#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g2x s TYR 3 N 0.00 2.76 0.28 0.00 2.02 -1.26 -2.03 117.35 119.11 2g2x s TYR 3 Ca 0.00 -0.13 -0.02 0.00 -0.37 0.00 0.00 57.07 56.55 2g2x s TYR 3 Cb 0.00 -1.54 0.01 0.00 -0.40 0.00 0.00 41.96 40.03 2g2x s TYR 3 CO 0.00 0.34 0.39 0.91 -1.57 0.00 0.00 175.55 175.62 2g2x n TRP 4 N 1.42 -1.27 -4.10 2.71 7.02 -0.67 -1.20 117.44 121.35 2g2x n TRP 4 Ca -0.15 -1.82 -0.14 0.00 -1.02 0.00 0.00 57.50 54.37 2g2x n TRP 4 Cb 0.52 0.45 -0.06 0.00 -2.42 0.00 0.00 31.31 29.80 2g2x n TRP 4 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 2g2x s LEU 5 N 0.00 0.95 0.02 -0.99 0.20 -1.26 -0.77 118.68 116.83 2g2x s LEU 5 Ca 0.22 -1.38 0.01 0.00 0.69 0.00 0.00 54.13 53.67 2g2x s LEU 5 Cb -0.01 1.30 -0.02 0.00 -0.43 0.00 0.00 46.19 47.03 2g2x s LEU 5 CO 0.16 -1.18 -0.04 -0.54 -0.29 0.00 0.00 176.35 174.46 2g2x s LYS 7 N -3.44 0.32 -0.21 1.98 1.02 0.09 -4.28 119.74 115.23 2g2x s LYS 7 Ca 0.31 -0.52 -0.15 0.00 0.02 0.00 0.00 55.97 55.62 2g2x s LYS 7 Cb 0.01 -0.04 0.06 0.00 -0.52 0.00 0.00 37.83 37.34 2g2x s LYS 7 CO 0.17 -0.01 0.54 0.45 -0.92 0.00 0.00 175.35 175.59 2g2x s SER 8 N -1.18 -0.64 -0.10 2.83 0.15 0.06 -4.92 113.70 109.90 2g2x s SER 8 Ca -0.11 1.14 -0.30 0.00 0.70 0.00 0.00 55.95 57.38 2g2x s SER 8 Cb -0.08 1.08 -0.02 0.00 -1.71 0.00 0.00 66.02 65.28 2g2x s SER 8 CO -0.00 -0.20 1.22 -0.70 1.20 0.00 0.00 173.24 174.75 2g2x s GLU 9 N 0.93 4.31 0.25 5.44 2.12 -1.26 -2.20 118.70 128.28 2g2x s GLU 9 Ca -0.05 1.66 -0.13 0.00 0.36 0.00 0.00 54.97 56.81 2g2x s GLU 9 Cb -0.05 -3.63 0.33 0.00 0.26 0.00 0.00 34.13 31.03 2g2x s GLU 9 CO -0.08 -0.54 1.57 -1.35 -0.54 0.00 0.00 175.26 174.31 2g2x h PRO 10 N 7.72 -0.02 0.00 4.30 0.11 -1.73 0.21 132.00 142.59 2g2x h PRO 10 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2g2x h PRO 10 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2g2x h PRO 10 CO 0.91 -0.01 0.00 -0.44 -0.21 0.00 0.00 178.00 178.25 2g2x h ASP 11 N -0.02 0.00 0.08 -2.05 3.32 -1.93 -2.58 116.42 113.24 2g2x h ASP 11 Ca 0.39 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.09 2g2x h ASP 11 Cb 0.64 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.16 2g2x h ASP 11 CO -0.95 0.00 -1.97 -0.62 -1.72 0.00 0.00 179.24 173.99 2g2x n GLU 12 N -2.56 0.70 -3.17 3.56 1.02 0.52 -4.93 120.64 115.78 2g2x n GLU 12 Ca 0.00 0.30 0.04 0.00 -0.02 0.00 0.00 57.16 57.49 2g2x n GLU 12 Cb 0.19 -1.68 -0.01 0.00 -0.02 0.00 0.00 31.44 29.92 2g2x n GLU 12 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2g2x s LEU 13 N -7.14 -0.98 0.40 -4.62 2.96 0.02 -5.03 118.68 104.28 2g2x s LEU 13 Ca -0.26 0.65 0.08 0.00 -0.22 0.00 0.00 54.13 54.38 2g2x s LEU 13 Cb 0.07 1.84 -0.00 0.00 0.50 0.00 0.00 46.19 48.60 2g2x s LEU 13 CO 0.70 -0.18 0.48 -0.94 -1.32 0.00 0.00 176.35 175.08 2g2x s SER 14 N 2.89 5.52 0.31 3.68 1.04 -1.01 -4.14 113.70 121.99 2g2x s SER 14 Ca 0.11 -0.47 0.03 0.00 0.48 0.00 0.00 55.95 56.10 2g2x s SER 14 Cb -0.13 -0.76 0.50 0.00 0.10 0.00 0.00 66.02 65.73 2g2x s SER 14 CO -0.17 -0.64 1.79 -0.29 0.98 0.00 0.00 173.24 174.91 2g2x h ILE 15 N 0.84 1.24 -0.33 -1.02 6.09 -1.94 -1.83 117.51 120.56 2g2x h ILE 15 Ca -0.42 -1.07 -0.02 0.00 -1.37 0.00 0.00 64.86 61.99 2g2x h ILE 15 Cb 1.27 1.19 -0.01 0.00 0.47 0.00 0.00 36.82 39.74 2g2x h ILE 15 CO 0.51 0.35 0.12 -0.33 -3.07 0.00 0.00 178.15 175.73 2g2x h GLU 16 N 0.45 0.49 -0.44 2.19 3.07 -1.95 -1.94 114.58 116.45 2g2x h GLU 16 Ca 0.08 -0.09 -0.04 0.00 -0.50 0.00 0.00 59.36 58.81 2g2x h GLU 16 Cb 0.53 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.34 2g2x h GLU 16 CO 0.03 0.50 0.10 0.00 -1.40 0.00 0.00 179.01 178.24 2g2x h ALA 17 N 0.97 1.35 -0.42 3.43 0.00 -1.87 -1.87 119.26 120.85 2g2x h ALA 17 Ca 0.11 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 2g2x h ALA 17 Cb 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2g2x h ALA 17 CO -0.01 0.46 -0.15 1.25 0.00 0.00 0.00 179.25 180.81 2g2x h LEU 18 N 0.64 0.78 -0.98 0.00 5.85 -1.06 0.01 115.31 120.55 2g2x h LEU 18 Ca 0.15 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 2g2x h LEU 18 Cb 0.25 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2g2x h LEU 18 CO -0.00 0.93 0.31 0.00 -0.34 0.00 0.00 178.44 179.34 2g2x h ALA 19 N 1.13 1.20 -0.09 1.25 0.00 -0.61 -0.74 119.26 121.40 2g2x h ALA 19 Ca 0.11 -0.16 -0.21 0.00 0.00 0.00 0.00 54.91 54.65 2g2x h ALA 19 Cb 0.64 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2g2x h ALA 19 CO 0.04 0.60 -0.79 0.00 0.00 0.00 0.00 179.25 179.10 2g2x h ARG 20 N 1.03 0.55 0.00 0.00 3.08 -0.91 -3.26 114.38 114.87 2g2x h ARG 20 Ca 0.24 -0.47 -0.14 0.00 0.07 0.00 0.00 59.98 59.69 2g2x h ARG 20 Cb 0.16 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2g2x h ARG 20 CO -0.03 1.10 -0.66 -0.07 -1.07 0.00 0.00 179.97 179.25 2g2x h LEU 21 N 0.37 0.00 0.00 3.04 3.38 -0.76 -3.48 115.31 117.86 2g2x h LEU 21 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2g2x h LEU 21 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 2g2x h LEU 21 CO 0.15 0.66 0.00 0.61 0.09 0.00 0.00 178.44 179.94 2g2x n GLY 22 N 0.50 2.04 2.99 0.83 0.00 -0.30 -4.84 105.19 106.41 2g2x n GLY 22 Ca -0.01 -0.41 -0.20 0.00 0.00 0.00 0.00 46.02 45.41 2g2x n GLY 22 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2g2x s GLU 23 N 0.00 0.86 0.05 1.61 2.12 -1.26 -3.61 118.70 118.47 2g2x s GLU 23 Ca 0.00 -0.28 -0.01 0.00 0.36 0.00 0.00 54.97 55.05 2g2x s GLU 23 Cb 0.00 -0.81 -0.04 0.00 0.26 0.00 0.00 34.13 33.54 2g2x s GLU 23 CO 0.00 0.11 -0.03 0.00 -0.54 0.00 0.00 175.26 174.80 2g2x s ALA 24 N 0.16 0.49 0.03 6.30 0.00 -0.32 -4.98 121.76 123.46 2g2x s ALA 24 Ca -0.02 -1.14 -0.21 0.00 0.00 0.00 0.00 51.96 50.58 2g2x s ALA 24 Cb -0.08 0.25 -0.06 0.00 0.00 0.00 0.00 23.12 23.23 2g2x s ALA 24 CO 0.00 -0.33 0.63 0.50 0.00 0.00 0.00 175.76 176.55 2g2x s ARG 25 N -3.60 4.33 -0.78 0.00 3.52 -1.26 -0.49 118.95 120.67 2g2x s ARG 25 Ca 0.04 0.81 -0.12 0.00 -0.13 0.00 0.00 55.73 56.33 2g2x s ARG 25 Cb 0.06 -3.31 0.20 0.00 -1.56 0.00 0.00 34.95 30.34 2g2x s ARG 25 CO -0.09 0.44 0.70 -0.46 -0.81 0.00 0.00 175.30 175.08 2g2x s TRP 26 N -0.47 3.68 0.47 5.12 -0.11 0.50 -4.93 118.94 123.20 2g2x s TRP 26 Ca 0.32 -2.07 0.06 0.00 1.22 0.00 0.00 56.10 55.63 2g2x s TRP 26 Cb -0.19 -3.72 -0.01 0.00 -1.50 0.00 0.00 33.47 28.05 2g2x s TRP 26 CO 0.19 -0.97 0.26 0.16 -4.62 0.00 0.00 176.95 171.98 2g2x s ASP 27 N 2.01 4.54 0.00 5.86 1.47 -1.26 -3.29 116.67 125.99 2g2x s ASP 27 Ca 0.17 -1.17 0.00 0.00 1.18 0.00 0.00 52.55 52.73 2g2x s ASP 27 Cb -0.13 -0.04 0.00 0.00 -0.34 0.00 0.00 42.92 42.41 2g2x s ASP 27 CO -0.07 -0.80 0.00 0.61 0.68 0.00 0.00 175.17 175.59 2g2x n GLY 28 N -1.47 0.76 3.67 2.12 0.00 -1.26 -5.03 105.19 103.98 2g2x n GLY 28 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 2g2x n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g2x s VAL 29 N -2.98 4.10 -0.11 1.61 1.01 -1.26 -4.87 120.40 117.90 2g2x s VAL 29 Ca 0.00 1.36 0.14 0.00 0.00 0.00 0.00 61.98 63.48 2g2x s VAL 29 Cb 0.00 -3.88 0.30 0.00 0.00 0.00 0.00 36.38 32.80 2g2x s VAL 29 CO 0.00 -0.09 1.15 0.54 0.00 0.00 0.00 175.10 176.69 2g2x n ARG 30 N 6.40 0.95 -3.85 2.72 5.12 -1.26 -4.73 116.66 122.01 2g2x n ARG 30 Ca 0.14 -2.43 -0.36 0.00 -1.93 0.00 0.00 57.85 53.27 2g2x n ARG 30 Cb 0.45 -1.13 -0.13 0.00 -1.16 0.00 0.00 32.46 30.49 2g2x n ARG 30 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2g2x s ASN 31 N -2.52 4.91 0.21 0.55 3.84 -1.26 -5.02 114.94 115.66 2g2x s ASN 31 Ca 0.28 -0.24 -0.10 0.00 0.21 0.00 0.00 52.86 53.02 2g2x s ASN 31 Cb 0.27 -1.87 0.31 0.00 -0.55 0.00 0.00 41.25 39.42 2g2x s ASN 31 CO -0.04 -0.01 1.68 1.88 -2.79 0.00 0.00 177.10 177.83 2g2x h TYR 32 N 8.03 0.08 -0.28 0.43 0.05 -1.99 0.11 116.97 123.40 2g2x h TYR 32 Ca -0.38 0.04 -0.03 0.00 0.05 0.00 0.00 58.73 58.41 2g2x h TYR 32 Cb 1.17 0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.96 2g2x h TYR 32 CO 0.64 -0.11 0.08 0.37 -1.05 0.00 0.00 178.16 178.09 2g2x h GLN 33 N 0.18 0.45 -1.00 4.88 5.75 -1.98 -0.04 115.11 123.34 2g2x h GLN 33 Ca 0.33 -0.10 0.02 0.00 -0.15 0.00 0.00 58.65 58.75 2g2x h GLN 33 Cb 0.52 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.95 2g2x h GLN 33 CO -0.47 0.52 0.66 0.00 -2.65 0.00 0.00 178.83 176.89 2g2x h ALA 34 N 0.91 1.31 -0.27 3.38 0.00 -1.67 -0.82 119.26 122.11 2g2x h ALA 34 Ca 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2g2x h ALA 34 Cb 0.27 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2g2x h ALA 34 CO -0.00 0.61 0.18 -0.09 0.00 0.00 0.00 179.25 179.95 2g2x h ARG 35 N 1.31 0.35 -0.66 0.00 2.43 -0.37 -1.48 114.38 115.97 2g2x h ARG 35 Ca 0.38 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.57 2g2x h ARG 35 Cb -0.08 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.36 2g2x h ARG 35 CO -0.10 0.23 0.43 -0.91 -1.51 0.00 0.00 179.97 178.11 2g2x h ASN 36 N 0.36 0.65 -0.06 -3.80 2.35 0.17 -0.71 115.58 114.54 2g2x h ASN 36 Ca 0.10 -0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.70 2g2x h ASN 36 Cb -0.03 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 2g2x h ASN 36 CO -0.03 0.44 -0.45 -0.26 -1.65 0.00 0.00 177.43 175.48 2g2x h PHE 37 N 0.76 0.74 -0.89 1.19 0.04 -0.60 -2.78 116.94 115.39 2g2x h PHE 37 Ca 0.27 -0.23 0.03 0.00 2.80 0.00 0.00 57.97 60.83 2g2x h PHE 37 Cb 0.12 -0.15 -0.05 0.00 2.20 0.00 0.00 35.95 38.07 2g2x h PHE 37 CO -0.00 0.95 0.58 -0.07 -0.60 0.00 0.00 178.31 179.17 2g2x h LEU 38 N 0.49 0.98 0.00 1.54 3.38 -0.14 -0.96 115.31 120.60 2g2x h LEU 38 Ca 0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2g2x h LEU 38 Cb 0.98 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2g2x h LEU 38 CO 0.09 0.69 0.00 0.54 0.09 0.00 0.00 178.44 179.85 2g2x n ARG 39 N -4.50 0.08 -2.33 1.13 1.74 -0.62 -4.35 116.66 107.81 2g2x n ARG 39 Ca 0.11 0.20 -0.40 0.00 -0.77 0.00 0.00 57.85 56.99 2g2x n ARG 39 Cb 0.06 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.02 2g2x n ARG 39 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2g2x n ALA 40 N -1.43 6.34 -3.52 7.54 0.00 -0.37 -4.87 120.51 124.22 2g2x n ALA 40 Ca 0.05 -4.33 -0.11 0.00 0.00 0.00 0.00 53.44 49.04 2g2x n ALA 40 Cb 0.16 -2.31 -0.04 0.00 0.00 0.00 0.00 19.45 17.26 2g2x n ALA 40 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2g2x s SER 42 N -0.78 -0.45 0.22 0.00 0.01 -1.26 -4.97 113.70 106.46 2g2x s SER 42 Ca 0.45 0.25 -0.31 0.00 1.31 0.00 0.00 55.95 57.66 2g2x s SER 42 Cb 0.23 0.42 -0.10 0.00 0.21 0.00 0.00 66.02 66.78 2g2x s SER 42 CO -0.16 -0.59 1.54 -0.69 0.41 0.00 0.00 173.24 173.75 2g2x s VAL 43 N -2.28 2.48 0.00 3.43 1.01 -1.26 -1.54 120.40 122.25 2g2x s VAL 43 Ca -0.01 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.35 2g2x s VAL 43 Cb -0.01 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.13 2g2x s VAL 43 CO -0.03 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.72 2g2x n GLY 44 N 2.99 2.52 3.75 4.51 0.00 -0.03 -5.00 105.19 113.94 2g2x n GLY 44 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2g2x n GLY 44 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2g2x s ASP 45 N -1.36 5.18 0.18 1.61 1.01 -0.59 -4.74 116.67 117.96 2g2x s ASP 45 Ca 0.00 2.41 0.10 0.00 0.71 0.00 0.00 52.55 55.77 2g2x s ASP 45 Cb 0.00 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 2g2x s ASP 45 CO 0.00 -1.60 -0.17 -1.61 0.21 0.00 0.00 175.17 171.99 2g2x s GLU 46 N -3.31 1.77 0.01 8.23 2.02 -0.86 -0.67 118.70 125.89 2g2x s GLU 46 Ca 0.77 -1.38 -0.08 0.00 0.02 0.00 0.00 54.97 54.31 2g2x s GLU 46 Cb -0.31 -2.01 0.00 0.00 0.10 0.00 0.00 34.13 31.91 2g2x s GLU 46 CO 0.34 0.42 0.15 -0.59 0.02 0.00 0.00 175.26 175.60 2g2x s PHE 47 N -1.61 0.06 0.04 1.61 -0.71 -0.10 -1.67 117.98 115.61 2g2x s PHE 47 Ca 0.22 -0.19 -0.30 0.00 -1.04 0.00 0.00 56.93 55.62 2g2x s PHE 47 Cb -0.09 -0.05 -0.04 0.00 -1.21 0.00 0.00 43.02 41.63 2g2x s PHE 47 CO 0.12 -0.32 1.03 -0.06 -1.34 0.00 0.00 175.22 174.65 2g2x s PHE 48 N -1.72 3.64 -0.47 3.49 0.08 0.05 -1.85 117.98 121.20 2g2x s PHE 48 Ca -0.12 1.63 -0.23 0.00 0.12 0.00 0.00 56.93 58.33 2g2x s PHE 48 Cb -0.06 -3.18 0.03 0.00 -0.57 0.00 0.00 43.02 39.24 2g2x s PHE 48 CO 0.00 -0.28 0.79 0.12 -0.10 0.00 0.00 175.22 175.75 2g2x s PHE 49 N 0.75 2.97 -0.28 0.36 5.36 0.56 -4.46 117.98 123.24 2g2x s PHE 49 Ca 0.52 0.09 -0.10 0.00 -0.96 0.00 0.00 56.93 56.48 2g2x s PHE 49 Cb -0.24 -3.70 -0.04 0.00 -0.34 0.00 0.00 43.02 38.70 2g2x s PHE 49 CO 0.29 -1.04 0.15 -0.47 -1.46 0.00 0.00 175.22 172.69 2g2x s TYR 50 N 3.33 3.17 -0.45 10.12 5.04 -1.26 -0.75 117.35 136.54 2g2x s TYR 50 Ca 0.29 -0.15 -0.28 0.00 -2.44 0.00 0.00 57.07 54.49 2g2x s TYR 50 Cb -0.13 -2.33 0.03 0.00 0.35 0.00 0.00 41.96 39.88 2g2x s TYR 50 CO 0.21 -0.27 1.08 -1.01 -1.34 0.00 0.00 175.55 174.23 2g2x s HIS 51 N 1.69 2.88 0.43 4.97 3.76 0.27 -0.76 115.29 128.54 2g2x s HIS 51 Ca 0.07 0.71 0.07 0.00 -0.15 0.00 0.00 55.06 55.75 2g2x s HIS 51 Cb -0.16 -4.23 -0.04 0.00 1.11 0.00 0.00 32.58 29.26 2g2x s HIS 51 CO 0.08 -1.16 0.18 -1.54 -0.85 0.00 0.00 174.74 171.45 2g2x s SER 52 N 2.31 4.40 -1.49 1.40 1.04 -0.93 -1.96 113.70 118.45 2g2x s SER 52 Ca 0.45 -1.14 -0.06 0.00 0.48 0.00 0.00 55.95 55.68 2g2x s SER 52 Cb -0.08 -0.34 0.05 0.00 0.10 0.00 0.00 66.02 65.74 2g2x s SER 52 CO 0.28 -0.60 0.58 -1.20 0.98 0.00 0.00 173.24 173.28 2g2x n SER 53 N -1.27 -1.59 -4.06 7.02 7.64 -1.26 -4.17 113.62 115.93 2g2x n SER 53 Ca -0.02 -0.98 -0.11 0.00 1.01 0.00 0.00 58.87 58.77 2g2x n SER 53 Cb 0.65 -3.11 -0.07 0.00 -1.01 0.00 0.00 64.21 60.66 2g2x n SER 53 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2g2x h PRO 55 N 2.41 0.02 -2.28 0.00 0.13 -1.96 -3.30 132.00 127.01 2g2x h PRO 55 Ca -0.30 -0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.23 2g2x h PRO 55 Cb 1.25 -0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.97 2g2x h PRO 55 CO 0.43 0.15 -0.73 0.94 -0.23 0.00 0.00 178.00 178.56 2g2x n GLN 56 N -4.38 1.88 -2.06 0.86 7.27 -1.26 -5.10 117.38 114.60 2g2x n GLN 56 Ca -0.02 -4.23 -0.40 0.00 0.07 0.00 0.00 57.00 52.42 2g2x n GLN 56 Cb 0.21 -1.99 -0.01 0.00 2.41 0.00 0.00 30.24 30.86 2g2x n GLN 56 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2g2x s PRO 57 N -1.89 4.22 0.00 3.69 0.04 -1.25 -4.88 135.00 134.93 2g2x s PRO 57 Ca 0.36 2.25 0.00 0.00 0.04 0.00 0.00 61.00 63.65 2g2x s PRO 57 Cb 0.12 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.69 2g2x s PRO 57 CO -0.07 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.07 2g2x n GLY 58 N 0.72 -0.65 3.64 0.56 0.00 -0.83 -1.29 105.19 107.33 2g2x n GLY 58 Ca 0.01 -1.38 -0.43 0.00 0.00 0.00 0.00 46.02 44.22 2g2x n GLY 58 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2g2x s ILE 59 N -1.91 4.58 -0.55 -0.61 1.01 -0.42 -0.56 121.20 122.74 2g2x s ILE 59 Ca 0.00 1.67 0.22 0.00 0.00 0.00 0.00 60.65 62.54 2g2x s ILE 59 Cb 0.00 -4.36 -0.18 0.00 0.01 0.00 0.00 42.46 37.94 2g2x s ILE 59 CO 0.00 -0.41 0.89 0.00 0.00 0.00 0.00 174.94 175.42 2g2x n ALA 60 N 6.69 3.49 0.00 9.38 0.00 0.07 -0.63 120.51 139.52 2g2x n ALA 60 Ca 0.10 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.09 2g2x n ALA 60 Cb 0.47 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 19.03 2g2x n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g2x n GLY 61 N 1.36 -1.00 3.23 0.00 0.00 -1.20 -0.88 105.19 106.69 2g2x n GLY 61 Ca 0.01 -0.88 -0.26 0.00 0.00 0.00 0.00 46.02 44.89 2g2x n GLY 61 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2g2x s ILE 62 N -3.00 1.60 0.24 -0.61 1.01 0.54 -0.32 121.20 120.65 2g2x s ILE 62 Ca 0.00 -1.04 0.01 0.00 0.00 0.00 0.00 60.65 59.62 2g2x s ILE 62 Cb 0.00 -1.37 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 2g2x s ILE 62 CO 0.00 0.30 0.18 0.00 0.00 0.00 0.00 174.94 175.42 2g2x s ALA 63 N -0.66 1.34 0.12 9.38 0.00 -0.77 -0.82 121.76 130.35 2g2x s ALA 63 Ca 0.07 -1.79 0.04 0.00 0.00 0.00 0.00 51.96 50.28 2g2x s ALA 63 Cb -0.08 1.41 -0.04 0.00 0.00 0.00 0.00 23.12 24.41 2g2x s ALA 63 CO 0.01 -0.62 -0.09 -0.98 0.00 0.00 0.00 175.76 174.08 2g2x s ARG 64 N -3.94 0.94 -0.21 0.00 1.70 0.17 -0.92 118.95 116.68 2g2x s ARG 64 Ca 0.39 -1.33 -0.25 0.00 -0.47 0.00 0.00 55.73 54.08 2g2x s ARG 64 Cb 0.05 -0.51 -0.01 0.00 -0.57 0.00 0.00 34.95 33.92 2g2x s ARG 64 CO 0.16 0.06 0.82 0.42 -1.08 0.00 0.00 175.30 175.68 2g2x s ILE 65 N -3.08 4.87 -1.26 4.99 -1.09 0.15 -1.25 121.20 124.52 2g2x s ILE 65 Ca 0.12 1.57 0.16 0.00 -2.23 0.00 0.00 60.65 60.27 2g2x s ILE 65 Cb 0.01 -4.11 -0.06 0.00 -1.58 0.00 0.00 42.46 36.72 2g2x s ILE 65 CO -0.01 -0.02 0.80 0.35 -1.23 0.00 0.00 174.94 174.83 2g2x n THR 66 N 5.00 0.00 -3.65 2.92 -2.24 0.12 -0.85 114.28 115.58 2g2x n THR 66 Ca 0.05 -0.27 -0.04 0.00 -2.27 0.00 0.00 64.05 61.52 2g2x n THR 66 Cb 0.48 1.13 -0.06 0.00 -2.10 0.00 0.00 70.33 69.78 2g2x n THR 66 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2g2x s ARG 67 N -2.09 0.50 1.08 -0.78 3.52 -1.11 -4.90 118.95 115.16 2g2x s ARG 67 Ca 0.11 1.29 -0.12 0.00 -0.13 0.00 0.00 55.73 56.88 2g2x s ARG 67 Cb 0.13 0.64 0.23 0.00 -1.56 0.00 0.00 34.95 34.39 2g2x s ARG 67 CO 0.48 -0.21 1.06 0.00 -0.81 0.00 0.00 175.30 175.82 2g2x s ALA 68 N 2.70 0.22 0.16 6.12 0.00 -1.26 -2.39 121.76 127.30 2g2x s ALA 68 Ca -0.05 -0.01 -0.33 0.00 0.00 0.00 0.00 51.96 51.57 2g2x s ALA 68 Cb -0.12 -3.27 -0.16 0.00 0.00 0.00 0.00 23.12 19.58 2g2x s ALA 68 CO -0.17 -3.40 1.09 0.00 0.00 0.00 0.00 175.76 173.28 2g2x n ALA 69 N -4.62 -1.27 -2.64 0.00 0.00 -1.25 -4.73 120.51 105.99 2g2x n ALA 69 Ca 0.05 0.47 -0.09 0.00 0.00 0.00 0.00 53.44 53.88 2g2x n ALA 69 Cb 0.54 -1.96 -0.07 0.00 0.00 0.00 0.00 19.45 17.96 2g2x n ALA 69 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2g2x s TYR 70 N -0.26 0.08 -0.06 0.00 1.13 -0.74 -4.94 117.35 112.56 2g2x s TYR 70 Ca 0.74 -0.49 -0.37 0.00 -1.41 0.00 0.00 57.07 55.54 2g2x s TYR 70 Cb -0.90 0.00 -0.15 0.00 -1.10 0.00 0.00 41.96 39.81 2g2x s TYR 70 CO 0.53 -0.57 1.62 -2.30 -2.51 0.00 0.00 175.55 172.32 2g2x n PRO 71 N -0.08 1.50 -1.99 -3.49 -0.02 -1.26 -0.61 135.00 129.05 2g2x n PRO 71 Ca -0.15 0.55 -0.41 0.00 -2.02 0.00 0.00 63.50 61.46 2g2x n PRO 71 Cb 0.63 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 2g2x n PRO 71 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2g2x s ASP 72 N 2.28 5.64 0.53 2.55 -1.08 -0.19 -4.67 116.67 121.72 2g2x s ASP 72 Ca 0.90 1.01 0.26 0.00 -0.52 0.00 0.00 52.55 54.20 2g2x s ASP 72 Cb -0.90 -2.53 1.49 0.00 -1.46 0.00 0.00 42.92 39.52 2g2x s ASP 72 CO 0.53 -1.96 2.12 1.55 0.52 0.00 0.00 175.17 177.93 2g2x h PRO 73 N 13.80 0.00 0.00 4.34 0.13 -1.90 -2.44 132.00 145.93 2g2x h PRO 73 Ca -0.31 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2g2x h PRO 73 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2g2x h PRO 73 CO 1.09 0.09 -0.02 1.79 -0.23 0.00 0.00 178.00 180.72 2g2x h THR 74 N 0.00 0.11 0.00 1.56 1.35 -1.91 -1.26 112.91 112.77 2g2x h THR 74 Ca -0.00 -0.21 -0.10 0.00 -0.55 0.00 0.00 66.41 65.55 2g2x h THR 74 Cb 0.22 1.18 -0.01 0.00 -1.73 0.00 0.00 68.15 67.81 2g2x h THR 74 CO 0.01 0.02 -0.45 0.00 -0.25 0.00 0.00 175.52 174.84 2g2x h ALA 75 N 1.98 1.12 0.00 6.62 0.00 -1.56 -3.01 119.26 124.40 2g2x h ALA 75 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2g2x h ALA 75 Cb 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2g2x h ALA 75 CO 0.00 0.57 -1.15 1.28 0.00 0.00 0.00 179.25 179.95 2g2x n LEU 76 N -3.80 0.66 -4.53 0.00 4.32 -0.55 -1.03 117.00 112.07 2g2x n LEU 76 Ca -0.01 -0.22 -0.43 0.00 -0.02 0.00 0.00 56.01 55.32 2g2x n LEU 76 Cb 0.51 -0.05 -0.05 0.00 -1.62 0.00 0.00 43.42 42.20 2g2x n LEU 76 CO 0.39 0.13 0.58 -0.62 -1.22 0.00 0.00 177.39 176.66 2g2x s ASP 77 N -3.55 6.39 0.58 -1.43 -1.08 -0.78 -4.92 116.67 111.88 2g2x s ASP 77 Ca 0.04 -0.18 0.28 0.00 -0.52 0.00 0.00 52.55 52.17 2g2x s ASP 77 Cb 0.15 -2.39 1.73 0.00 -1.46 0.00 0.00 42.92 40.95 2g2x s ASP 77 CO 0.84 -0.96 2.20 -0.65 0.52 0.00 0.00 175.17 177.12 2g2x h PRO 78 N 9.03 0.00 0.00 4.34 0.11 -1.89 -1.44 132.00 142.16 2g2x h PRO 78 Ca -0.25 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.76 2g2x h PRO 78 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2g2x h PRO 78 CO 0.98 0.00 -0.48 0.93 -0.21 0.00 0.00 178.00 179.22 2g2x h GLU 79 N 0.00 0.00 -6.85 1.05 5.08 -1.92 -3.45 114.58 108.48 2g2x h GLU 79 Ca 0.03 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.89 2g2x h GLU 79 Cb 0.16 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.42 2g2x h GLU 79 CO -0.00 0.48 0.45 0.45 -1.00 0.00 0.00 179.01 179.39 2g2x s SER 80 N -6.55 7.11 0.08 1.42 0.15 -0.54 -4.92 113.70 110.44 2g2x s SER 80 Ca 0.00 2.19 0.20 0.00 0.70 0.00 0.00 55.95 59.04 2g2x s SER 80 Cb 0.11 -2.61 0.83 0.00 -1.71 0.00 0.00 66.02 62.64 2g2x s SER 80 CO 0.72 -0.25 1.63 1.41 1.20 0.00 0.00 173.24 177.95 2g2x n HIS 81 N 0.80 0.27 -0.83 3.44 8.25 -1.26 -2.44 115.22 123.45 2g2x n HIS 81 Ca 0.01 0.10 0.08 0.00 -0.26 0.00 0.00 57.72 57.64 2g2x n HIS 81 Cb 0.46 -0.66 0.40 0.00 1.12 0.00 0.00 29.99 31.31 2g2x n HIS 81 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2g2x n TYR 82 N -1.74 1.95 -1.95 4.41 4.01 -1.26 -4.99 117.16 117.59 2g2x n TYR 82 Ca 0.04 -0.70 -0.38 0.00 -0.16 0.00 0.00 57.90 56.70 2g2x n TYR 82 Cb 0.23 -0.45 0.02 0.00 -0.31 0.00 0.00 39.34 38.84 2g2x n TYR 82 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 2g2x s HIS 83 N -2.53 2.53 -0.17 -0.72 5.65 -1.02 -3.98 115.29 115.05 2g2x s HIS 83 Ca 0.54 1.41 0.00 0.00 0.25 0.00 0.00 55.06 57.27 2g2x s HIS 83 Cb 0.40 -3.68 0.03 0.00 -1.18 0.00 0.00 32.58 28.15 2g2x s HIS 83 CO 0.18 -2.43 -0.12 0.34 -0.65 0.00 0.00 174.74 172.07 2g2x s ASP 84 N -0.99 2.99 0.39 9.88 -1.08 -0.20 -4.96 116.67 122.70 2g2x s ASP 84 Ca 0.66 -0.67 0.05 0.00 -0.52 0.00 0.00 52.55 52.08 2g2x s ASP 84 Cb -0.37 -1.18 0.77 0.00 -1.46 0.00 0.00 42.92 40.68 2g2x s ASP 84 CO 0.45 -0.10 2.04 0.00 0.52 0.00 0.00 175.17 178.08 2g2x h ALA 85 N 8.02 1.64 -0.02 3.66 0.00 -1.96 -2.44 119.26 128.17 2g2x h ALA 85 Ca -0.33 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2g2x h ALA 85 Cb 1.12 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2g2x h ALA 85 CO 0.50 0.33 0.00 1.63 0.00 0.00 0.00 179.25 181.71 2g2x n LYS 86 N -4.46 1.48 -3.30 0.00 5.02 -1.26 -4.89 118.16 110.76 2g2x n LYS 86 Ca 0.04 -0.70 -0.33 0.00 -2.02 0.00 0.00 58.31 55.29 2g2x n LYS 86 Cb 0.05 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.53 2g2x n LYS 86 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2g2x s ALA 87 N -1.98 3.49 0.24 7.82 0.00 -0.92 -4.98 121.76 125.43 2g2x s ALA 87 Ca 0.40 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 52.26 2g2x s ALA 87 Cb 0.21 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.71 2g2x s ALA 87 CO 0.33 0.43 0.16 0.95 0.00 0.00 0.00 175.76 177.63 2g2x s THR 88 N -1.73 0.09 0.17 0.00 -4.23 -0.70 -4.91 115.64 104.35 2g2x s THR 88 Ca 0.46 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.84 2g2x s THR 88 Cb -0.13 -2.51 0.08 0.00 1.34 0.00 0.00 72.50 71.28 2g2x s THR 88 CO 0.20 0.00 1.79 0.74 -0.54 0.00 0.00 174.62 176.80 2g2x h THR 89 N 2.46 1.19 -0.00 3.99 2.02 -1.99 -2.24 112.91 118.34 2g2x h THR 89 Ca -0.34 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.36 2g2x h THR 89 Cb 1.25 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 2g2x h THR 89 CO 0.51 0.20 -0.19 -0.67 0.37 0.00 0.00 175.52 175.75 2g2x n ASP 90 N -4.59 0.37 -3.14 4.18 -0.08 -1.26 -4.31 116.55 107.72 2g2x n ASP 90 Ca 0.04 -0.21 -0.22 0.00 -1.51 0.00 0.00 54.79 52.89 2g2x n ASP 90 Cb 0.08 -0.10 -0.05 0.00 2.34 0.00 0.00 41.12 43.39 2g2x n ASP 90 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2g2x n LYS 91 N -1.23 0.67 -3.63 -0.67 4.76 -0.94 -5.08 118.16 112.03 2g2x n LYS 91 Ca 0.10 -2.98 -0.40 0.00 -2.87 0.00 0.00 58.31 52.16 2g2x n LYS 91 Cb 0.31 -1.30 -0.11 0.00 -1.84 0.00 0.00 35.03 32.09 2g2x n LYS 91 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2g2x s ASN 92 N -1.10 5.64 0.00 4.39 3.84 -0.89 -1.71 114.94 125.11 2g2x s ASN 92 Ca 0.34 -1.08 0.22 0.00 0.21 0.00 0.00 52.86 52.55 2g2x s ASN 92 Cb 0.16 -1.99 0.97 0.00 -0.55 0.00 0.00 41.25 39.84 2g2x s ASN 92 CO -0.14 -0.39 1.71 -0.81 -2.79 0.00 0.00 177.10 174.68 2g2x n PRO 93 N 4.95 0.04 -4.02 0.43 -0.04 -1.26 -4.86 135.00 130.24 2g2x n PRO 93 Ca -0.12 0.11 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 2g2x n PRO 93 Cb 0.45 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.36 2g2x n PRO 93 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2g2x s TRP 94 N -2.95 3.26 0.15 0.54 0.52 -1.26 -5.06 118.94 114.15 2g2x s TRP 94 Ca 0.12 0.11 0.07 0.00 0.02 0.00 0.00 56.10 56.42 2g2x s TRP 94 Cb 0.15 -1.64 -0.04 0.00 -1.15 0.00 0.00 33.47 30.78 2g2x s TRP 94 CO 0.40 0.54 -0.16 -1.12 0.02 0.00 0.00 176.95 176.63 2g2x s SER 95 N -2.51 2.34 0.23 2.95 0.01 -1.26 -1.03 113.70 114.43 2g2x s SER 95 Ca 0.31 -0.87 0.01 0.00 1.31 0.00 0.00 55.95 56.71 2g2x s SER 95 Cb -0.12 -0.11 -0.05 0.00 0.21 0.00 0.00 66.02 65.95 2g2x s SER 95 CO 0.24 -0.11 0.07 0.00 0.41 0.00 0.00 173.24 173.85 2g2x s ALA 96 N -2.26 1.57 0.06 1.44 0.00 0.21 -4.60 121.76 118.18 2g2x s ALA 96 Ca 0.14 -1.78 -0.04 0.00 0.00 0.00 0.00 51.96 50.28 2g2x s ALA 96 Cb -0.04 0.95 -0.02 0.00 0.00 0.00 0.00 23.12 24.00 2g2x s ALA 96 CO 0.05 -0.44 0.06 0.14 0.00 0.00 0.00 175.76 175.57 2g2x s VAL 97 N -3.77 0.18 -0.03 0.00 -7.23 -1.21 -1.79 120.40 106.55 2g2x s VAL 97 Ca 0.34 -1.49 -0.00 0.00 -1.81 0.00 0.00 61.98 59.02 2g2x s VAL 97 Cb 0.07 -1.34 -0.04 0.00 0.56 0.00 0.00 36.38 35.64 2g2x s VAL 97 CO 0.11 -0.82 0.02 -1.81 -0.31 0.00 0.00 175.10 172.29 2g2x s ASP 98 N -2.75 5.30 0.28 4.85 1.01 -1.01 -0.37 116.67 123.98 2g2x s ASP 98 Ca 0.04 0.09 0.05 0.00 0.71 0.00 0.00 52.55 53.44 2g2x s ASP 98 Cb 0.05 -1.46 -0.06 0.00 1.01 0.00 0.00 42.92 42.47 2g2x s ASP 98 CO -0.09 0.32 -0.02 0.68 0.21 0.00 0.00 175.17 176.26 2g2x s VAL 99 N -1.03 1.40 0.02 -1.27 -7.23 0.35 0.15 120.40 112.80 2g2x s VAL 99 Ca 0.18 -2.07 -0.04 0.00 -1.81 0.00 0.00 61.98 58.23 2g2x s VAL 99 Cb -0.12 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.32 2g2x s VAL 99 CO 0.08 -0.25 0.07 0.00 -0.31 0.00 0.00 175.10 174.69 2g2x s ALA 100 N -3.17 -0.07 0.31 1.32 0.00 -0.38 -1.17 121.76 118.60 2g2x s ALA 100 Ca 0.30 -0.45 -0.29 0.00 0.00 0.00 0.00 51.96 51.53 2g2x s ALA 100 Cb 0.05 0.17 -0.10 0.00 0.00 0.00 0.00 23.12 23.25 2g2x s ALA 100 CO 0.12 -0.23 1.15 -1.58 0.00 0.00 0.00 175.76 175.22 2g2x s HIS 101 N -1.89 3.38 0.02 0.00 2.46 -1.24 -0.66 115.29 117.37 2g2x s HIS 101 Ca -0.11 1.61 -0.01 0.00 0.47 0.00 0.00 55.06 57.02 2g2x s HIS 101 Cb -0.06 -3.38 -0.00 0.00 -0.13 0.00 0.00 32.58 29.00 2g2x s HIS 101 CO -0.02 -0.95 -0.02 0.28 -2.47 0.00 0.00 174.74 171.57 2g2x n VAL 102 N 0.91 0.39 -3.64 0.89 0.31 -0.43 -4.80 118.33 111.96 2g2x n VAL 102 Ca 0.00 0.10 -0.15 0.00 -0.01 0.00 0.00 64.34 64.28 2g2x n VAL 102 Cb 0.44 -1.55 -0.08 0.00 -0.91 0.00 0.00 33.84 31.75 2g2x n VAL 102 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 2g2x s GLN 103 N -2.03 0.80 -0.22 5.55 0.74 0.00 -4.97 119.66 119.54 2g2x s GLN 103 Ca -0.02 0.40 -0.02 0.00 0.05 0.00 0.00 55.36 55.77 2g2x s GLN 103 Cb 0.01 0.38 0.01 0.00 1.10 0.00 0.00 33.01 34.51 2g2x s GLN 103 CO 0.02 -0.19 -0.09 -0.08 -0.55 0.00 0.00 175.29 174.40 2g2x s THR 104 N -0.56 2.86 0.41 -0.34 -1.32 -1.26 -0.34 115.64 115.09 2g2x s THR 104 Ca -0.07 -0.80 -0.26 0.00 -1.21 0.00 0.00 61.69 59.35 2g2x s THR 104 Cb -0.03 -2.34 -0.09 0.00 -1.51 0.00 0.00 72.50 68.53 2g2x s THR 104 CO 0.05 0.37 1.30 -0.36 -2.21 0.00 0.00 174.62 173.77 2g2x s PHE 105 N 1.37 2.80 0.27 9.09 0.08 -0.06 -4.91 117.98 126.62 2g2x s PHE 105 Ca 0.03 1.41 -0.04 0.00 0.12 0.00 0.00 56.93 58.46 2g2x s PHE 105 Cb -0.15 -3.67 0.37 0.00 -0.57 0.00 0.00 43.02 39.00 2g2x s PHE 105 CO -0.06 -2.11 1.94 -1.35 -0.10 0.00 0.00 175.22 173.54 2g2x h PRO 106 N 2.62 1.19 -4.53 0.24 0.11 -1.99 -3.41 132.00 126.23 2g2x h PRO 106 Ca -0.50 -0.07 -0.44 0.00 0.11 0.00 0.00 66.00 65.10 2g2x h PRO 106 Cb 1.25 -0.27 -0.31 0.00 0.11 0.00 0.00 31.00 31.77 2g2x h PRO 106 CO 0.62 0.79 -0.79 1.03 -0.21 0.00 0.00 178.00 179.44 2g2x s ARG 107 N -6.02 1.05 0.35 1.05 0.52 -1.26 -5.12 118.95 109.51 2g2x s ARG 107 Ca -0.12 -0.30 -0.29 0.00 -0.52 0.00 0.00 55.73 54.50 2g2x s ARG 107 Cb 0.18 -0.96 -0.11 0.00 0.52 0.00 0.00 34.95 34.58 2g2x s ARG 107 CO 0.81 0.08 1.52 0.08 0.02 0.00 0.00 175.30 177.81 2g2x s VAL 108 N 0.33 2.07 -0.88 3.52 1.01 -1.26 -4.90 120.40 120.29 2g2x s VAL 108 Ca -0.05 0.06 -0.21 0.00 0.00 0.00 0.00 61.98 61.78 2g2x s VAL 108 Cb -0.10 -3.04 0.10 0.00 0.00 0.00 0.00 36.38 33.33 2g2x s VAL 108 CO 0.01 0.01 1.16 -0.76 0.00 0.00 0.00 175.10 175.52 2g2x s LEU 109 N -1.61 4.50 0.44 3.92 1.43 0.20 -4.90 118.68 122.66 2g2x s LEU 109 Ca 0.56 -1.61 -0.23 0.00 -1.03 0.00 0.00 54.13 51.81 2g2x s LEU 109 Cb -0.47 -2.45 -0.10 0.00 0.03 0.00 0.00 46.19 43.20 2g2x s LEU 109 CO 0.58 -1.28 0.89 -0.62 0.23 0.00 0.00 176.35 176.15 2g2x n GLU 110 N 7.41 1.10 -0.34 1.70 1.02 -1.26 -1.30 120.64 128.97 2g2x n GLU 110 Ca 0.19 0.40 0.06 0.00 -0.02 0.00 0.00 57.16 57.78 2g2x n GLU 110 Cb 0.49 -1.91 0.22 0.00 -0.02 0.00 0.00 31.44 30.21 2g2x n GLU 110 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2g2x h LEU 111 N 1.24 0.86 -0.67 -4.62 5.85 -1.56 -1.55 115.31 114.86 2g2x h LEU 111 Ca -0.44 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.34 2g2x h LEU 111 Cb 1.36 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.23 2g2x h LEU 111 CO 0.55 0.46 0.44 1.23 -0.34 0.00 0.00 178.44 180.78 2g2x h GLY 112 N 0.94 0.95 1.01 3.75 0.00 -1.90 0.39 103.07 108.20 2g2x h GLY 112 Ca 0.47 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 47.44 2g2x h GLY 112 CO -0.27 0.33 0.35 -0.09 0.00 0.00 0.00 176.54 176.86 2g2x h ARG 113 N 0.89 0.98 -0.50 4.80 9.65 -1.67 -2.72 114.38 125.81 2g2x h ARG 113 Ca 0.25 -0.13 -0.07 0.00 -1.10 0.00 0.00 59.98 58.93 2g2x h ARG 113 Cb -0.08 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 28.30 2g2x h ARG 113 CO -0.07 0.75 0.03 -0.07 2.80 0.00 0.00 179.97 183.42 2g2x h LEU 114 N 0.95 0.78 -1.38 3.80 3.38 -0.53 -2.33 115.31 119.98 2g2x h LEU 114 Ca 0.24 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2g2x h LEU 114 Cb 0.08 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2g2x h LEU 114 CO -0.03 0.82 0.00 0.11 0.09 0.00 0.00 178.44 179.43 2g2x h LYS 115 N 0.76 0.00 -0.00 1.13 1.57 -0.65 -2.18 116.57 117.20 2g2x h LYS 115 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2g2x h LYS 115 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2g2x h LYS 115 CO 0.01 0.00 -0.02 1.04 -0.57 0.00 0.00 179.45 179.92 2g2x n GLN 116 N -3.01 0.61 -3.01 3.15 6.02 -0.88 -4.69 117.38 115.57 2g2x n GLN 116 Ca 0.01 -0.04 -0.43 0.00 -0.01 0.00 0.00 57.00 56.52 2g2x n GLN 116 Cb 0.30 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.01 2g2x n GLN 116 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2g2x s GLN 117 N -2.42 3.16 0.61 -1.09 -1.52 -0.82 -4.86 119.66 112.72 2g2x s GLN 117 Ca 0.33 -0.77 0.41 0.00 -1.95 0.00 0.00 55.36 53.38 2g2x s GLN 117 Cb 0.21 -4.13 2.17 0.00 -0.22 0.00 0.00 33.01 31.04 2g2x s GLN 117 CO 0.44 -1.44 2.25 0.00 -0.25 0.00 0.00 175.29 176.29 2g2x h ALA 118 N 9.20 1.00 0.00 6.09 0.00 -1.88 0.23 119.26 133.91 2g2x h ALA 118 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2g2x h ALA 118 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2g2x h ALA 118 CO 1.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.71 2g2x n GLY 119 N -0.99 -1.10 0.61 0.00 0.00 -1.26 -2.57 105.19 99.88 2g2x n GLY 119 Ca -0.02 -0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.00 2g2x n GLY 119 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2g2x n LEU 120 N -1.49 3.17 -0.07 0.99 4.77 0.82 -4.70 117.00 120.48 2g2x n LEU 120 Ca 0.04 -2.58 0.20 0.00 -0.03 0.00 0.00 56.01 53.65 2g2x n LEU 120 Cb 0.21 -0.37 0.64 0.00 -2.33 0.00 0.00 43.42 41.57 2g2x n LEU 120 CO 0.16 0.68 1.20 1.62 -1.33 0.00 0.00 177.39 179.73 2g2x h VAL 121 N 1.45 0.72 -0.01 4.08 3.04 -1.55 -0.88 116.25 123.11 2g2x h VAL 121 Ca 0.00 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 2g2x h VAL 121 Cb 1.05 0.60 0.00 0.00 -2.01 0.00 0.00 31.29 30.93 2g2x h VAL 121 CO 0.10 0.02 -0.30 -0.62 -1.01 0.00 0.00 177.57 175.76 2g2x n GLU 122 N -4.39 0.66 -2.54 4.17 -0.58 -1.26 -4.85 120.64 111.85 2g2x n GLU 122 Ca 0.12 -0.38 -0.43 0.00 -0.42 0.00 0.00 57.16 56.06 2g2x n GLU 122 Cb 0.64 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 30.00 2g2x n GLU 122 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2g2x s LEU 123 N -2.60 4.02 0.47 -4.62 2.96 -0.34 -4.91 118.68 113.66 2g2x s LEU 123 Ca 0.22 1.31 0.30 0.00 -0.22 0.00 0.00 54.13 55.75 2g2x s LEU 123 Cb 0.19 -3.54 1.39 0.00 0.50 0.00 0.00 46.19 44.73 2g2x s LEU 123 CO 0.55 -0.86 1.73 -0.65 -1.32 0.00 0.00 176.35 175.81 2g2x h PRO 124 N 8.28 0.15 -0.98 0.98 0.11 -1.88 -1.34 132.00 137.31 2g2x h PRO 124 Ca -0.23 -0.01 0.23 0.00 0.11 0.00 0.00 66.00 66.10 2g2x h PRO 124 Cb 1.08 -0.03 -0.12 0.00 0.11 0.00 0.00 31.00 32.04 2g2x h PRO 124 CO 1.01 0.10 0.56 1.25 -0.21 0.00 0.00 178.00 180.70 2g2x h LEU 125 N 0.15 0.63 -2.98 2.35 5.85 -1.90 -0.60 115.31 118.81 2g2x h LEU 125 Ca 0.66 0.13 0.00 0.00 0.84 0.00 0.00 57.88 59.52 2g2x h LEU 125 Cb 2.21 0.04 0.00 0.00 0.37 0.00 0.00 40.66 43.28 2g2x h LEU 125 CO -0.19 0.11 0.00 1.33 -0.34 0.00 0.00 178.44 179.35 2g2x n VAL 126 N -4.90 1.59 -3.77 1.05 0.24 -0.51 -4.94 118.33 107.10 2g2x n VAL 126 Ca 0.25 -1.12 -0.36 0.00 -2.04 0.00 0.00 64.34 61.08 2g2x n VAL 126 Cb 0.70 0.22 -0.07 0.00 -1.47 0.00 0.00 33.84 33.22 2g2x n VAL 126 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2g2x s GLN 127 N -1.62 3.85 0.21 7.34 -0.21 -0.24 -5.03 119.66 123.97 2g2x s GLN 127 Ca 0.51 -0.12 -0.32 0.00 0.02 0.00 0.00 55.36 55.45 2g2x s GLN 127 Cb 0.31 -3.31 -0.14 0.00 1.00 0.00 0.00 33.01 30.87 2g2x s GLN 127 CO 0.27 0.52 1.30 1.17 -2.12 0.00 0.00 175.29 176.43 2g2x n LYS 128 N 2.77 1.66 -0.69 2.91 4.81 -1.26 -2.47 118.16 125.89 2g2x n LYS 128 Ca -0.17 0.59 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 2g2x n LYS 128 Cb 0.53 -2.18 0.00 0.00 0.02 0.00 0.00 35.03 33.41 2g2x n LYS 128 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2g2x n GLY 129 N 2.06 1.15 3.75 3.14 0.00 -1.26 -5.00 105.19 109.02 2g2x n GLY 129 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2g2x n GLY 129 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2g2x s SER 130 N -2.97 6.68 -0.08 1.61 0.15 -1.03 -4.90 113.70 113.17 2g2x s SER 130 Ca 0.00 2.67 0.11 0.00 0.70 0.00 0.00 55.95 59.43 2g2x s SER 130 Cb 0.00 -2.63 0.17 0.00 -1.71 0.00 0.00 66.02 61.85 2g2x s SER 130 CO 0.00 -0.66 1.06 0.54 1.20 0.00 0.00 173.24 175.38 2g2x n ARG 131 N 1.94 1.13 -2.69 5.44 5.12 -1.26 -5.04 116.66 121.30 2g2x n ARG 131 Ca 0.05 -1.95 -0.43 0.00 -1.93 0.00 0.00 57.85 53.59 2g2x n ARG 131 Cb 0.41 -1.14 -0.02 0.00 -1.16 0.00 0.00 32.46 30.54 2g2x n ARG 131 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2g2x s LEU 132 N -1.79 4.20 0.00 0.55 2.96 -1.26 -4.93 118.68 118.41 2g2x s LEU 132 Ca 0.18 1.47 0.22 0.00 -0.22 0.00 0.00 54.13 55.79 2g2x s LEU 132 Cb 0.16 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.33 2g2x s LEU 132 CO 0.02 -0.51 1.08 -1.54 -1.32 0.00 0.00 176.35 174.08 2g2x n SER 133 N 5.40 2.11 -4.05 3.68 3.41 -1.26 -4.89 113.62 118.01 2g2x n SER 133 Ca 0.09 -1.55 -0.11 0.00 -0.26 0.00 0.00 58.87 57.05 2g2x n SER 133 Cb 0.48 0.42 -0.11 0.00 -0.26 0.00 0.00 64.21 64.74 2g2x n SER 133 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2g2x s VAL 134 N -2.36 0.37 0.24 -3.33 1.01 -1.26 -0.73 120.40 114.35 2g2x s VAL 134 Ca 0.19 -1.22 0.06 0.00 0.00 0.00 0.00 61.98 61.02 2g2x s VAL 134 Cb 0.18 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.79 2g2x s VAL 134 CO 0.52 -0.56 0.24 -2.16 0.00 0.00 0.00 175.10 173.14 2g2x s PRO 136 N -2.11 3.06 -0.06 2.72 0.04 -1.26 -4.61 135.00 132.78 2g2x s PRO 136 Ca -0.07 -0.96 0.01 0.00 0.04 0.00 0.00 61.00 60.01 2g2x s PRO 136 Cb -0.06 -2.66 0.02 0.00 0.04 0.00 0.00 34.50 31.85 2g2x s PRO 136 CO -0.02 0.41 -0.06 0.08 0.04 0.00 0.00 177.00 177.46 2g2x s VAL 137 N -2.07 0.69 0.50 -0.36 1.01 -0.34 -4.73 120.40 115.10 2g2x s VAL 137 Ca 0.33 -0.18 -0.18 0.00 0.00 0.00 0.00 61.98 61.95 2g2x s VAL 137 Cb -0.08 -0.70 -0.08 0.00 0.00 0.00 0.00 36.38 35.51 2g2x s VAL 137 CO 0.26 0.27 1.00 0.42 0.00 0.00 0.00 175.10 177.05 2g2x s THR 138 N 1.08 4.18 0.30 3.92 -4.23 -1.26 -4.24 115.64 115.39 2g2x s THR 138 Ca -0.08 1.19 0.05 0.00 -1.18 0.00 0.00 61.69 61.67 2g2x s THR 138 Cb -0.14 -3.56 0.29 0.00 1.34 0.00 0.00 72.50 70.43 2g2x s THR 138 CO -0.01 -0.45 1.77 -0.65 -0.54 0.00 0.00 174.62 174.75 2g2x h PRO 139 N 1.23 0.73 -0.65 3.99 0.11 -1.98 0.26 132.00 135.69 2g2x h PRO 139 Ca -0.48 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 2g2x h PRO 139 Cb 1.20 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 2g2x h PRO 139 CO 0.60 0.48 0.14 0.93 -0.21 0.00 0.00 178.00 179.94 2g2x h GLU 140 N 0.75 1.03 -0.12 1.05 3.07 -1.99 -0.55 114.58 117.81 2g2x h GLU 140 Ca 0.57 -0.25 -0.16 0.00 -0.50 0.00 0.00 59.36 59.02 2g2x h GLU 140 Cb 0.87 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.64 2g2x h GLU 140 CO -0.38 0.93 -0.61 1.96 -1.40 0.00 0.00 179.01 179.51 2g2x h GLN 141 N 0.98 0.42 -0.56 2.33 4.20 -1.21 -2.56 115.11 118.72 2g2x h GLN 141 Ca 0.20 -0.29 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 2g2x h GLN 141 Cb 0.37 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 2g2x h GLN 141 CO 0.00 0.90 0.25 2.35 -0.67 0.00 0.00 178.83 181.67 2g2x h TRP 142 N 0.31 0.82 -0.51 2.96 2.91 -0.10 -2.27 115.95 120.06 2g2x h TRP 142 Ca -0.01 -0.05 -0.01 0.00 1.13 0.00 0.00 58.89 59.95 2g2x h TRP 142 Cb 1.15 -0.25 -0.02 0.00 -0.51 0.00 0.00 29.16 29.52 2g2x h TRP 142 CO 0.04 0.64 0.27 0.00 -1.03 0.00 0.00 178.44 178.36 2g2x h ALA 143 N 1.09 0.66 -0.66 2.65 0.00 -0.98 -0.88 119.26 121.14 2g2x h ALA 143 Ca 0.19 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2g2x h ALA 143 Cb 0.14 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2g2x h ALA 143 CO -0.02 0.20 0.16 -0.39 0.00 0.00 0.00 179.25 179.20 2g2x h VAL 144 N 0.68 1.25 -0.40 0.00 -1.51 -1.27 -1.08 116.25 113.92 2g2x h VAL 144 Ca 0.18 -0.92 -0.09 0.00 -1.23 0.00 0.00 66.70 64.64 2g2x h VAL 144 Cb 0.08 0.57 -0.01 0.00 -2.13 0.00 0.00 31.29 29.80 2g2x h VAL 144 CO -0.03 0.35 -0.10 0.40 -1.23 0.00 0.00 177.57 176.96 2g2x h ILE 145 N 0.99 1.28 0.00 7.19 2.04 -1.06 -2.35 117.51 125.58 2g2x h ILE 145 Ca 0.21 -1.20 -0.05 0.00 1.00 0.00 0.00 64.86 64.82 2g2x h ILE 145 Cb 0.34 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 2g2x h ILE 145 CO 0.00 0.40 -0.23 -0.37 0.00 0.00 0.00 178.15 177.95 2g2x h VAL 146 N 0.58 0.66 0.00 1.67 -1.51 -1.05 -2.02 116.25 114.58 2g2x h VAL 146 Ca 0.10 -1.04 -0.07 0.00 -1.23 0.00 0.00 66.70 64.46 2g2x h VAL 146 Cb 0.63 1.67 -0.01 0.00 -2.13 0.00 0.00 31.29 31.45 2g2x h VAL 146 CO 0.04 0.23 -0.34 0.00 -1.23 0.00 0.00 177.57 176.27 2g2x h ALA 147 N 1.77 1.00 -0.05 5.19 0.00 -0.83 -2.58 119.26 123.75 2g2x h ALA 147 Ca -0.00 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.45 2g2x h ALA 147 Cb 0.65 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2g2x h ALA 147 CO 0.03 0.42 -0.64 -0.07 0.00 0.00 0.00 179.25 179.00 2g2x h LEU 148 N 0.00 0.22 -1.41 0.00 3.38 -0.85 -1.52 115.31 115.14 2g2x h LEU 148 Ca -0.00 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2g2x h LEU 148 Cb 0.87 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2g2x h LEU 148 CO 0.04 0.80 0.00 -0.09 0.09 0.00 0.00 178.44 179.28 2g2x h ARG 149 N 0.14 0.00 0.00 1.13 2.43 -1.34 -3.51 114.38 113.23 2g2x h ARG 149 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2g2x h ARG 149 Cb 1.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 2g2x h ARG 149 CO 0.10 0.00 0.00 1.28 -1.51 0.00 0.00 179.97 179.84