# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 M C C 83.15 11.08 14.71 26.11 116.17 -161.98 -94.37 135.84 99.52 0.39 0.09 99.29 0.26 0.11 0.04 0.01 0.00 0.20 0.09 1 A C C 55.42 8.53 11.24 20.84 112.40 -128.47 -83.09 141.54 80.49 4.64 14.88 73.21 1.80 7.10 8.02 4.97 0.00 2.88 2.01 2 E C C 127.09 3.81 11.31 16.65 107.38 -141.65 -84.95 93.19 71.82 5.80 22.37 45.09 13.42 13.65 10.64 11.47 0.02 3.59 2.12 3 K C C 123.72 5.78 10.88 18.07 107.19 90.26 -86.90 81.25 63.75 6.06 30.19 38.67 13.65 11.90 13.91 16.08 0.04 3.73 2.02 4 K C C 121.04 5.98 11.93 19.26 107.25 114.12 -86.70 92.14 65.08 6.08 28.83 44.08 10.09 10.78 15.10 13.95 0.02 3.80 2.17 5 Q C C 108.65 6.40 12.17 19.90 108.75 141.07 -88.38 90.39 71.16 5.04 23.79 45.41 12.58 13.12 13.27 10.54 0.03 2.87 2.18 6 N C C 98.70 6.07 13.49 20.86 106.71 105.16 -93.07 65.80 79.36 4.12 16.52 40.17 18.75 21.41 8.65 7.01 0.03 2.13 1.85 7 G C C 37.50 8.46 14.94 24.11 114.88 -124.17 106.42 175.68 87.56 3.41 9.03 37.46 25.71 25.34 2.77 5.56 0.01 1.86 1.29 8 T C C 65.97 11.18 14.47 25.98 113.84 -79.75 -93.83 133.63 81.29 8.93 9.78 48.98 17.81 15.00 2.97 6.64 0.01 5.61 2.97 9 S C C 51.43 10.83 16.56 27.74 117.04 -163.66 -102.38 136.18 75.71 15.24 9.05 47.22 17.90 11.21 2.91 6.07 0.02 10.69 3.98 10 Y C C 108.93 12.08 17.25 29.17 112.85 -153.69 -101.78 113.01 70.66 20.22 9.12 45.52 15.72 9.93 2.97 6.14 0.04 14.88 4.80 11 Q C C 69.31 13.54 18.44 31.55 117.10 150.83 -106.85 138.87 71.17 20.63 8.20 42.88 17.64 12.06 2.32 5.63 0.05 15.75 3.66 12 S C C 43.84 14.24 21.00 34.26 102.32 -139.67 -93.16 15.61 74.33 19.85 5.83 44.34 21.12 9.69 1.68 4.30 0.04 13.41 5.41 13 I C C 22.53 21.39 16.70 37.67 118.31 110.35 -98.56 131.30 87.06 11.88 1.05 64.91 21.32 1.25 0.50 0.60 0.00 7.57 3.84 14 P C C 24.58 15.52 18.22 34.59 113.94 -108.07 -65.17 146.78 88.69 7.99 3.32 82.85 3.51 2.42 1.16 2.01 0.00 4.80 3.25 15 R C T 134.02 8.11 19.24 28.38 93.39 -119.49 -63.60 -28.48 72.38 2.61 25.01 6.21 15.11 51.22 3.66 20.72 0.08 1.47 1.52 16 F C T 86.70 10.54 18.63 29.88 96.94 57.69 -86.26 0.58 71.47 2.61 25.92 7.21 12.07 52.02 3.31 22.43 0.06 1.48 1.41 17 S C C 13.67 21.26 11.45 32.06 105.19 102.69 -77.51 75.04 69.01 5.37 25.62 47.57 12.41 7.94 3.47 23.33 0.00 2.65 2.62 18 K C T 119.74 7.21 19.47 27.28 96.92 84.95 -70.88 -22.27 87.23 2.79 9.98 14.47 14.56 57.94 1.42 8.66 0.02 1.53 1.41 19 L C T 96.41 8.42 18.63 27.22 96.41 55.69 -83.65 -3.35 89.58 1.80 8.62 12.32 18.26 58.46 0.90 8.20 0.01 1.04 0.81 20 H C C 40.65 18.35 12.89 30.59 115.34 80.40 -102.62 128.36 94.70 3.71 1.58 50.25 38.94 5.35 0.38 1.15 0.00 1.35 2.58 21 P C T 74.06 8.14 20.97 29.59 97.65 -130.71 -69.41 -3.92 97.70 1.43 0.88 28.29 29.86 39.65 0.13 0.81 0.00 0.83 0.43 22 V C S 44.96 16.28 19.22 34.46 109.55 65.59 -101.54 67.57 86.14 12.74 1.11 28.27 32.06 26.87 0.21 1.03 0.00 8.03 3.52 23 I C C 19.15 21.99 15.76 37.29 118.23 80.91 -97.53 131.29 79.34 20.41 0.25 41.16 39.89 0.65 0.11 0.16 0.00 11.57 6.46 24 P C C 24.89 14.22 18.11 33.48 114.00 -108.48 -64.47 145.84 85.43 14.10 0.47 84.46 1.46 0.35 0.14 0.26 0.00 7.98 5.35 25 R H G 137.11 8.20 17.65 26.96 92.18 -119.62 -61.29 -31.39 35.84 0.94 63.22 3.31 5.74 25.58 3.16 61.34 0.01 0.62 0.25 26 R H G 123.56 7.70 19.20 27.29 91.96 62.49 -76.21 -13.90 36.04 1.43 62.53 3.54 5.15 26.36 3.94 59.61 0.03 0.98 0.39 27 Y H G 50.35 17.21 16.29 33.00 100.02 56.18 -91.21 -7.61 33.87 3.66 62.47 16.31 7.79 11.44 6.00 55.06 0.02 2.06 1.31 28 V C C 20.11 19.71 15.19 34.49 105.73 71.70 -95.55 63.82 69.87 1.94 28.18 49.79 17.83 2.97 25.00 2.67 0.01 0.69 1.05 29 P H H 55.05 8.12 19.59 28.56 96.33 61.20 -63.80 -38.36 30.90 0.89 68.21 17.78 4.60 9.65 59.54 7.58 0.03 0.52 0.31 30 E H H 74.28 8.39 20.01 29.07 93.90 47.56 -67.65 -32.30 21.55 0.81 77.64 10.22 3.27 9.05 66.97 9.63 0.05 0.56 0.25 31 W H H 21.64 21.54 14.24 35.46 92.96 56.29 -66.68 -36.25 10.49 0.50 89.01 4.70 1.73 4.57 75.08 13.42 0.03 0.36 0.12 32 K H H 87.87 12.50 17.59 29.90 91.86 57.77 -65.27 -33.60 11.43 0.51 88.06 3.67 1.90 6.27 75.31 12.29 0.07 0.33 0.16 33 N H H 106.93 2.99 20.07 23.04 94.26 50.79 -81.63 -19.63 21.98 0.55 77.47 3.32 3.27 15.13 66.27 11.19 0.24 0.30 0.27 34 D C H 45.08 12.98 14.88 28.27 104.39 54.21 -101.19 53.33 52.02 0.95 47.04 22.64 7.13 23.87 37.84 7.40 0.07 0.39 0.66 35 M H H 63.57 15.55 14.47 29.53 94.87 142.29 -66.36 -30.12 30.46 0.82 68.72 13.07 4.27 13.01 43.22 25.51 0.07 0.44 0.41 36 K H H 129.23 3.74 20.59 24.96 92.40 67.61 -64.17 -31.43 32.79 0.54 66.68 2.59 2.84 25.29 41.66 26.86 0.19 0.30 0.26 37 N H H 31.38 16.31 15.98 32.50 96.54 45.97 -95.55 1.02 30.86 0.49 68.65 4.59 3.11 21.11 39.41 31.18 0.10 0.26 0.23 38 R H H 59.36 18.35 16.05 33.51 93.07 97.22 -60.72 -41.41 2.43 0.09 97.48 1.26 0.51 0.88 96.38 0.88 0.00 0.06 0.02 39 E H H 114.21 3.71 22.92 26.86 91.68 52.46 -63.75 -40.12 0.67 0.06 99.27 0.16 0.12 0.41 98.83 0.42 0.00 0.04 0.01 40 L H H 50.39 9.67 21.64 32.03 91.92 50.18 -65.08 -41.98 0.30 0.07 99.63 0.05 0.07 0.22 99.12 0.46 0.00 0.06 0.01 41 L H H 9.24 22.81 18.57 41.19 92.30 49.71 -64.39 -43.19 0.32 0.07 99.61 0.05 0.06 0.25 99.19 0.38 0.01 0.06 0.01 42 V H H 38.31 14.02 21.30 35.23 92.15 49.81 -64.09 -42.20 1.01 0.14 98.85 0.18 0.14 0.77 98.35 0.41 0.02 0.11 0.02 43 K H H 106.34 3.25 25.00 27.64 91.60 49.71 -64.35 -41.73 2.00 0.13 97.87 0.41 0.23 1.45 97.36 0.39 0.02 0.10 0.03 44 N H H 28.28 13.64 20.16 34.56 92.44 49.24 -65.23 -41.64 2.71 0.17 97.11 0.64 0.35 1.97 96.21 0.61 0.04 0.12 0.05 45 C H H 9.80 19.42 15.83 35.56 91.87 51.08 -64.04 -41.94 2.58 0.12 97.29 0.67 0.35 1.76 95.91 1.15 0.03 0.08 0.04 46 E H H 119.97 4.21 19.89 25.17 91.78 50.42 -64.40 -39.36 3.63 0.10 96.27 0.56 0.37 2.86 94.78 1.27 0.04 0.06 0.04 47 M H H 109.72 4.82 18.64 24.19 92.09 50.82 -67.50 -32.99 7.74 0.09 92.17 0.65 0.57 6.54 91.08 1.01 0.06 0.04 0.05 48 S H H 33.68 13.23 14.15 27.96 94.37 48.98 -83.63 -10.66 35.58 0.46 63.96 4.25 4.28 26.57 63.22 1.09 0.13 0.16 0.31 49 G C T 50.76 3.84 20.07 24.49 95.32 -120.38 77.50 12.91 97.71 1.06 1.22 28.14 16.83 53.10 0.51 0.50 0.00 0.68 0.24 50 I C C 57.02 13.26 17.28 30.72 113.65 107.02 -107.39 101.29 85.35 14.00 0.64 56.96 23.97 5.06 0.20 0.52 0.00 9.94 3.35 51 I C C 34.89 18.76 16.53 34.91 116.90 -150.89 -104.01 124.66 82.34 17.42 0.24 59.88 22.21 0.80 0.08 0.18 0.00 13.00 3.84 52 P C C 35.01 14.28 18.38 33.24 114.02 -119.06 -68.74 147.79 89.46 10.21 0.34 83.15 4.89 1.31 0.09 0.26 0.00 8.45 1.86 53 K C C 109.40 10.65 18.58 29.46 119.87 -151.55 -105.41 138.80 90.11 9.25 0.63 57.17 30.44 2.67 0.22 0.48 0.00 4.53 4.49 54 G C S 24.82 9.05 20.02 29.62 136.43 61.77 140.92 -176.59 90.15 5.37 4.48 22.52 60.64 7.30 1.64 2.41 0.01 2.71 2.78 55 P C T 66.49 10.65 18.44 29.39 96.34 -50.91 -66.52 -26.82 72.76 1.40 25.84 8.47 13.63 50.51 7.49 18.23 0.04 0.86 0.78 56 H C T 60.09 16.54 18.10 33.49 97.23 54.04 -83.29 -4.23 69.06 3.34 27.59 10.49 11.07 46.95 8.91 18.83 0.09 2.38 1.28 57 D C C 37.00 16.95 19.22 35.38 100.72 81.15 -85.33 6.83 55.74 12.50 31.76 26.28 14.16 17.31 11.89 18.57 0.20 8.81 2.77 58 E C C 65.65 13.23 23.03 35.87 116.43 92.71 -98.44 140.99 51.95 27.55 20.49 26.25 13.60 14.06 11.08 8.86 0.31 22.56 3.26 59 S E E 19.18 17.39 21.79 38.96 119.12 -129.19 -101.11 138.22 42.59 46.15 11.26 34.20 5.05 3.46 7.26 4.07 0.06 43.63 2.27 60 L E E 15.18 20.94 21.48 41.88 113.41 -161.22 -102.87 121.26 23.50 68.19 8.31 13.99 7.23 5.04 5.49 3.19 0.25 61.85 2.97 61 F E E 27.31 17.85 21.20 38.84 121.80 -160.48 -114.66 133.32 19.78 74.99 5.23 11.97 5.56 4.54 3.48 2.23 0.13 68.12 3.96 62 L C E 32.23 17.86 18.95 36.18 114.40 -158.27 -103.23 117.93 53.89 39.03 7.08 14.41 13.61 28.98 2.49 4.11 0.06 34.20 2.14 63 D C T 78.01 8.41 19.34 28.38 95.66 -5.59 53.87 35.96 87.86 5.44 6.70 10.90 19.74 57.82 2.11 3.91 0.01 4.58 0.93 64 K C T 114.06 9.93 16.85 27.04 94.21 -66.75 64.38 22.93 88.94 4.20 6.86 14.52 25.98 48.99 2.02 4.33 0.01 3.28 0.88 65 R C E 100.86 9.49 19.39 29.31 116.89 110.60 -109.06 140.50 56.99 38.61 4.40 27.52 15.05 16.49 1.94 2.47 0.02 34.51 2.00 66 E E E 56.25 15.01 18.81 33.56 120.95 -130.39 -109.46 138.83 30.64 66.60 2.76 22.64 6.17 3.19 1.61 1.41 0.01 62.65 2.32 67 R E E 64.76 14.87 21.41 35.96 118.65 -150.56 -104.65 133.24 22.53 74.15 3.33 17.78 3.22 1.84 2.43 1.45 0.02 68.67 4.59 68 M E E 27.53 19.57 18.83 37.87 116.31 -157.06 -103.27 131.01 40.76 53.07 6.17 25.14 9.42 8.83 2.82 3.44 0.04 47.70 2.60 69 N C C 42.96 13.90 19.43 33.42 121.15 -167.34 -115.78 143.73 61.39 32.84 5.77 32.65 16.22 15.07 2.04 3.63 0.04 27.76 2.59 70 E C C 88.39 11.32 17.51 28.86 102.13 -132.78 -80.09 26.92 76.16 18.52 5.32 30.19 26.17 21.68 1.70 3.39 0.03 14.44 2.41 71 V C C 82.50 8.63 17.09 26.06 103.92 71.92 -90.08 6.94 79.25 17.01 3.75 38.15 26.06 16.44 1.32 2.36 0.02 13.15 2.51 72 E C C 73.19 9.67 13.77 24.75 119.96 108.88 -97.10 138.62 79.49 18.91 1.60 49.18 29.71 1.70 1.09 0.66 0.00 14.64 3.02 73 P C C 73.48 5.79 17.42 24.12 111.73 -104.47 -66.65 142.93 77.02 17.88 5.10 69.74 4.46 2.32 3.72 1.57 0.00 14.03 4.15 74 R C C 88.01 15.65 11.48 26.18 101.17 -140.22 -77.53 -14.09 52.53 5.49 41.98 35.96 7.46 8.88 29.15 13.20 0.03 3.89 1.44 75 V H H 93.97 4.43 16.90 22.11 101.21 83.07 -77.86 -25.62 39.70 8.51 51.79 20.79 9.29 10.96 36.02 14.68 0.23 6.41 1.63 76 R H H 121.46 5.99 16.81 23.48 102.91 51.61 -85.08 -8.57 32.55 12.39 55.06 19.56 6.44 7.88 38.07 15.97 0.19 9.97 1.92 77 V H H 31.92 17.11 11.39 27.93 97.53 81.41 -70.80 -35.94 32.05 10.16 57.79 22.26 5.65 5.79 44.94 11.41 0.09 8.20 1.66 78 E H H 100.06 8.58 15.20 24.41 95.92 56.48 -73.88 -22.83 38.29 7.52 54.19 23.37 6.87 9.15 40.73 12.56 0.11 5.68 1.53 79 A C H 70.98 4.32 15.08 20.32 100.30 62.68 -80.64 -18.59 49.99 5.30 44.72 22.87 10.57 17.41 31.90 12.08 0.19 3.42 1.56 80 K C C 118.65 6.65 14.75 22.36 103.32 53.38 -88.91 9.24 63.77 6.51 29.72 31.60 14.37 18.81 20.35 8.70 0.12 3.73 2.34 81 H C C 64.80 13.58 10.85 24.53 118.11 89.50 -102.20 133.61 90.05 6.29 3.66 51.27 37.46 1.92 2.84 0.93 0.00 2.84 2.74 82 P C C 70.11 6.64 14.60 22.64 108.05 -118.73 -67.66 146.33 81.93 4.19 13.88 68.57 6.88 6.18 8.90 5.16 0.00 2.76 1.55 83 N C C 101.82 5.61 14.59 21.38 101.05 -116.53 -75.67 -4.47 65.64 2.83 31.53 43.24 10.60 11.21 17.15 14.97 0.01 1.63 1.19 84 F C C 93.33 10.69 12.51 23.66 102.08 71.60 -80.14 -12.84 56.63 3.61 39.76 35.88 10.02 10.38 21.43 18.83 0.03 2.16 1.27 85 E C C 97.86 7.90 14.19 23.00 103.37 70.68 -78.70 15.15 54.01 4.91 41.08 37.16 8.05 8.53 22.15 19.45 0.02 3.29 1.35 86 R C C 126.57 7.70 14.90 23.38 104.22 68.25 -84.03 4.31 55.12 8.62 36.27 36.62 8.67 9.49 21.60 15.32 0.07 5.75 2.48 87 Y C C 92.47 12.93 12.25 24.99 104.09 74.21 -91.93 19.73 61.29 10.13 28.58 40.82 9.45 10.47 17.53 11.71 0.07 6.68 3.25 88 D C T 97.34 5.24 15.00 21.83 110.52 111.13 -83.73 118.64 73.70 7.45 18.85 27.78 12.90 33.84 11.25 7.07 0.08 4.95 2.13 89 G C T 50.43 4.66 16.40 22.04 99.46 12.10 82.03 2.46 85.55 5.49 8.96 27.63 19.39 39.79 3.22 4.89 0.01 3.85 1.22 90 L C C 51.32 15.15 12.10 27.30 115.30 133.53 -86.35 133.07 84.86 12.54 2.60 63.83 17.91 2.60 1.16 1.51 0.00 7.19 5.79 91 R C C 140.78 5.55 20.31 27.03 114.84 -160.67 -109.38 115.59 89.21 10.39 0.40 78.53 9.90 0.65 0.15 0.26 0.00 7.80 2.71 92 P C C 28.82 20.07 13.06 32.33 116.25 -140.60 -73.84 146.62 92.21 6.77 1.02 86.19 4.43 1.43 0.28 0.69 0.00 5.64 1.34 93 E C C 104.38 7.14 21.49 29.02 112.54 -122.83 -85.39 129.18 84.62 13.49 1.88 75.26 6.26 2.26 0.60 1.34 0.00 9.68 4.61 94 F C C 63.25 17.00 14.46 30.86 115.23 -164.79 -103.65 124.88 73.55 24.43 2.02 60.41 9.36 2.69 0.72 1.45 0.00 15.79 9.55 95 H C C 92.53 9.11 17.19 27.00 122.23 -174.19 -110.79 144.92 73.58 24.51 1.91 60.78 9.28 2.45 0.75 1.27 0.00 15.74 9.72 96 T C C 35.18 12.65 13.54 27.33 125.52 -160.20 -121.59 149.18 82.82 15.89 1.29 68.27 11.21 2.17 0.49 0.85 0.00 9.32 7.69 97 A C T 72.71 6.04 15.00 22.44 92.98 -125.16 -66.51 -21.65 97.08 1.34 1.58 5.17 19.62 72.35 0.22 1.28 0.00 0.97 0.40 98 Q C T 113.08 4.76 14.80 20.64 97.14 54.51 -91.14 -5.65 97.39 1.21 1.40 5.32 20.27 71.84 0.19 1.18 0.00 0.82 0.36 99 S C C 31.67 13.47 9.78 23.60 115.24 85.06 -98.08 130.88 83.11 14.66 2.23 51.95 27.54 3.34 0.87 1.38 0.01 6.35 8.56 100 K C T 135.35 4.33 15.27 20.95 95.72 -153.58 -71.34 -18.95 75.86 6.65 17.48 22.79 23.26 31.16 7.90 8.55 0.08 4.13 2.13 101 Y C T 112.40 8.50 14.38 23.80 100.67 59.43 -91.44 8.49 68.09 12.25 19.67 20.13 20.15 29.70 9.98 8.42 0.30 7.92 3.39 102 Q C C 96.38 8.63 16.09 25.45 101.27 -121.81 27.64 54.70 63.41 18.63 17.95 39.25 11.14 13.71 10.39 7.16 0.08 13.98 4.28 103 S C C 39.32 12.85 14.18 27.44 119.16 154.67 -99.23 145.27 56.82 25.84 17.34 43.20 7.34 5.54 13.10 4.35 0.02 22.65 3.80 104 S E E 52.00 9.87 17.86 28.14 116.70 -145.95 -102.49 138.88 38.37 39.28 22.35 23.03 10.22 6.27 17.06 5.20 0.28 35.16 2.77 105 L E E 69.94 13.01 16.37 29.31 112.63 -134.02 -91.69 124.51 31.59 44.94 23.47 17.73 9.79 5.74 17.89 5.20 0.14 41.71 1.80 106 M E E 73.88 12.02 16.62 28.92 117.11 -168.17 -107.67 129.78 24.75 54.72 20.54 16.77 5.10 3.84 16.41 4.22 0.07 51.94 1.65 107 F E E 86.42 12.38 16.54 29.20 126.24 -171.13 -125.41 142.41 23.54 62.31 14.15 17.56 3.39 3.20 11.01 3.41 0.06 59.11 2.25 108 R E E 105.18 11.20 17.08 28.79 127.05 -170.23 -125.06 142.31 30.14 62.79 7.08 23.50 4.24 2.65 5.69 1.81 0.04 58.71 3.36 109 K C C 89.79 11.94 15.52 27.76 128.00 -169.82 -127.08 146.90 53.97 41.86 4.17 38.67 11.25 4.35 2.71 1.70 0.02 38.05 3.25 110 D C C 60.57 9.64 14.52 25.33 120.29 -145.24 -109.67 134.81 80.27 15.82 3.90 62.46 13.07 4.31 2.32 1.76 0.01 13.44 2.64 111 N C C 100.80 6.46 14.13 21.93 97.09 -145.37 -75.52 -9.89 73.66 3.65 22.69 28.14 20.84 25.61 13.81 8.08 0.11 2.12 1.29 112 T C T 87.29 3.86 15.51 20.02 96.17 67.63 -78.05 -16.77 69.26 2.77 27.98 25.21 18.22 27.04 17.80 8.97 0.10 1.37 1.29 113 V C C 56.88 10.76 11.97 23.46 100.94 59.81 -81.11 -19.31 60.53 3.13 36.34 25.58 17.52 19.18 24.80 9.74 0.14 1.51 1.52 114 G C C 29.97 8.70 12.38 22.24 104.13 53.22 -59.07 -38.36 61.09 2.47 36.44 35.59 11.66 14.09 22.66 13.54 0.04 1.28 1.13 115 Q H G 121.44 2.96 12.99 17.02 97.93 44.23 -73.40 -26.58 47.17 3.36 49.47 22.47 9.17 16.04 22.97 26.15 0.07 1.96 1.18 116 D C G 96.48 3.95 11.82 17.11 97.87 61.70 -79.07 -10.41 48.56 3.83 47.61 21.58 8.92 18.79 20.30 26.67 0.08 2.31 1.34 117 F C C 103.20 8.91 8.54 18.18 102.57 62.32 -89.37 12.29 59.49 3.35 37.16 42.07 3.65 15.94 16.69 18.06 0.01 2.02 1.56 118 Q C C 119.75 4.22 12.62 18.51 106.33 116.77 -83.38 89.92 99.50 0.23 0.27 98.94 0.33 0.34 0.17 0.03 0.00 0.13 0.05