca 0.00 0.58 -0.04 0.00 0.21 0.00 0.00 52.86 53.61 2bgp s ASN 97 Cb 0.00 -2.22 0.03 0.00 -0.55 0.00 0.00 41.25 38.51 2bgp s ASN 97 CO 0.00 0.05 0.16 -1.00 -2.79 0.00 0.00 177.10 173.51 2bgp s HIS 98 N 0.64 -0.18 -0.10 0.43 3.76 -1.13 -4.92 115.29 113.79 2bgp s HIS 98 Ca 0.19 0.47 -0.22 0.00 -0.15 0.00 0.00 55.06 55.35 2bgp s HIS 98 Cb -0.14 0.01 -0.04 0.00 1.11 0.00 0.00 32.58 33.53 2bgp s HIS 98 CO 0.06 -0.12 0.64 -1.54 -0.85 0.00 0.00 174.74 172.93 2bgp s SER 99 N 0.54 6.87 0.06 1.40 1.04 -1.26 -3.95 113.70 118.39 2bgp s SER 99 Ca -0.04 1.05 0.06 0.00 0.48 0.00 0.00 55.95 57.50 2bgp s SER 99 Cb -0.05 -2.37 -0.03 0.00 0.10 0.00 0.00 66.02 63.67 2bgp s SER 99 CO -0.03 -0.12 -0.16 -0.36 0.98 0.00 0.00 173.24 173.55 2bgp s PHE 100 N 0.97 1.42 -5.00 5.02 0.08 -1.18 -3.22 117.98 116.07 2bgp s PHE 100 Ca 0.34 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.99 2bgp s PHE 100 Cb -0.17 -0.82 0.00 0.00 -0.57 0.00 0.00 43.02 41.46 2bgp s PHE 100 CO 0.15 0.08 0.00 0.41 -0.10 0.00 0.00 175.22 175.76 2bgp n GLY 101 N 1.59 -0.44 2.89 4.36 0.00 0.28 0.39 105.19 114.26 2bgp n GLY 101 Ca -0.19 -0.99 -0.15 0.00 0.00 0.00 0.00 46.02 44.69 2bgp n GLY 101 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bgp s VAL 102 N -3.46 -0.22 0.37 1.61 -7.23 -0.78 -1.75 120.40 108.94 2bgp s VAL 102 Ca 0.00 0.29 0.04 0.00 -1.81 0.00 0.00 61.98 60.50 2bgp s VAL 102 Cb 0.00 -0.31 -0.05 0.00 0.56 0.00 0.00 36.38 36.59 2bgp s VAL 102 CO 0.00 0.12 0.07 0.00 -0.31 0.00 0.00 175.10 174.99 2bgp s ARG 103 N 1.99 1.80 -0.08 4.82 1.04 -0.93 -0.76 118.95 126.84 2bgp s ARG 103 Ca -0.01 -2.05 0.02 0.00 -1.04 0.00 0.00 55.73 52.66 2bgp s ARG 103 Cb -0.12 -0.88 0.01 0.00 -2.04 0.00 0.00 34.95 31.92 2bgp s ARG 103 CO -0.06 -0.29 -0.14 0.08 -0.04 0.00 0.00 175.30 174.85 2bgp s VAL 104 N -3.21 1.33 0.03 4.99 1.01 -0.16 -1.91 120.40 122.49 2bgp s VAL 104 Ca 0.30 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.71 2bgp s VAL 104 Cb 0.06 -1.21 -0.00 0.00 0.00 0.00 0.00 36.38 35.23 2bgp s VAL 104 CO 0.14 0.40 0.04 0.61 0.00 0.00 0.00 175.10 176.29 2bgp n GLY 105 N 3.94 3.47 0.35 4.51 0.00 -1.09 -0.80 105.19 115.57 2bgp n GLY 105 Ca -0.21 -1.54 0.01 0.00 0.00 0.00 0.00 46.02 44.29 2bgp n GLY 105 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2bgp h SER 106 N 0.20 0.85 0.11 1.61 4.64 -1.98 -0.53 113.55 118.45 2bgp h SER 106 Ca -0.03 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 2bgp h SER 106 Cb 0.12 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2bgp h SER 106 CO 0.04 0.60 -0.09 -1.28 -0.87 0.00 0.00 176.83 175.22 2bgp h SER 107 N 0.99 0.00 -1.15 4.97 0.87 -2.01 -3.37 113.55 113.85 2bgp h SER 107 Ca 0.29 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.73 2bgp h SER 107 Cb -0.05 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 61.70 2bgp h SER 107 CO -0.07 0.09 -0.50 -1.81 -0.53 0.00 0.00 176.83 174.01 2bgp s ASP 108 N -6.85 -1.12 0.16 6.23 1.11 -0.40 -4.96 116.67 110.83 2bgp s ASP 108 Ca -0.04 -1.07 -0.14 0.00 0.18 0.00 0.00 52.55 51.48 2bgp s ASP 108 Cb 0.16 1.73 -0.07 0.00 1.07 0.00 0.00 42.92 45.81 2bgp s ASP 108 CO 0.66 -0.16 0.56 -1.66 1.18 0.00 0.00 175.17 175.75 2bgp s TRP 109 N 1.62 3.58 0.00 4.23 1.48 -0.35 -2.67 118.94 126.82 2bgp s TRP 109 Ca 0.19 1.05 0.00 0.00 -1.06 0.00 0.00 56.10 56.28 2bgp s TRP 109 Cb -0.05 -2.37 0.00 0.00 -1.16 0.00 0.00 33.47 29.89 2bgp s TRP 109 CO -0.06 0.40 0.00 0.41 -4.06 0.00 0.00 176.95 173.63 2bgp n GLY 110 N 0.66 2.44 3.86 3.67 0.00 -1.17 -3.88 105.19 110.77 2bgp n GLY 110 Ca -0.04 -1.39 -0.33 0.00 0.00 0.00 0.00 46.02 44.26 2bgp n GLY 110 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bgp s TYR 111 N -1.98 3.44 -0.28 1.61 2.02 -1.26 -3.13 117.35 117.77 2bgp s TYR 111 Ca 0.00 0.97 -0.16 0.00 -0.37 0.00 0.00 57.07 57.51 2bgp s TYR 111 Cb 0.00 -2.33 0.11 0.00 -0.40 0.00 0.00 41.96 39.34 2bgp s TYR 111 CO 0.00 0.26 0.82 1.41 -1.57 0.00 0.00 175.55 176.48 2bgp s MET 112 N -2.72 0.55 0.84 -0.62 -2.45 -1.14 -4.12 119.30 109.64 2bgp s MET 112 Ca 0.47 0.96 -0.12 0.00 -1.25 0.00 0.00 55.69 55.75 2bgp s MET 112 Cb -0.12 0.11 0.11 0.00 1.25 0.00 0.00 34.83 36.19 2bgp s MET 112 CO 0.20 -0.12 1.20 1.21 1.05 0.00 0.00 175.02 178.57 2bgp s ASN 113 N 1.49 4.12 -0.22 1.11 2.47 -1.26 -1.26 114.94 121.40 2bgp s ASN 113 Ca -0.10 0.57 -0.07 0.00 0.42 0.00 0.00 52.86 53.69 2bgp s ASN 113 Cb -0.04 -0.95 0.10 0.00 -1.45 0.00 0.00 41.25 38.91 2bgp s ASN 113 CO -0.18 -2.12 0.47 -0.69 -3.72 0.00 0.00 177.10 170.86 2bgp s VAL 114 N -3.63 -0.73 -0.18 -5.21 1.01 0.37 -4.80 120.40 107.24 2bgp s VAL 114 Ca 0.65 0.12 -0.15 0.00 0.00 0.00 0.00 61.98 62.60 2bgp s VAL 114 Cb -0.09 -0.75 -0.06 0.00 0.00 0.00 0.00 36.38 35.48 2bgp s VAL 114 CO 0.50 0.04 -0.28 1.41 0.00 0.00 0.00 175.10 176.77 2bgp n HIS 115 N 5.40 0.31 -3.65 5.22 8.25 0.18 0.14 115.22 131.07 2bgp n HIS 115 Ca -0.09 0.13 -0.02 0.00 -0.26 0.00 0.00 57.72 57.49 2bgp n HIS 115 Cb 0.49 -0.64 -0.06 0.00 1.12 0.00 0.00 29.99 30.91 2bgp n HIS 115 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2bgp s SER 116 N -6.01 -0.02 0.46 0.41 0.15 -1.20 -3.15 113.70 104.34 2bgp s SER 116 Ca -0.26 0.03 -0.04 0.00 0.70 0.00 0.00 55.95 56.38 2bgp s SER 116 Cb 0.04 0.03 -0.04 0.00 -1.71 0.00 0.00 66.02 64.35 2bgp s SER 116 CO 0.38 -0.01 0.75 -0.76 1.20 0.00 0.00 173.24 174.80 2bgp s LEU 117 N -0.46 3.69 -0.00 3.45 1.02 -0.97 -2.78 118.68 122.63 2bgp s LEU 117 Ca 0.09 0.86 0.02 0.00 0.02 0.00 0.00 54.13 55.11 2bgp s LEU 117 Cb -0.03 -3.80 -0.00 0.00 0.02 0.00 0.00 46.19 42.37 2bgp s LEU 117 CO -0.13 -0.53 -0.05 -0.75 0.02 0.00 0.00 176.35 174.91 2bgp s LYS 118 N -4.65 0.40 -0.25 1.70 2.47 -0.77 -2.04 119.74 116.60 2bgp s LYS 118 Ca 0.46 -0.21 -0.02 0.00 -1.56 0.00 0.00 55.97 54.65 2bgp s LYS 118 Cb -0.10 -0.37 0.13 0.00 -1.46 0.00 0.00 37.83 36.03 2bgp s LYS 118 CO 0.43 0.10 0.35 -0.51 0.16 0.00 0.00 175.35 175.88 2bgp s LEU 119 N -0.20 -0.53 0.47 5.43 1.43 -1.03 -2.21 118.68 122.04 2bgp s LEU 119 Ca 0.01 -0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.13 2bgp s LEU 119 Cb -0.02 0.94 -0.02 0.00 0.03 0.00 0.00 46.19 47.12 2bgp s LEU 119 CO -0.00 -0.32 0.06 -1.61 0.23 0.00 0.00 176.35 174.71 2bgp s GLU 120 N 2.49 2.09 -1.39 1.70 2.02 -0.92 -1.93 118.70 122.77 2bgp s GLU 120 Ca 0.11 -2.31 -0.09 0.00 0.02 0.00 0.00 54.97 52.70 2bgp s GLU 120 Cb -0.15 -1.15 -0.09 0.00 0.10 0.00 0.00 34.13 32.84 2bgp s GLU 120 CO -0.18 -0.41 2.80 1.28 0.02 0.00 0.00 175.26 178.76 2bgp n LEU 121 N -1.12 7.73 -3.09 1.80 7.99 -1.26 -0.62 117.00 128.43 2bgp n LEU 121 Ca -0.14 -3.97 -0.00 0.00 -0.01 0.00 0.00 56.01 51.89 2bgp n LEU 121 Cb 0.66 -1.44 -0.00 0.00 -0.11 0.00 0.00 43.42 42.53 2bgp n LEU 121 CO 0.37 1.73 -0.39 0.18 -1.51 0.00 0.00 177.39 177.77 2bgp n LEU 122 N 3.66 -4.44 0.00 2.23 4.32 -1.26 -4.90 117.00 116.62 2bgp n LEU 122 Ca 0.69 0.73 0.00 0.00 -0.02 0.00 0.00 56.01 57.42 2bgp n LEU 122 Cb 0.24 -1.84 0.00 0.00 -1.62 0.00 0.00 43.42 40.20 2bgp n LEU 122 CO 0.79 -2.06 0.00 0.61 -1.22 0.00 0.00 177.39 175.50