#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2t n LYS 2 N 0.00 0.00 0.32 0.03 4.01 -1.26 -3.11 118.16 118.15 2i2t n LYS 2 Ca 0.00 0.00 0.18 0.00 -0.51 0.00 0.00 58.31 57.98 2i2t n LYS 2 Cb 0.00 -0.05 0.97 0.00 -0.51 0.00 0.00 35.03 35.44 2i2t n LYS 2 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2i2t h ALA 3 N -2.00 1.16 0.15 7.82 0.00 -2.06 -2.63 119.26 121.70 2i2t h ALA 3 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2i2t h ALA 3 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2i2t h ALA 3 CO 0.00 -0.16 -0.18 0.87 0.00 0.00 0.00 179.25 179.77 2i2t h LYS 4 N 0.00 -0.33 -0.79 0.00 1.57 -2.01 -2.31 116.57 112.71 2i2t h LYS 4 Ca 0.00 0.02 0.16 0.00 -1.87 0.00 0.00 60.65 58.97 2i2t h LYS 4 Cb 0.33 0.07 -0.11 0.00 0.08 0.00 0.00 32.23 32.61 2i2t h LYS 4 CO 0.00 -0.22 0.30 0.93 -0.57 0.00 0.00 179.45 179.89 2i2t h GLU 5 N -0.34 0.39 -6.11 3.15 4.39 -1.41 -3.43 114.58 111.23 2i2t h GLU 5 Ca -0.02 -0.02 -0.72 0.00 0.34 0.00 0.00 59.36 58.94 2i2t h GLU 5 Cb 0.30 -0.09 0.07 0.00 -0.10 0.00 0.00 28.75 28.93 2i2t h GLU 5 CO -0.04 0.26 0.04 1.28 -1.16 0.00 0.00 179.01 179.38 2i2t n LEU 6 N -5.05 0.30 -3.39 1.33 7.99 -0.87 -3.07 117.00 114.24 2i2t n LEU 6 Ca 0.16 1.15 -0.12 0.00 -0.01 0.00 0.00 56.01 57.18 2i2t n LEU 6 Cb 0.48 -1.03 0.01 0.00 -0.11 0.00 0.00 43.42 42.77 2i2t n LEU 6 CO 0.16 -1.88 0.08 -1.14 -1.51 0.00 0.00 177.39 173.10 2i2t n ARG 7 N 1.57 -1.41 -0.49 3.23 3.00 -1.26 -4.94 116.66 116.35 2i2t n ARG 7 Ca 0.18 1.11 0.00 0.00 -0.00 0.00 0.00 57.85 59.15 2i2t n ARG 7 Cb 0.17 -4.32 0.00 0.00 0.00 0.00 0.00 32.46 28.30 2i2t n ARG 7 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2i2t n GLU 8 N -2.34 0.00 -2.07 -0.14 2.13 -1.17 -5.11 120.64 111.93 2i2t n GLU 8 Ca -0.13 -0.87 0.00 0.00 0.66 0.00 0.00 57.16 56.82 2i2t n GLU 8 Cb 0.58 -0.44 0.00 0.00 0.27 0.00 0.00 31.44 31.85 2i2t n GLU 8 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2i2t n LYS 9 N 0.00 -5.34 -0.09 5.31 4.01 -1.26 -4.43 118.16 116.36 2i2t n LYS 9 Ca 0.00 3.77 -0.02 0.00 -0.51 0.00 0.00 58.31 61.55 2i2t n LYS 9 Cb 0.67 -4.12 -0.02 0.00 -0.51 0.00 0.00 35.03 31.06 2i2t n LYS 9 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 2i2t n SER 10 N 1.84 -0.22 -0.31 4.39 3.41 -1.26 -1.66 113.62 119.82 2i2t n SER 10 Ca 0.00 0.85 0.25 0.00 -0.26 0.00 0.00 58.87 59.71 2i2t n SER 10 Cb 0.00 -0.29 0.47 0.00 -0.26 0.00 0.00 64.21 64.12 2i2t n SER 10 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2i2t n VAL 11 N -3.33 -0.39 0.05 -3.33 0.31 -1.26 -1.47 118.33 108.91 2i2t n VAL 11 Ca 0.00 1.96 -0.02 0.00 -0.01 0.00 0.00 64.34 66.27 2i2t n VAL 11 Cb 0.05 -3.07 -0.01 0.00 -0.91 0.00 0.00 33.84 29.90 2i2t n VAL 11 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2i2t h GLU 12 N 0.00 -0.13 -0.80 5.55 5.08 -1.53 -3.25 114.58 119.50 2i2t h GLU 12 Ca 0.73 0.01 0.19 0.00 -1.00 0.00 0.00 59.36 59.28 2i2t h GLU 12 Cb 1.82 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 31.05 2i2t h GLU 12 CO -0.77 -0.09 0.54 1.05 -1.00 0.00 0.00 179.01 178.74 2i2t h GLU 13 N -0.15 0.28 -0.24 2.33 4.11 -1.48 -2.20 114.58 117.23 2i2t h GLU 13 Ca -0.01 -0.02 0.06 0.00 0.07 0.00 0.00 59.36 59.46 2i2t h GLU 13 Cb 0.11 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.22 2i2t h GLU 13 CO 0.02 0.19 -0.30 1.25 0.07 0.00 0.00 179.01 180.24 2i2t h LEU 14 N 0.29 -0.95 -0.02 3.06 7.12 -1.29 0.62 115.31 124.14 2i2t h LEU 14 Ca 0.40 0.16 0.00 0.00 0.13 0.00 0.00 57.88 58.56 2i2t h LEU 14 Cb 1.12 0.43 0.00 0.00 -0.53 0.00 0.00 40.66 41.67 2i2t h LEU 14 CO -0.11 -0.32 0.00 0.59 -0.13 0.00 0.00 178.44 178.47 2i2t n ASN 15 N -5.40 0.03 0.10 1.25 4.13 -0.87 -2.45 115.26 112.05 2i2t n ASN 15 Ca -0.01 0.51 0.01 0.00 1.68 0.00 0.00 54.58 56.76 2i2t n ASN 15 Cb 0.32 -0.51 -0.02 0.00 -1.54 0.00 0.00 39.78 38.02 2i2t n ASN 15 CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 2i2t h THR 16 N 0.00 0.89 0.02 3.41 2.02 0.50 -3.28 112.91 116.47 2i2t h THR 16 Ca 0.00 -2.33 -0.27 0.00 0.77 0.00 0.00 66.41 64.59 2i2t h THR 16 Cb 0.36 2.39 -0.04 0.00 -1.74 0.00 0.00 68.15 69.13 2i2t h THR 16 CO 0.00 0.51 -1.44 1.05 0.37 0.00 0.00 175.52 176.01 2i2t h GLU 17 N 0.00 0.04 -0.77 6.66 -0.00 -0.42 -3.28 114.58 116.82 2i2t h GLU 17 Ca -0.05 -0.07 0.21 0.00 -0.00 0.00 0.00 59.36 59.45 2i2t h GLU 17 Cb 1.49 0.03 -0.04 0.00 -0.00 0.00 0.00 28.75 30.23 2i2t h GLU 17 CO 0.07 0.78 0.54 1.25 -0.00 0.00 0.00 179.01 181.65 2i2t h LEU 18 N 0.01 0.10 0.25 3.06 7.12 -1.58 0.14 115.31 124.42 2i2t h LEU 18 Ca -0.18 0.01 -0.01 0.00 0.13 0.00 0.00 57.88 57.82 2i2t h LEU 18 Cb 1.93 -0.01 0.00 0.00 -0.53 0.00 0.00 40.66 42.05 2i2t h LEU 18 CO 0.11 0.04 -0.12 -0.07 -0.13 0.00 0.00 178.44 178.27 2i2t h LEU 19 N 0.10 -0.29 -0.70 2.25 4.07 -1.67 -0.24 115.31 118.83 2i2t h LEU 19 Ca 0.37 -0.13 0.08 0.00 0.08 0.00 0.00 57.88 58.28 2i2t h LEU 19 Cb 1.33 0.07 -0.11 0.00 1.08 0.00 0.00 40.66 43.04 2i2t h LEU 19 CO -0.04 -0.03 -0.54 0.78 -1.08 0.00 0.00 178.44 177.52 2i2t h ASN 20 N -0.55 -1.91 0.35 -0.43 4.21 -1.12 -2.45 115.58 113.69 2i2t h ASN 20 Ca -0.03 0.28 -0.02 0.00 1.21 0.00 0.00 56.30 57.74 2i2t h ASN 20 Cb 0.40 0.83 -0.00 0.00 -1.12 0.00 0.00 38.32 38.43 2i2t h ASN 20 CO 0.06 -0.32 -0.21 -0.07 -1.29 0.00 0.00 177.43 175.60 2i2t h LEU 21 N -0.19 -0.53 -8.52 1.61 3.38 -1.50 0.11 115.31 109.67 2i2t h LEU 21 Ca 0.14 0.03 -0.61 0.00 0.09 0.00 0.00 57.88 57.53 2i2t h LEU 21 Cb 0.52 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 2i2t h LEU 21 CO -0.77 -0.33 1.50 -0.11 0.09 0.00 0.00 178.44 178.83 2i2t n LEU 22 N -3.59 2.02 0.00 1.67 7.94 -0.10 -2.12 117.00 122.82 2i2t n LEU 22 Ca -0.06 0.21 0.00 0.00 -1.11 0.00 0.00 56.01 55.05 2i2t n LEU 22 Cb 0.22 -1.30 0.00 0.00 0.53 0.00 0.00 43.42 42.87 2i2t n LEU 22 CO 0.15 -0.87 0.00 0.54 -1.11 0.00 0.00 177.39 176.10 2i2t n ARG 23 N 8.41 0.00 0.00 1.96 5.12 -1.26 -4.40 116.66 126.50 2i2t n ARG 23 Ca 0.43 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.35 2i2t n ARG 23 Cb 0.28 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.58 2i2t n ARG 23 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2i2t n GLU 24 N 0.00 0.00 0.00 5.56 1.02 -1.20 0.14 120.64 126.16 2i2t n GLU 24 Ca 0.00 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2i2t n GLU 24 Cb 0.00 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 29.86 2i2t n GLU 24 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 2i2t n GLN 25 N -0.93 0.00 0.29 3.49 0.00 0.37 -4.73 117.38 115.87 2i2t n GLN 25 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.00 56.84 2i2t n GLN 25 Cb 0.06 -0.27 -0.08 0.00 0.00 0.00 0.00 30.24 29.95 2i2t n GLN 25 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 2i2t h PHE 26 N 0.00 -0.64 -0.60 3.69 -0.00 -0.82 -1.82 116.94 116.76 2i2t h PHE 26 Ca 0.00 -0.02 0.07 0.00 -0.00 0.00 0.00 57.97 58.02 2i2t h PHE 26 Cb 0.00 0.21 -0.06 0.00 -0.00 0.00 0.00 35.95 36.10 2i2t h PHE 26 CO 0.00 -0.39 0.29 -0.91 -0.00 0.00 0.00 178.31 177.30 2i2t h ASN 27 N -0.70 0.39 -0.16 0.41 -0.26 0.91 0.16 115.58 116.32 2i2t h ASN 27 Ca -0.07 0.04 0.05 0.00 -0.56 0.00 0.00 56.30 55.76 2i2t h ASN 27 Cb 0.53 -0.02 -0.05 0.00 -1.06 0.00 0.00 38.32 37.72 2i2t h ASN 27 CO 0.12 0.25 -0.18 -0.07 -1.06 0.00 0.00 177.43 176.48 2i2t h LEU 28 N 0.53 -0.57 -2.47 1.61 -0.00 -1.52 0.94 115.31 113.84 2i2t h LEU 28 Ca 0.28 0.10 -0.00 0.00 -0.00 0.00 0.00 57.88 58.26 2i2t h LEU 28 Cb 0.23 0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 41.16 2i2t h LEU 28 CO -0.21 -0.23 -0.02 0.03 -0.00 0.00 0.00 178.44 178.01 2i2t h ARG 29 N -0.21 0.00 0.03 1.13 3.08 -0.43 -2.04 114.38 115.94 2i2t h ARG 29 Ca 0.11 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.94 2i2t h ARG 29 Cb 0.37 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 2i2t h ARG 29 CO -0.28 0.02 -1.17 0.52 -1.07 0.00 0.00 179.97 177.99 2i2t h MET 30 N 0.00 0.07 0.24 0.04 2.86 0.22 -2.97 114.93 115.38 2i2t h MET 30 Ca -0.00 -0.12 0.01 0.00 -2.06 0.00 0.00 59.70 57.53 2i2t h MET 30 Cb 0.15 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.82 2i2t h MET 30 CO 0.00 1.06 -0.38 0.37 1.06 0.00 0.00 176.91 179.01 2i2t h GLN 31 N -0.78 -0.67 -0.92 1.72 5.75 0.96 -2.08 115.11 119.10 2i2t h GLN 31 Ca -0.30 0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.29 2i2t h GLN 31 Cb 1.41 0.15 -0.05 0.00 1.07 0.00 0.00 27.48 30.06 2i2t h GLN 31 CO -0.10 -0.45 0.60 0.00 -2.65 0.00 0.00 178.83 176.23 2i2t h ALA 32 N -0.21 1.42 0.00 3.38 0.00 -1.44 0.27 119.26 122.68 2i2t h ALA 32 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2i2t h ALA 32 Cb 0.67 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2i2t h ALA 32 CO -0.15 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.59 2i2t n ALA 33 N -2.39 2.07 -2.85 0.00 0.00 -0.83 -2.43 120.51 114.08 2i2t n ALA 33 Ca 0.12 -0.06 -0.12 0.00 0.00 0.00 0.00 53.44 53.39 2i2t n ALA 33 Cb 0.10 -1.14 0.02 0.00 0.00 0.00 0.00 19.45 18.43 2i2t n ALA 33 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2i2t n SER 34 N -0.77 0.86 0.00 0.00 7.64 0.08 -5.03 113.62 116.40 2i2t n SER 34 Ca 0.07 -2.84 0.00 0.00 1.01 0.00 0.00 58.87 57.11 2i2t n SER 34 Cb 0.03 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 2i2t n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2i2t n GLY 35 N 0.04 3.99 7.00 0.23 0.00 -1.02 -4.86 105.19 110.57 2i2t n GLY 35 Ca 0.14 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2i2t n GLY 35 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2i2t n GLN 36 N 14.00 0.00 -0.13 1.61 6.02 -1.26 -3.62 117.38 134.00 2i2t n GLN 36 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 57.01 2i2t n GLN 36 Cb 0.00 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.26 2i2t n GLN 36 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2i2t n LEU 37 N 0.00 0.00 0.00 1.08 4.77 -1.26 -4.75 117.00 116.84 2i2t n LEU 37 Ca 0.00 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2i2t n LEU 37 Cb 0.00 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 2i2t n LEU 37 CO 0.00 -0.49 0.00 1.67 -1.33 0.00 0.00 177.39 177.24 2i2t n GLN 38 N -0.82 0.00 -0.84 3.23 0.00 -1.26 -4.97 117.38 112.72 2i2t n GLN 38 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 57.00 56.82 2i2t n GLN 38 Cb 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 30.24 30.22 2i2t n GLN 38 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2i2t n GLN 39 N 0.00 2.05 0.08 3.69 1.13 -1.26 -4.30 117.38 118.77 2i2t n GLN 39 Ca 0.00 -1.20 -0.07 0.00 -1.94 0.00 0.00 57.00 53.79 2i2t n GLN 39 Cb 0.00 -2.20 -0.05 0.00 0.11 0.00 0.00 30.24 28.10 2i2t n GLN 39 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2i2t h SER 40 N 4.69 0.08 0.16 1.08 4.64 -1.99 -2.94 113.55 119.27 2i2t h SER 40 Ca 0.37 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.61 2i2t h SER 40 Cb 0.71 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2i2t h SER 40 CO 0.88 0.97 -0.03 1.12 -0.87 0.00 0.00 176.83 178.90 2i2t h HIS 41 N 0.02 0.00 0.00 4.77 2.07 -2.00 0.47 115.15 120.48 2i2t h HIS 41 Ca -0.03 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.41 2i2t h HIS 41 Cb 1.63 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.60 2i2t h HIS 41 CO 0.01 0.03 -0.41 1.25 -3.07 0.00 0.00 177.93 175.74 2i2t h LEU 42 N 0.00 0.00 -0.82 6.12 5.85 -1.84 -1.38 115.31 123.24 2i2t h LEU 42 Ca -0.00 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 2i2t h LEU 42 Cb 0.11 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 2i2t h LEU 42 CO 0.00 0.41 0.03 -0.07 -0.34 0.00 0.00 178.44 178.47 2i2t h LEU 43 N 0.00 0.88 -0.49 2.25 3.38 -0.16 -0.40 115.31 120.77 2i2t h LEU 43 Ca -0.00 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 2i2t h LEU 43 Cb 0.81 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2i2t h LEU 43 CO 0.05 0.92 0.30 0.50 0.09 0.00 0.00 178.44 180.31 2i2t h LYS 44 N 0.85 0.66 0.00 1.13 1.63 -1.19 -3.29 116.57 116.36 2i2t h LYS 44 Ca 0.16 -0.06 -0.36 0.00 -0.85 0.00 0.00 60.65 59.55 2i2t h LYS 44 Cb 0.46 -0.14 0.17 0.00 -0.60 0.00 0.00 32.23 32.12 2i2t h LYS 44 CO 0.02 0.48 0.15 1.04 -3.45 0.00 0.00 179.45 177.69 2i2t n GLN 45 N -4.71 -2.57 0.00 1.90 6.02 -0.16 -2.51 117.38 115.35 2i2t n GLN 45 Ca 0.02 -1.59 0.00 0.00 -0.01 0.00 0.00 57.00 55.42 2i2t n GLN 45 Cb 0.05 -1.40 0.00 0.00 1.02 0.00 0.00 30.24 29.91 2i2t n GLN 45 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2i2t n VAL 46 N -4.41 0.00 0.29 5.09 0.31 -1.23 -4.14 118.33 114.25 2i2t n VAL 46 Ca 0.14 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.32 2i2t n VAL 46 Cb 0.52 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.37 2i2t n VAL 46 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2i2t h ARG 47 N 0.00 -0.85 -2.04 5.55 3.08 -1.63 1.48 114.38 119.97 2i2t h ARG 47 Ca 0.00 0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 2i2t h ARG 47 Cb 0.00 0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 2i2t h ARG 47 CO 0.00 -0.57 -0.02 -2.13 -1.07 0.00 0.00 179.97 176.18 2i2t n ARG 48 N -4.81 0.85 0.00 0.04 0.63 -1.04 -1.72 116.66 110.60 2i2t n ARG 48 Ca -0.11 -0.10 0.00 0.00 -0.92 0.00 0.00 57.85 56.72 2i2t n ARG 48 Cb 0.38 -1.23 0.00 0.00 0.45 0.00 0.00 32.46 32.06 2i2t n ARG 48 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2i2t n ASP 49 N 1.77 0.00 0.29 6.15 8.00 -0.45 -4.64 116.55 127.68 2i2t n ASP 49 Ca 0.04 0.00 0.16 0.00 0.71 0.00 0.00 54.79 55.70 2i2t n ASP 49 Cb 0.42 0.06 0.91 0.00 -0.02 0.00 0.00 41.12 42.48 2i2t n ASP 49 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2i2t h VAL 50 N 0.00 0.43 0.42 2.53 2.07 0.29 -0.72 116.25 121.28 2i2t h VAL 50 Ca 0.00 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 2i2t h VAL 50 Cb 0.00 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 2i2t h VAL 50 CO 0.00 0.04 -0.20 0.00 0.02 0.00 0.00 177.57 177.42 2i2t h ALA 51 N 1.96 -0.57 -0.75 1.67 0.00 -1.68 -1.46 119.26 118.44 2i2t h ALA 51 Ca -0.00 -0.12 0.14 0.00 0.00 0.00 0.00 54.91 54.93 2i2t h ALA 51 Cb 0.12 0.22 -0.14 0.00 0.00 0.00 0.00 17.79 17.99 2i2t h ALA 51 CO 0.00 -0.53 -0.25 0.00 0.00 0.00 0.00 179.25 178.47 2i2t h ARG 52 N -1.15 -0.04 -0.15 0.00 3.08 -1.56 3.43 114.38 117.99 2i2t h ARG 52 Ca -0.06 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 2i2t h ARG 52 Cb 0.44 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 2i2t h ARG 52 CO 0.10 -0.03 0.09 0.28 -1.07 0.00 0.00 179.97 179.34 2i2t h VAL 53 N -0.05 1.08 0.00 2.04 2.07 -1.26 0.33 116.25 120.47 2i2t h VAL 53 Ca 0.33 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.60 2i2t h VAL 53 Cb 0.57 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 2i2t h VAL 53 CO -0.78 0.07 -0.18 0.11 0.02 0.00 0.00 177.57 176.81 2i2t h LYS 54 N 0.16 0.00 0.41 1.57 1.57 0.40 -1.65 116.57 119.04 2i2t h LYS 54 Ca 0.05 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2i2t h LYS 54 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2i2t h LYS 54 CO -0.01 0.18 -0.20 1.15 -0.57 0.00 0.00 179.45 180.01 2i2t h THR 55 N 0.00 0.57 -3.55 -0.16 2.02 0.76 -3.18 112.91 109.37 2i2t h THR 55 Ca -0.00 -0.35 -0.42 0.00 0.77 0.00 0.00 66.41 66.41 2i2t h THR 55 Cb 0.47 0.74 0.19 0.00 -1.74 0.00 0.00 68.15 67.80 2i2t h THR 55 CO 0.02 0.06 0.15 -0.76 0.37 0.00 0.00 175.52 175.37 2i2t s LEU 56 N -9.73 0.85 0.00 2.58 2.01 0.10 -1.03 118.68 113.47 2i2t s LEU 56 Ca -0.15 0.64 0.00 0.00 0.01 0.00 0.00 54.13 54.62 2i2t s LEU 56 Cb 0.03 -2.40 0.00 0.00 0.01 0.00 0.00 46.19 43.82 2i2t s LEU 56 CO 0.57 -4.00 0.00 -0.11 1.01 0.00 0.00 176.35 173.81 2i2t n LEU 57 N -4.68 0.00 0.02 1.79 -0.00 -1.24 -4.22 117.00 108.66 2i2t n LEU 57 Ca 0.13 0.00 -0.08 0.00 -0.00 0.00 0.00 56.01 56.06 2i2t n LEU 57 Cb 0.59 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.95 2i2t n LEU 57 CO 0.46 0.00 0.26 -1.13 -0.00 0.00 0.00 177.39 176.98 2i2t h ASN 58 N 0.00 -0.13 0.00 1.96 -1.24 -1.51 -3.13 115.58 111.53 2i2t h ASN 58 Ca 0.00 -0.33 0.00 0.00 0.71 0.00 0.00 56.30 56.68 2i2t h ASN 58 Cb 0.00 0.03 0.00 0.00 0.73 0.00 0.00 38.32 39.08 2i2t h ASN 58 CO 0.00 0.48 0.09 1.05 -1.29 0.00 0.00 177.43 177.76 2i2t h GLU 59 N -0.96 0.00 0.00 6.67 -0.00 -1.25 0.19 114.58 119.23 2i2t h GLU 59 Ca -0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 59.34 2i2t h GLU 59 Cb 0.46 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.21 2i2t h GLU 59 CO 0.03 0.00 -0.00 -0.22 -0.00 0.00 0.00 179.01 178.81 2i2t h LYS 60 N 0.00 0.00 -5.56 1.06 3.11 -1.80 -3.41 116.57 109.97 2i2t h LYS 60 Ca 0.00 0.00 -0.49 0.00 -2.81 0.00 0.00 60.65 57.35 2i2t h LYS 60 Cb 0.18 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.40 2i2t h LYS 60 CO 0.00 0.00 1.64 0.00 -2.81 0.00 0.00 179.45 178.28 2i2t n ALA 61 N -2.12 0.79 0.00 5.00 0.00 0.67 -2.57 120.51 122.28 2i2t n ALA 61 Ca -0.03 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.68 2i2t n ALA 61 Cb 0.10 -3.00 0.00 0.00 0.00 0.00 0.00 19.45 16.55 2i2t n ALA 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i2t n GLY 62 N 6.11 0.24 0.00 0.00 0.00 -1.26 -5.12 105.19 105.16 2i2t n GLY 62 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.44 2i2t n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32