# 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 V C C 43.02 15.37 19.95 34.98 120.26 -161.28 -109.65 130.86 99.21 0.79 0.00 99.32 0.05 0.01 0.00 0.00 0.00 0.61 0.01 1 I E E 35.05 16.93 17.27 34.45 118.39 -157.32 -107.09 129.10 44.96 54.94 0.10 44.64 0.33 0.10 0.03 0.04 0.00 54.35 0.52 2 W E E 108.51 9.92 20.38 30.96 119.67 -160.01 -109.24 129.75 14.06 85.76 0.18 13.17 0.80 0.16 0.08 0.08 0.00 84.98 0.73 3 M E E 32.20 19.12 14.33 33.25 117.92 -156.68 -105.43 128.09 14.92 84.89 0.19 13.93 0.81 0.16 0.08 0.08 0.00 84.21 0.71 4 T E E 70.61 7.67 20.11 28.41 113.29 -171.75 -110.88 100.40 31.57 68.13 0.30 25.55 5.02 0.81 0.08 0.21 0.00 67.57 0.76 5 Q C E 74.92 11.58 16.35 28.33 125.46 62.80 -119.03 141.70 55.35 44.32 0.33 36.78 17.71 1.71 0.07 0.29 0.00 42.25 1.18 6 S C C 58.35 8.83 17.15 26.79 119.60 -128.67 -96.97 142.63 83.28 16.58 0.14 59.95 21.53 1.18 0.02 0.14 0.00 16.35 0.81 7 P C S 69.38 9.29 16.75 26.53 111.12 -56.58 -70.33 147.30 87.99 11.64 0.37 32.64 42.62 11.71 0.03 0.46 0.00 12.01 0.53 8 G C E 33.61 9.18 18.01 27.51 115.05 -138.75 93.88 -152.62 50.03 49.63 0.34 21.88 22.21 6.59 0.03 0.41 0.00 48.22 0.65 9 T E E 73.80 8.33 19.25 28.41 127.00 -17.70 -124.88 139.37 19.84 80.07 0.09 17.52 1.78 0.22 0.01 0.08 0.00 79.93 0.45 10 L E E 25.49 20.11 14.88 34.62 125.42 -169.60 -124.60 137.92 3.64 96.36 0.01 3.36 0.19 0.01 0.00 0.00 0.00 96.26 0.17 11 S E E 63.64 6.92 23.55 31.45 121.74 -158.15 -114.36 133.51 2.50 97.50 0.00 2.28 0.13 0.01 0.00 0.00 0.00 97.47 0.11 12 L E E 16.83 21.25 13.88 34.84 132.41 174.92 -135.01 150.08 15.26 84.73 0.01 14.65 0.52 0.02 0.00 0.01 0.00 83.56 1.25 13 S C C 52.77 4.82 23.58 28.11 122.22 -127.81 -87.87 157.59 94.21 5.77 0.03 93.29 1.13 0.09 0.00 0.01 0.00 5.03 0.44 14 P C T 60.69 13.72 14.43 28.31 109.62 -81.23 -59.62 135.67 99.21 0.38 0.41 0.25 2.44 96.76 0.02 0.25 0.00 0.20 0.07 15 G C T 46.33 4.35 19.37 24.53 96.00 23.43 88.66 -6.46 99.37 0.27 0.36 0.45 2.89 96.18 0.02 0.25 0.00 0.18 0.02 16 E C C 82.59 8.28 17.74 27.16 121.74 119.24 -82.58 150.69 91.88 7.87 0.25 75.10 16.30 0.47 0.04 0.22 0.00 7.15 0.73 17 R E E 126.14 9.19 18.73 29.13 123.81 -136.18 -109.47 141.15 41.80 58.15 0.05 41.22 0.70 0.06 0.01 0.03 0.00 56.90 1.07 18 A E E 10.05 21.28 15.47 36.67 131.65 -171.38 -132.57 148.75 2.17 97.83 0.01 2.01 0.09 0.01 0.00 0.01 0.00 97.79 0.10 19 T E E 65.61 8.55 24.62 33.77 121.25 -147.51 -113.56 132.25 1.18 98.82 0.00 1.04 0.06 0.00 0.00 0.00 0.00 98.87 0.03 20 L E E 6.18 25.24 16.80 42.50 122.38 -168.07 -116.79 132.70 6.36 93.63 0.01 5.58 0.41 0.02 0.00 0.01 0.00 93.90 0.09 21 S E E 37.30 10.02 26.51 36.97 125.35 -166.54 -118.39 141.78 16.15 83.83 0.02 14.38 0.91 0.05 0.00 0.01 0.00 84.48 0.16 22 C E E 5.33 25.13 16.53 41.90 131.69 -174.81 -134.87 146.93 14.00 85.97 0.04 12.96 0.69 0.07 0.01 0.03 0.00 85.66 0.58 23 R E E 113.41 6.50 26.45 33.69 122.03 -159.85 -117.80 133.23 9.30 90.65 0.06 8.61 0.51 0.06 0.03 0.03 0.00 86.98 3.78 24 A C C 10.27 23.67 11.85 35.01 118.69 -146.30 -91.90 139.74 51.22 48.31 0.47 47.70 2.39 0.48 0.12 0.34 0.00 46.69 2.27 25 S C S 74.10 3.71 21.21 25.11 98.29 -157.60 -87.13 -16.27 87.57 11.57 0.85 36.46 46.56 4.55 0.08 0.86 0.00 10.76 0.73 26 Q C S 94.20 4.53 19.75 24.86 133.46 24.84 -136.48 161.20 90.37 8.43 1.21 14.04 67.69 8.74 0.10 1.07 0.00 7.53 0.83 27 S C C 71.82 5.89 19.24 26.19 114.85 -92.22 -73.60 139.43 90.44 8.29 1.26 74.59 10.13 5.14 0.15 1.49 0.00 7.38 1.11 28 V C C 19.14 21.98 11.30 32.64 123.72 -160.95 -116.51 138.20 74.63 24.28 1.09 64.48 6.32 2.25 0.37 0.83 0.00 15.05 10.69 29 S C C 79.95 3.12 22.99 26.25 101.33 -158.25 -94.69 8.99 87.75 11.56 0.69 58.20 23.36 6.23 0.13 0.73 0.00 9.16 2.20 30 S C S 27.31 14.99 16.43 31.63 131.80 86.89 -118.39 159.17 88.33 10.90 0.76 36.92 44.71 6.93 0.09 0.79 0.00 9.25 1.30 31 T C S 62.59 11.33 21.15 32.59 99.09 -139.37 -90.93 -13.85 87.02 12.76 0.22 17.62 64.57 3.38 0.01 0.20 0.00 13.78 0.44 32 Y E E 56.56 13.49 23.83 37.76 130.64 47.48 -130.40 143.51 17.15 82.67 0.18 13.01 3.46 0.73 0.02 0.17 0.00 82.27 0.35 33 L E E 3.73 25.88 20.05 46.27 128.29 -171.43 -128.99 142.37 1.89 98.10 0.01 1.70 0.10 0.01 0.00 0.00 0.00 98.12 0.06 34 A E E 11.28 17.73 27.61 45.19 128.57 -163.67 -122.52 143.81 0.53 99.47 0.00 0.47 0.02 0.00 0.00 0.00 0.00 99.50 0.01 35 W E E 8.45 24.42 22.72 46.94 125.03 -156.26 -115.83 139.90 0.58 99.41 0.00 0.52 0.02 0.00 0.00 0.00 0.00 99.45 0.01 36 Y E E 24.25 17.21 23.59 40.85 132.97 -174.07 -132.26 150.09 0.57 99.43 0.00 0.49 0.02 0.00 0.00 0.00 0.00 99.47 0.02 37 Q E E 43.23 14.25 21.57 36.07 121.31 -143.75 -109.73 135.56 2.42 97.58 0.00 1.99 0.22 0.01 0.00 0.00 0.00 97.71 0.07 38 Q E E 53.50 14.05 15.54 30.10 119.23 -147.99 -104.06 135.03 27.54 72.44 0.02 24.77 1.97 0.08 0.00 0.02 0.00 72.17 0.99 39 K C C 98.88 6.22 15.53 23.09 119.76 -143.45 -94.58 146.18 97.96 2.01 0.03 95.87 2.16 0.18 0.01 0.02 0.00 1.46 0.31 40 P C T 104.43 3.81 11.45 17.24 109.53 -86.78 -58.35 133.99 99.64 0.10 0.26 0.35 3.41 95.91 0.01 0.25 0.00 0.06 0.02 41 G C T 69.22 0.28 13.00 10.57 95.17 17.91 83.59 -2.99 99.68 0.07 0.26 0.45 3.39 95.83 0.01 0.27 0.00 0.04 0.01 42 Q C S 89.39 5.46 10.05 17.65 129.49 96.44 -114.58 159.22 93.97 5.62 0.41 35.88 56.89 1.27 0.08 0.34 0.00 1.95 3.58 43 A C C 76.18 2.20 17.68 19.75 116.97 -98.38 -69.33 150.48 97.41 2.56 0.03 86.69 10.72 0.19 0.00 0.03 0.00 2.04 0.33 44 P C C 44.38 18.10 11.31 28.72 114.89 -100.37 -65.74 143.93 91.93 8.04 0.03 90.00 1.86 0.12 0.00 0.02 0.00 7.78 0.22 45 R E E 103.90 8.18 21.36 30.32 124.67 -160.66 -121.79 138.98 7.41 92.55 0.04 6.58 0.66 0.06 0.01 0.02 0.00 92.09 0.57 46 L E E 62.20 15.89 18.42 33.81 110.81 -115.70 -75.50 126.55 0.95 99.05 0.01 0.84 0.04 0.00 0.00 0.00 0.00 99.08 0.03 47 L E E 22.29 18.49 21.11 39.48 101.36 175.25 -96.64 -33.85 1.84 98.15 0.01 1.30 0.40 0.02 0.00 0.00 0.00 98.26 0.01 48 I E E 12.37 21.26 21.84 42.81 136.40 4.59 -148.58 142.09 0.48 99.51 0.01 0.40 0.03 0.00 0.00 0.00 0.00 99.55 0.01 49 Y E E 63.89 17.53 23.15 39.33 129.55 -172.99 -132.78 139.80 4.01 95.94 0.04 3.35 0.32 0.04 0.01 0.01 0.00 96.14 0.11 50 G E E 12.02 17.80 21.73 38.56 134.82 159.99 -138.60 166.65 36.28 63.11 0.61 24.20 10.57 2.44 0.14 0.45 0.00 61.59 0.61 51 A C C 36.00 13.75 20.32 33.87 117.64 -115.58 -101.76 144.38 65.20 29.68 5.12 35.82 20.84 10.39 1.36 3.52 0.03 26.05 1.99 52 S C C 49.52 12.18 17.81 29.72 105.98 -133.97 -89.03 12.64 74.94 11.02 14.04 31.57 23.56 21.84 3.48 9.55 0.07 7.44 2.50 53 S C T 69.07 7.01 18.12 25.70 101.36 35.54 -84.98 -3.01 72.58 7.04 20.38 24.90 23.93 26.04 5.50 13.00 0.10 4.23 2.30 54 R C C 123.77 8.24 17.08 25.92 106.09 58.63 -92.63 42.41 67.06 13.17 19.77 33.34 17.66 18.13 6.25 12.36 0.11 8.42 3.72 55 A C C 43.70 15.32 12.87 27.56 109.91 128.90 -87.60 112.68 71.40 13.46 15.14 45.24 13.95 12.91 5.19 9.69 0.04 9.19 3.78 56 T C C 87.11 5.40 18.07 24.65 113.82 -156.10 -102.98 125.23 77.14 13.66 9.20 32.21 19.75 27.08 2.97 5.50 0.08 8.97 3.43 57 G C C 43.90 5.81 19.06 25.64 106.09 9.85 88.35 -0.27 87.81 8.94 3.25 33.23 30.02 25.48 0.58 2.72 0.00 5.85 2.11 58 I C C 34.49 20.56 11.76 31.13 115.37 121.45 -93.41 130.84 92.61 6.94 0.45 72.04 19.78 1.03 0.17 0.30 0.00 3.93 2.75 59 P C C 52.53 10.27 16.16 27.46 113.28 -113.27 -66.91 151.59 89.45 3.75 6.80 72.79 6.21 9.66 1.01 6.55 0.00 2.76 1.02 60 D C T 118.09 2.67 18.26 21.79 94.06 -108.23 -67.27 -19.47 81.54 3.11 15.35 11.72 22.83 46.89 1.16 14.47 0.01 2.14 0.77 61 R C T 101.48 10.82 17.77 28.68 97.01 59.88 -90.74 -5.35 72.26 11.61 16.14 13.88 19.37 39.76 1.20 14.59 0.03 10.12 1.04 62 F E E 22.70 23.25 12.78 35.24 120.07 83.11 -109.71 132.26 20.70 76.38 2.92 16.20 4.25 1.80 0.88 1.77 0.01 73.44 1.65 63 S E E 54.52 6.68 23.63 31.41 133.61 166.30 -136.00 155.02 8.23 91.59 0.19 7.04 1.05 0.21 0.09 0.09 0.00 90.77 0.76 64 G E E 22.40 18.24 15.51 32.60 141.40 165.82 -159.49 168.98 9.58 90.34 0.08 8.21 1.09 0.19 0.02 0.04 0.00 90.06 0.39 65 S E E 65.32 4.75 22.10 28.44 136.11 -163.22 -147.84 156.11 18.39 81.52 0.10 15.75 2.01 0.30 0.02 0.07 0.00 81.34 0.50 66 G E E 29.26 11.52 15.40 27.54 139.61 131.56 100.59 162.24 35.17 64.67 0.16 25.93 8.72 1.21 0.02 0.17 0.00 62.67 1.28 67 S C C 76.10 3.33 20.85 24.73 119.25 -104.41 -123.42 125.54 58.33 41.19 0.48 41.24 14.75 3.42 0.10 0.52 0.00 35.95 4.03 68 G C S 33.67 10.11 18.95 29.22 109.05 -46.96 64.87 -126.86 98.27 1.07 0.67 2.34 53.72 42.40 0.02 0.64 0.00 0.73 0.14 69 T C S 56.64 13.98 16.59 30.59 97.74 -6.05 -97.83 -2.50 98.18 1.27 0.55 2.25 53.80 42.33 0.02 0.51 0.00 0.95 0.13 70 D E E 61.95 8.58 22.43 32.15 118.38 83.46 -106.38 130.05 38.13 61.63 0.24 25.69 12.22 1.69 0.03 0.28 0.00 57.95 2.13 71 F E E 7.53 24.75 15.72 40.98 127.91 -173.63 -124.91 140.98 13.24 86.76 0.01 12.68 0.36 0.02 0.00 0.00 0.00 86.51 0.43 72 T E E 36.86 10.12 27.27 38.44 122.03 -162.42 -117.77 133.03 3.52 96.48 0.00 3.08 0.12 0.00 0.00 0.00 0.00 96.75 0.04 73 L E E 3.00 26.21 18.74 45.91 119.42 -162.16 -112.47 128.49 0.28 99.72 0.00 0.28 0.00 0.00 0.00 0.00 0.00 99.71 0.00 74 T E E 39.52 10.06 27.19 38.10 120.13 -164.96 -114.99 128.54 0.14 99.86 0.00 0.15 0.00 0.00 0.00 0.00 0.00 99.84 0.01 75 I E E 7.51 24.11 16.35 41.02 117.82 -167.18 -114.93 125.64 2.65 97.35 0.00 2.79 0.03 0.00 0.00 0.00 0.00 96.81 0.38 76 S C S 46.00 7.33 22.82 30.48 122.15 -171.08 -109.65 154.48 92.08 7.89 0.03 44.51 44.61 1.70 0.00 0.05 0.00 8.95 0.17 77 R C S 145.41 3.93 23.65 27.63 95.64 9.02 57.29 54.92 98.83 1.16 0.01 9.49 87.52 1.84 0.00 0.01 0.00 1.06 0.08 78 L C C 17.51 23.84 10.40 33.72 114.29 -148.22 -76.40 134.09 99.00 1.00 0.01 97.76 1.42 0.02 0.00 0.00 0.00 0.35 0.44 79 E C C 85.45 4.55 24.33 28.63 130.17 -173.97 -125.38 157.27 99.85 0.13 0.01 99.43 0.45 0.00 0.00 0.00 0.00 0.03 0.08 80 P H G 66.41 13.77 15.03 28.82 90.97 -104.59 -59.06 -31.36 3.44 0.02 96.54 0.16 0.19 2.19 0.22 97.22 0.00 0.01 0.00 81 E H G 122.12 4.23 21.51 26.55 90.10 63.18 -71.74 -16.08 2.77 0.02 97.20 0.09 0.15 1.84 0.15 97.75 0.00 0.02 0.00 82 D H G 15.81 20.13 16.96 37.40 94.27 62.64 -87.15 -1.82 3.84 0.05 96.11 0.51 0.39 1.64 0.23 97.17 0.00 0.04 0.00 83 F C C 41.46 18.31 20.54 38.70 117.01 103.24 -81.70 135.26 85.09 14.55 0.36 81.69 3.39 0.13 0.03 0.34 0.00 14.06 0.36 84 A E E 11.24 18.88 23.45 41.56 141.38 157.94 -152.28 169.28 5.06 94.93 0.01 4.70 0.30 0.02 0.00 0.00 0.00 94.67 0.31 85 V E E 28.81 16.28 25.63 41.70 119.11 -111.65 -107.33 131.01 0.56 99.44 0.00 0.52 0.02 0.00 0.00 0.00 0.00 99.45 0.01 86 Y E E 7.77 24.80 21.25 45.92 123.60 -166.21 -115.31 136.63 0.38 99.62 0.00 0.33 0.02 0.00 0.00 0.00 0.00 99.65 0.01 87 Y E E 31.85 16.70 27.13 43.54 128.78 -170.45 -123.66 143.43 1.42 98.57 0.01 1.20 0.07 0.01 0.00 0.00 0.00 98.69 0.02 88 C E E 4.08 24.81 21.10 45.98 123.91 -158.95 -117.13 137.23 7.04 92.89 0.06 5.88 0.74 0.08 0.01 0.03 0.00 93.12 0.14 89 Q E E 41.25 13.76 25.24 39.03 128.03 -171.87 -122.47 142.44 8.88 90.99 0.13 7.77 0.82 0.15 0.03 0.06 0.00 90.83 0.34 90 H E E 53.21 16.37 18.56 34.62 117.24 -140.64 -98.18 130.86 19.32 80.41 0.27 16.12 2.71 0.58 0.07 0.18 0.00 79.50 0.84 91 Y E E 92.74 11.12 16.47 28.23 118.25 -164.17 -110.29 128.08 47.33 52.01 0.66 35.11 10.00 3.52 0.15 0.62 0.00 48.55 2.05 92 G C S 42.80 4.80 14.46 20.64 123.81 54.70 118.90 -172.93 86.63 12.54 0.82 23.57 39.45 23.38 0.06 0.94 0.00 11.68 0.92 93 S C S 93.33 1.82 13.65 16.03 100.15 -52.25 -86.61 -6.24 95.10 4.08 0.83 18.74 55.05 21.36 0.07 0.93 0.00 3.18 0.67 94 S C S 68.55 3.71 13.71 18.98 121.55 66.41 -105.64 143.14 92.10 7.37 0.53 31.20 56.66 4.55 0.08 0.51 0.00 5.69 1.31 95 P C C 80.66 7.46 14.84 23.44 113.75 -96.73 -68.26 147.28 89.26 9.74 1.00 59.57 21.78 7.45 0.14 1.04 0.00 9.14 0.87 96 L C C 53.98 15.70 13.18 28.77 116.97 -132.90 -93.64 134.40 62.55 36.18 1.27 49.72 8.95 3.44 0.25 1.10 0.00 34.51 2.01 97 T E E 69.82 8.24 20.52 29.46 122.26 -159.41 -115.00 135.47 36.79 62.23 0.98 30.99 4.07 1.32 0.38 0.66 0.00 57.03 5.55 98 F E E 50.86 19.28 14.70 33.03 113.77 -156.49 -98.69 126.48 39.26 59.21 1.53 29.28 7.67 3.72 0.55 1.16 0.01 52.18 5.42 99 G C C 28.43 10.84 19.03 29.88 116.92 -146.19 -66.46 -160.10 70.07 28.89 1.05 37.16 23.13 10.33 0.13 1.01 0.00 26.91 1.33 100 Q C C 121.76 4.64 21.34 26.43 102.28 -39.79 -84.14 9.38 74.21 24.52 1.27 38.73 25.99 9.66 0.14 1.28 0.00 23.08 1.12 101 G C C 16.60 17.39 16.44 32.86 126.17 -128.27 92.99 175.09 68.42 31.16 0.42 51.84 12.17 2.59 0.05 0.44 0.00 32.22 0.69 102 T E E 29.58 16.60 19.06 35.59 126.13 -108.75 -118.20 142.95 17.65 82.27 0.08 15.80 1.26 0.13 0.02 0.05 0.00 82.27 0.46 103 R E E 112.75 9.83 23.11 33.25 120.92 -145.04 -106.61 134.00 2.41 97.57 0.02 2.13 0.19 0.02 0.01 0.01 0.00 97.53 0.12 104 L E E 12.91 22.98 15.14 38.06 121.86 -165.85 -114.67 132.76 2.03 97.95 0.01 1.94 0.07 0.01 0.00 0.00 0.00 97.91 0.07 105 E E E 91.49 6.36 23.75 30.61 119.36 -160.50 -110.23 130.46 3.89 96.09 0.02 3.77 0.14 0.02 0.01 0.01 0.00 95.82 0.22 106 I E E 26.03 20.72 11.49 31.62 116.56 -153.70 -102.11 126.29 22.74 77.19 0.07 22.83 0.29 0.06 0.03 0.03 0.00 75.87 0.90 107 K C C 128.28 4.10 19.85 24.75 113.57 -150.17 -93.45 129.17 99.28 0.72 0.00 99.34 0.06 0.01 0.00 0.00 0.00 0.58 0.01