#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nef n TRP 57 N 0.00 0.00 -1.84 0.00 -0.00 -1.26 -4.17 117.44 110.16 2nef n TRP 57 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.50 57.09 2nef n TRP 57 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 31.31 31.31 2nef n TRP 57 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 177.69 177.58 2nef n LEU 58 N -0.15 7.23 -0.51 5.87 7.94 -1.26 -4.70 117.00 131.42 2nef n LEU 58 Ca 0.00 -4.38 0.00 0.00 -1.11 0.00 0.00 56.01 50.52 2nef n LEU 58 Cb 0.00 -1.57 0.00 0.00 0.53 0.00 0.00 43.42 42.38 2nef n LEU 58 CO 0.00 1.42 0.18 1.21 -1.11 0.00 0.00 177.39 179.09 2nef n GLU 59 N 4.71 0.69 0.00 1.96 2.13 -1.26 -3.63 120.64 125.25 2nef n GLU 59 Ca 0.54 0.00 0.08 0.00 0.66 0.00 0.00 57.16 58.44 2nef n GLU 59 Cb 0.34 -1.34 0.47 0.00 0.27 0.00 0.00 31.44 31.19 2nef n GLU 59 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2nef n ALA 60 N 0.17 2.14 -1.44 4.31 0.00 -1.26 -4.12 120.51 120.31 2nef n ALA 60 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2nef n ALA 60 Cb 0.18 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2nef n ALA 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2nef n GLN 61 N -0.95 0.00 0.00 0.00 1.13 -1.24 -5.12 117.38 111.19 2nef n GLN 61 Ca 0.12 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.18 2nef n GLN 61 Cb 0.05 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.40 2nef n GLN 61 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2nef n GLU 62 N -0.66 0.00 0.00 -1.09 4.07 -1.26 -5.05 120.64 116.66 2nef n GLU 62 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2nef n GLU 62 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 2nef n GLU 62 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 2nef n GLU 63 N -1.41 0.00 0.08 5.31 2.13 -1.26 -4.91 120.64 120.57 2nef n GLU 63 Ca 0.00 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.86 2nef n GLU 63 Cb 0.00 0.00 0.23 0.00 0.27 0.00 0.00 31.44 31.94 2nef n GLU 63 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2nef n GLU 64 N 0.00 0.06 -0.48 5.31 1.02 -1.26 -0.00 120.64 125.28 2nef n GLU 64 Ca 0.00 0.50 0.05 0.00 -0.02 0.00 0.00 57.16 57.68 2nef n GLU 64 Cb 0.00 -1.82 0.23 0.00 -0.02 0.00 0.00 31.44 29.84 2nef n GLU 64 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2nef n GLU 65 N -1.77 3.11 -3.54 3.49 -0.58 -1.26 -4.74 120.64 115.35 2nef n GLU 65 Ca -0.01 -1.83 -0.10 0.00 -0.42 0.00 0.00 57.16 54.80 2nef n GLU 65 Cb 0.14 -1.85 -0.10 0.00 -0.57 0.00 0.00 31.44 29.06 2nef n GLU 65 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2nef s VAL 66 N -1.94 -0.57 -0.18 2.62 1.01 1.00 -4.85 120.40 117.48 2nef s VAL 66 Ca 0.32 0.09 -0.02 0.00 0.00 0.00 0.00 61.98 62.37 2nef s VAL 66 Cb 0.23 -0.68 -0.22 0.00 0.00 0.00 0.00 36.38 35.71 2nef s VAL 66 CO 0.11 -0.00 0.11 0.61 0.00 0.00 0.00 175.10 175.92 2nef n GLY 67 N 5.37 -0.49 3.32 4.51 0.00 -1.26 -4.99 105.19 111.65 2nef n GLY 67 Ca -0.06 -0.23 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 2nef n GLY 67 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2nef s PHE 68 N -2.54 -0.32 0.57 1.61 -0.71 -1.26 -5.16 117.98 110.18 2nef s PHE 68 Ca -0.27 0.50 -0.18 0.00 -1.04 0.00 0.00 56.93 55.94 2nef s PHE 68 Cb 0.08 0.19 -0.04 0.00 -1.21 0.00 0.00 43.02 42.03 2nef s PHE 68 CO 0.70 -0.46 1.12 -1.25 -1.34 0.00 0.00 175.22 173.99 2nef s PRO 69 N -1.34 3.23 0.00 1.99 0.04 -1.26 -5.03 135.00 132.63 2nef s PRO 69 Ca -0.13 1.54 0.00 0.00 0.04 0.00 0.00 61.00 62.45 2nef s PRO 69 Cb -0.04 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.51 2nef s PRO 69 CO 0.06 -0.93 0.00 1.33 0.04 0.00 0.00 177.00 177.49 2nef n VAL 70 N -1.59 0.00 -3.16 -0.36 0.24 -1.26 -5.04 118.33 107.17 2nef n VAL 70 Ca 0.11 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 62.09 2nef n VAL 70 Cb 0.51 -1.96 -0.06 0.00 -1.47 0.00 0.00 33.84 30.86 2nef n VAL 70 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2nef s THR 71 N -0.14 4.69 0.00 3.34 -4.23 -1.26 -5.04 115.64 113.01 2nef s THR 71 Ca 0.00 0.92 0.00 0.00 -1.18 0.00 0.00 61.69 61.43 2nef s THR 71 Cb 0.00 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.22 2nef s THR 71 CO 0.00 -0.16 0.00 -0.81 -0.54 0.00 0.00 174.62 173.11 2nef n PRO 72 N -0.32 1.00 -1.54 3.99 -0.04 -1.26 -3.97 135.00 132.87 2nef n PRO 72 Ca 0.03 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.15 2nef n PRO 72 Cb 0.53 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.91 2nef n PRO 72 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2nef n GLN 73 N 0.00 0.66 -2.21 0.54 6.02 -1.26 -4.64 117.38 116.49 2nef n GLN 73 Ca 0.00 -0.10 -0.26 0.00 -0.01 0.00 0.00 57.00 56.63 2nef n GLN 73 Cb 0.00 -2.85 0.16 0.00 1.02 0.00 0.00 30.24 28.57 2nef n GLN 73 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 2nef n VAL 74 N 7.84 0.00 -1.60 5.09 0.24 -0.34 -4.92 118.33 124.63 2nef n VAL 74 Ca 0.47 -1.26 -0.58 0.00 -2.04 0.00 0.00 64.34 60.93 2nef n VAL 74 Cb 0.38 -1.21 -0.08 0.00 -1.47 0.00 0.00 33.84 31.46 2nef n VAL 74 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2nef n PRO 75 N -3.32 0.57 -1.62 7.34 -0.02 -1.26 -4.29 135.00 132.40 2nef n PRO 75 Ca 0.16 0.21 -0.36 0.00 -2.02 0.00 0.00 63.50 61.49 2nef n PRO 75 Cb 0.58 -1.78 -0.03 0.00 -0.02 0.00 0.00 33.50 32.24 2nef n PRO 75 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2nef s LEU 76 N 1.22 3.38 0.38 2.45 1.43 -1.26 -4.25 118.68 122.04 2nef s LEU 76 Ca 0.92 0.96 -0.14 0.00 -1.03 0.00 0.00 54.13 54.84 2nef s LEU 76 Cb -1.17 -2.51 -0.08 0.00 0.03 0.00 0.00 46.19 42.46 2nef s LEU 76 CO 0.59 -2.84 0.80 -0.13 0.23 0.00 0.00 176.35 175.00 2nef s ARG 77 N 8.13 3.95 -0.08 1.70 0.52 -1.26 -5.02 118.95 126.90 2nef s ARG 77 Ca 0.94 0.69 -0.30 0.00 -0.52 0.00 0.00 55.73 56.54 2nef s ARG 77 Cb -0.16 -2.35 -0.02 0.00 0.52 0.00 0.00 34.95 32.93 2nef s ARG 77 CO 0.25 0.02 1.06 -1.25 0.02 0.00 0.00 175.30 175.41 2nef s PRO 78 N -3.41 4.41 0.63 3.54 0.04 -1.26 -4.64 135.00 134.32 2nef s PRO 78 Ca 0.55 1.48 -0.17 0.00 0.04 0.00 0.00 61.00 62.90 2nef s PRO 78 Cb -0.10 -3.54 -0.01 0.00 0.04 0.00 0.00 34.50 30.89 2nef s PRO 78 CO 0.23 -0.34 1.17 1.41 0.04 0.00 0.00 177.00 179.51 2nef s MET 79 N 1.99 2.81 0.03 4.56 1.75 -1.26 -5.04 119.30 124.14 2nef s MET 79 Ca 0.51 1.65 0.04 0.00 -1.25 0.00 0.00 55.69 56.64 2nef s MET 79 Cb -0.20 -1.93 -0.02 0.00 2.84 0.00 0.00 34.83 35.52 2nef s MET 79 CO 0.20 -1.29 -0.12 0.95 -0.65 0.00 0.00 175.02 174.11 2nef s THR 80 N -1.92 0.91 0.28 10.11 -4.23 -1.26 -4.95 115.64 114.57 2nef s THR 80 Ca 0.73 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 60.35 2nef s THR 80 Cb -0.26 -0.84 0.26 0.00 1.34 0.00 0.00 72.50 73.00 2nef s THR 80 CO 0.37 -0.05 1.75 0.22 -0.54 0.00 0.00 174.62 176.37 2nef h TYR 81 N 5.02 0.80 -0.30 3.99 3.20 -2.00 2.65 116.97 130.33 2nef h TYR 81 Ca -0.36 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.53 2nef h TYR 81 Cb 1.19 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.22 2nef h TYR 81 CO 0.53 0.14 0.13 -0.22 -1.64 0.00 0.00 178.16 177.11 2nef h LYS 82 N 0.60 0.41 -0.59 1.82 3.64 -1.96 -1.30 116.57 119.19 2nef h LYS 82 Ca 0.51 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.78 2nef h LYS 82 Cb 0.79 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.50 2nef h LYS 82 CO -0.40 0.33 0.10 0.00 -2.27 0.00 0.00 179.45 177.20 2nef h ALA 83 N 1.74 1.06 0.07 5.00 0.00 0.42 0.86 119.26 128.42 2nef h ALA 83 Ca 0.11 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2nef h ALA 83 Cb 0.06 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2nef h ALA 83 CO -0.01 0.61 -0.04 0.00 0.00 0.00 0.00 179.25 179.81 2nef h ALA 84 N 1.20 -0.10 -0.12 0.00 0.00 0.02 1.20 119.26 121.46 2nef h ALA 84 Ca 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2nef h ALA 84 Cb 0.39 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2nef h ALA 84 CO 0.01 -0.50 0.04 0.28 0.00 0.00 0.00 179.25 179.08 2nef h VAL 85 N -0.22 1.17 -0.58 0.00 2.07 -1.31 1.14 116.25 118.51 2nef h VAL 85 Ca -0.01 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 2nef h VAL 85 Cb 0.19 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 2nef h VAL 85 CO 0.02 0.15 0.36 0.44 0.02 0.00 0.00 177.57 178.56 2nef h ASP 86 N 0.02 0.69 -0.38 0.57 5.19 -0.72 -1.72 116.42 120.08 2nef h ASP 86 Ca 0.04 -0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 2nef h ASP 86 Cb 0.20 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 39.52 2nef h ASP 86 CO -0.00 0.53 0.21 0.25 -3.12 0.00 0.00 179.24 177.11 2nef h LEU 87 N 0.79 0.47 -0.76 1.55 5.85 0.19 -0.05 115.31 123.35 2nef h LEU 87 Ca 0.21 -0.09 0.14 0.00 0.84 0.00 0.00 57.88 58.99 2nef h LEU 87 Cb -0.04 -0.12 -0.10 0.00 0.37 0.00 0.00 40.66 40.77 2nef h LEU 87 CO -0.04 0.42 0.31 0.77 -0.34 0.00 0.00 178.44 179.56 2nef h SER 88 N 0.48 0.28 0.18 1.25 4.64 0.21 -0.18 113.55 120.42 2nef h SER 88 Ca 0.13 0.11 -0.18 0.00 -0.47 0.00 0.00 61.79 61.39 2nef h SER 88 Cb 0.06 0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2nef h SER 88 CO -0.02 0.10 -0.67 0.45 -0.87 0.00 0.00 176.83 175.82 2nef h HIS 89 N 0.44 0.59 0.60 4.77 3.86 -0.80 -1.90 115.15 122.72 2nef h HIS 89 Ca 0.42 -0.25 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 2nef h HIS 89 Cb 0.64 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 29.00 2nef h HIS 89 CO -0.16 0.99 -0.48 0.35 0.86 0.00 0.00 177.93 179.49 2nef h PHE 90 N 0.32 -1.31 0.00 2.45 3.04 0.79 -0.64 116.94 121.59 2nef h PHE 90 Ca -0.02 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.91 2nef h PHE 90 Cb 1.24 0.49 -0.00 0.00 2.56 0.00 0.00 35.95 40.23 2nef h PHE 90 CO 0.04 -0.67 -0.08 -0.07 -2.02 0.00 0.00 178.31 175.51 2nef h LEU 91 N -1.05 0.00 0.21 0.59 3.38 -1.42 -1.78 115.31 115.24 2nef h LEU 91 Ca -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2nef h LEU 91 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2nef h LEU 91 CO 0.00 0.08 -0.10 0.50 0.09 0.00 0.00 178.44 179.01 2nef h LYS 92 N 0.00 -0.27 0.29 1.13 3.11 -0.42 0.89 116.57 121.30 2nef h LYS 92 Ca -0.00 0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 57.84 2nef h LYS 92 Cb 0.16 0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.45 2nef h LYS 92 CO 0.01 -0.01 -0.14 0.93 -2.81 0.00 0.00 179.45 177.43 2nef h GLU 93 N -0.51 -0.37 0.00 1.90 5.08 -0.91 -3.31 114.58 116.46 2nef h GLU 93 Ca -0.03 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2nef h GLU 93 Cb 0.38 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2nef h GLU 93 CO 0.05 -0.25 0.00 1.63 -1.00 0.00 0.00 179.01 179.44 2nef n LYS 94 N -3.96 0.03 -4.39 2.33 5.02 -0.69 -4.82 118.16 111.68 2nef n LYS 94 Ca -0.05 0.12 -0.20 0.00 -2.02 0.00 0.00 58.31 56.16 2nef n LYS 94 Cb 0.15 -1.55 -0.10 0.00 -0.02 0.00 0.00 35.03 33.51 2nef n LYS 94 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2nef s GLY 95 N -3.08 1.68 -0.52 0.72 0.00 0.31 -4.99 107.32 101.44 2nef s GLY 95 Ca 0.11 -1.82 0.07 0.00 0.00 0.00 0.00 44.72 43.08 2nef s GLY 95 CO 0.45 -1.79 0.86 0.61 0.00 0.00 0.00 173.10 173.23 2nef n GLY 96 N -0.50 4.90 0.10 0.20 0.00 -1.23 -4.04 105.19 104.62 2nef n GLY 96 Ca -0.06 -2.44 -0.14 0.00 0.00 0.00 0.00 46.02 43.38 2nef n GLY 96 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2nef h LEU 97 N 3.13 0.36 -9.58 0.99 5.85 -1.90 -3.40 115.31 110.75 2nef h LEU 97 Ca 0.13 -0.37 -0.58 0.00 0.84 0.00 0.00 57.88 57.89 2nef h LEU 97 Cb 0.66 -0.12 0.16 0.00 0.37 0.00 0.00 40.66 41.73 2nef h LEU 97 CO 0.72 1.27 -0.16 1.21 -0.34 0.00 0.00 178.44 181.14 2nef n GLU 98 N -3.53 0.78 -0.37 1.25 0.00 -1.26 -0.34 120.64 117.17 2nef n GLU 98 Ca -0.07 0.29 0.00 0.00 0.00 0.00 0.00 57.16 57.39 2nef n GLU 98 Cb 0.99 -1.85 0.00 0.00 0.00 0.00 0.00 31.44 30.58 2nef n GLU 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2nef n GLY 99 N 1.55 0.00 3.63 8.31 0.00 0.44 -4.86 105.19 114.26 2nef n GLY 99 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2nef n GLY 99 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nef s LEU 100 N 0.00 3.89 -0.43 0.99 2.96 0.53 -4.75 118.68 121.88 2nef s LEU 100 Ca 0.00 1.30 -0.27 0.00 -0.22 0.00 0.00 54.13 54.94 2nef s LEU 100 Cb 0.00 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 43.09 2nef s LEU 100 CO 0.00 -1.11 2.28 -0.63 -1.32 0.00 0.00 176.35 175.56 2nef s ILE 101 N 4.54 3.06 -0.40 6.68 -1.09 -1.26 -2.50 121.20 130.24 2nef s ILE 101 Ca 0.59 0.05 -0.27 0.00 -2.23 0.00 0.00 60.65 58.79 2nef s ILE 101 Cb -0.18 -3.14 -0.03 0.00 -1.58 0.00 0.00 42.46 37.52 2nef s ILE 101 CO 0.24 -0.12 2.02 -2.28 -1.23 0.00 0.00 174.94 173.57 2nef s HIS 102 N 10.69 1.50 0.00 3.97 5.65 1.04 -4.88 115.29 133.25 2nef s HIS 102 Ca 0.94 0.82 0.00 0.00 0.25 0.00 0.00 55.06 57.07 2nef s HIS 102 Cb -0.21 -3.97 0.00 0.00 -1.18 0.00 0.00 32.58 27.22 2nef s HIS 102 CO 0.28 -2.98 0.00 0.43 -0.65 0.00 0.00 174.74 171.82 2nef n SER 103 N 12.16 0.00 0.00 9.88 7.64 -1.26 -3.39 113.62 138.66 2nef n SER 103 Ca 0.26 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.14 2nef n SER 103 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 2nef n SER 103 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nef n GLN 104 N 0.00 0.00 0.08 1.43 1.13 -1.26 -4.77 117.38 113.99 2nef n GLN 104 Ca 0.00 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.18 2nef n GLN 104 Cb 0.00 -0.13 0.15 0.00 0.11 0.00 0.00 30.24 30.37 2nef n GLN 104 CO 0.00 0.00 0.00 0.07 -1.44 0.00 0.00 177.06 175.69 2nef h ARG 105 N 0.00 0.00 -0.39 -1.09 0.11 -2.01 -3.33 114.38 107.67 2nef h ARG 105 Ca 0.00 0.00 0.11 0.00 0.10 0.00 0.00 59.98 60.19 2nef h ARG 105 Cb 0.00 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.06 2nef h ARG 105 CO 0.00 0.00 0.34 0.00 0.10 0.00 0.00 179.97 180.41 2nef h ARG 106 N 0.00 0.00 -0.61 0.08 3.08 -1.95 0.51 114.38 115.49 2nef h ARG 106 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 2nef h ARG 106 Cb 0.81 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.84 2nef h ARG 106 CO 0.00 0.00 0.20 0.37 -1.07 0.00 0.00 179.97 179.47 2nef h GLN 107 N 0.00 0.94 -0.10 0.04 4.15 -1.95 -2.83 115.11 115.36 2nef h GLN 107 Ca 0.19 -0.20 0.02 0.00 0.77 0.00 0.00 58.65 59.43 2nef h GLN 107 Cb 0.87 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.39 2nef h GLN 107 CO -0.00 0.83 -0.05 -0.44 -1.93 0.00 0.00 178.83 177.24 2nef h ASP 108 N 0.86 -0.16 -0.10 -0.69 5.19 -1.15 -1.03 116.42 119.35 2nef h ASP 108 Ca 0.20 0.04 0.02 0.00 -0.62 0.00 0.00 57.03 56.67 2nef h ASP 108 Cb 0.27 0.09 -0.05 0.00 0.18 0.00 0.00 39.33 39.82 2nef h ASP 108 CO -0.01 -0.07 -0.46 0.40 -3.12 0.00 0.00 179.24 175.98 2nef h ILE 109 N -0.04 0.00 0.02 0.35 2.04 -1.42 1.91 117.51 120.37 2nef h ILE 109 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.92 2nef h ILE 109 Cb 0.12 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.19 2nef h ILE 109 CO -0.13 0.00 -0.14 0.25 0.00 0.00 0.00 178.15 178.13 2nef h LEU 110 N -0.51 -0.43 -0.37 1.44 5.85 -1.30 1.96 115.31 121.96 2nef h LEU 110 Ca 0.02 0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.87 2nef h LEU 110 Cb 0.58 0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.69 2nef h LEU 110 CO -0.36 -0.15 -0.18 0.44 -0.34 0.00 0.00 178.44 177.85 2nef h ASP 111 N -0.19 -0.63 -0.59 1.25 5.19 -0.95 -0.94 116.42 119.56 2nef h ASP 111 Ca -0.00 0.14 -0.01 0.00 -0.62 0.00 0.00 57.03 56.54 2nef h ASP 111 Cb 0.20 0.34 -0.03 0.00 0.18 0.00 0.00 39.33 40.02 2nef h ASP 111 CO -0.08 -0.22 0.33 0.25 -3.12 0.00 0.00 179.24 176.40 2nef h LEU 112 N -0.12 0.73 -0.53 1.55 5.85 0.34 -2.37 115.31 120.76 2nef h LEU 112 Ca 0.18 -0.09 0.10 0.00 0.84 0.00 0.00 57.88 58.92 2nef h LEU 112 Cb 0.41 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.16 2nef h LEU 112 CO -0.45 0.61 0.00 -0.25 -0.34 0.00 0.00 178.44 178.01 2nef h TRP 113 N 0.80 -0.03 -0.00 1.25 7.01 0.44 1.17 115.95 126.58 2nef h TRP 113 Ca 0.21 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.25 2nef h TRP 113 Cb 0.03 0.10 -0.00 0.00 -2.10 0.00 0.00 29.16 27.18 2nef h TRP 113 CO -0.01 -0.12 0.01 0.82 -2.79 0.00 0.00 178.44 176.35 2nef h ILE 114 N 0.12 0.13 0.00 2.65 1.08 -0.77 -3.02 117.51 117.71 2nef h ILE 114 Ca 0.27 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.74 2nef h ILE 114 Cb 0.41 0.99 0.00 0.00 -3.07 0.00 0.00 36.82 35.15 2nef h ILE 114 CO -0.44 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.02 2nef n TYR 115 N -3.27 0.00 0.46 1.37 9.36 0.40 -3.38 117.16 122.10 2nef n TYR 115 Ca -0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.19 2nef n TYR 115 Cb 0.09 -0.38 0.00 0.00 -0.63 0.00 0.00 39.34 38.42 2nef n TYR 115 CO 0.00 0.00 0.00 -2.39 0.22 0.00 0.00 176.86 174.69 2nef n HIS 116 N -1.63 0.00 0.00 2.98 1.44 -1.09 -4.28 115.22 112.63 2nef n HIS 116 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2nef n HIS 116 Cb 0.00 -0.03 0.00 0.00 0.12 0.00 0.00 29.99 30.08 2nef n HIS 116 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 2nef n THR 117 N 0.09 0.00 0.00 0.61 -2.24 -1.15 -4.10 114.28 107.50 2nef n THR 117 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2nef n THR 117 Cb 0.06 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 2nef n THR 117 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nef n GLN 118 N 0.00 0.00 0.00 -0.78 3.00 -1.26 -4.41 117.38 113.93 2nef n GLN 118 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2nef n GLN 118 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 2nef n GLN 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2nef n GLY 119 N 5.00 0.44 3.79 1.08 0.00 -1.26 -1.20 105.19 113.04 2nef n GLY 119 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2nef n GLY 119 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nef s TYR 120 N -0.41 2.92 0.09 1.61 2.02 -1.26 -4.06 117.35 118.27 2nef s TYR 120 Ca 0.00 1.56 0.05 0.00 -0.37 0.00 0.00 57.07 58.32 2nef s TYR 120 Cb 0.00 -3.10 -0.03 0.00 -0.40 0.00 0.00 41.96 38.42 2nef s TYR 120 CO 0.00 -1.03 -0.14 -0.59 -1.57 0.00 0.00 175.55 172.22 2nef s PHE 121 N -2.01 1.31 -0.52 2.71 -0.71 -1.26 -4.28 117.98 113.22 2nef s PHE 121 Ca 0.68 -0.51 -0.27 0.00 -1.04 0.00 0.00 56.93 55.79 2nef s PHE 121 Cb -0.18 -0.71 -0.02 0.00 -1.21 0.00 0.00 43.02 40.90 2nef s PHE 121 CO 0.24 0.09 1.83 -1.25 -1.34 0.00 0.00 175.22 174.79 2nef s PRO 122 N -2.17 2.86 0.00 1.99 0.04 -1.26 -4.58 135.00 131.88 2nef s PRO 122 Ca 0.03 0.86 0.01 0.00 0.04 0.00 0.00 61.00 61.94 2nef s PRO 122 Cb -0.08 -4.32 0.02 0.00 0.04 0.00 0.00 34.50 30.16 2nef s PRO 122 CO 0.02 -2.44 0.71 -0.40 0.04 0.00 0.00 177.00 174.94 2nef n ASP 123 N 11.91 -0.04 0.00 6.66 5.75 -1.26 -4.86 116.55 134.71 2nef n ASP 123 Ca 0.21 -1.41 0.00 0.00 -0.01 0.00 0.00 54.79 53.58 2nef n ASP 123 Cb 0.50 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 2nef n ASP 123 CO 0.00 0.00 0.00 -2.67 -0.11 0.00 0.00 177.20 174.42 2nef n TRP 124 N 0.02 0.00 -2.27 2.11 4.27 -1.26 -4.98 117.44 115.32 2nef n TRP 124 Ca -0.02 0.00 -0.39 0.00 -3.89 0.00 0.00 57.50 53.20 2nef n TRP 124 Cb 0.60 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.52 2nef n TRP 124 CO 0.00 0.00 0.00 1.14 -2.29 0.00 0.00 177.69 176.54 2nef s GLN 125 N -0.93 2.89 0.19 -2.67 1.03 -1.26 -4.63 119.66 114.29 2nef s GLN 125 Ca 0.00 0.15 0.00 0.00 0.04 0.00 0.00 55.36 55.56 2nef s GLN 125 Cb 0.00 -4.36 -0.04 0.00 0.03 0.00 0.00 33.01 28.64 2nef s GLN 125 CO 0.00 -2.49 0.08 -0.80 -2.54 0.00 0.00 175.29 169.53 2nef s ASN 126 N 6.14 0.67 -0.00 12.60 0.02 -1.26 -5.08 114.94 128.03 2nef s ASN 126 Ca 0.53 -1.30 -0.28 0.00 -1.02 0.00 0.00 52.86 50.78 2nef s ASN 126 Cb -0.10 0.25 0.08 0.00 0.02 0.00 0.00 41.25 41.50 2nef s ASN 126 CO 0.16 -0.73 0.72 -0.31 0.02 0.00 0.00 177.10 176.96 2nef s TYR 127 N -3.93 -0.56 0.52 2.20 1.51 -1.26 -3.03 117.35 112.80 2nef s TYR 127 Ca 0.32 0.75 -0.22 0.00 -1.01 0.00 0.00 57.07 56.92 2nef s TYR 127 Cb 0.07 0.47 -0.06 0.00 -0.11 0.00 0.00 41.96 42.34 2nef s TYR 127 CO 0.08 -0.64 1.24 0.95 -1.11 0.00 0.00 175.55 176.08 2nef s THR 128 N -2.09 2.64 -0.41 -0.71 -4.23 -1.10 -4.86 115.64 104.88 2nef s THR 128 Ca -0.05 0.46 -0.29 0.00 -1.18 0.00 0.00 61.69 60.64 2nef s THR 128 Cb -0.00 -3.22 0.01 0.00 1.34 0.00 0.00 72.50 70.62 2nef s THR 128 CO 0.01 -0.03 1.37 -2.16 -0.54 0.00 0.00 174.62 173.27 2nef s PRO 129 N -2.92 3.63 0.00 3.99 0.04 -1.26 -4.82 135.00 133.67 2nef s PRO 129 Ca 0.70 0.93 0.00 0.00 0.04 0.00 0.00 61.00 62.67 2nef s PRO 129 Cb -0.33 -4.00 0.00 0.00 0.04 0.00 0.00 34.50 30.21 2nef s PRO 129 CO 0.39 -1.49 0.00 0.41 0.04 0.00 0.00 177.00 176.34 2nef n GLY 130 N 4.96 0.71 2.98 0.56 0.00 -1.26 -5.16 105.19 107.98 2nef n GLY 130 Ca 0.16 0.60 -0.19 0.00 0.00 0.00 0.00 46.02 46.59 2nef n GLY 130 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2nef n PRO 131 N 0.00 -1.36 0.00 1.61 -0.02 -1.26 -4.58 135.00 129.39 2nef n PRO 131 Ca 0.00 -0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.08 2nef n PRO 131 Cb 0.00 -1.32 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 2nef n PRO 131 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nef n GLY 132 N 2.67 1.49 3.32 -1.23 0.00 -1.26 -4.79 105.19 105.39 2nef n GLY 132 Ca 0.03 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 2nef n GLY 132 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2nef n ILE 133 N 0.00 0.00 -3.27 -0.61 5.41 -1.26 -4.73 119.36 114.90 2nef n ILE 133 Ca 0.00 -0.34 0.03 0.00 1.00 0.00 0.00 62.75 63.44 2nef n ILE 133 Cb 0.00 -0.74 -0.03 0.00 -0.71 0.00 0.00 39.64 38.16 2nef n ILE 133 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 2nef s ARG 134 N -3.80 0.32 0.30 0.38 3.52 -1.13 -4.84 118.95 113.71 2nef s ARG 134 Ca 0.60 0.67 -0.16 0.00 -0.13 0.00 0.00 55.73 56.70 2nef s ARG 134 Cb -0.16 0.39 -0.09 0.00 -1.56 0.00 0.00 34.95 33.53 2nef s ARG 134 CO 0.64 -0.24 0.74 0.71 -0.81 0.00 0.00 175.30 176.34 2nef s TYR 135 N 2.74 3.43 -0.06 5.12 1.51 -1.26 -2.82 117.35 126.00 2nef s TYR 135 Ca 0.02 1.26 -0.30 0.00 -1.01 0.00 0.00 57.07 57.04 2nef s TYR 135 Cb -0.10 -2.56 -0.02 0.00 -0.11 0.00 0.00 41.96 39.17 2nef s TYR 135 CO -0.16 0.14 1.06 -1.25 -1.11 0.00 0.00 175.55 174.23 2nef s PRO 136 N -2.79 4.43 0.29 -1.71 0.04 -1.26 -2.72 135.00 131.28 2nef s PRO 136 Ca 0.52 1.49 -0.01 0.00 0.04 0.00 0.00 61.00 63.04 2nef s PRO 136 Cb -0.11 -3.52 0.45 0.00 0.04 0.00 0.00 34.50 31.36 2nef s PRO 136 CO 0.18 -0.29 1.93 -0.07 0.04 0.00 0.00 177.00 178.78 2nef h LEU 137 N 7.74 0.98-10.32 -3.56 3.38 -1.87 -3.42 115.31 108.24 2nef h LEU 137 Ca -0.34 -0.01 -0.49 0.00 0.09 0.00 0.00 57.88 57.13 2nef h LEU 137 Cb 1.17 -0.22 0.15 0.00 0.09 0.00 0.00 40.66 41.85 2nef h LEU 137 CO 0.84 0.66 0.25 0.42 0.09 0.00 0.00 178.44 180.70 2nef s THR 138 N -5.96 2.73 -0.10 0.22 -4.23 -1.26 -4.69 115.64 102.35 2nef s THR 138 Ca -0.12 0.24 -0.10 0.00 -1.18 0.00 0.00 61.69 60.53 2nef s THR 138 Cb 0.19 -2.68 -0.03 0.00 1.34 0.00 0.00 72.50 71.32 2nef s THR 138 CO 0.80 -0.31 -0.19 0.33 -0.54 0.00 0.00 174.62 174.71 2nef n PHE 139 N -3.88 0.00 -0.63 3.99 7.35 -1.26 -4.47 117.46 118.57 2nef n PHE 139 Ca 0.08 0.00 0.49 0.00 -0.76 0.00 0.00 57.45 57.26 2nef n PHE 139 Cb 0.55 -0.27 0.79 0.00 0.35 0.00 0.00 39.48 40.90 2nef n PHE 139 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 2nef h GLY 140 N -0.54 0.23 -7.34 7.13 0.00 -1.89 -3.31 103.07 97.35 2nef h GLY 140 Ca 0.00 -0.02 -0.52 0.00 0.00 0.00 0.00 47.33 46.79 2nef h GLY 140 CO 0.00 -0.08 1.18 0.86 0.00 0.00 0.00 176.54 178.50 2nef s TRP 141 N -4.94 2.15 -0.18 5.60 -0.00 -1.26 -3.22 118.94 117.08 2nef s TRP 141 Ca -0.05 0.06 -0.04 0.00 -0.00 0.00 0.00 56.10 56.06 2nef s TRP 141 Cb 0.27 -4.48 -0.07 0.00 -0.00 0.00 0.00 33.47 29.20 2nef s TRP 141 CO 0.88 -2.08 2.93 0.00 -0.00 0.00 0.00 176.95 178.67 2nef s TYR 143 N -0.35 2.53 -0.07 0.00 2.02 -1.26 -1.49 117.35 118.73 2nef s TYR 143 Ca 0.51 -1.26 0.01 0.00 -0.37 0.00 0.00 57.07 55.96 2nef s TYR 143 Cb 0.29 -1.74 0.02 0.00 -0.40 0.00 0.00 41.96 40.13 2nef s TYR 143 CO -0.07 -0.58 -0.10 0.21 -1.57 0.00 0.00 175.55 173.44 2nef s LYS 144 N 0.83 1.56 0.44 -0.62 2.20 -1.06 -4.20 119.74 118.90 2nef s LYS 144 Ca -0.07 -0.34 -0.22 0.00 -0.36 0.00 0.00 55.97 54.98 2nef s LYS 144 Cb -0.15 -1.39 -0.09 0.00 -1.51 0.00 0.00 37.83 34.68 2nef s LYS 144 CO -0.01 -0.05 1.01 -0.51 -0.36 0.00 0.00 175.35 175.42 2nef s LEU 145 N 0.93 3.97 -0.28 5.43 1.43 -1.13 -0.73 118.68 128.30 2nef s LEU 145 Ca -0.10 1.87 -0.15 0.00 -1.03 0.00 0.00 54.13 54.72 2nef s LEU 145 Cb -0.15 -4.44 0.08 0.00 0.03 0.00 0.00 46.19 41.72 2nef s LEU 145 CO 0.01 -0.54 0.68 -0.69 0.23 0.00 0.00 176.35 176.04 2nef s VAL 146 N -1.95 -0.10 -1.01 -1.59 1.01 -1.09 -2.83 120.40 112.84 2nef s VAL 146 Ca 0.62 0.00 -0.23 0.00 0.00 0.00 0.00 61.98 62.38 2nef s VAL 146 Cb -0.15 -0.99 0.02 0.00 0.00 0.00 0.00 36.38 35.25 2nef s VAL 146 CO 0.19 0.00 1.64 -2.16 0.00 0.00 0.00 175.10 174.77 2nef s PRO 147 N 1.76 3.28 0.00 2.72 0.04 -1.26 -3.05 135.00 138.48 2nef s PRO 147 Ca -0.10 -0.95 0.13 0.00 0.04 0.00 0.00 61.00 60.13 2nef s PRO 147 Cb -0.06 -5.28 0.47 0.00 0.04 0.00 0.00 34.50 29.67 2nef s PRO 147 CO -0.20 -2.62 1.35 0.28 0.04 0.00 0.00 177.00 175.85 2nef n VAL 148 N 7.18 0.29 -2.35 -0.36 0.31 -1.26 -4.87 118.33 117.27 2nef n VAL 148 Ca 0.37 -0.33 -0.42 0.00 -0.01 0.00 0.00 64.34 63.95 2nef n VAL 148 Cb 0.49 0.20 -0.03 0.00 -0.91 0.00 0.00 33.84 33.59 2nef n VAL 148 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2nef s GLU 149 N -1.71 4.43 0.87 5.55 2.02 -1.26 -4.99 118.70 123.61 2nef s GLU 149 Ca 0.23 1.88 -0.16 0.00 0.02 0.00 0.00 54.97 56.94 2nef s GLU 149 Cb 0.12 -3.28 -0.03 0.00 0.10 0.00 0.00 34.13 31.04 2nef s GLU 149 CO 0.17 -0.23 -0.53 -2.30 0.02 0.00 0.00 175.26 172.40 2nef n PRO 150 N 3.34 -0.66 0.00 0.39 -0.02 -1.26 -4.96 135.00 131.82 2nef n PRO 150 Ca 0.08 -0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 2nef n PRO 150 Cb 0.45 -1.18 0.00 0.00 -0.02 0.00 0.00 33.50 32.74 2nef n PRO 150 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2nef n GLU 151 N 0.91 0.00 -0.04 -0.52 4.71 -1.26 -4.55 120.64 119.89 2nef n GLU 151 Ca 0.00 0.00 0.09 0.00 -0.01 0.00 0.00 57.16 57.24 2nef n GLU 151 Cb 0.44 0.00 0.42 0.00 -1.01 0.00 0.00 31.44 31.29 2nef n GLU 151 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2nef n LYS 152 N 0.00 1.31 -2.71 3.49 4.76 -1.26 -4.63 118.16 119.12 2nef n LYS 152 Ca 0.00 -0.47 -0.42 0.00 -2.87 0.00 0.00 58.31 54.55 2nef n LYS 152 Cb 0.00 -1.30 -0.02 0.00 -1.84 0.00 0.00 35.03 31.86 2nef n LYS 152 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2nef s LEU 153 N -1.49 4.16 -0.28 -0.35 2.01 -1.26 -4.90 118.68 116.56 2nef s LEU 153 Ca 0.27 -1.86 -0.21 0.00 0.01 0.00 0.00 54.13 52.34 2nef s LEU 153 Cb 0.13 -2.50 0.10 0.00 0.01 0.00 0.00 46.19 43.93 2nef s LEU 153 CO 0.21 -1.27 0.87 -0.70 1.01 0.00 0.00 176.35 176.46 2nef s GLU 154 N 3.91 0.61 -0.38 1.70 2.12 -1.26 -4.62 118.70 120.78 2nef s GLU 154 Ca 0.42 0.85 0.07 0.00 0.36 0.00 0.00 54.97 56.67 2nef s GLU 154 Cb -0.01 0.23 0.29 0.00 0.26 0.00 0.00 34.13 34.90 2nef s GLU 154 CO -0.07 -0.09 1.26 -0.85 -0.54 0.00 0.00 175.26 174.96 2nef n GLU 155 N 3.08 0.87 -0.33 4.30 0.00 -1.26 -4.72 120.64 122.58 2nef n GLU 155 Ca -0.16 -1.48 0.11 0.00 0.00 0.00 0.00 57.16 55.63 2nef n GLU 155 Cb 0.57 -0.11 0.28 0.00 0.00 0.00 0.00 31.44 32.18 2nef n GLU 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2nef h ALA 156 N 1.84 1.49 0.00 -1.84 0.00 -2.03 -3.39 119.26 115.33 2nef h ALA 156 Ca -0.35 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2nef h ALA 156 Cb 1.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2nef h ALA 156 CO -0.09 -0.08 0.00 0.09 0.00 0.00 0.00 179.25 179.16 2nef n ASN 157 N -4.83 0.00 -3.65 0.00 3.02 -1.26 -5.13 115.26 103.42 2nef n ASN 157 Ca 0.21 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.61 2nef n ASN 157 Cb 0.52 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.61 2nef n ASN 157 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2nef s LYS 158 N -0.23 0.78 -0.36 3.52 -2.85 -1.26 -5.13 119.74 114.21 2nef s LYS 158 Ca 0.00 0.56 -0.20 0.00 -1.00 0.00 0.00 55.97 55.33 2nef s LYS 158 Cb 0.00 0.37 0.00 0.00 -2.06 0.00 0.00 37.83 36.15 2nef s LYS 158 CO 0.00 -0.16 0.64 0.16 0.10 0.00 0.00 175.35 176.09 2nef s ASP 174 N -0.25 6.42 0.47 0.03 -4.77 -1.26 -4.73 116.67 112.57 2nef s ASP 174 Ca -0.04 0.12 -0.09 0.00 -3.30 0.00 0.00 52.55 49.24 2nef s ASP 174 Cb -0.03 -2.33 -0.05 0.00 -1.09 0.00 0.00 42.92 39.42 2nef s ASP 174 CO 0.03 -0.61 0.81 -1.81 0.70 0.00 0.00 175.17 174.30 2nef s ASP 175 N 1.80 6.38 0.00 2.11 1.01 -1.26 -5.07 116.67 121.64 2nef s ASP 175 Ca 0.24 1.10 0.00 0.00 0.71 0.00 0.00 52.55 54.60 2nef s ASP 175 Cb -0.14 -2.31 0.00 0.00 1.01 0.00 0.00 42.92 41.47 2nef s ASP 175 CO 0.15 -0.54 0.00 -2.65 0.21 0.00 0.00 175.17 172.35 2nef n PRO 176 N -1.88 2.78 0.00 8.23 -0.02 -1.26 -4.71 135.00 138.15 2nef n PRO 176 Ca 0.02 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.64 2nef n PRO 176 Cb 0.54 0.00 0.72 0.00 -0.02 0.00 0.00 33.50 34.75 2nef n PRO 176 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2nef n GLU 177 N 0.00 0.49 -2.55 -0.52 0.28 -1.26 -4.61 120.64 112.47 2nef n GLU 177 Ca 0.00 0.02 -0.41 0.00 -0.16 0.00 0.00 57.16 56.61 2nef n GLU 177 Cb 0.00 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.34 2nef n GLU 177 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 2nef s ARG 178 N -2.46 3.29 0.75 3.44 3.52 -1.26 -5.00 118.95 121.23 2nef s ARG 178 Ca 0.29 -0.47 -0.11 0.00 -0.13 0.00 0.00 55.73 55.31 2nef s ARG 178 Cb 0.19 -4.49 0.04 0.00 -1.56 0.00 0.00 34.95 29.13 2nef s ARG 178 CO 0.40 -2.17 1.08 -1.21 -0.81 0.00 0.00 175.30 172.60 2nef s GLU 179 N 5.54 2.50 0.48 5.12 0.41 -1.26 -4.96 118.70 126.53 2nef s GLU 179 Ca 0.38 0.70 -0.04 0.00 -0.41 0.00 0.00 54.97 55.60 2nef s GLU 179 Cb -0.06 -1.96 -0.03 0.00 -1.78 0.00 0.00 34.13 30.30 2nef s GLU 179 CO 0.08 -1.34 0.77 0.08 -0.49 0.00 0.00 175.26 174.36 2nef s VAL 180 N -3.16 4.77 0.10 2.63 1.01 -1.26 -5.00 120.40 119.49 2nef s VAL 180 Ca 0.59 0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.74 2nef s VAL 180 Cb -0.14 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 2nef s VAL 180 CO 0.54 -0.76 -0.20 -0.76 0.00 0.00 0.00 175.10 173.93 2nef s LEU 181 N -4.71 2.60 0.07 3.92 1.43 -1.22 -4.58 118.68 116.20 2nef s LEU 181 Ca 0.47 -0.55 0.07 0.00 -1.03 0.00 0.00 54.13 53.09 2nef s LEU 181 Cb -0.10 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 2nef s LEU 181 CO 0.44 0.20 -0.15 -1.83 0.23 0.00 0.00 176.35 175.24 2nef s GLU 182 N -1.91 2.08 -0.17 1.70 4.04 -1.17 0.34 118.70 123.61 2nef s GLU 182 Ca 0.16 -1.00 -0.29 0.00 0.04 0.00 0.00 54.97 53.88 2nef s GLU 182 Cb -0.10 -2.24 -0.02 0.00 0.02 0.00 0.00 34.13 31.79 2nef s GLU 182 CO 0.08 0.53 1.37 -1.58 -1.84 0.00 0.00 175.26 173.81 2nef s TRP 183 N -1.05 2.61 -0.68 4.83 0.51 -1.04 -2.66 118.94 121.46 2nef s TRP 183 Ca 0.17 0.81 -0.17 0.00 -2.12 0.00 0.00 56.10 54.79 2nef s TRP 183 Cb -0.11 -3.68 0.14 0.00 -0.81 0.00 0.00 33.47 29.02 2nef s TRP 183 CO 0.09 -2.18 0.73 0.50 -0.51 0.00 0.00 176.95 175.58 2nef s ARG 184 N 3.79 3.24 0.24 4.98 6.06 0.09 -0.42 118.95 136.94 2nef s ARG 184 Ca 0.60 -1.74 -0.30 0.00 -2.50 0.00 0.00 55.73 51.79 2nef s ARG 184 Cb -0.23 -4.40 -0.09 0.00 0.06 0.00 0.00 34.95 30.29 2nef s ARG 184 CO 0.20 -1.47 1.34 0.12 -2.50 0.00 0.00 175.30 172.98 2nef s PHE 185 N 1.85 3.16 -0.42 5.12 2.19 -1.26 -2.55 117.98 126.07 2nef s PHE 185 Ca 0.14 1.23 0.09 0.00 0.33 0.00 0.00 56.93 58.71 2nef s PHE 185 Cb -0.20 -3.67 0.35 0.00 -1.31 0.00 0.00 43.02 38.20 2nef s PHE 185 CO -0.00 -2.04 1.07 -3.47 1.83 0.00 0.00 175.22 172.61 2nef n ASP 186 N 2.10 -1.32 0.13 6.13 2.03 -0.55 -4.96 116.55 120.11 2nef n ASP 186 Ca 0.05 -3.25 0.02 0.00 0.52 0.00 0.00 54.79 52.12 2nef n ASP 186 Cb 0.42 1.05 0.09 0.00 -0.72 0.00 0.00 41.12 41.96 2nef n ASP 186 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2nef n SER 187 N 0.13 0.09 0.25 1.67 7.64 -1.26 0.57 113.62 122.71 2nef n SER 187 Ca 0.08 0.30 0.08 0.00 1.01 0.00 0.00 58.87 60.34 2nef n SER 187 Cb 0.73 -0.15 0.61 0.00 -1.01 0.00 0.00 64.21 64.39 2nef n SER 187 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2nef h ARG 188 N 0.00 0.00 0.00 1.43 2.47 -1.92 0.26 114.38 116.62 2nef h ARG 188 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2nef h ARG 188 Cb 1.13 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.45 2nef h ARG 188 CO 0.00 0.07 0.00 1.28 0.56 0.00 0.00 179.97 181.88 2nef n LEU 189 N -4.40 0.00 0.00 3.04 4.77 0.19 -2.07 117.00 118.53 2nef n LEU 189 Ca -0.03 0.03 0.09 0.00 -0.03 0.00 0.00 56.01 56.07 2nef n LEU 189 Cb 0.15 -0.03 0.54 0.00 -2.33 0.00 0.00 43.42 41.75 2nef n LEU 189 CO 0.34 -0.02 0.74 0.00 -1.33 0.00 0.00 177.39 177.12 2nef n ALA 190 N -1.03 2.22 0.00 -1.18 0.00 0.92 -3.04 120.51 118.40 2nef n ALA 190 Ca 0.06 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2nef n ALA 190 Cb 0.03 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.19 2nef n ALA 190 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2nef n PHE 191 N -0.96 0.00 0.00 0.00 3.72 -0.88 -5.04 117.46 114.30 2nef n PHE 191 Ca 0.14 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.54 2nef n PHE 191 Cb 0.06 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 2nef n PHE 191 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 2nef n HIS 192 N -0.75 -0.07 -2.67 1.38 8.25 -1.17 -5.06 115.22 115.14 2nef n HIS 192 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.41 2nef n HIS 192 Cb 0.06 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.22 2nef n HIS 192 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2nef n HIS 193 N -0.07 -1.02 -0.02 4.41 1.44 -1.26 -5.04 115.22 113.65 2nef n HIS 193 Ca 0.00 -1.08 -0.01 0.00 -2.01 0.00 0.00 57.72 54.62 2nef n HIS 193 Cb 0.00 1.31 -0.00 0.00 0.12 0.00 0.00 29.99 31.41 2nef n HIS 193 CO 0.00 0.00 0.00 1.98 -2.81 0.00 0.00 176.34 175.51 2nef h MET 194 N 1.62 -0.04 -0.32 -1.40 4.05 -1.97 -3.22 114.93 113.66 2nef h MET 194 Ca -0.44 0.00 0.09 0.00 -0.28 0.00 0.00 59.70 59.07 2nef h MET 194 Cb 1.24 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 32.04 2nef h MET 194 CO -0.13 -0.03 0.46 0.00 0.23 0.00 0.00 176.91 177.45 2nef h ALA 195 N -1.19 1.94 -0.30 0.39 0.00 -1.88 0.15 119.26 118.36 2nef h ALA 195 Ca -0.00 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 2nef h ALA 195 Cb 0.03 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2nef h ALA 195 CO 0.01 -0.63 -0.51 -0.09 0.00 0.00 0.00 179.25 178.03 2nef h ARG 196 N 0.00 0.87 0.00 0.00 2.43 -1.84 -2.82 114.38 113.02 2nef h ARG 196 Ca 0.15 -0.53 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 2nef h ARG 196 Cb 1.07 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 2nef h ARG 196 CO -0.00 1.17 0.00 0.93 -1.51 0.00 0.00 179.97 180.56 2nef h GLU 197 N 0.68 0.00 0.00 0.20 4.39 -0.72 -3.20 114.58 115.93 2nef h GLU 197 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 2nef h GLU 197 Cb 1.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.77 2nef h GLU 197 CO 0.12 0.00 0.00 1.28 -1.16 0.00 0.00 179.01 179.25 2nef n LEU 198 N -2.85 0.32 -3.22 1.33 4.77 -1.07 -4.84 117.00 111.44 2nef n LEU 198 Ca 0.01 0.52 -0.19 0.00 -0.03 0.00 0.00 56.01 56.31 2nef n LEU 198 Cb 0.29 -0.44 -0.07 0.00 -2.33 0.00 0.00 43.42 40.88 2nef n LEU 198 CO 0.25 -0.44 -0.17 -1.00 -1.33 0.00 0.00 177.39 174.70 2nef s HIS 199 N -1.17 0.11 -0.14 -1.77 3.76 -1.17 -4.97 115.29 109.94 2nef s HIS 199 Ca 0.00 -1.57 0.18 0.00 -0.15 0.00 0.00 55.06 53.52 2nef s HIS 199 Cb 0.00 -0.50 -0.10 0.00 1.11 0.00 0.00 32.58 33.10 2nef s HIS 199 CO 0.00 -0.97 0.90 -1.00 -0.85 0.00 0.00 174.74 172.82 2nef h PRO 200 N 5.77 0.00 0.00 8.40 0.13 -1.76 -3.34 132.00 141.21 2nef h PRO 200 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2nef h PRO 200 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 2nef h PRO 200 CO 0.24 0.26 0.00 -1.91 -0.23 0.00 0.00 178.00 176.36 2nef n GLU 201 N -2.88 0.35 0.00 0.86 2.13 -1.26 -3.01 120.64 116.83 2nef n GLU 201 Ca -0.07 0.08 0.00 0.00 0.66 0.00 0.00 57.16 57.83 2nef n GLU 201 Cb 0.79 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 31.00 2nef n GLU 201 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2nef n TYR 202 N -1.22 0.00 -2.38 4.31 4.02 -1.25 -4.81 117.16 115.82 2nef n TYR 202 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.99 2nef n TYR 202 Cb 0.14 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.44 2nef n TYR 202 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2nef n PHE 203 N -0.43 0.00 -1.55 -0.72 3.72 -1.17 -5.12 117.46 112.20 2nef n PHE 203 Ca 0.00 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 2nef n PHE 203 Cb 0.03 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.56 2nef n PHE 203 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2nef n LYS 204 N 0.00 1.07 -0.04 -1.08 5.02 -1.26 -4.94 118.16 116.93 2nef n LYS 204 Ca 0.00 0.38 -0.04 0.00 -2.02 0.00 0.00 58.31 56.63 2nef n LYS 204 Cb 0.00 -1.77 0.04 0.00 -0.02 0.00 0.00 35.03 33.28 2nef n LYS 204 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2nef n ASN 205 N 1.05 -2.16 -0.12 4.39 5.03 -1.26 -4.88 115.26 117.31 2nef n ASN 205 Ca 0.10 -0.13 0.15 0.00 0.87 0.00 0.00 54.58 55.58 2nef n ASN 205 Cb 0.36 -0.15 0.84 0.00 -1.02 0.00 0.00 39.78 39.81 2nef n ASN 205 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43