#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2avy s THR 2 N 0.00 2.29 0.25 0.00 2.01 -1.26 -4.99 115.64 113.93 2avy s THR 2 Ca 0.00 -2.13 -0.12 0.00 0.31 0.00 0.00 61.69 59.75 2avy s THR 2 Cb 0.00 -2.13 0.34 0.00 0.01 0.00 0.00 72.50 70.72 2avy s THR 2 CO 0.00 -0.24 1.58 -0.37 -0.69 0.00 0.00 174.62 174.90 2avy h VAL 3 N 2.93 0.11 0.27 3.82 -1.51 -2.04 0.44 116.25 120.28 2avy h VAL 3 Ca -0.44 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 2avy h VAL 3 Cb 1.22 0.11 -0.02 0.00 -2.13 0.00 0.00 31.29 30.48 2avy h VAL 3 CO 0.52 0.00 -0.28 0.78 -1.23 0.00 0.00 177.57 177.37 2avy h ASN 4 N -0.02 -0.74 0.17 4.19 4.21 -1.99 0.60 115.58 122.01 2avy h ASN 4 Ca 0.39 0.07 0.00 0.00 1.21 0.00 0.00 56.30 57.97 2avy h ASN 4 Cb 0.62 0.25 0.00 0.00 -1.12 0.00 0.00 38.32 38.08 2avy h ASN 4 CO -0.89 -0.40 0.00 0.00 -1.29 0.00 0.00 177.43 174.85 2avy n GLN 5 N -5.40 0.10 -0.07 0.81 6.02 0.21 -1.83 117.38 117.21 2avy n GLN 5 Ca -0.09 0.53 -0.18 0.00 -0.01 0.00 0.00 57.00 57.24 2avy n GLN 5 Cb 0.30 -1.77 -0.13 0.00 1.02 0.00 0.00 30.24 29.66 2avy n GLN 5 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2avy n LEU 6 N -1.97 2.58 -0.19 1.08 4.77 0.13 -3.28 117.00 120.12 2avy n LEU 6 Ca 0.00 0.04 0.06 0.00 -0.03 0.00 0.00 56.01 56.08 2avy n LEU 6 Cb 0.07 -0.87 0.35 0.00 -2.33 0.00 0.00 43.42 40.64 2avy n LEU 6 CO 0.09 0.86 1.22 0.58 -1.33 0.00 0.00 177.39 178.80 2avy h VAL 7 N 0.03 1.03 0.00 4.08 2.07 0.91 -0.90 116.25 123.47 2avy h VAL 7 Ca -0.50 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 66.75 2avy h VAL 7 Cb 1.98 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 2avy h VAL 7 CO -0.00 0.14 0.00 -2.11 0.02 0.00 0.00 177.57 175.62 2avy n ARG 8 N -4.48 0.00 -3.75 1.57 1.85 -0.98 -4.66 116.66 106.21 2avy n ARG 8 Ca 0.11 0.29 -0.35 0.00 -1.00 0.00 0.00 57.85 56.90 2avy n ARG 8 Cb 0.22 -0.94 -0.10 0.00 -1.05 0.00 0.00 32.46 30.59 2avy n ARG 8 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 2avy s LYS 9 N -1.05 2.62 0.00 2.89 -2.85 -1.21 -5.09 119.74 115.06 2avy s LYS 9 Ca 0.00 -2.79 0.00 0.00 -1.00 0.00 0.00 55.97 52.18 2avy s LYS 9 Cb 0.00 -3.69 0.00 0.00 -2.06 0.00 0.00 37.83 32.08 2avy s LYS 9 CO 0.00 -1.20 0.00 -2.30 0.10 0.00 0.00 175.35 171.95 2avy n PRO 10 N 3.02 2.26 -3.39 1.78 -0.02 -0.34 -4.50 135.00 133.81 2avy n PRO 10 Ca 0.12 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.19 2avy n PRO 10 Cb 0.36 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 33.75 2avy n PRO 10 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2avy s ARG 11 N 0.00 3.54 0.55 -0.52 1.81 -1.26 -4.97 118.95 118.10 2avy s ARG 11 Ca 0.00 -0.42 -0.18 0.00 -1.72 0.00 0.00 55.73 53.41 2avy s ARG 11 Cb 0.00 -3.81 -0.05 0.00 -0.45 0.00 0.00 34.95 30.63 2avy s ARG 11 CO 0.00 -0.55 1.09 0.00 -0.68 0.00 0.00 175.30 175.16 2avy s ALA 12 N 2.05 2.71 0.00 2.13 0.00 -1.26 -5.06 121.76 122.33 2avy s ALA 12 Ca 0.12 0.66 0.00 0.00 0.00 0.00 0.00 51.96 52.75 2avy s ALA 12 Cb -0.16 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2avy s ALA 12 CO 0.12 -0.74 0.00 0.54 0.00 0.00 0.00 175.76 175.67 2avy n ARG 13 N -1.50 1.04 -3.10 0.00 5.12 -1.26 -5.11 116.66 111.84 2avy n ARG 13 Ca 0.10 0.00 0.06 0.00 -1.93 0.00 0.00 57.85 56.08 2avy n ARG 13 Cb 0.52 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.82 2avy n ARG 13 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2avy s LYS 14 N 0.00 0.01 -0.65 5.56 2.36 -1.26 -5.10 119.74 120.66 2avy s LYS 14 Ca 0.00 0.01 -0.26 0.00 -2.55 0.00 0.00 55.97 53.17 2avy s LYS 14 Cb 0.00 0.00 -0.12 0.00 -1.05 0.00 0.00 37.83 36.66 2avy s LYS 14 CO 0.00 -0.01 2.44 0.28 1.55 0.00 0.00 175.35 179.61 2avy n VAL 15 N 4.87 -0.05 -1.66 4.02 0.31 -1.26 -4.85 118.33 119.70 2avy n VAL 15 Ca 0.10 -0.62 -0.50 0.00 -0.01 0.00 0.00 64.34 63.32 2avy n VAL 15 Cb 0.59 -2.19 -0.05 0.00 -0.91 0.00 0.00 33.84 31.29 2avy n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2avy n ALA 16 N 15.47 0.77 -2.82 3.52 0.00 -1.26 -4.91 120.51 131.29 2avy n ALA 16 Ca 0.45 0.25 -0.43 0.00 0.00 0.00 0.00 53.44 53.70 2avy n ALA 16 Cb 0.44 -2.48 -0.05 0.00 0.00 0.00 0.00 19.45 17.36 2avy n ALA 16 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2avy s LYS 17 N 4.30 3.16 -0.74 0.00 1.02 -1.26 -5.00 119.74 121.22 2avy s LYS 17 Ca 0.95 -0.76 -0.26 0.00 0.02 0.00 0.00 55.97 55.92 2avy s LYS 17 Cb -0.75 -4.16 0.04 0.00 -0.52 0.00 0.00 37.83 32.45 2avy s LYS 17 CO 0.53 -1.55 1.24 -1.12 -0.92 0.00 0.00 175.35 173.53 2avy s SER 18 N 3.21 6.18 -0.90 2.83 0.01 -1.26 -4.93 113.70 118.83 2avy s SER 18 Ca 0.21 -0.58 -0.25 0.00 1.31 0.00 0.00 55.95 56.65 2avy s SER 18 Cb -0.17 -2.54 -0.19 0.00 0.21 0.00 0.00 66.02 63.33 2avy s SER 18 CO 0.12 -1.76 2.20 -0.46 0.41 0.00 0.00 173.24 173.76 2avy n ASN 19 N 9.08 1.27 -3.18 2.44 0.23 -1.26 -4.71 115.26 119.13 2avy n ASN 19 Ca 0.03 -1.92 0.05 0.00 -0.53 0.00 0.00 54.58 52.21 2avy n ASN 19 Cb 0.48 -1.60 -0.02 0.00 -2.08 0.00 0.00 39.78 36.56 2avy n ASN 19 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2avy s VAL 20 N 14.84 -0.23 0.15 3.53 1.01 -1.26 -5.01 120.40 133.43 2avy s VAL 20 Ca 0.85 0.00 -0.07 0.00 0.00 0.00 0.00 61.98 62.76 2avy s VAL 20 Cb -0.12 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 35.17 2avy s VAL 20 CO 0.15 0.00 1.42 1.55 0.00 0.00 0.00 175.10 178.22 2avy h PRO 21 N 7.79 0.67 -2.09 2.72 0.13 -1.96 -3.21 132.00 136.05 2avy h PRO 21 Ca -0.13 -0.48 -0.11 0.00 -0.87 0.00 0.00 66.00 64.41 2avy h PRO 21 Cb 1.16 0.08 -0.04 0.00 0.13 0.00 0.00 31.00 32.32 2avy h PRO 21 CO -0.09 1.10 -0.19 0.00 -0.23 0.00 0.00 178.00 178.59 2avy n ALA 22 N -2.55 5.07 -1.00 -0.56 0.00 -1.26 -4.73 120.51 115.47 2avy n ALA 22 Ca -0.05 -1.10 0.00 0.00 0.00 0.00 0.00 53.44 52.29 2avy n ALA 22 Cb 0.66 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 18.17 2avy n ALA 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2avy n LEU 23 N 2.25 0.00 -0.41 0.00 4.77 -1.21 -4.65 117.00 117.75 2avy n LEU 23 Ca 0.26 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.19 2avy n LEU 23 Cb 0.69 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.76 2avy n LEU 23 CO 0.09 0.00 -0.05 1.21 -1.33 0.00 0.00 177.39 177.32 2avy n GLU 24 N 0.00 -1.85 -3.60 3.23 4.07 -1.26 -2.62 120.64 118.61 2avy n GLU 24 Ca 0.00 0.65 -0.25 0.00 -0.06 0.00 0.00 57.16 57.50 2avy n GLU 24 Cb 0.00 -5.01 0.03 0.00 -0.06 0.00 0.00 31.44 26.39 2avy n GLU 24 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2avy n ALA 25 N 1.01 -2.60 -2.69 4.31 0.00 -1.26 -5.00 120.51 114.28 2avy n ALA 25 Ca -0.05 -0.21 -0.18 0.00 0.00 0.00 0.00 53.44 53.01 2avy n ALA 25 Cb 0.51 -2.93 -0.12 0.00 0.00 0.00 0.00 19.45 16.91 2avy n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2avy h PRO 27 N 4.19 0.00 -3.02 0.00 0.13 -1.91 -3.47 132.00 127.92 2avy h PRO 27 Ca -0.40 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.77 2avy h PRO 27 Cb 1.19 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.25 2avy h PRO 27 CO 0.42 0.60 0.21 1.14 -0.23 0.00 0.00 178.00 180.14 2avy s GLN 28 N -3.61 1.66 -0.01 0.86 0.00 -1.26 -4.61 119.66 112.69 2avy s GLN 28 Ca -0.01 -0.88 -0.03 0.00 -0.00 0.00 0.00 55.36 54.45 2avy s GLN 28 Cb 0.13 0.60 -0.00 0.00 0.00 0.00 0.00 33.01 33.73 2avy s GLN 28 CO 0.76 -0.75 0.06 0.15 0.00 0.00 0.00 175.29 175.51 2avy s LYS 29 N -3.88 0.23 0.39 9.60 -0.14 -0.49 -4.97 119.74 120.48 2avy s LYS 29 Ca 0.09 -0.20 -0.21 0.00 -1.36 0.00 0.00 55.97 54.30 2avy s LYS 29 Cb -0.05 0.09 -0.10 0.00 -1.68 0.00 0.00 37.83 36.09 2avy s LYS 29 CO 0.02 -0.04 0.90 0.50 -0.76 0.00 0.00 175.35 175.97 2avy s ARG 30 N -0.67 4.24 0.00 1.68 3.52 -1.26 0.21 118.95 126.67 2avy s ARG 30 Ca -0.07 1.06 0.00 0.00 -0.13 0.00 0.00 55.73 56.58 2avy s ARG 30 Cb -0.05 -2.35 0.00 0.00 -1.56 0.00 0.00 34.95 31.00 2avy s ARG 30 CO 0.00 0.07 0.00 0.41 -0.81 0.00 0.00 175.30 174.97 2avy n GLY 31 N -0.36 6.02 0.00 8.12 0.00 -0.46 -1.21 105.19 117.30 2avy n GLY 31 Ca 0.05 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.47 2avy n GLY 31 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2avy n VAL 32 N 0.00 0.00 -1.52 1.61 0.31 -1.26 -4.29 118.33 113.19 2avy n VAL 32 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 2avy n VAL 32 Cb 0.00 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2avy n VAL 32 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2avy h THR 34 N 1.22 1.40 -2.72 0.00 2.02 0.43 -3.32 112.91 111.92 2avy h THR 34 Ca -0.05 -2.25 0.09 0.00 0.77 0.00 0.00 66.41 64.97 2avy h THR 34 Cb 0.11 2.69 -0.02 0.00 -1.74 0.00 0.00 68.15 69.20 2avy h THR 34 CO 0.00 0.66 0.47 -0.60 0.37 0.00 0.00 175.52 176.43 2avy s ARG 35 N -3.04 1.68 -0.25 6.66 6.06 -1.25 -4.80 118.95 124.00 2avy s ARG 35 Ca -0.12 -1.09 0.02 0.00 -2.50 0.00 0.00 55.73 52.04 2avy s ARG 35 Cb 0.04 0.46 0.06 0.00 0.06 0.00 0.00 34.95 35.57 2avy s ARG 35 CO 0.86 -0.79 -0.08 0.08 -2.50 0.00 0.00 175.30 172.87 2avy s VAL 36 N -2.14 1.90 0.63 7.11 1.01 -1.26 -3.47 120.40 124.18 2avy s VAL 36 Ca 0.20 -1.50 0.03 0.00 0.00 0.00 0.00 61.98 60.71 2avy s VAL 36 Cb -0.04 -2.09 0.12 0.00 0.00 0.00 0.00 36.38 34.37 2avy s VAL 36 CO 0.08 -0.09 0.87 -1.22 0.00 0.00 0.00 175.10 174.73 2avy n TYR 37 N 4.53 -2.78 -2.72 5.22 4.01 -0.23 -4.96 117.16 120.22 2avy n TYR 37 Ca -0.12 -1.72 -0.03 0.00 -0.16 0.00 0.00 57.90 55.87 2avy n TYR 37 Cb 0.43 -0.62 0.10 0.00 -0.31 0.00 0.00 39.34 38.94 2avy n TYR 37 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2avy n THR 38 N -2.57 0.41 -0.89 -0.72 -1.04 -1.26 -2.82 114.28 105.39 2avy n THR 38 Ca 0.15 -1.75 -0.33 0.00 -2.04 0.00 0.00 64.05 60.08 2avy n THR 38 Cb 0.55 1.05 0.12 0.00 -1.82 0.00 0.00 70.33 70.23 2avy n THR 38 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2avy n THR 39 N -1.02 0.55 -3.55 12.58 -2.24 -1.21 -4.37 114.28 115.02 2avy n THR 39 Ca -0.07 -0.20 -0.32 0.00 -2.27 0.00 0.00 64.05 61.19 2avy n THR 39 Cb 0.85 -0.76 -0.05 0.00 -2.10 0.00 0.00 70.33 68.27 2avy n THR 39 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2avy s THR 40 N -2.31 5.05 0.14 4.28 -4.23 -1.26 -2.21 115.64 115.10 2avy s THR 40 Ca 0.62 0.26 -0.02 0.00 -1.18 0.00 0.00 61.69 61.36 2avy s THR 40 Cb -0.25 -3.62 0.03 0.00 1.34 0.00 0.00 72.50 70.00 2avy s THR 40 CO 0.63 0.01 0.12 -0.81 -0.54 0.00 0.00 174.62 174.03 2avy n PRO 41 N 0.05 -1.25 0.00 3.99 -0.04 -1.26 -4.88 135.00 131.61 2avy n PRO 41 Ca -0.01 -0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.25 2avy n PRO 41 Cb 0.52 -0.19 0.00 0.00 -0.04 0.00 0.00 33.50 33.79 2avy n PRO 41 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2avy n LYS 42 N -1.88 1.21 0.05 0.54 4.76 -0.98 -4.96 118.16 116.90 2avy n LYS 42 Ca 0.02 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.26 2avy n LYS 42 Cb 0.07 0.00 -0.12 0.00 -1.84 0.00 0.00 35.03 33.13 2avy n LYS 42 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2avy h LYS 43 N 0.00 0.53 -0.63 1.97 1.57 -1.98 -3.35 116.57 114.68 2avy h LYS 43 Ca 0.00 -0.66 -0.07 0.00 -1.87 0.00 0.00 60.65 58.05 2avy h LYS 43 Cb 0.00 0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2avy h LYS 43 CO 0.00 1.27 0.11 -1.00 -0.57 0.00 0.00 179.45 179.26 2avy h PRO 44 N 0.09 1.01 -6.14 3.15 0.13 -2.01 -3.45 132.00 124.78 2avy h PRO 44 Ca -0.14 -0.25 -0.51 0.00 -0.87 0.00 0.00 66.00 64.23 2avy h PRO 44 Cb 1.66 -0.13 -0.04 0.00 0.13 0.00 0.00 31.00 32.62 2avy h PRO 44 CO 0.18 0.93 -0.38 -0.80 -0.23 0.00 0.00 178.00 177.70 2avy s ASN 45 N -6.53 4.96 0.00 1.44 0.01 -1.26 -5.14 114.94 108.42 2avy s ASN 45 Ca -0.11 -0.82 0.00 0.00 -0.71 0.00 0.00 52.86 51.22 2avy s ASN 45 Cb 0.15 -0.47 0.00 0.00 0.41 0.00 0.00 41.25 41.33 2avy s ASN 45 CO 0.83 -0.69 0.00 -0.24 -1.51 0.00 0.00 177.10 175.50 2avy n SER 46 N -1.55 0.73 -1.13 -1.22 2.88 -1.26 -4.40 113.62 107.68 2avy n SER 46 Ca 0.03 -0.14 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 2avy n SER 46 Cb 0.62 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 2avy n SER 46 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2avy n ALA 47 N -3.00 -2.36 -2.68 -1.46 0.00 -1.26 -4.69 120.51 105.07 2avy n ALA 47 Ca 0.00 0.29 -0.42 0.00 0.00 0.00 0.00 53.44 53.31 2avy n ALA 47 Cb 0.00 -1.08 -0.03 0.00 0.00 0.00 0.00 19.45 18.34 2avy n ALA 47 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2avy s LEU 48 N -1.73 4.26 0.47 0.00 2.34 -1.26 -4.16 118.68 118.60 2avy s LEU 48 Ca 0.00 1.57 0.04 0.00 0.06 0.00 0.00 54.13 55.79 2avy s LEU 48 Cb 0.00 -3.56 0.02 0.00 -0.56 0.00 0.00 46.19 42.09 2avy s LEU 48 CO 0.00 -0.43 0.66 -0.13 -1.06 0.00 0.00 176.35 175.39 2avy s ARG 49 N 1.89 2.78 -0.13 1.48 3.00 -0.94 -4.97 118.95 122.06 2avy s ARG 49 Ca 0.49 -0.90 -0.05 0.00 0.00 0.00 0.00 55.73 55.27 2avy s ARG 49 Cb -0.19 -2.62 -0.04 0.00 0.00 0.00 0.00 34.95 32.10 2avy s ARG 49 CO 0.19 -0.42 0.05 0.15 0.00 0.00 0.00 175.30 175.28 2avy s LYS 50 N -4.54 3.51 0.21 3.54 3.01 -1.26 -3.28 119.74 120.93 2avy s LYS 50 Ca 0.54 -0.33 0.03 0.00 -1.01 0.00 0.00 55.97 55.20 2avy s LYS 50 Cb -0.10 -3.05 -0.01 0.00 -1.01 0.00 0.00 37.83 33.65 2avy s LYS 50 CO 0.36 0.53 0.21 1.33 0.51 0.00 0.00 175.35 178.29 2avy n VAL 51 N 2.72 0.00 -3.65 3.17 0.24 -1.13 -2.90 118.33 116.78 2avy n VAL 51 Ca -0.18 -1.41 -0.01 0.00 -2.04 0.00 0.00 64.34 60.70 2avy n VAL 51 Cb 0.53 0.74 -0.06 0.00 -1.47 0.00 0.00 33.84 33.58 2avy n VAL 51 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2avy s ARG 53 N 0.72 4.48 -0.04 0.00 0.52 -1.23 -0.31 118.95 123.09 2avy s ARG 53 Ca -0.03 1.97 0.06 0.00 -0.52 0.00 0.00 55.73 57.22 2avy s ARG 53 Cb -0.03 -3.18 -0.01 0.00 0.52 0.00 0.00 34.95 32.25 2avy s ARG 53 CO -0.12 -0.06 -0.22 0.08 0.02 0.00 0.00 175.30 175.00 2avy s VAL 54 N -0.59 1.76 -1.09 3.52 1.01 0.31 0.10 120.40 125.42 2avy s VAL 54 Ca 0.50 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 2avy s VAL 54 Cb -0.35 -1.49 0.30 0.00 0.00 0.00 0.00 36.38 34.84 2avy s VAL 54 CO 0.42 0.50 1.58 -1.14 0.00 0.00 0.00 175.10 176.46 2avy n ARG 55 N 2.87 4.57 -1.09 2.72 0.63 -1.26 -0.74 116.66 124.35 2avy n ARG 55 Ca -0.17 -4.49 -0.35 0.00 -0.92 0.00 0.00 57.85 51.93 2avy n ARG 55 Cb 0.52 -2.54 0.00 0.00 0.45 0.00 0.00 32.46 30.90 2avy n ARG 55 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2avy n LEU 56 N 1.30 -2.81 -0.00 6.15 4.32 -1.21 -4.14 117.00 120.60 2avy n LEU 56 Ca 0.30 0.63 0.23 0.00 -0.02 0.00 0.00 56.01 57.15 2avy n LEU 56 Cb 0.32 -0.74 0.72 0.00 -1.62 0.00 0.00 43.42 42.10 2avy n LEU 56 CO 0.71 -3.86 1.20 0.71 -1.22 0.00 0.00 177.39 174.93 2avy h THR 57 N 0.13 0.49 -0.37 -5.08 1.35 -1.49 0.27 112.91 108.21 2avy h THR 57 Ca -0.33 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.48 2avy h THR 57 Cb 1.24 0.63 -0.03 0.00 -1.73 0.00 0.00 68.15 68.27 2avy h THR 57 CO 0.38 0.00 0.06 -0.46 -0.25 0.00 0.00 175.52 175.25 2avy n ASN 58 N -3.98 3.68 0.00 5.36 2.04 -1.26 -4.91 115.26 116.20 2avy n ASN 58 Ca 0.11 -2.59 0.00 0.00 -0.44 0.00 0.00 54.58 51.66 2avy n ASN 58 Cb 0.72 -0.62 0.00 0.00 -2.53 0.00 0.00 39.78 37.35 2avy n ASN 58 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2avy n GLY 59 N 0.24 1.24 3.51 4.83 0.00 0.94 -4.92 105.19 111.03 2avy n GLY 59 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 2avy n GLY 59 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2avy n PHE 60 N 0.00 0.72 -1.96 1.61 3.01 -1.26 -4.44 117.46 115.13 2avy n PHE 60 Ca 0.00 0.31 -0.32 0.00 1.01 0.00 0.00 57.45 58.45 2avy n PHE 60 Cb 0.00 -2.36 0.02 0.00 -0.01 0.00 0.00 39.48 37.12 2avy n PHE 60 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2avy s GLU 61 N 8.79 3.27 0.00 -1.08 2.02 -1.26 -3.32 118.70 127.12 2avy s GLU 61 Ca 1.28 1.14 0.00 0.00 0.02 0.00 0.00 54.97 57.41 2avy s GLU 61 Cb -1.02 -2.03 0.00 0.00 0.10 0.00 0.00 34.13 31.18 2avy s GLU 61 CO 0.44 -0.84 0.00 1.55 0.02 0.00 0.00 175.26 176.43 2avy n VAL 62 N -2.24 0.00 -2.98 2.63 3.14 0.08 -4.95 118.33 114.00 2avy n VAL 62 Ca 0.08 0.00 -0.40 0.00 -2.96 0.00 0.00 64.34 61.06 2avy n VAL 62 Cb 0.53 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 33.27 2avy n VAL 62 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2avy s THR 63 N -1.31 5.00 0.07 1.55 -1.32 -1.26 0.11 115.64 118.49 2avy s THR 63 Ca 0.00 1.55 0.05 0.00 -1.21 0.00 0.00 61.69 62.08 2avy s THR 63 Cb 0.00 -4.09 -0.04 0.00 -1.51 0.00 0.00 72.50 66.86 2avy s THR 63 CO 0.00 0.20 -0.05 -0.55 -2.21 0.00 0.00 174.62 172.02 2avy s SER 64 N 0.89 4.73 0.37 8.08 0.15 0.57 -4.24 113.70 124.25 2avy s SER 64 Ca 0.39 -0.24 -0.24 0.00 0.70 0.00 0.00 55.95 56.57 2avy s SER 64 Cb -0.18 -1.05 -0.10 0.00 -1.71 0.00 0.00 66.02 62.98 2avy s SER 64 CO 0.18 0.20 0.96 -0.47 1.20 0.00 0.00 173.24 175.32 2avy s TYR 65 N -1.21 3.49 -0.60 3.44 5.04 0.44 -2.29 117.35 125.66 2avy s TYR 65 Ca 0.22 1.70 0.04 0.00 -2.44 0.00 0.00 57.07 56.60 2avy s TYR 65 Cb -0.11 -2.94 0.35 0.00 0.35 0.00 0.00 41.96 39.61 2avy s TYR 65 CO 0.14 -0.05 1.07 -0.89 -1.34 0.00 0.00 175.55 174.48 2avy n ILE 66 N 0.04 3.26 -0.79 3.14 5.41 -1.14 0.74 119.36 130.02 2avy n ILE 66 Ca 0.04 -5.51 -0.33 0.00 1.00 0.00 0.00 62.75 57.95 2avy n ILE 66 Cb 0.51 -1.39 0.11 0.00 -0.71 0.00 0.00 39.64 38.16 2avy n ILE 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2avy n GLY 67 N -0.27 -2.65 0.00 7.39 0.00 -1.26 -4.84 105.19 103.56 2avy n GLY 67 Ca 0.34 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2avy n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2avy n GLY 68 N 2.66 2.63 2.34 -0.02 0.00 -1.26 -4.82 105.19 106.73 2avy n GLY 68 Ca -0.00 -1.75 -0.27 0.00 0.00 0.00 0.00 46.02 44.00 2avy n GLY 68 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2avy n GLU 69 N 0.90 2.93 0.00 1.61 2.13 -1.26 -4.58 120.64 122.37 2avy n GLU 69 Ca 0.00 -2.23 0.00 0.00 0.66 0.00 0.00 57.16 55.59 2avy n GLU 69 Cb 0.00 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 29.42 2avy n GLU 69 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2avy n GLY 70 N 1.78 -0.29 3.80 8.31 0.00 -1.26 -4.76 105.19 112.77 2avy n GLY 70 Ca 0.54 0.65 -0.29 0.00 0.00 0.00 0.00 46.02 46.92 2avy n GLY 70 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2avy s HIS 71 N 0.00 2.64 -0.06 1.61 -3.43 -1.26 -4.51 115.29 110.29 2avy s HIS 71 Ca 0.00 0.94 0.02 0.00 -0.80 0.00 0.00 55.06 55.22 2avy s HIS 71 Cb 0.00 -3.31 0.07 0.00 -1.43 0.00 0.00 32.58 27.91 2avy s HIS 71 CO 0.00 -2.14 0.59 -1.71 -2.00 0.00 0.00 174.74 169.48 2avy n ASN 72 N -3.63 -0.32 -4.95 7.38 2.85 -1.26 -5.05 115.26 110.28 2avy n ASN 72 Ca 0.07 -1.04 -0.21 0.00 -0.11 0.00 0.00 54.58 53.29 2avy n ASN 72 Cb 0.58 0.14 -0.02 0.00 1.24 0.00 0.00 39.78 41.72 2avy n ASN 72 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2avy s LEU 73 N -0.68 4.26 0.46 1.20 1.43 -1.26 -4.58 118.68 119.51 2avy s LEU 73 Ca 0.01 0.04 0.05 0.00 -1.03 0.00 0.00 54.13 53.20 2avy s LEU 73 Cb 0.07 -2.80 -0.04 0.00 0.03 0.00 0.00 46.19 43.46 2avy s LEU 73 CO -0.02 -0.06 0.07 -1.58 0.23 0.00 0.00 176.35 174.99 2avy s GLN 74 N -3.91 2.12 0.00 1.70 -0.44 -1.26 -5.00 119.66 112.87 2avy s GLN 74 Ca 0.34 -2.18 0.00 0.00 -2.50 0.00 0.00 55.36 51.02 2avy s GLN 74 Cb -0.09 -1.69 0.00 0.00 -1.64 0.00 0.00 33.01 29.59 2avy s GLN 74 CO 0.28 -0.24 0.73 0.39 0.50 0.00 0.00 175.29 176.96 2avy n GLU 75 N -1.20 0.90 0.00 1.67 1.02 -1.26 -3.29 120.64 118.47 2avy n GLU 75 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 2avy n GLU 75 Cb 0.66 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 30.92 2avy n GLU 75 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2avy n HIS 76 N -0.30 0.00 -1.67 -0.32 8.25 -1.25 -4.61 115.22 115.33 2avy n HIS 76 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.06 2avy n HIS 76 Cb 0.08 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.22 2avy n HIS 76 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2avy n SER 77 N 0.00 1.90 -4.61 0.41 3.41 -1.21 -4.77 113.62 108.75 2avy n SER 77 Ca 0.00 1.01 -0.39 0.00 -0.26 0.00 0.00 58.87 59.23 2avy n SER 77 Cb 0.00 -1.45 -0.08 0.00 -0.26 0.00 0.00 64.21 62.41 2avy n SER 77 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2avy s VAL 78 N -1.29 5.13 0.49 -3.33 1.01 -1.26 -3.85 120.40 117.30 2avy s VAL 78 Ca 0.66 0.70 0.04 0.00 0.00 0.00 0.00 61.98 63.38 2avy s VAL 78 Cb -0.49 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.12 2avy s VAL 78 CO 0.54 0.14 0.12 0.27 0.00 0.00 0.00 175.10 176.17 2avy s ILE 79 N 2.11 1.58 -0.17 2.22 -5.25 -1.26 -0.62 121.20 119.82 2avy s ILE 79 Ca 0.18 -1.84 0.00 0.00 -0.99 0.00 0.00 60.65 58.00 2avy s ILE 79 Cb -0.16 -2.42 0.03 0.00 2.95 0.00 0.00 42.46 42.87 2avy s ILE 79 CO 0.09 0.00 -0.11 -0.22 -1.79 0.00 0.00 174.94 172.92 2avy s LEU 80 N -3.95 1.91 0.45 0.37 2.96 -1.26 -1.36 118.68 117.80 2avy s LEU 80 Ca 0.22 -0.68 -0.22 0.00 -0.22 0.00 0.00 54.13 53.23 2avy s LEU 80 Cb 0.02 -1.14 -0.08 0.00 0.50 0.00 0.00 46.19 45.48 2avy s LEU 80 CO 0.12 -0.12 1.06 -0.63 -1.32 0.00 0.00 176.35 175.46 2avy s ILE 81 N 1.48 3.68 0.12 6.68 1.01 0.13 0.11 121.20 134.41 2avy s ILE 81 Ca 0.02 1.16 0.00 0.00 0.00 0.00 0.00 60.65 61.83 2avy s ILE 81 Cb -0.15 -3.54 0.00 0.00 0.01 0.00 0.00 42.46 38.78 2avy s ILE 81 CO -0.09 -0.11 0.00 -1.14 0.00 0.00 0.00 174.94 173.60 2avy n ARG 82 N -0.55 0.00 0.00 2.79 0.63 -0.29 -1.39 116.66 117.84 2avy n ARG 82 Ca 0.07 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.00 2avy n ARG 82 Cb 0.51 -0.43 0.00 0.00 0.45 0.00 0.00 32.46 32.98 2avy n ARG 82 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2avy n GLY 83 N 3.23 -0.00 2.85 5.14 0.00 -1.26 -4.55 105.19 110.60 2avy n GLY 83 Ca 0.00 -0.91 -0.02 0.00 0.00 0.00 0.00 46.02 45.09 2avy n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2avy n GLY 84 N 0.00 -2.79 2.19 -0.02 0.00 -1.26 -2.31 105.19 101.00 2avy n GLY 84 Ca 0.00 0.83 -0.21 0.00 0.00 0.00 0.00 46.02 46.65 2avy n GLY 84 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2avy n ARG 85 N 1.81 -3.66 -3.78 1.61 1.85 -1.25 -4.02 116.66 109.23 2avy n ARG 85 Ca -0.18 -1.03 -0.14 0.00 -1.00 0.00 0.00 57.85 55.50 2avy n ARG 85 Cb 0.34 -1.25 -0.15 0.00 -1.05 0.00 0.00 32.46 30.35 2avy n ARG 85 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2avy s VAL 86 N -1.87 -0.05 0.00 8.89 1.01 -0.96 -4.83 120.40 122.60 2avy s VAL 86 Ca 0.46 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.61 2avy s VAL 86 Cb -0.07 -0.12 0.00 0.00 0.00 0.00 0.00 36.38 36.19 2avy s VAL 86 CO 0.38 0.07 0.47 1.17 0.00 0.00 0.00 175.10 177.19 2avy n LYS 87 N 3.98 0.00 -0.58 2.72 3.00 -1.26 -3.62 118.16 122.39 2avy n LYS 87 Ca -0.25 0.29 0.45 0.00 -0.00 0.00 0.00 58.31 58.80 2avy n LYS 87 Cb 0.52 -1.09 0.71 0.00 0.00 0.00 0.00 35.03 35.17 2avy n LYS 87 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2avy n ASP 88 N -1.36 0.06 -4.22 3.14 10.43 -1.26 -3.40 116.55 119.95 2avy n ASP 88 Ca 0.00 1.03 -0.40 0.00 2.57 0.00 0.00 54.79 57.99 2avy n ASP 88 Cb 0.00 -0.51 -0.09 0.00 1.84 0.00 0.00 41.12 42.36 2avy n ASP 88 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2avy s LEU 89 N -8.03 5.43 0.60 0.64 2.01 -1.24 -2.33 118.68 115.76 2avy s LEU 89 Ca -0.05 -1.79 -0.17 0.00 0.01 0.00 0.00 54.13 52.13 2avy s LEU 89 Cb 0.26 -1.97 -0.03 0.00 0.01 0.00 0.00 46.19 44.45 2avy s LEU 89 CO 0.79 -0.62 1.09 -2.16 1.01 0.00 0.00 176.35 176.47 2avy s PRO 90 N 1.35 3.16 0.00 1.29 0.04 -1.22 -2.97 135.00 136.66 2avy s PRO 90 Ca 0.05 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.48 2avy s PRO 90 Cb -0.25 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.30 2avy s PRO 90 CO -0.00 -0.96 0.00 0.41 0.04 0.00 0.00 177.00 176.48 2avy n GLY 91 N -0.45 1.65 3.35 0.56 0.00 -1.26 -4.85 105.19 104.20 2avy n GLY 91 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 2avy n GLY 91 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2avy n VAL 92 N -1.62 4.41 -1.38 1.61 0.31 -1.16 -4.68 118.33 115.82 2avy n VAL 92 Ca 0.00 -4.96 -0.29 0.00 -0.01 0.00 0.00 64.34 59.08 2avy n VAL 92 Cb 0.00 -2.48 0.11 0.00 -0.91 0.00 0.00 33.84 30.56 2avy n VAL 92 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 2avy n ARG 93 N 4.38 2.61 -3.90 5.55 1.85 -1.26 -2.26 116.66 123.63 2avy n ARG 93 Ca 0.33 -3.30 -0.09 0.00 -1.00 0.00 0.00 57.85 53.78 2avy n ARG 93 Cb 0.41 -2.23 -0.06 0.00 -1.05 0.00 0.00 32.46 29.53 2avy n ARG 93 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 2avy s TYR 94 N -3.64 0.23 -0.04 2.89 2.02 -1.26 -3.78 117.35 113.77 2avy s TYR 94 Ca 0.60 -0.59 -0.04 0.00 -0.37 0.00 0.00 57.07 56.68 2avy s TYR 94 Cb 0.49 0.12 0.01 0.00 -0.40 0.00 0.00 41.96 42.18 2avy s TYR 94 CO 0.02 -0.82 0.12 -1.58 -1.57 0.00 0.00 175.55 171.72 2avy s HIS 95 N -3.95 -0.13 -0.07 2.71 5.65 -0.98 0.17 115.29 118.70 2avy s HIS 95 Ca 0.16 0.32 -0.30 0.00 0.25 0.00 0.00 55.06 55.49 2avy s HIS 95 Cb 0.01 0.02 -0.02 0.00 -1.18 0.00 0.00 32.58 31.42 2avy s HIS 95 CO 0.01 -0.07 1.00 0.95 -0.65 0.00 0.00 174.74 175.97 2avy s THR 96 N 0.21 4.81 0.20 0.89 -4.23 0.23 -1.14 115.64 116.61 2avy s THR 96 Ca -0.01 2.05 -0.32 0.00 -1.18 0.00 0.00 61.69 62.22 2avy s THR 96 Cb -0.02 -4.32 -0.14 0.00 1.34 0.00 0.00 72.50 69.36 2avy s THR 96 CO -0.01 0.05 1.43 0.52 -0.54 0.00 0.00 174.62 176.08 2avy n VAL 97 N 4.34 0.62 -3.12 2.29 0.31 0.29 -4.78 118.33 118.28 2avy n VAL 97 Ca 0.08 -0.15 -0.42 0.00 -0.01 0.00 0.00 64.34 63.84 2avy n VAL 97 Cb 0.49 -1.40 -0.07 0.00 -0.91 0.00 0.00 33.84 31.96 2avy n VAL 97 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2avy s ARG 98 N 0.02 3.70 0.00 5.55 1.81 -1.26 -4.22 118.95 124.55 2avy s ARG 98 Ca 0.73 0.06 0.00 0.00 -1.72 0.00 0.00 55.73 54.80 2avy s ARG 98 Cb -0.69 -3.80 0.00 0.00 -0.45 0.00 0.00 34.95 30.01 2avy s ARG 98 CO 0.46 -0.71 0.00 0.41 -0.68 0.00 0.00 175.30 174.79 2avy n GLY 99 N 4.65 0.53 3.40 -3.53 0.00 0.26 -4.21 105.19 106.30 2avy n GLY 99 Ca -0.02 -0.31 -0.15 0.00 0.00 0.00 0.00 46.02 45.55 2avy n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2avy s ALA 100 N -2.20 -1.35 0.00 4.61 0.00 -1.26 -5.05 121.76 116.51 2avy s ALA 100 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.68 2avy s ALA 100 Cb 0.00 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.37 2avy s ALA 100 CO 0.00 -0.44 0.00 1.28 0.00 0.00 0.00 175.76 176.60 2avy n LEU 101 N 0.65 0.00 -1.28 0.00 4.32 -1.26 -2.26 117.00 117.17 2avy n LEU 101 Ca -0.19 0.00 -0.03 0.00 -0.02 0.00 0.00 56.01 55.77 2avy n LEU 101 Cb 0.59 0.00 0.12 0.00 -1.62 0.00 0.00 43.42 42.51 2avy n LEU 101 CO 0.21 0.00 0.66 0.47 -1.22 0.00 0.00 177.39 177.51 2avy n ASP 102 N -1.31 3.11 -1.90 -1.43 9.92 0.21 -4.87 116.55 120.28 2avy n ASP 102 Ca 0.00 -2.51 0.00 0.00 -0.53 0.00 0.00 54.79 51.75 2avy n ASP 102 Cb 0.00 -0.61 0.00 0.00 -0.64 0.00 0.00 41.12 39.87 2avy n ASP 102 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2avy n SER 104 N -2.80 0.00 0.00 0.00 3.41 -1.26 -4.71 113.62 108.25 2avy n SER 104 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2avy n SER 104 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2avy n SER 104 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2avy n GLY 105 N 5.00 1.66 3.33 5.00 0.00 -1.26 -0.57 105.19 118.35 2avy n GLY 105 Ca 0.00 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 2avy n GLY 105 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2avy n VAL 106 N -0.21 0.86 -4.34 1.61 0.24 -1.25 -4.64 118.33 110.61 2avy n VAL 106 Ca 0.00 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.34 61.50 2avy n VAL 106 Cb 0.00 -0.12 -0.11 0.00 -1.47 0.00 0.00 33.84 32.14 2avy n VAL 106 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2avy s LYS 107 N -1.14 2.13 0.00 7.34 3.01 -1.26 -4.34 119.74 125.47 2avy s LYS 107 Ca 0.60 -1.00 0.00 0.00 -1.01 0.00 0.00 55.97 54.56 2avy s LYS 107 Cb -0.62 -2.29 0.00 0.00 -1.01 0.00 0.00 37.83 33.92 2avy s LYS 107 CO 0.62 0.52 0.00 -0.25 0.51 0.00 0.00 175.35 176.75 2avy n ASP 108 N 0.97 -4.01 -4.70 2.83 9.92 -1.26 -4.95 116.55 115.35 2avy n ASP 108 Ca -0.14 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.69 2avy n ASP 108 Cb 0.52 -2.71 -0.03 0.00 -0.64 0.00 0.00 41.12 38.27 2avy n ASP 108 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2avy s ARG 109 N -1.42 4.41 0.00 -1.24 1.81 -1.26 -4.91 118.95 116.35 2avy s ARG 109 Ca 0.00 1.61 0.05 0.00 -1.72 0.00 0.00 55.73 55.67 2avy s ARG 109 Cb 0.00 -3.49 -0.01 0.00 -0.45 0.00 0.00 34.95 31.00 2avy s ARG 109 CO 0.00 -0.32 0.40 1.63 -0.68 0.00 0.00 175.30 176.32 2avy n LYS 110 N 4.68 3.06 -4.98 3.54 5.02 -1.26 -4.89 118.16 123.32 2avy n LYS 110 Ca 0.09 -0.34 -0.32 0.00 -2.02 0.00 0.00 58.31 55.72 2avy n LYS 110 Cb 0.47 -0.88 -0.14 0.00 -0.02 0.00 0.00 35.03 34.46 2avy n LYS 110 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2avy s GLN 111 N -1.03 2.44 -1.20 1.97 -0.21 -1.26 -4.66 119.66 115.71 2avy s GLN 111 Ca 0.04 -0.75 -0.00 0.00 0.02 0.00 0.00 55.36 54.67 2avy s GLN 111 Cb 0.04 -2.31 -0.00 0.00 1.00 0.00 0.00 33.01 31.74 2avy s GLN 111 CO 0.14 0.60 0.99 0.00 -2.12 0.00 0.00 175.29 174.90 2avy n ALA 112 N 2.37 -2.04 -0.36 6.09 0.00 -1.26 -4.91 120.51 120.40 2avy n ALA 112 Ca -0.17 -0.05 0.03 0.00 0.00 0.00 0.00 53.44 53.24 2avy n ALA 112 Cb 0.52 -2.57 0.18 0.00 0.00 0.00 0.00 19.45 17.58 2avy n ALA 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2avy h ARG 113 N -1.86 1.14 -0.34 0.00 3.08 -1.87 -2.79 114.38 111.74 2avy h ARG 113 Ca -0.59 -0.07 0.04 0.00 0.07 0.00 0.00 59.98 59.43 2avy h ARG 113 Cb 1.34 -0.26 -0.07 0.00 0.08 0.00 0.00 29.97 31.06 2avy h ARG 113 CO 0.50 0.75 -0.52 0.77 -1.07 0.00 0.00 179.97 180.40 2avy h SER 114 N 1.17 -1.72 -4.27 7.04 0.02 -1.91 -3.35 113.55 110.52 2avy h SER 114 Ca 0.42 0.22 -0.51 0.00 -0.84 0.00 0.00 61.79 61.08 2avy h SER 114 Cb 0.15 0.70 0.13 0.00 0.14 0.00 0.00 62.40 63.52 2avy h SER 114 CO -0.16 -0.39 0.33 -0.54 -1.14 0.00 0.00 176.83 174.92 2avy s LYS 115 N -5.47 2.27 1.01 3.45 1.02 -1.05 -4.80 119.74 116.16 2avy s LYS 115 Ca -0.14 1.30 0.00 0.00 0.02 0.00 0.00 55.97 57.15 2avy s LYS 115 Cb 0.08 -1.89 0.00 0.00 -0.52 0.00 0.00 37.83 35.50 2avy s LYS 115 CO 0.57 -1.65 0.00 0.66 -0.92 0.00 0.00 175.35 174.01 2avy n TYR 116 N -3.26 -2.27 -3.49 3.18 4.01 -1.26 -4.58 117.16 109.48 2avy n TYR 116 Ca 0.10 0.52 -0.42 0.00 -0.16 0.00 0.00 57.90 57.93 2avy n TYR 116 Cb 0.52 -0.85 -0.05 0.00 -0.31 0.00 0.00 39.34 38.66 2avy n TYR 116 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2avy s GLY 117 N -4.70 2.64 -0.27 2.72 0.00 -1.26 -4.58 107.32 101.87 2avy s GLY 117 Ca 0.00 -3.35 -0.24 0.00 0.00 0.00 0.00 44.72 41.14 2avy s GLY 117 CO 0.00 1.20 0.72 -1.34 0.00 0.00 0.00 173.10 173.68 2avy s VAL 118 N -0.04 0.00 -0.28 1.40 -7.23 -1.26 -3.74 120.40 109.25 2avy s VAL 118 Ca 0.18 0.00 -0.03 0.00 -1.81 0.00 0.00 61.98 60.33 2avy s VAL 118 Cb -0.14 -1.00 0.11 0.00 0.56 0.00 0.00 36.38 35.91 2avy s VAL 118 CO -0.07 0.00 0.19 -1.59 -0.31 0.00 0.00 175.10 173.32 2avy s LYS 119 N 0.54 0.23 -0.09 4.82 -2.85 -1.26 -4.51 119.74 116.63 2avy s LYS 119 Ca -0.01 -0.31 -0.06 0.00 -1.00 0.00 0.00 55.97 54.59 2avy s LYS 119 Cb -0.05 -1.03 0.02 0.00 -2.06 0.00 0.00 37.83 34.71 2avy s LYS 119 CO -0.02 -0.97 0.12 -2.13 0.10 0.00 0.00 175.35 172.45 2avy n ARG 120 N 5.28 -3.03 -0.03 1.78 0.63 -1.26 -4.99 116.66 115.03 2avy n ARG 120 Ca -0.05 2.38 -0.03 0.00 -0.92 0.00 0.00 57.85 59.23 2avy n ARG 120 Cb 0.45 -3.03 0.03 0.00 0.45 0.00 0.00 32.46 30.36 2avy n ARG 120 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2avy n PRO 121 N 2.10 -1.89 0.00 -0.14 -0.04 -1.26 -4.74 135.00 129.03 2avy n PRO 121 Ca -0.20 -0.16 0.00 0.00 -0.04 0.00 0.00 63.50 63.09 2avy n PRO 121 Cb 0.31 -0.23 0.00 0.00 -0.04 0.00 0.00 33.50 33.55 2avy n PRO 121 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2avy n LYS 122 N -2.17 0.00 -0.61 0.54 2.85 -1.26 -5.25 118.16 112.26 2avy n LYS 122 Ca 0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 2avy n LYS 122 Cb 0.07 -1.06 0.00 0.00 -0.65 0.00 0.00 35.03 33.39 2avy n LYS 122 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35