E8NH77_DROME Loading...

SD15168p

AlphaFold DB , UniProt , Accession E8NH77, Species DROME (Drosophila melanogaster, Fruit fly), Gene sw, Length 634 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	57	Low	74.7	Confident	208 Å²	208	145.3 Å²	145.3	100%	1.025	67%	0.669	S	S	*	*				0	-38	0	-73.9	-70.9	-108.6	0	0	111.5	R3 A5	M1-R3 PolarHBondContact O-N 3.48Å; M1-A5 PolarHBondContact O-N 2.72Å
2	D	63.8	Low	75.2	Confident	138 Å²	138	138.3 Å²	138.3	74%	0.738	66%	0.656	S	S	*	*	H	α-helix	trans	-66.8	-37.5	-175	-62.1	-46.1	0	0	0	116.4	K4 A5 E6	D2-K4 VanDerWaalsContact C-N 3.31Å; D2-K4 PolarHBondContact O-N 3.21Å; D2-A5 PolarHBondContact O-N 3.28Å; D2-E6 PolarHBondContact O-N 3.26Å
3	R	61.5	Low	75.9	Confident	212 Å²	212	140 Å²	140	80%	0.8	66%	0.659	S	S	*	*	H	α-helix	trans	-67.5	-29.8	-178.4	-161.3	172.7	-175.8	174.7	0.6	113.5	M1 L7	M1-R3 PolarHBondContact O-N 3.48Å; R3-L7 PolarHBondContact O-N 3.19Å
4	K	75.9	Confident	75.9	Confident	146 Å²	146	137.4 Å²	137.4	64%	0.635	65%	0.651	S	S	*	*	H	α-helix	trans	-74	-40.2	175.4	-170.8	178.8	176.8	-176.2	0	110.9	D2 E6 L7 E8	D2-K4 VanDerWaalsContact C-N 3.31Å; D2-K4 PolarHBondContact O-N 3.21Å; K4-E6 VanDerWaalsContact C-N 3.33Å; K4-E6 PolarHBondContact O-N 3.24Å; K4-L7 PolarHBondContact O-N 3.34Å; K4-E8 PolarHBondContact O-N 3.32Å
5	A	79.8	Confident	76.2	Confident	56 Å²	56	131.9 Å²	131.9	46%	0.463	64%	0.637	S	S	.	*	H	α-helix	trans	-65	-36	174.4	0	0	0	0	0	112.2	M1 D2 R9	M1-A5 PolarHBondContact O-N 2.72Å; D2-A5 PolarHBondContact O-N 3.28Å; A5-R9 WeakPolarHBondContact O-CB 3.32Å; A5-R9 PolarHBondContact O-N 3.09Å
6	E	77.8	Confident	76.5	Confident	105 Å²	105	127.1 Å²	127.1	49%	0.491	63%	0.626	S	S	.	*	H	α-helix	trans	-69.1	-38.8	176.2	-156.9	-163.9	143.8	0	0	112.5	D2 K4 R9 K10	D2-E6 PolarHBondContact O-N 3.26Å; K4-E6 VanDerWaalsContact C-N 3.33Å; K4-E6 PolarHBondContact O-N 3.24Å; E6-R9 PolarHBondContact O-N 3.14Å; E6-K10 PolarHBondContact O-N 3.46Å; E6-K10 IonicContact OE1-NZ 3.13Å; E6-K10 PolarHBondContact OE1-NZ 3.06Å
7	L	75.9	Confident	76.9	Confident	117 Å²	117	126.8 Å²	126.8	61%	0.613	63%	0.627	S	S	*	*	H	α-helix	trans	-67	-41	175.8	-114.3	161	0	0	0	112	R3 K4 R9 K10 K11	R3-L7 PolarHBondContact O-N 3.19Å; K4-L7 PolarHBondContact O-N 3.34Å; L7-R9 VanDerWaalsContact C-N 3.34Å; L7-K10 PolarHBondContact O-N 3.06Å; L7-K11 WeakPolarHBondContact O-CB 3.47Å; L7-K11 PolarHBondContact O-N 2.95Å
8	E	78.3	Confident	77	Confident	120 Å²	120	129.4 Å²	129.4	56%	0.561	63%	0.628	S	S	*	*	H	α-helix	trans	-65.7	-37.4	174.5	-78.7	178	-179	0	0	111.7	K4 K11 A12	K4-E8 PolarHBondContact O-N 3.32Å; E8-K11 PolarHBondContact O-N 2.94Å; E8-A12 VanDerWaalsContact O-CB 3.31Å; E8-A12 WeakPolarHBondContact O-CB 3.48Å; E8-A12 PolarHBondContact O-N 3.33Å
9	R	80.9	Confident	77.5	Confident	204 Å²	204	129.7 Å²	129.7	77%	0.77	63%	0.629	S	S	*	*	H	α-helix	trans	-67.3	-39.3	174.7	-164.5	176.3	-177.7	178.3	0.8	112.4	A5 E6 L7 K13	A5-R9 WeakPolarHBondContact O-CB 3.32Å; A5-R9 PolarHBondContact O-N 3.09Å; E6-R9 PolarHBondContact O-N 3.14Å; L7-R9 VanDerWaalsContact C-N 3.34Å; R9-K13 WeakPolarHBondContact O-CB 3.44Å; R9-K13 PolarHBondContact O-N 3.44Å
10	K	84.4	Confident	77.9	Confident	130 Å²	130	127.8 Å²	127.8	57%	0.565	62%	0.619	S	S	*	*	H	α-helix	trans	-66.8	-41.1	174	-81.4	173.6	170.1	157.2	0	111.7	E6 L7 K13 L14	E6-K10 PolarHBondContact O-N 3.46Å; E6-K10 IonicContact OE1-NZ 3.13Å; E6-K10 PolarHBondContact OE1-NZ 3.06Å; L7-K10 PolarHBondContact O-N 3.06Å; K10-K13 PolarHBondContact O-N 3.44Å; K10-L14 PolarHBondContact O-N 3.39Å
11	K	86.6	Confident	78.1	Confident	162 Å²	162	128.9 Å²	128.9	70%	0.704	62%	0.62	S	S	*	*	H	α-helix	trans	-65.2	-41.9	176	-169.7	176.4	179.8	-179.5	0	112.1	L7 E8 L14 A15	L7-K11 WeakPolarHBondContact O-CB 3.47Å; L7-K11 PolarHBondContact O-N 2.95Å; E8-K11 PolarHBondContact O-N 2.94Å; K11-L14 PolarHBondContact O-N 3.29Å; K11-A15 WeakPolarHBondContact O-CB 3.46Å; K11-A15 PolarHBondContact O-N 2.92Å
12	A	80.5	Confident	79.2	Confident	61 Å²	61	122.8 Å²	122.8	50%	0.504	59%	0.592	S	S	.	*	H	α-helix	trans	-63.9	-40.1	174.9	0	0	0	0	0	112	E8 A15 A16	E8-A12 VanDerWaalsContact O-CB 3.31Å; E8-A12 WeakPolarHBondContact O-CB 3.48Å; E8-A12 PolarHBondContact O-N 3.33Å; A12-A15 PolarHBondContact O-N 3.45Å; A12-A16 PolarHBondContact O-N 3.48Å
13	K	84.4	Confident	80	Confident	161 Å²	161	121.7 Å²	121.7	70%	0.7	58%	0.578	S	S	*	*	H	α-helix	trans	-66.3	-37.8	176.4	-163.3	174.1	-176.1	-178.8	0	112.3	R9 K10 L17	R9-K13 WeakPolarHBondContact O-CB 3.44Å; R9-K13 PolarHBondContact O-N 3.44Å; K10-K13 PolarHBondContact O-N 3.44Å; K13-L17 PolarHBondContact O-N 3.33Å
14	L	75.7	Confident	80.9	Confident	104 Å²	104	120.3 Å²	120.3	55%	0.545	57%	0.572	S	S	.	*	H	α-helix	trans	-70.2	-36.7	176.6	-153.4	106.7	0	0	0	112.1	K10 K11 L17 R18	K10-L14 PolarHBondContact O-N 3.39Å; K11-L14 PolarHBondContact O-N 3.29Å; L14-L17 PolarHBondContact O-N 2.91Å; L14-R18 PolarHBondContact O-N 3.26Å; L14-R18 VanDerWaalsContact O-N 3.09Å
15	A	81	Confident	80.9	Confident	54 Å²	54	121.1 Å²	121.1	45%	0.446	57%	0.571	S	S	.	*	H	α-helix	trans	-64.9	-43.7	175.1	0	0	0	0	0	111.7	K11 A12 L17 R18 E19	K11-A15 WeakPolarHBondContact O-CB 3.46Å; K11-A15 PolarHBondContact O-N 2.92Å; A12-A15 PolarHBondContact O-N 3.45Å; A15-L17 VanDerWaalsContact C-N 3.3Å; A15-L17 PolarHBondContact O-N 3.47Å; A15-R18 PolarHBondContact O-N 3.33Å; A15-E19 PolarHBondContact O-N 3.46Å
16	A	81.1	Confident	80.8	Confident	56 Å²	56	125.1 Å²	125.1	46%	0.463	57%	0.574	S	S	.	*	H	α-helix	trans	-61.9	-36.9	175.5	0	0	0	0	0	112.6	A12 E19 E20	A12-A16 PolarHBondContact O-N 3.48Å; A16-E19 PolarHBondContact O-N 3.15Å; A16-E20 WeakPolarHBondContact O-CB 3.47Å; A16-E20 PolarHBondContact O-N 2.91Å
17	L	82.3	Confident	80.9	Confident	122 Å²	122	125.5 Å²	125.5	64%	0.639	58%	0.576	S	S	*	*	H	α-helix	trans	-69.9	-33.3	177.1	-123.7	155.6	0	0	0	112.7	K13 L14 A15 K21	K13-L17 PolarHBondContact O-N 3.33Å; L14-L17 PolarHBondContact O-N 2.91Å; A15-L17 VanDerWaalsContact C-N 3.3Å; A15-L17 PolarHBondContact O-N 3.47Å; L17-K21 WeakPolarHBondContact O-CB 3.42Å; L17-K21 PolarHBondContact O-N 3Å; L17-K21 VanDerWaalsContact O-N 3.16Å
18	R	79.1	Confident	80.8	Confident	173 Å²	173	126.5 Å²	126.5	65%	0.653	58%	0.575	S	S	*	*	H	α-helix	trans	-69.9	-43.6	172.6	-77.3	-177.6	176.8	179.7	-2.4	111.6	L14 A15 E20 K21 D22	L14-R18 PolarHBondContact O-N 3.26Å; L14-R18 VanDerWaalsContact O-N 3.09Å; A15-R18 PolarHBondContact O-N 3.33Å; R18-E20 VanDerWaalsContact C-N 3.33Å; R18-E20 PolarHBondContact O-N 2.87Å; R18-K21 PolarHBondContact O-N 3.46Å; R18-D22 PolarHBondContact O-N 3.36Å
19	E	86.3	Confident	80.6	Confident	136 Å²	136	125.4 Å²	125.4	64%	0.636	57%	0.57	S	S	*	*	H	α-helix	trans	-64.1	-38.1	178.3	-169.5	173.7	-173.3	0	0	112.1	A15 A16 D22 R23	A15-E19 PolarHBondContact O-N 3.46Å; A16-E19 PolarHBondContact O-N 3.15Å; E19-D22 PolarHBondContact O-N 3.11Å; E19-R23 WeakPolarHBondContact O-CB 3.42Å; E19-R23 PolarHBondContact O-N 3.49Å
20	E	84.9	Confident	80.3	Confident	91 Å²	91	121 Å²	121	43%	0.425	56%	0.561	S	S	.	*	H	α-helix	trans	-63.9	-41.8	172.7	-171.3	62.5	-144.2	0	0	112.1	A16 R18 R23 R24	A16-E20 WeakPolarHBondContact O-CB 3.47Å; A16-E20 PolarHBondContact O-N 2.91Å; R18-E20 VanDerWaalsContact C-N 3.33Å; R18-E20 PolarHBondContact O-N 2.87Å; E20-R23 PolarHBondContact O-N 3.4Å; E20-R23 IonicContact OE1-CZ 3.69Å; E20-R23 IonicContact OE1-NE 2.74Å; E20-R23 IonicContact OE1-NH2 2.78Å; E20-R23 PolarHBondContact OE1-NH2 3.35Å; E20-R23 IonicContact OE2-CZ 3.84Å; E20-R23 IonicContact OE2-NH1 3.18Å; E20-R23 PolarHBondContact OE2-NH1 2.87Å; E20-R23 IonicContact OE2-NH2 3.52Å; E20-R23 PolarHBondContact OE2-NH2 2.84Å; E20-R24 WeakPolarHBondContact O-CB 3.49Å; E20-R24 PolarHBondContact O-N 2.89Å
21	K	82.6	Confident	79.7	Confident	151 Å²	151	121.5 Å²	121.5	66%	0.657	56%	0.563	S	S	*	*	H	α-helix	trans	-66.4	-39.6	177.5	-168.5	179.9	178.9	-177.1	0	111.7	L17 R18 R24 R25	L17-K21 WeakPolarHBondContact O-CB 3.42Å; L17-K21 PolarHBondContact O-N 3Å; L17-K21 VanDerWaalsContact O-N 3.16Å; R18-K21 PolarHBondContact O-N 3.46Å; K21-R24 PolarHBondContact O-N 3.27Å; K21-R25 WeakPolarHBondContact O-CB 3.22Å; K21-R25 PolarHBondContact O-N 3.23Å
22	D	79.8	Confident	78.8	Confident	79 Å²	79	117.6 Å²	117.6	42%	0.422	55%	0.55	S	S	.	*	H	α-helix	trans	-70.9	-34.3	176.9	-74.4	-14.6	0	0	0	112.1	R18 E19 R25 R26	R18-D22 PolarHBondContact O-N 3.36Å; E19-D22 PolarHBondContact O-N 3.11Å; D22-R25 PolarHBondContact O-N 3.29Å; D22-R26 PolarHBondContact O-N 2.88Å
23	R	81.4	Confident	78.3	Confident	116 Å²	116	121.6 Å²	121.6	44%	0.438	56%	0.56	S	S	.	*	H	α-helix	trans	-64.5	-46.8	171.4	-170.2	173.6	73.2	-142.1	1.6	111.1	E19 E20 R25 R26 E27	E19-R23 WeakPolarHBondContact O-CB 3.42Å; E19-R23 PolarHBondContact O-N 3.49Å; E20-R23 PolarHBondContact O-N 3.4Å; E20-R23 IonicContact OE1-CZ 3.69Å; E20-R23 IonicContact OE1-NE 2.74Å; E20-R23 IonicContact OE1-NH2 2.78Å; E20-R23 PolarHBondContact OE1-NH2 3.35Å; E20-R23 IonicContact OE2-CZ 3.84Å; E20-R23 IonicContact OE2-NH1 3.18Å; E20-R23 PolarHBondContact OE2-NH1 2.87Å; E20-R23 IonicContact OE2-NH2 3.52Å; E20-R23 PolarHBondContact OE2-NH2 2.84Å; R23-R25 VanDerWaalsContact C-N 3.28Å; R23-R25 PolarHBondContact O-N 3.04Å; R23-R26 PolarHBondContact O-N 2.97Å; R23-E27 WeakPolarHBondContact O-CG 3.42Å; R23-E27 PolarHBondContact O-N 2.78Å
24	R	79.3	Confident	77.3	Confident	183 Å²	183	120.7 Å²	120.7	69%	0.691	56%	0.558	S	S	*	*	H	α-helix	trans	-63	-34.1	176.4	-160.8	-178.5	84	171.2	6.6	112.4	E20 K21 K28	E20-R24 WeakPolarHBondContact O-CB 3.49Å; E20-R24 PolarHBondContact O-N 2.89Å; K21-R24 PolarHBondContact O-N 3.27Å; R24-K28 WeakPolarHBondContact O-CB 3.4Å; R24-K28 PolarHBondContact O-N 2.86Å
25	R	76.1	Confident	76.5	Confident	162 Å²	162	120.4 Å²	120.4	61%	0.611	55%	0.554	S	S	*	*	H	α-helix	trans	-68	-45.3	174.6	-173.2	-179.6	175.9	168.9	8.2	111.3	K21 D22 R23 K28 E29	K21-R25 WeakPolarHBondContact O-CB 3.22Å; K21-R25 PolarHBondContact O-N 3.23Å; D22-R25 PolarHBondContact O-N 3.29Å; R23-R25 VanDerWaalsContact C-N 3.28Å; R23-R25 PolarHBondContact O-N 3.04Å; R25-K28 WeakPolarHBondContact O-CB 3.33Å; R25-K28 PolarHBondContact O-N 3.07Å; R25-E29 IonicContact CZ-OE1 2.79Å; R25-E29 IonicContact NE-OE1 2.78Å; R25-E29 PolarHBondContact NE-OE1 3.36Å; R25-E29 VanDerWaalsContact NE-OE1 3.14Å; R25-E29 WeakPolarHBondContact O-CG 3.34Å; R25-E29 PolarHBondContact O-N 3.39Å
26	R	78.6	Confident	75.4	Confident	141 Å²	141	120 Å²	120	53%	0.532	55%	0.551	S	S	.	*	H	α-helix	trans	-64.2	-38.5	175.4	-84.6	-174.5	-101.4	122.1	-4.2	112.8	D22 R23 K28 E29 I30	D22-R26 PolarHBondContact O-N 2.88Å; R23-R26 PolarHBondContact O-N 2.97Å; R26-K28 VanDerWaalsContact C-N 3.31Å; R26-K28 PolarHBondContact O-N 3.37Å; R26-E29 PolarHBondContact O-N 3.44Å; R26-I30 WeakPolarHBondContact O-CB 3.47Å; R26-I30 WeakPolarHBondContact O-CD1 3.47Å; R26-I30 WeakPolarHBondContact O-CG1 3.22Å; R26-I30 PolarHBondContact O-N 3.22Å
27	E	78.7	Confident	74.1	Confident	112 Å²	112	120.2 Å²	120.2	52%	0.523	55%	0.553	S	S	.	*	H	α-helix	trans	-63.6	-37.9	172.9	-75.6	172.7	-175.9	0	0	111.9	R23 K31	R23-E27 WeakPolarHBondContact O-CG 3.42Å; R23-E27 PolarHBondContact O-N 2.78Å; E27-K31 WeakPolarHBondContact O-CB 3.45Å; E27-K31 PolarHBondContact O-N 2.9Å
28	K	75.1	Confident	72.4	Confident	138 Å²	138	117 Å²	117	60%	0.6	55%	0.549	S	S	*	.	H	α-helix	trans	-67.6	-42.7	173.9	-165.9	179	178.1	-173.2	0	111.8	R24 R25 R26 I30 K31 D32	R24-K28 WeakPolarHBondContact O-CB 3.4Å; R24-K28 PolarHBondContact O-N 2.86Å; R25-K28 WeakPolarHBondContact O-CB 3.33Å; R25-K28 PolarHBondContact O-N 3.07Å; R26-K28 VanDerWaalsContact C-N 3.31Å; R26-K28 PolarHBondContact O-N 3.37Å; K28-I30 VanDerWaalsContact C-N 3.35Å; K28-I30 PolarHBondContact O-N 2.9Å; K28-K31 PolarHBondContact O-N 2.7Å; K28-D32 WeakPolarHBondContact O-CB 3.31Å; K28-D32 PolarHBondContact O-N 2.64Å
29	E	73.6	Confident	70.9	Confident	97 Å²	97	117.7 Å²	117.7	45%	0.453	55%	0.552	S	S	.	*	H	α-helix	trans	-63.8	-38.1	175.9	-75.5	168.4	-174.2	0	0	112	R25 R26 M33	R25-E29 IonicContact CZ-OE1 2.79Å; R25-E29 IonicContact NE-OE1 2.78Å; R25-E29 PolarHBondContact NE-OE1 3.36Å; R25-E29 VanDerWaalsContact NE-OE1 3.14Å; R25-E29 WeakPolarHBondContact O-CG 3.34Å; R25-E29 PolarHBondContact O-N 3.39Å; R26-E29 PolarHBondContact O-N 3.44Å; E29-M33 VanDerWaalsContact O-CB 3.26Å; E29-M33 WeakPolarHBondContact O-CB 3.46Å; E29-M33 PolarHBondContact O-N 3.06Å
30	I	75.3	Confident	68.9	Low	112 Å²	112	118.3 Å²	118.3	57%	0.574	56%	0.558	S	S	*	*	H	α-helix	trans	-67.2	-40.6	173.9	-68.2	163.5	0	0	0	110.8	R26 K28 M33 E34	R26-I30 WeakPolarHBondContact O-CB 3.47Å; R26-I30 WeakPolarHBondContact O-CD1 3.47Å; R26-I30 WeakPolarHBondContact O-CG1 3.22Å; R26-I30 PolarHBondContact O-N 3.22Å; K28-I30 VanDerWaalsContact C-N 3.35Å; K28-I30 PolarHBondContact O-N 2.9Å; I30-M33 PolarHBondContact O-N 3.49Å; I30-E34 WeakPolarHBondContact O-CB 3.26Å; I30-E34 PolarHBondContact O-N 3.18Å
31	K	71.9	Confident	66.5	Low	141 Å²	141	117.2 Å²	117.2	61%	0.613	57%	0.571	S	S	*	*	H	α-helix	trans	-66.9	-39.9	177	-167.1	176.5	-178.6	-178.6	0	112.1	E27 K28 M33 E34 E35	E27-K31 WeakPolarHBondContact O-CB 3.45Å; E27-K31 PolarHBondContact O-N 2.9Å; K28-K31 PolarHBondContact O-N 2.7Å; K31-M33 VanDerWaalsContact C-N 3.3Å; K31-E34 PolarHBondContact O-N 2.81Å; K31-E35 WeakPolarHBondContact O-CB 3.25Å; K31-E35 PolarHBondContact O-N 3.48Å
32	D	66.2	Low	64.1	Low	80 Å²	80	113.3 Å²	113.3	43%	0.428	57%	0.574	S	S	.	*	H	α-helix	trans	-68.3	-32.2	175	-66.8	-13.2	0	0	0	110.6	K28 A36	K28-D32 WeakPolarHBondContact O-CB 3.31Å; K28-D32 PolarHBondContact O-N 2.64Å; D32-A36 VanDerWaalsContact O-CB 3.25Å; D32-A36 WeakPolarHBondContact O-CB 3.38Å; D32-A36 PolarHBondContact O-N 2.88Å
33	M	70.5	Confident	61.8	Low	145 Å²	145	113 Å²	113	71%	0.714	59%	0.589	S	S	*	*	H	α-helix	trans	-74	-34.8	173.7	-163.7	175.1	113.7	0	0	112.7	E29 I30 K31 A37	E29-M33 VanDerWaalsContact O-CB 3.26Å; E29-M33 WeakPolarHBondContact O-CB 3.46Å; E29-M33 PolarHBondContact O-N 3.06Å; I30-M33 PolarHBondContact O-N 3.49Å; K31-M33 VanDerWaalsContact C-N 3.3Å; M33-A37 WeakPolarHBondContact O-CB 3.38Å; M33-A37 PolarHBondContact O-N 3.34Å
34	E	63	Low	59.8	Low	141 Å²	141	112.5 Å²	112.5	66%	0.659	61%	0.609	S	S	*	*	H	α-helix	trans	-69.1	-38.3	172	-169.1	175.8	-173.2	0	0	111.1	I30 K31 A37 G38	I30-E34 WeakPolarHBondContact O-CB 3.26Å; I30-E34 PolarHBondContact O-N 3.18Å; K31-E34 PolarHBondContact O-N 2.81Å; E34-A37 PolarHBondContact O-N 3.22Å; E34-G38 PolarHBondContact O-N 3.47Å
35	E	60.4	Low	57.9	Low	98 Å²	98	107.4 Å²	107.4	46%	0.458	61%	0.614	S	S	.	*	H	α-helix	trans	-69.7	-36.9	173.6	-160	-177.9	147.8	0	0	111.8	K31 G38 R39	K31-E35 WeakPolarHBondContact O-CB 3.25Å; K31-E35 PolarHBondContact O-N 3.48Å; E35-G38 PolarHBondContact O-N 3.4Å; E35-R39 WeakPolarHBondContact O-CG 3.48Å; E35-R39 PolarHBondContact O-N 2.86Å; E35-R39 IonicContact OE1-CZ 3.95Å; E35-R39 IonicContact OE1-NE 3.06Å; E35-R39 IonicContact OE1-NH2 3.16Å; E35-R39 PolarHBondContact OE1-NH2 2.83Å
36	A	56.4	Low	56.1	Low	46 Å²	46	106.9 Å²	106.9	38%	0.38	62%	0.622	S	S	.	*	H	α-helix	trans	-67.4	-38.6	172.1	0	0	0	0	0	112.2	D32 G38 R39 I40	D32-A36 VanDerWaalsContact O-CB 3.25Å; D32-A36 WeakPolarHBondContact O-CB 3.38Å; D32-A36 PolarHBondContact O-N 2.88Å; A36-G38 VanDerWaalsContact C-N 3.35Å; A36-R39 PolarHBondContact O-N 3.25Å; A36-I40 VanDerWaalsContact O-CG1 3.31Å; A36-I40 WeakPolarHBondContact O-CG1 3.42Å; A36-I40 PolarHBondContact O-N 3.28Å
37	A	54.3	Low	54.4	Low	61 Å²	61	104.8 Å²	104.8	50%	0.504	62%	0.621	S	S	.	*	H	α-helix	trans	-66	-37.3	172.7	0	0	0	0	0	111.9	M33 E34 R39 I40 G41	M33-A37 WeakPolarHBondContact O-CB 3.38Å; M33-A37 PolarHBondContact O-N 3.34Å; E34-A37 PolarHBondContact O-N 3.22Å; A37-R39 VanDerWaalsContact C-N 3.31Å; A37-R39 PolarHBondContact O-N 2.92Å; A37-I40 PolarHBondContact O-N 2.85Å; A37-G41 PolarHBondContact O-N 2.86Å; A37-G41 VanDerWaalsContact O-N 3.11Å
38	G	47.3	Very low	52.9	Low	54 Å²	54	108.5 Å²	108.5	56%	0.557	64%	0.635	S	S	*	*	H	α-helix	trans	-63.3	-32.6	171.4	0	0	0	0	0	113.6	E34 E35 A36	E34-G38 PolarHBondContact O-N 3.47Å; E35-G38 PolarHBondContact O-N 3.4Å; A36-G38 VanDerWaalsContact C-N 3.35Å
39	R	48	Very low	51.6	Low	188 Å²	188	107.5 Å²	107.5	71%	0.709	64%	0.637	S	S	*	*	H	α-helix	trans	-76.6	-29.2	174.2	-71.8	179	-165.6	-167.3	6.5	113.4	E35 A36 A37	E35-R39 WeakPolarHBondContact O-CG 3.48Å; E35-R39 PolarHBondContact O-N 2.86Å; E35-R39 IonicContact OE1-CZ 3.95Å; E35-R39 IonicContact OE1-NE 3.06Å; E35-R39 IonicContact OE1-NH2 3.16Å; E35-R39 PolarHBondContact OE1-NH2 2.83Å; A36-R39 PolarHBondContact O-N 3.25Å; A37-R39 VanDerWaalsContact C-N 3.31Å; A37-R39 PolarHBondContact O-N 2.92Å
40	I	43.8	Very low	50.5	Low	149 Å²	149	108.4 Å²	108.4	76%	0.764	64%	0.641	S	S	*	*	H	α-helix	trans	-78.3	-23.3	176.4	-64.7	165	0	0	0	111.6	A36 A37	A36-I40 VanDerWaalsContact O-CG1 3.31Å; A36-I40 WeakPolarHBondContact O-CG1 3.42Å; A36-I40 PolarHBondContact O-N 3.28Å; A37-I40 PolarHBondContact O-N 2.85Å
41	G	34.1	Very low	49.5	Very low	68 Å²	68	112.5 Å²	112.5	70%	0.701	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-5.5	173.8	0	0	0	0	0	116	A37 G43	A37-G41 PolarHBondContact O-N 2.86Å; A37-G41 VanDerWaalsContact O-N 3.11Å; G41-G43 PolarHBondContact O-N 3.42Å
42	G	32.5	Very low	48.6	Very low	69 Å²	69	112.6 Å²	112.6	71%	0.711	65%	0.65	S	S	*	*	S	Bend	trans	-88.9	8.7	-173.5	0	0	0	0	0	116.1
43	G	32.4	Very low	48.2	Very low	73 Å²	73	113.3 Å²	113.3	75%	0.753	65%	0.653	S	S	*	*	S	Bend	trans	-118.3	35.3	-167.3	0	0	0	0	0	115.9	G41	G41-G43 PolarHBondContact O-N 3.42Å
44	A	39.2	Very low	47.6	Very low	104 Å²	104	111.1 Å²	111.1	86%	0.86	64%	0.644	S	S	*	*	S	Bend	trans	-164.3	73.1	169.4	0	0	0	0	0	111.5
45	G	38	Very low	47.3	Very low	76 Å²	76	109.5 Å²	109.5	78%	0.784	64%	0.64	S	S	*	*			trans	-164.6	61.7	178.1	0	0	0	0	0	111.7
46	I	39.8	Very low	47.3	Very low	152 Å²	152	111.7 Å²	111.7	78%	0.779	65%	0.65	S	S	*	*	S	Bend	trans	-119.7	131.6	163.9	-63.6	176.4	0	0	0	107.3
47	D	42.4	Very low	47.3	Very low	97 Å²	97	114.8 Å²	114.8	52%	0.519	66%	0.658	S	S	.	*			trans	-45	128.6	-163.5	-66.8	-52.5	0	0	0	116.6	D49 Q50	D47-D49 PolarHBondContact O-N 2.93Å; D47-Q50 HydrophobicContact CB-CB 4.41Å; D47-Q50 HydrophobicContact CB-CG 4.08Å
48	K	46.3	Very low	47.3	Very low	189 Å²	189	115.8 Å²	115.8	82%	0.822	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-16.4	169.6	-93.6	-179.4	174.7	175.6	0	113.6
49	D	48	Very low	47.8	Very low	117 Å²	117	117.5 Å²	117.5	63%	0.626	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-38	179.4	-87.4	-13.8	0	0	0	112.4	D47 R51 K52 D53	D47-D49 PolarHBondContact O-N 2.93Å; D49-R51 VanDerWaalsContact C-N 3.28Å; D49-R51 PolarHBondContact O-N 2.92Å; D49-K52 PolarHBondContact O-N 3.22Å; D49-K52 VanDerWaalsContact O-N 3.14Å; D49-D53 PolarHBondContact O-N 3.18Å
50	Q	51.6	Low	48.2	Very low	117 Å²	117	113.2 Å²	113.2	55%	0.547	66%	0.657	S	S	.	*	H	α-helix	trans	-69.1	-24.6	-178.6	-66.1	-176.5	3.6	0	0	113.6	D47 L54	D47-Q50 HydrophobicContact CB-CB 4.41Å; D47-Q50 HydrophobicContact CB-CG 4.08Å; Q50-L54 PolarHBondContact O-N 3.41Å
51	R	52.3	Low	48.6	Very low	198 Å²	198	112.7 Å²	112.7	75%	0.747	66%	0.655	S	S	*	*	H	α-helix	trans	-73.8	-30.4	173.6	-84.4	-175.9	-177.5	172	2.4	113.3	D49 D55	D49-R51 VanDerWaalsContact C-N 3.28Å; D49-R51 PolarHBondContact O-N 2.92Å; R51-D55 WeakPolarHBondContact O-CB 3.46Å; R51-D55 PolarHBondContact O-N 2.92Å; R51-D55 VanDerWaalsContact O-N 3.09Å
52	K	54.3	Low	49.3	Very low	143 Å²	143	112.8 Å²	112.8	62%	0.622	66%	0.656	S	S	*	*	H	α-helix	trans	-72	-41.6	176.8	-76.4	-179.9	177	176.6	0	111	D49 L54 D55 E56	D49-K52 PolarHBondContact O-N 3.22Å; D49-K52 VanDerWaalsContact O-N 3.14Å; K52-L54 VanDerWaalsContact C-N 3.34Å; K52-L54 PolarHBondContact O-N 2.96Å; K52-D55 PolarHBondContact O-N 3.32Å; K52-E56 WeakPolarHBondContact O-CB 3.45Å; K52-E56 PolarHBondContact O-N 3.16Å
53	D	56.9	Low	50.3	Low	94 Å²	94	114.1 Å²	114.1	50%	0.503	65%	0.65	S	S	.	*	H	α-helix	trans	-67.4	-34.5	178.7	-63.9	-17.3	0	0	0	112.1	D49 M57	D49-D53 PolarHBondContact O-N 3.18Å; D53-M57 WeakPolarHBondContact O-CB 3.49Å; D53-M57 WeakPolarHBondContact O-CG 3.2Å; D53-M57 PolarHBondContact O-N 3.4Å
54	L	58.3	Low	51.1	Low	99 Å²	99	113.7 Å²	113.7	52%	0.518	64%	0.64	S	S	.	*	H	α-helix	trans	-70.7	-40.6	173.7	-99.3	158.5	0	0	0	112.9	Q50 K52 M57 L58	Q50-L54 PolarHBondContact O-N 3.41Å; K52-L54 VanDerWaalsContact C-N 3.34Å; K52-L54 PolarHBondContact O-N 2.96Å; L54-M57 HydrophobicContact CD2-CE 4.46Å; L54-M57 HydrophobicContact CG-CE 4.41Å; L54-M57 PolarHBondContact O-N 2.72Å; L54-L58 WeakPolarHBondContact O-CB 3.38Å; L54-L58 WeakPolarHBondContact O-CD1 3.45Å; L54-L58 VanDerWaalsContact O-CG 3.22Å; L54-L58 WeakPolarHBondContact O-CG 3.1Å; L54-L58 PolarHBondContact O-N 2.82Å
55	D	56	Low	51.6	Low	107 Å²	107	112.6 Å²	112.6	57%	0.572	62%	0.623	S	S	*	*	H	α-helix	trans	-68.4	-33.8	176	-87.1	-14.9	0	0	0	112.1	R51 K52 S59	R51-D55 WeakPolarHBondContact O-CB 3.46Å; R51-D55 PolarHBondContact O-N 2.92Å; R51-D55 VanDerWaalsContact O-N 3.09Å; K52-D55 PolarHBondContact O-N 3.32Å; D55-S59 WeakPolarHBondContact O-CB 3.49Å; D55-S59 PolarHBondContact O-N 2.95Å
56	E	61.4	Low	52.3	Low	145 Å²	145	114.2 Å²	114.2	68%	0.678	62%	0.618	S	S	*	*	H	α-helix	trans	-70.3	-39.4	174.6	-126.6	174.1	-171.9	0	0	111.8	K52 S59 S60	K52-E56 WeakPolarHBondContact O-CB 3.45Å; K52-E56 PolarHBondContact O-N 3.16Å; E56-S59 PolarHBondContact O-N 2.81Å; E56-S60 PolarHBondContact O-N 2.89Å
57	M	55.7	Low	52.9	Low	110 Å²	110	111.1 Å²	111.1	54%	0.542	61%	0.61	S	S	.	*	H	α-helix	trans	-65.4	-42.5	173.3	-76.9	-166	-69.7	0	0	112.1	D53 L54 S59 S60 L61	D53-M57 WeakPolarHBondContact O-CB 3.49Å; D53-M57 WeakPolarHBondContact O-CG 3.2Å; D53-M57 PolarHBondContact O-N 3.4Å; L54-M57 HydrophobicContact CD2-CE 4.46Å; L54-M57 HydrophobicContact CG-CE 4.41Å; L54-M57 PolarHBondContact O-N 2.72Å; M57-S59 VanDerWaalsContact C-N 3.33Å; M57-S59 PolarHBondContact O-N 2.94Å; M57-S60 PolarHBondContact O-N 2.91Å; M57-S60 PolarHBondContact O-OG 3.34Å; M57-L61 WeakPolarHBondContact O-CD1 3.41Å; M57-L61 PolarHBondContact O-N 3.45Å
58	L	55.9	Low	53.2	Low	82 Å²	82	112.4 Å²	112.4	43%	0.429	61%	0.613	S	S	.	*	H	α-helix	trans	-67.3	-32.5	178.6	-72.2	167	0	0	0	112.8	L54 L61 V63	L54-L58 WeakPolarHBondContact O-CB 3.38Å; L54-L58 WeakPolarHBondContact O-CD1 3.45Å; L54-L58 VanDerWaalsContact O-CG 3.22Å; L54-L58 WeakPolarHBondContact O-CG 3.1Å; L54-L58 PolarHBondContact O-N 2.82Å; L58-L61 PolarHBondContact O-N 2.89Å; L58-V63 PolarHBondContact O-N 3.44Å
59	S	57.8	Low	53.4	Low	90 Å²	90	107.6 Å²	107.6	63%	0.629	60%	0.599	S	S	*	*	H	α-helix	trans	-66.9	-37.9	173.6	-170.4	0	0	0	0	112.5	D55 E56 M57 L61 G62	D55-S59 WeakPolarHBondContact O-CB 3.49Å; D55-S59 PolarHBondContact O-N 2.95Å; E56-S59 PolarHBondContact O-N 2.81Å; M57-S59 VanDerWaalsContact C-N 3.33Å; M57-S59 PolarHBondContact O-N 2.94Å; S59-L61 PolarHBondContact O-N 2.73Å; S59-G62 PolarHBondContact O-N 3.42Å
60	S	55.3	Low	53.4	Low	99 Å²	99	107.5 Å²	107.5	69%	0.692	60%	0.598	S	S	*	*	H	α-helix	trans	-67.6	-20.3	176.2	77.9	0	0	0	0	114	E56 M57	E56-S60 PolarHBondContact O-N 2.89Å; M57-S60 PolarHBondContact O-N 2.91Å; M57-S60 PolarHBondContact O-OG 3.34Å
61	L	52.9	Low	53.1	Low	137 Å²	137	105.1 Å²	105.1	72%	0.717	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	4.5	176.8	-86.8	135.4	0	0	0	113.6	M57 L58 S59	M57-L61 WeakPolarHBondContact O-CD1 3.41Å; M57-L61 PolarHBondContact O-N 3.45Å; L58-L61 PolarHBondContact O-N 2.89Å; S59-L61 PolarHBondContact O-N 2.73Å
62	G	47.5	Very low	52.8	Low	70 Å²	70	99.9 Å²	99.9	72%	0.722	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.1	18.4	171.1	0	0	0	0	0	115.5	S59	S59-G62 PolarHBondContact O-N 3.42Å
63	V	53.6	Low	52.4	Low	98 Å²	98	99.3 Å²	99.3	59%	0.594	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-100.8	116.7	175.8	-176.7	0	0	0	0	109.1	L58	L58-V63 PolarHBondContact O-N 3.44Å
64	A	48.9	Very low	51.7	Low	64 Å²	64	99.2 Å²	99.2	53%	0.529	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-72.3	147.8	-177.2	0	0	0	0	0	112.5
65	P	50.8	Low	50.9	Low	80 Å²	80	99.1 Å²	99.1	52%	0.519	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-69.4	144.4	-174.7	25.7	-32	0	0	0	113.2	S67 E68	P65-S67 PolarHBondContact O-N 3.28Å; P65-E68 PolarHBondContact O-N 3.14Å; P65-E68 VanDerWaalsContact O-N 3.15Å
66	V	52.7	Low	50.1	Low	111 Å²	111	99.8 Å²	99.8	67%	0.673	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-13.8	-171.9	-178.7	0	0	0	0	114.1	E68	V66-E68 PolarHBondContact O-N 3.16Å
67	S	51.3	Low	48.9	Very low	87 Å²	87	100.5 Å²	100.5	61%	0.608	62%	0.621	S	S	*	*	H	α-helix	trans	-68.5	-26.2	175.3	51.2	0	0	0	0	114.4	P65	P65-S67 PolarHBondContact O-N 3.28Å
68	E	49.1	Very low	47.8	Very low	124 Å²	124	99.9 Å²	99.9	58%	0.579	63%	0.628	S	S	*	*	H	α-helix	trans	-83.7	-24.4	177.4	-77	-169.1	151.4	0	0	113.4	P65 V66 L70 S71 S72	P65-E68 PolarHBondContact O-N 3.14Å; P65-E68 VanDerWaalsContact O-N 3.15Å; V66-E68 PolarHBondContact O-N 3.16Å; E68-L70 VanDerWaalsContact C-N 3.33Å; E68-S71 WeakPolarHBondContact CA-OG 3.44Å; E68-S71 PolarHBondContact O-OG 3.16Å; E68-S72 PolarHBondContact O-OG 3.39Å
69	V	51.2	Low	46.6	Very low	88 Å²	88	104.6 Å²	104.6	53%	0.533	65%	0.65	S	S	.	*	H	α-helix	trans	-70.9	-34	175.7	-177.3	0	0	0	0	110.6	S72	V69-S72 WeakPolarHBondContact O-CB 3.43Å; V69-S72 PolarHBondContact O-N 3.39Å
70	L	48.7	Very low	45.4	Very low	115 Å²	115	107 Å²	107	60%	0.602	66%	0.661	S	S	*	*	H	α-helix	trans	-77.2	-25.4	179.5	-68.7	171.8	0	0	0	113.7	E68 S72	E68-L70 VanDerWaalsContact C-N 3.33Å; L70-S72 VanDerWaalsContact C-N 3.26Å; L70-S72 PolarHBondContact O-N 2.72Å
71	S	44.7	Very low	44.2	Very low	66 Å²	66	107.6 Å²	107.6	46%	0.462	67%	0.665	S	S	.	*	H	α-helix	trans	-74.2	-16.7	170.3	47.6	0	0	0	0	113.7	E68 S74	E68-S71 WeakPolarHBondContact CA-OG 3.44Å; E68-S71 PolarHBondContact O-OG 3.16Å; S71-S74 PolarHBondContact O-OG 3.02Å
72	S	46	Very low	43	Very low	88 Å²	88	108.9 Å²	108.9	62%	0.615	67%	0.673	S	S	*	*	H	α-helix	trans	-82.6	-22.8	179.4	-53	0	0	0	0	112.6	E68 V69 L70	E68-S72 PolarHBondContact O-OG 3.39Å; V69-S72 WeakPolarHBondContact O-CB 3.43Å; V69-S72 PolarHBondContact O-N 3.39Å; L70-S72 VanDerWaalsContact C-N 3.26Å; L70-S72 PolarHBondContact O-N 2.72Å
73	L	46.5	Very low	42.1	Very low	132 Å²	132	112.8 Å²	112.8	69%	0.691	68%	0.677	S	S	*	*	H	α-helix	trans	-92.6	-16.2	179.7	-82.2	147.6	0	0	0	113.5	S75	L73-S75 VanDerWaalsContact C-N 3.33Å; L73-S75 PolarHBondContact O-N 3.38Å
74	S	42.3	Very low	40.9	Very low	92 Å²	92	112.7 Å²	112.7	64%	0.643	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	4.9	-179.4	58.6	0	0	0	0	114.9	S71	S71-S74 PolarHBondContact O-OG 3.02Å
75	S	39.6	Very low	39.9	Very low	96 Å²	96	116.5 Å²	116.5	67%	0.671	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	9.6	-176.1	-56.1	0	0	0	0	114.9	L73	L73-S75 VanDerWaalsContact C-N 3.33Å; L73-S75 PolarHBondContact O-N 3.38Å
76	V	40	Very low	38.9	Very low	122 Å²	122	118 Å²	118	74%	0.739	70%	0.7	S	S	*	*	S	Bend	trans	-113.5	-9.9	-178.1	178	0	0	0	0	114.2
77	N	35.6	Very low	37.7	Very low	160 Å²	160	121.3 Å²	121.3	86%	0.856	71%	0.708	S	S	*	*			trans	-107.9	79.1	177.8	-83.9	-2.5	0	0	0	112.3
78	S	33	Very low	36.9	Very low	97 Å²	97	123.4 Å²	123.4	68%	0.678	72%	0.718	S	S	*	*			trans	-153.1	66.5	163.2	60.2	0	0	0	0	111.3
79	M	31.3	Very low	36.3	Very low	180 Å²	180	123.5 Å²	123.5	89%	0.887	73%	0.729	S	S	*	*			trans	-160.1	90.7	153.5	-83.3	-55.5	142.1	0	0	108
80	T	31.8	Very low	35	Very low	140 Å²	140	126.7 Å²	126.7	86%	0.859	74%	0.743	S	S	*	*			trans	173.6	119.1	131.7	48.4	0	0	0	0	109.4
81	S	29.9	Very low	34.1	Very low	113 Å²	113	125 Å²	125	79%	0.79	75%	0.745	S	S	*	*			trans	-99	122	164.1	52.9	0	0	0	0	107.2
82	D	28.5	Very low	33.3	Very low	163 Å²	163	127.2 Å²	127.2	87%	0.872	76%	0.761	S	S	*	*			trans	-130.1	121.9	165.8	-88.3	-34.3	0	0	0	110.9
83	N	29	Very low	32.6	Very low	153 Å²	153	131.5 Å²	131.5	82%	0.818	78%	0.776	S	S	*	*			trans	-114	129.8	170	-156.7	11.1	0	0	0	107.4
84	S	28.8	Very low	31.8	Very low	96 Å²	96	134.3 Å²	134.3	67%	0.671	79%	0.786	S	S	*	*			trans	71.3	120.9	153.8	70.7	0	0	0	0	122
85	N	27.4	Very low	31.2	Very low	143 Å²	143	134 Å²	134	77%	0.765	79%	0.789	S	S	*	*			trans	83	117	130	-87.5	-3.2	0	0	0	122.7
86	T	28.8	Very low	30.6	Very low	111 Å²	111	136.7 Å²	136.7	68%	0.681	80%	0.801	S	S	*	*			trans	63.1	110.4	132.3	62.5	0	0	0	0	118.8
87	Q	27.9	Very low	30.1	Very low	181 Å²	181	136.5 Å²	136.5	85%	0.846	80%	0.8	S	S	*	*				160.7	138.3	112.1	-86	176.8	5	0	0	110.4
88	T	35	Very low	29.8	Very low	132 Å²	132	136.5 Å²	136.5	81%	0.81	80%	0.8	S	S	*	*			trans	-51.2	155.6	165.1	46.9	0	0	0	0	112.2
89	P	35.6	Very low	29.5	Very low	126 Å²	126	135 Å²	135	82%	0.818	80%	0.801	S	S	*	*				-144.7	148.7	117.3	31.4	-13.5	0	0	0	115.7
90	D	24	Very low	29.6	Very low	154 Å²	154	135.7 Å²	135.7	82%	0.824	80%	0.802	S	S	*	*			trans	-78.2	161.7	164.8	-165.4	5.6	0	0	0	111
91	A	30.8	Very low	29.5	Very low	79 Å²	79	134.1 Å²	134.1	65%	0.653	80%	0.796	S	S	*	*			trans	51	113.8	155.1	0	0	0	0	0	121.4
92	S	28.3	Very low	29.7	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	80%	0.8	S	S	*	*				-178.6	125.1	120.2	34.5	0	0	0	0	111.2
93	L	31.4	Very low	29.7	Very low	177 Å²	177	129 Å²	129	93%	0.927	80%	0.8	S	S	*	*				-178.8	119.1	123.1	-90.8	167.2	0	0	0	109.7
94	Q	29.5	Very low	29.9	Very low	192 Å²	192	131.4 Å²	131.4	90%	0.897	80%	0.803	S	S	*	*			trans	-78.6	163.6	176.1	-78.3	-179	-18.3	0	0	112.5
95	A	29.4	Very low	30.4	Very low	86 Å²	86	136.6 Å²	136.6	71%	0.711	81%	0.813	S	S	*	*			trans	-46.8	147.4	176.4	0	0	0	0	0	116.9
96	T	26.4	Very low	31.1	Very low	151 Å²	151	138.2 Å²	138.2	93%	0.926	82%	0.816	S	S	*	*			trans	-129.3	135.5	144.1	37	0	0	0	0	109.5
97	V	30.1	Very low	31.6	Very low	118 Å²	118	137.6 Å²	137.6	72%	0.715	81%	0.814	S	S	*	*			trans	-114.6	148.1	-171.2	159.8	0	0	0	0	109
98	N	28.9	Very low	32.5	Very low	160 Å²	160	137.1 Å²	137.1	86%	0.856	82%	0.816	S	S	*	*			trans	90.7	112.6	160	-74.3	-14.8	0	0	0	120.2
99	G	27.2	Very low	32.5	Very low	67 Å²	67	138.1 Å²	138.1	69%	0.691	82%	0.817	S	S	*	*				150.7	133.7	98.8	0	0	0	0	0	115.6
100	Q	32.6	Very low	32.9	Very low	194 Å²	194	140.2 Å²	140.2	91%	0.907	82%	0.82	S	S	*	*			trans	81.1	136.9	171.6	-53.6	-177.4	6.5	0	0	116.2
101	S	29.1	Very low	33.9	Very low	107 Å²	107	137.6 Å²	137.6	75%	0.748	81%	0.814	S	S	*	*			cis	175.3	124.9	-25.8	43.6	0	0	0	0	106.4
102	G	35.5	Very low	34.9	Very low	85 Å²	85	140.7 Å²	140.7	88%	0.876	83%	0.825	S	S	*	*			trans	57.2	77	144.9	0	0	0	0	0	120.1
103	G	28.8	Very low	35.4	Very low	83 Å²	83	144.9 Å²	144.9	86%	0.856	82%	0.824	S	S	*	*			trans	-101.9	113.5	157.5	0	0	0	0	0	110.9
104	K	32.8	Very low	35.8	Very low	203 Å²	203	143.2 Å²	143.2	88%	0.883	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-58.2	137.5	-173.6	-67.9	170.2	176.9	174.9	0	113.2	Q106	K104-Q106 PolarHBondContact O-N 3.02Å
105	K	38.8	Very low	36.5	Very low	205 Å²	205	139.7 Å²	139.7	89%	0.891	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-56.4	124.9	164	-72.7	-179.1	176.5	-179.6	0	109.4
106	Q	42.1	Very low	37.1	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63.6	129.8	166.8	-73.8	-83.8	-9.4	0	0	108.9	K104	K104-Q106 PolarHBondContact O-N 3.02Å
107	P	39.7	Very low	38	Very low	99 Å²	99	140.7 Å²	140.7	64%	0.643	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.6	130.4	171.2	29.4	-30.4	0	0	0	109.4	N109	P107-N109 PolarHBondContact O-N 2.97Å; P107-N109 VanDerWaalsContact O-N 3.13Å
108	L	46.7	Very low	38.8	Very low	170 Å²	170	140.7 Å²	140.7	89%	0.89	80%	0.803	S	S	*	*			trans	-60.6	111	166.6	-78.7	138.2	0	0	0	108.5	L110	L108-L110 PolarHBondContact O-N 3.45Å
109	N	35.1	Very low	39.9	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	80%	0.8	S	S	*	*			trans	-72.9	111.5	170.7	-86.2	-20	0	0	0	109.1	P107 S111	P107-N109 PolarHBondContact O-N 2.97Å; P107-N109 VanDerWaalsContact O-N 3.13Å; N109-S111 PolarHBondContact O-N 2.72Å
110	L	44	Very low	41	Very low	171 Å²	171	143.7 Å²	143.7	90%	0.895	80%	0.802	S	S	*	*			trans	-68.5	115	161.6	-97.2	102.7	0	0	0	108.8	L108	L108-L110 PolarHBondContact O-N 3.45Å
111	S	45.8	Very low	42.1	Very low	98 Å²	98	139.1 Å²	139.1	69%	0.685	79%	0.789	S	S	*	*			trans	-89.3	122	165.4	57.1	0	0	0	0	109.5	N109 Y113	N109-S111 PolarHBondContact O-N 2.72Å; S111-Y113 PolarHBondContact O-N 3.13Å
112	V	51.8	Low	43.4	Very low	145 Å²	145	139.8 Å²	139.8	88%	0.879	79%	0.791	S	S	*	*			trans	-70.6	109.6	169.5	177.9	0	0	0	0	108
113	Y	37.3	Very low	44.2	Very low	202 Å²	202	145.4 Å²	145.4	79%	0.792	79%	0.791	S	S	*	*			trans	-85.5	125.8	167.8	-122	-92.8	0	0	0	108.3	S111 V115	S111-Y113 PolarHBondContact O-N 3.13Å; Y113-V115 PolarHBondContact O-N 3.48Å
114	N	40.2	Very low	45.1	Very low	142 Å²	142	150 Å²	150	76%	0.759	79%	0.79	S	S	*	*			trans	-75	97.9	175.2	-159.2	14.5	0	0	0	108.3	Q116	N114-Q116 PolarHBondContact O-N 3.45Å; N114-Q116 VanDerWaalsContact O-N 3.13Å
115	V	44.5	Very low	45.9	Very low	118 Å²	118	146.2 Å²	146.2	72%	0.715	79%	0.785	S	S	*	*			trans	-71.5	104.2	174.1	178.5	0	0	0	0	107.3	Y113 A117	Y113-V115 PolarHBondContact O-N 3.48Å; V115-A117 VanDerWaalsContact C-N 3.29Å; V115-A117 PolarHBondContact O-N 3.09Å
116	Q	40.8	Very low	45.9	Very low	166 Å²	166	144.2 Å²	144.2	78%	0.776	78%	0.783	S	S	*	*			trans	-70.5	92.8	164.7	-77.8	-166.8	-19.4	0	0	108.3	N114 T118	N114-Q116 PolarHBondContact O-N 3.45Å; N114-Q116 VanDerWaalsContact O-N 3.13Å; Q116-T118 PolarHBondContact O-N 3.34Å
117	A	46.5	Very low	46.2	Very low	91 Å²	91	141.3 Å²	141.3	75%	0.752	78%	0.777	S	S	*	*			trans	-66.1	97.7	166.6	0	0	0	0	0	108.3	V115 N119	V115-A117 VanDerWaalsContact C-N 3.29Å; V115-A117 PolarHBondContact O-N 3.09Å; A117-N119 PolarHBondContact O-N 2.94Å
118	T	46.9	Very low	46.4	Very low	118 Å²	118	146 Å²	146	72%	0.724	78%	0.783	S	S	*	*			trans	-81	98.1	167.1	31.3	0	0	0	0	107.5	Q116 I120	Q116-T118 PolarHBondContact O-N 3.34Å; T118-I120 PolarHBondContact O-N 3.28Å
119	N	51.7	Low	46.5	Very low	150 Å²	150	143.1 Å²	143.1	80%	0.802	77%	0.772	S	S	*	*			trans	-73.7	106.6	168.8	-163.7	-14.9	0	0	0	107.3	A117 P121	A117-N119 PolarHBondContact O-N 2.94Å; N119-P121 WeakPolarHBondContact O-CD 3.5Å
120	I	50.8	Low	46.8	Very low	141 Å²	141	143.4 Å²	143.4	72%	0.723	77%	0.766	S	S	*	*			trans	-82.5	107.7	174.8	-60.4	167.6	0	0	0	105.9	T118	T118-I120 PolarHBondContact O-N 3.28Å
121	P	55	Low	46.6	Very low	98 Å²	98	143.8 Å²	143.8	64%	0.636	76%	0.764	S	S	*	*			trans	-61.9	143.4	174.4	26.3	-32.3	0	0	0	109.2	N119 K123	N119-P121 WeakPolarHBondContact O-CD 3.5Å; P121-K123 PolarHBondContact O-N 2.98Å
122	P	56.9	Low	46.2	Very low	121 Å²	121	144.8 Å²	144.8	79%	0.786	77%	0.766	S	S	*	*			trans	-57.6	138.3	177.6	23.8	-31.9	0	0	0	109.6	E124	P122-E124 PolarHBondContact O-N 3.04Å; P122-E124 VanDerWaalsContact O-N 3.08Å
123	K	51.2	Low	45.1	Very low	203 Å²	203	146.5 Å²	146.5	88%	0.883	76%	0.764	S	S	*	*			trans	-56.1	115.7	177.7	-78.1	-177.7	174.2	-178.5	0	109.1	P121 T125	P121-K123 PolarHBondContact O-N 2.98Å; K123-T125 PolarHBondContact O-N 3.2Å; K123-T125 VanDerWaalsContact O-N 3.13Å
124	E	49.3	Very low	45	Very low	178 Å²	178	143 Å²	143	83%	0.832	76%	0.764	S	S	*	*			trans	-61.4	114.6	166	-78.1	-175.4	159.6	0	0	108.5	P122 L126	P122-E124 PolarHBondContact O-N 3.04Å; P122-E124 VanDerWaalsContact O-N 3.08Å; E124-L126 PolarHBondContact O-N 3.09Å; E124-L126 VanDerWaalsContact O-N 3.12Å
125	T	48.3	Very low	44.6	Very low	125 Å²	125	142.6 Å²	142.6	77%	0.767	77%	0.767	S	S	*	*			trans	-72.1	99.8	166	38	0	0	0	0	107.7	K123 V127	K123-T125 PolarHBondContact O-N 3.2Å; K123-T125 VanDerWaalsContact O-N 3.13Å; T125-V127 VanDerWaalsContact C-N 3.32Å; T125-V127 PolarHBondContact O-N 3.39Å
126	L	39.8	Very low	44	Very low	163 Å²	163	142.2 Å²	142.2	85%	0.853	77%	0.77	S	S	*	*			trans	-65	93.3	170.3	-78.5	161.2	0	0	0	108.9	E124 Y128	E124-L126 PolarHBondContact O-N 3.09Å; E124-L126 VanDerWaalsContact O-N 3.12Å; L126-Y128 PolarHBondContact O-N 3.2Å
127	V	48.8	Very low	43.5	Very low	115 Å²	115	141.4 Å²	141.4	70%	0.697	78%	0.776	S	S	*	*			trans	-77.4	107.5	168.4	-177.7	0	0	0	0	107.4	T125 T129	T125-V127 VanDerWaalsContact C-N 3.32Å; T125-V127 PolarHBondContact O-N 3.39Å; V127-T129 HydrophobicContact CG1-CG2 4.23Å; V127-T129 PolarHBondContact O-N 3.39Å
128	Y	42.4	Very low	42.7	Very low	197 Å²	197	140.9 Å²	140.9	77%	0.773	78%	0.779	S	S	*	*			trans	-78.2	100.4	174	-172.2	-98.5	0	0	0	109.5	L126 K130	L126-Y128 PolarHBondContact O-N 3.2Å; Y128-K130 HydrophobicContact CD1-CB 4.24Å; Y128-K130 HydrophobicContact CE1-CB 3.7Å; Y128-K130 HydrophobicContact CE1-CD 4.3Å; Y128-K130 HydrophobicContact CE1-CG 3.99Å
129	T	49.4	Very low	42	Very low	110 Å²	110	139.2 Å²	139.2	68%	0.675	79%	0.785	S	S	*	*			trans	-92.3	105.4	166.1	55.9	0	0	0	0	109.1	V127 Q131	V127-T129 HydrophobicContact CG1-CG2 4.23Å; V127-T129 PolarHBondContact O-N 3.39Å; T129-Q131 PolarHBondContact O-N 3.45Å; T129-Q131 VanDerWaalsContact O-N 3.11Å
130	K	41.2	Very low	40.8	Very low	159 Å²	159	135.5 Å²	135.5	69%	0.691	78%	0.783	S	S	*	*			trans	-75.5	95	171	-158.9	-179.8	-176.9	-179.4	0	108.8	Y128 T132	Y128-K130 HydrophobicContact CD1-CB 4.24Å; Y128-K130 HydrophobicContact CE1-CB 3.7Å; Y128-K130 HydrophobicContact CE1-CD 4.3Å; Y128-K130 HydrophobicContact CE1-CG 3.99Å; K130-T132 PolarHBondContact O-N 3.38Å
131	Q	39.3	Very low	39.8	Very low	180 Å²	180	137.3 Å²	137.3	84%	0.841	79%	0.794	S	S	*	*			trans	-82.5	104.8	166.7	-81	-173.8	-6.2	0	0	108.8	T129 Q133	T129-Q131 PolarHBondContact O-N 3.45Å; T129-Q131 VanDerWaalsContact O-N 3.11Å; Q131-Q133 PolarHBondContact O-N 3Å
132	T	36.9	Very low	38.6	Very low	118 Å²	118	136.1 Å²	136.1	72%	0.724	80%	0.8	S	S	*	*			trans	-75.1	113.8	168.7	-33.4	0	0	0	0	107.9	K130 T134	K130-T132 PolarHBondContact O-N 3.38Å; T132-T134 PolarHBondContact O-N 3.27Å
133	Q	30.3	Very low	37.1	Very low	182 Å²	182	138.3 Å²	138.3	85%	0.85	81%	0.805	S	S	*	*			trans	-81.5	108.5	-179.5	-166.4	176.8	32.8	0	0	109.5	Q131	Q131-Q133 PolarHBondContact O-N 3Å
134	T	33.8	Very low	36.1	Very low	128 Å²	128	132.6 Å²	132.6	79%	0.785	80%	0.796	S	S	*	*			trans	-126.4	123.4	162	45.8	0	0	0	0	109.5	T132	T132-T134 PolarHBondContact O-N 3.27Å
135	T	32.2	Very low	35.1	Very low	133 Å²	133	133.1 Å²	133.1	82%	0.816	80%	0.798	S	S	*	*			trans	-75.5	124.7	179	47.8	0	0	0	0	111.6
136	S	32	Very low	34	Very low	111 Å²	111	131 Å²	131	78%	0.776	79%	0.793	S	S	*	*			trans	-164.3	111.6	145.8	55.3	0	0	0	0	112.1
137	T	29.9	Very low	33.5	Very low	149 Å²	149	129 Å²	129	91%	0.914	79%	0.788	S	S	*	*			trans	-7	131	147.4	1.1	0	0	0	0	118.9
138	G	31.2	Very low	32.5	Very low	79 Å²	79	130.9 Å²	130.9	81%	0.814	79%	0.794	S	S	*	*			trans	113.7	106.2	133.9	0	0	0	0	0	119.2
139	G	30.4	Very low	32	Very low	83 Å²	83	131.9 Å²	131.9	86%	0.856	80%	0.798	S	S	*	*			trans	88.6	107.7	131	0	0	0	0	0	121.1
140	G	28.2	Very low	31.1	Very low	72 Å²	72	137.7 Å²	137.7	74%	0.742	81%	0.809	S	S	*	*				76.7	113.3	121.8	0	0	0	0	0	122.4
141	N	29	Very low	30.5	Very low	179 Å²	179	136.3 Å²	136.3	96%	0.957	81%	0.813	S	S	*	*			trans	57.8	133.1	145.1	-71.6	-1.5	0	0	0	122.7
142	G	29.1	Very low	30.2	Very low	74 Å²	74	135.9 Å²	135.9	76%	0.763	82%	0.816	S	S	*	*			trans	125.5	104.1	136.9	0	0	0	0	0	118
143	D	27.1	Very low	29.8	Very low	166 Å²	166	134.9 Å²	134.9	89%	0.888	82%	0.82	S	S	*	*			trans	21.6	142.9	143.1	-61	-29.8	0	0	0	124.5
144	A	29	Very low	29.7	Very low	84 Å²	84	136 Å²	136	69%	0.694	82%	0.822	S	S	*	*			trans	95.5	116.9	134.3	0	0	0	0	0	122.9
145	H	27.8	Very low	29.5	Very low	188 Å²	188	137.9 Å²	137.9	87%	0.87	83%	0.827	S	S	*	*			trans	68.1	120.7	132.4	-72	-65.6	0	0	0	124.7
146	A	26.9	Very low	29.4	Very low	81 Å²	81	135.7 Å²	135.7	67%	0.669	82%	0.823	S	S	*	*				85.8	136.5	119.4	0	0	0	0	0	124
147	T	28.1	Very low	29.3	Very low	122 Å²	122	140.2 Å²	140.2	75%	0.748	83%	0.832	S	S	*	*			trans	83.6	126	144.2	44.5	0	0	0	0	123.8
148	D	27.6	Very low	29.3	Very low	153 Å²	153	136.3 Å²	136.3	82%	0.818	82%	0.821	S	S	*	*			trans	83.5	130.3	132.2	-61.9	-15.3	0	0	0	124.6
149	Y	32.5	Very low	29.3	Very low	218 Å²	218	139.7 Å²	139.7	86%	0.855	82%	0.821	S	S	*	*			trans	-59.2	147.2	171	-90.3	-105	0	0	0	113.4
150	Y	31.2	Very low	29.4	Very low	232 Å²	232	142.4 Å²	142.4	91%	0.91	82%	0.816	S	S	*	*			trans	-155.4	152	140.7	-100.6	-74.1	0	0	0	113.4
151	V	28.4	Very low	29.6	Very low	130 Å²	130	147.9 Å²	147.9	79%	0.788	82%	0.822	S	S	*	*			trans	-73.4	147.9	-170	173.5	0	0	0	0	113.4
152	L	32.5	Very low	29.8	Very low	171 Å²	171	147.6 Å²	147.6	90%	0.895	82%	0.815	S	S	*	*			trans	-118	120.6	165.8	-72.8	174.6	0	0	0	110.8
153	A	29	Very low	29.9	Very low	98 Å²	98	148.6 Å²	148.6	81%	0.81	81%	0.81	S	S	*	*			trans	-78.7	146.7	173.9	0	0	0	0	0	111.4
154	F	27.3	Very low	30.1	Very low	205 Å²	205	146.6 Å²	146.6	90%	0.899	81%	0.809	S	S	*	*			trans	-103.9	125.4	173.9	-126.3	-94.2	0	0	0	107.7
155	D	29.2	Very low	30.4	Very low	167 Å²	167	150.7 Å²	150.7	89%	0.893	82%	0.819	S	S	*	*			trans	-118.8	130.6	166.3	-95.7	-26.2	0	0	0	109.4
156	A	31.5	Very low	30.7	Very low	88 Å²	88	151.3 Å²	151.3	73%	0.727	82%	0.822	S	S	*	*			trans	-103	143.9	-175.8	0	0	0	0	0	111.2
157	Q	30.5	Very low	31.1	Very low	206 Å²	206	154.8 Å²	154.8	96%	0.963	83%	0.829	S	S	*	*			trans	-173.2	127.8	160.2	-118.9	154.8	-5.2	0	0	107.3
158	G	29.1	Very low	31.3	Very low	67 Å²	67	157.4 Å²	157.4	69%	0.691	84%	0.838	S	S	*	*			cis	172.7	133.7	-1.1	0	0	0	0	0	106.3
159	D	31.8	Very low	31.4	Very low	149 Å²	149	153.2 Å²	153.2	80%	0.797	83%	0.831	S	S	*	*			trans	17.2	143.5	133.2	-65.2	-3.6	0	0	0	118.1
160	D	32.1	Very low	31.4	Very low	141 Å²	141	151 Å²	151	75%	0.754	83%	0.834	S	S	*	*			cis	-169.9	160.6	22.5	-98.1	-35.6	0	0	0	108.9
161	E	31.7	Very low	31.3	Very low	186 Å²	186	143.5 Å²	143.5	87%	0.869	83%	0.827	S	S	*	*				170.2	112.9	121.7	-84.1	-148.6	177.9	0	0	114.4
162	E	34.2	Very low	31.3	Very low	173 Å²	173	147.6 Å²	147.6	81%	0.808	84%	0.835	S	S	*	*			trans	19.2	124.5	144.4	-75	-170.1	144	0	0	125.7
163	S	30.6	Very low	31.3	Very low	96 Å²	96	144.9 Å²	144.9	67%	0.671	83%	0.825	S	S	*	*				60.2	125.9	113.7	96.9	0	0	0	0	123.1
164	S	31.1	Very low	31.6	Very low	124 Å²	124	144.8 Å²	144.8	87%	0.867	82%	0.819	S	S	*	*				172.2	125.2	125.1	-74.4	0	0	0	0	113.1
165	L	35.1	Very low	31.8	Very low	169 Å²	169	144 Å²	144	89%	0.885	82%	0.815	S	S	*	*			trans	-70	154.7	179.3	-78.5	152.4	0	0	0	115
166	Q	33.8	Very low	31.9	Very low	202 Å²	202	144 Å²	144	94%	0.944	81%	0.814	S	S	*	*				-172.3	153.8	125.8	-104.2	166.3	26.5	0	0	115
167	N	35.6	Very low	32.2	Very low	153 Å²	153	145.2 Å²	145.2	82%	0.818	81%	0.814	S	S	*	*			trans	-119	137.4	-164.5	-163.7	18.9	0	0	0	108.6
168	L	32.7	Very low	32.8	Very low	178 Å²	178	141.4 Å²	141.4	93%	0.932	81%	0.808	S	S	*	*			trans	-166.5	134.5	156.1	-135	79.6	0	0	0	112.5
169	G	28.9	Very low	32.8	Very low	65 Å²	65	141.5 Å²	141.5	67%	0.67	81%	0.808	S	S	*	*			trans	-111.3	-176.5	179.2	0	0	0	0	0	115.7
170	N	32.5	Very low	33	Very low	171 Å²	171	145.4 Å²	145.4	91%	0.914	81%	0.814	S	S	*	*			trans	94.6	99.4	160.5	-71.6	30.6	0	0	0	121.8
171	G	29.7	Very low	33.1	Very low	75 Å²	75	146.6 Å²	146.6	77%	0.773	82%	0.819	S	S	*	*				57.7	127.2	113.9	0	0	0	0	0	123.9
172	F	27.6	Very low	33.3	Very low	216 Å²	216	144.8 Å²	144.8	95%	0.947	82%	0.821	S	S	*	*			trans	-156.6	150.8	144.9	-132	-91.8	0	0	0	113.5
173	T	33.7	Very low	33.4	Very low	113 Å²	113	146.2 Å²	146.2	69%	0.693	83%	0.827	S	S	*	*			trans	-116.9	149.2	-162	59.6	0	0	0	0	114.3
174	S	34.3	Very low	33.5	Very low	97 Å²	97	144.4 Å²	144.4	68%	0.678	82%	0.823	S	S	*	*			trans	85.6	131.9	135.1	100.2	0	0	0	0	124
175	K	33.3	Very low	33.8	Very low	189 Å²	189	146.1 Å²	146.1	82%	0.822	82%	0.822	S	S	*	*			trans	91.8	95.8	141.6	-61.6	-171.7	-174.3	-171.7	0	123.2
176	L	31.2	Very low	34	Very low	167 Å²	167	144.1 Å²	144.1	87%	0.874	82%	0.819	S	S	*	*				20.5	164.3	119.1	-69.7	160.6	0	0	0	121.4
177	P	36.8	Very low	34.2	Very low	112 Å²	112	141 Å²	141	73%	0.727	81%	0.814	S	S	*	*			cis	-141.7	-143.4	-9.9	32.3	-4.7	0	0	0	113.3
178	P	42.2	Very low	34.7	Very low	127 Å²	127	139.9 Å²	139.9	83%	0.825	81%	0.812	S	S	*	*				-124.5	164.8	-75.6	36.4	-18.5	0	0	0	115.7
179	G	30.1	Very low	35.1	Very low	68 Å²	68	140.5 Å²	140.5	70%	0.701	81%	0.808	S	S	*	*			trans	168.5	100.3	163.1	0	0	0	0	0	119.2
180	Y	34.9	Very low	36	Very low	232 Å²	232	145 Å²	145	91%	0.91	82%	0.816	S	S	*	*			trans	38.5	110.1	151.4	-63.4	-83.5	0	0	0	124.3
181	L	35.8	Very low	36.9	Very low	165 Å²	165	143.2 Å²	143.2	86%	0.864	81%	0.811	S	S	*	*			trans	-7.3	138.1	148	-58.9	166.5	0	0	0	121.2
182	T	35.7	Very low	38.1	Very low	148 Å²	148	143.5 Å²	143.5	91%	0.908	81%	0.807	S	S	*	*			trans	-127.5	146.9	139.4	56.6	0	0	0	0	110.7
183	H	35.8	Very low	39.1	Very low	203 Å²	203	138.9 Å²	138.9	94%	0.94	80%	0.798	S	S	*	*			trans	-78.3	145.3	-157.4	-155.9	-86.5	0	0	0	114.9
184	G	33.4	Very low	39.7	Very low	58 Å²	58	138 Å²	138	60%	0.598	80%	0.803	S	S	*	*			trans	113.9	85.4	138	0	0	0	0	0	119.7
185	L	36.9	Very low	40.6	Very low	161 Å²	161	139.1 Å²	139.1	84%	0.843	80%	0.8	S	S	*	*				-177.2	131	126.1	-104.2	143.1	0	0	0	109.8	T187	L185-T187 PolarHBondContact O-N 3.5Å
186	P	38.5	Very low	41.5	Very low	126 Å²	126	133.7 Å²	133.7	82%	0.818	78%	0.783	S	S	*	*			trans	-79.4	112.2	-176.1	1.5	16.1	0	0	0	110.1
187	T	38.2	Very low	42.6	Very low	137 Å²	137	130.7 Å²	130.7	84%	0.84	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-94.6	122.5	164.9	37.2	0	0	0	0	109.2	L185 K189	L185-T187 PolarHBondContact O-N 3.5Å; T187-K189 PolarHBondContact O-N 2.8Å
188	V	45.8	Very low	43.4	Very low	129 Å²	129	131.6 Å²	131.6	78%	0.782	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-57	127.4	-177.6	172.5	0	0	0	0	109.6	D190	V188-D190 PolarHBondContact O-N 2.79Å
189	K	41.6	Very low	43.8	Very low	191 Å²	191	131.1 Å²	131.1	83%	0.83	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-71	121.6	164.2	-82.8	-179	173.8	179.5	0	107.8	T187 V191	T187-K189 PolarHBondContact O-N 2.8Å; K189-V191 PolarHBondContact O-N 3.18Å; K189-V191 VanDerWaalsContact O-N 3.09Å
190	D	48.7	Very low	44.7	Very low	159 Å²	159	132.4 Å²	132.4	85%	0.85	75%	0.748	S	S	*	*			trans	-59	114.5	165.4	-67.5	-36.4	0	0	0	108.5	V188 A192	V188-D190 PolarHBondContact O-N 2.79Å; D190-A192 PolarHBondContact O-N 2.96Å
191	V	50.8	Low	45.3	Very low	134 Å²	134	128.6 Å²	128.6	81%	0.812	74%	0.736	S	S	*	*			trans	-72.7	114.9	172.3	175	0	0	0	0	106.3	K189	K189-V191 PolarHBondContact O-N 3.18Å; K189-V191 VanDerWaalsContact O-N 3.09Å
192	A	55.3	Low	45.8	Very low	82 Å²	82	129.2 Å²	129.2	68%	0.678	73%	0.731	S	S	*	*			trans	-53.9	135.4	167.6	0	0	0	0	0	108.9	D190 A194	D190-A192 PolarHBondContact O-N 2.96Å; A192-A194 PolarHBondContact O-N 3.13Å
193	P	48.2	Very low	46.2	Very low	119 Å²	119	130.6 Å²	130.6	77%	0.773	73%	0.728	S	S	*	*			trans	-58.5	135.3	-174.8	23.1	-32.1	0	0	0	110.3	I195	P193-I195 PolarHBondContact O-N 3.47Å
194	A	46.2	Very low	46.6	Very low	95 Å²	95	125.2 Å²	125.2	79%	0.785	71%	0.709	S	S	*	*			trans	-61.7	111.3	175.6	0	0	0	0	0	109.3	A192 T196	A192-A194 PolarHBondContact O-N 3.13Å; A194-T196 PolarHBondContact O-N 3.45Å
195	I	52.5	Low	47.1	Very low	119 Å²	119	130.4 Å²	130.4	61%	0.61	72%	0.718	S	S	*	*			trans	-60.4	117.7	173.3	-60.1	158.5	0	0	0	107.4	P193 E199 I200	P193-I195 PolarHBondContact O-N 3.47Å; I195-E199 HydrophobicContact CG2-CB 4.39Å; I195-I200 HydrophobicContact CG2-CD1 3.96Å; I195-I200 HydrophobicContact CG2-CG1 3.63Å
196	T	52.3	Low	47.7	Very low	76 Å²	76	128.2 Å²	128.2	47%	0.466	71%	0.711	S	S	.	*			trans	-73.9	148.1	174.5	60.9	0	0	0	0	109.7	A194 L198 E199	A194-T196 PolarHBondContact O-N 3.45Å; T196-L198 PolarHBondContact O-N 2.75Å; T196-E199 PolarHBondContact O-N 2.82Å; T196-E199 VanDerWaalsContact O-N 3.11Å
197	P	55	Low	48.1	Very low	104 Å²	104	131.2 Å²	131.2	68%	0.675	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-3.5	-178.7	-21.4	31.8	0	0	0	115.4
198	L	53.5	Low	48.6	Very low	131 Å²	131	133.5 Å²	133.5	69%	0.686	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-24.4	178.4	-77.7	161.4	0	0	0	113.1	T196 K202	T196-L198 PolarHBondContact O-N 2.75Å; L198-K202 PolarHBondContact O-N 3.4Å
199	E	50.4	Low	48.6	Very low	117 Å²	117	135.5 Å²	135.5	55%	0.547	71%	0.71	S	S	.	*	H	α-helix	trans	-80.5	-34.8	173.7	-78.3	176	154.7	0	0	111.6	I195 T196 K201 K202 E203	I195-E199 HydrophobicContact CG2-CB 4.39Å; T196-E199 PolarHBondContact O-N 2.82Å; T196-E199 VanDerWaalsContact O-N 3.11Å; E199-K201 PolarHBondContact O-N 2.97Å; E199-K202 PolarHBondContact O-N 2.89Å; E199-E203 PolarHBondContact O-N 3.41Å; E199-E203 VanDerWaalsContact O-N 3.07Å
200	I	49.3	Very low	49.1	Very low	95 Å²	95	132.5 Å²	132.5	49%	0.487	71%	0.708	S	S	.	*	H	α-helix	trans	-60.4	-32.5	171.4	-60	171.4	0	0	0	110.6	I195 T204	I195-I200 HydrophobicContact CG2-CD1 3.96Å; I195-I200 HydrophobicContact CG2-CG1 3.63Å; I200-T204 WeakPolarHBondContact O-CB 3.28Å; I200-T204 PolarHBondContact O-N 3.36Å; I200-T204 VanDerWaalsContact O-N 3.12Å; I200-T204 PolarHBondContact O-OG1 2.81Å
201	K	46.8	Very low	49.6	Very low	152 Å²	152	131.4 Å²	131.4	66%	0.661	70%	0.702	S	S	*	*	H	α-helix	trans	-75	-24.2	175.2	-86.2	-175.2	175.1	-178.9	0	114.6	E199 T204	E199-K201 PolarHBondContact O-N 2.97Å; K201-T204 WeakPolarHBondContact CA-OG1 3.46Å
202	K	46.9	Very low	50	Low	177 Å²	177	133.2 Å²	133.2	77%	0.77	70%	0.701	S	S	*	*	H	α-helix	trans	-85	-29.6	176.1	-88.7	-177.7	174.4	-179.6	0	112.6	L198 E199	L198-K202 PolarHBondContact O-N 3.4Å; E199-K202 PolarHBondContact O-N 2.89Å
203	E	43.2	Very low	50.5	Low	177 Å²	177	132.8 Å²	132.8	83%	0.827	69%	0.687	S	S	*	*	H	α-helix	trans	-83.9	-13.8	171.8	-69.7	-172.9	158.7	0	0	113.3	E199	E199-E203 PolarHBondContact O-N 3.41Å; E199-E203 VanDerWaalsContact O-N 3.07Å
204	T	45.5	Very low	51.9	Low	90 Å²	90	130 Å²	130	55%	0.552	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	27.4	167.7	50.1	0	0	0	0	113.5	I200 K201 V206	I200-T204 WeakPolarHBondContact O-CB 3.28Å; I200-T204 PolarHBondContact O-N 3.36Å; I200-T204 VanDerWaalsContact O-N 3.12Å; I200-T204 PolarHBondContact O-OG1 2.81Å; K201-T204 WeakPolarHBondContact CA-OG1 3.46Å; T204-V206 PolarHBondContact O-N 3.14Å
205	E	44	Very low	53.4	Low	167 Å²	167	132.7 Å²	132.7	78%	0.78	67%	0.667	S	S	*	*	S	Bend	trans	-73.7	86.4	146.4	-81.8	-166.1	168.3	0	0	107.2	K207	E205-K207 PolarHBondContact O-N 3.43Å
206	V	48.6	Very low	54.5	Low	116 Å²	116	134 Å²	134	70%	0.703	67%	0.67	S	S	*	*			trans	-31.7	108	165.2	177.5	0	0	0	0	108.4	T204 K208	T204-V206 PolarHBondContact O-N 3.14Å; V206-K208 PolarHBondContact O-N 3Å
207	K	46.9	Very low	55.7	Low	188 Å²	188	135.4 Å²	135.4	82%	0.817	67%	0.672	S	S	*	*			trans	-49.7	104.5	150.7	-79.1	-179.6	178.8	177	0	103.5	E205 E209	E205-K207 PolarHBondContact O-N 3.43Å; K207-E209 PolarHBondContact O-N 3.21Å
208	K	50	Low	56.9	Low	186 Å²	186	134.9 Å²	134.9	81%	0.809	66%	0.659	S	S	*	*			trans	-59.6	95	166.8	-87.2	-179.3	176	176	0	103.7	V206 V210	V206-K208 PolarHBondContact O-N 3Å; K208-V210 PolarHBondContact O-N 3.35Å
209	E	45.9	Very low	58.1	Low	170 Å²	170	134.7 Å²	134.7	79%	0.794	65%	0.654	S	S	*	*			trans	-50.6	114	161.4	-66.9	-174.2	172.5	0	0	103.8	K207 N211	K207-E209 PolarHBondContact O-N 3.21Å; E209-N211 PolarHBondContact O-N 3.18Å
210	V	51.8	Low	59.6	Low	128 Å²	128	135.9 Å²	135.9	78%	0.776	66%	0.662	S	S	*	*			trans	-61.7	101	173.4	176.9	0	0	0	0	103	K208 E212	K208-V210 PolarHBondContact O-N 3.35Å; V210-E212 VanDerWaalsContact C-N 3.33Å; V210-E212 PolarHBondContact O-N 3.39Å
211	N	57.9	Low	61.1	Low	136 Å²	136	134.6 Å²	134.6	73%	0.727	66%	0.655	S	S	*	*			trans	-50.6	108.3	169.4	-101.7	7.5	0	0	0	105.3	E209 L213	E209-N211 PolarHBondContact O-N 3.18Å; N211-L213 VanDerWaalsContact C-N 3.29Å; N211-L213 PolarHBondContact O-N 2.58Å
212	E	59.3	Low	62.9	Low	172 Å²	172	132 Å²	132	80%	0.804	65%	0.647	S	S	*	*			trans	-63.3	102.1	173.6	-68.4	-169.3	167.2	0	0	105.5	V210 S214	V210-E212 VanDerWaalsContact C-N 3.33Å; V210-E212 PolarHBondContact O-N 3.39Å; E212-S214 PolarHBondContact O-N 3.19Å
213	L	65.6	Low	64.7	Low	74 Å²	74	129.4 Å²	129.4	39%	0.387	64%	0.642	S	S	.	*			trans	-52.2	133.2	175.1	-80.2	117	0	0	0	107.9	N211 Q217 K218 I221	N211-L213 VanDerWaalsContact C-N 3.29Å; N211-L213 PolarHBondContact O-N 2.58Å; L213-Q217 HydrophobicContact CB-CB 4.12Å; L213-Q217 HydrophobicContact CD2-CB 3.67Å; L213-K218 HydrophobicContact CB-CG 3.99Å; L213-K218 WeakPolarHBondContact O-CE 3.46Å; L213-K218 PolarHBondContact O-NZ 3.49Å; L213-I221 HydrophobicContact CD1-CD1 4.4Å; L213-I221 HydrophobicContact CD2-CD1 3.54Å
214	S	78.3	Confident	66.9	Low	61 Å²	61	123.4 Å²	123.4	43%	0.427	62%	0.619	S	S	.	*			trans	-48.9	145.1	172	171.4	0	0	0	0	109.5	E212 E216 Q217 K218	E212-S214 PolarHBondContact O-N 3.19Å; S214-E216 PolarHBondContact O-N 3.49Å; S214-Q217 WeakPolarHBondContact O-CA 3.21Å; S214-Q217 WeakPolarHBondContact O-CB 3.43Å; S214-Q217 PolarHBondContact O-N 2.87Å; S214-K218 PolarHBondContact O-N 3.05Å
215	E	76.6	Confident	68.6	Low	150 Å²	150	124.7 Å²	124.7	70%	0.701	62%	0.619	S	S	*	*	H	α-helix	trans	-53.6	-31.4	-179.8	-70.9	-178.5	160.8	0	0	112.5	K218 Q219	E215-K218 WeakPolarHBondContact O-CB 3.49Å; E215-K218 PolarHBondContact O-N 3.35Å; E215-Q219 WeakPolarHBondContact O-CG 3.4Å; E215-Q219 PolarHBondContact O-N 2.97Å
216	E	76.4	Confident	70.5	Confident	146 Å²	146	122.2 Å²	122.2	68%	0.682	61%	0.611	S	S	*	*	H	α-helix	trans	-67.8	-40	174.5	-61.2	177.2	173.2	0	0	112.4	S214 Q219 M220	S214-E216 PolarHBondContact O-N 3.49Å; E216-Q219 PolarHBondContact O-N 2.76Å; E216-M220 WeakPolarHBondContact O-CB 3.38Å; E216-M220 VanDerWaalsContact O-CG 3.28Å; E216-M220 WeakPolarHBondContact O-CG 3.13Å; E216-M220 PolarHBondContact O-N 2.65Å
217	Q	77.9	Confident	72.3	Confident	106 Å²	106	120.4 Å²	120.4	50%	0.495	59%	0.594	S	S	.	*	H	α-helix	trans	-70.5	-35.4	175.2	-66.5	175.8	-19	0	0	111	L213 S214 M220 I221	L213-Q217 HydrophobicContact CB-CB 4.12Å; L213-Q217 HydrophobicContact CD2-CB 3.67Å; S214-Q217 WeakPolarHBondContact O-CA 3.21Å; S214-Q217 WeakPolarHBondContact O-CB 3.43Å; S214-Q217 PolarHBondContact O-N 2.87Å; Q217-M220 PolarHBondContact O-N 3.42Å; Q217-I221 WeakPolarHBondContact O-CB 3.13Å; Q217-I221 WeakPolarHBondContact O-CD1 3.31Å; Q217-I221 WeakPolarHBondContact O-CG1 3.47Å; Q217-I221 PolarHBondContact O-N 3Å
218	K	79.6	Confident	73.9	Confident	94 Å²	94	116 Å²	116	41%	0.409	58%	0.576	S	S	.	*	H	α-helix	trans	-61.9	-46.1	171.7	-69.9	173.7	176	161.2	0	110.8	L213 S214 E215 I221 I222	L213-K218 HydrophobicContact CB-CG 3.99Å; L213-K218 WeakPolarHBondContact O-CE 3.46Å; L213-K218 PolarHBondContact O-NZ 3.49Å; S214-K218 PolarHBondContact O-N 3.05Å; E215-K218 WeakPolarHBondContact O-CB 3.49Å; E215-K218 PolarHBondContact O-N 3.35Å; K218-I221 PolarHBondContact O-N 3.22Å; K218-I222 WeakPolarHBondContact O-CB 3.36Å; K218-I222 WeakPolarHBondContact O-CD1 3.44Å; K218-I222 WeakPolarHBondContact O-CG1 3.34Å; K218-I222 PolarHBondContact O-N 3.23Å
219	Q	79.4	Confident	75.3	Confident	126 Å²	126	113.7 Å²	113.7	59%	0.589	56%	0.562	S	S	*	*	H	α-helix	trans	-62.5	-42.8	176	-74.7	178	1.5	0	0	112.2	E215 E216 I221 I222 L223	E215-Q219 WeakPolarHBondContact O-CG 3.4Å; E215-Q219 PolarHBondContact O-N 2.97Å; E216-Q219 PolarHBondContact O-N 2.76Å; Q219-I221 VanDerWaalsContact C-N 3.31Å; Q219-I221 PolarHBondContact O-N 3.34Å; Q219-I222 PolarHBondContact O-N 3.49Å; Q219-L223 WeakPolarHBondContact O-CB 3.48Å; Q219-L223 WeakPolarHBondContact O-CD1 3.46Å; Q219-L223 PolarHBondContact O-N 3.21Å
220	M	81	Confident	77.1	Confident	142 Å²	142	112 Å²	112	70%	0.7	55%	0.553	S	S	*	*	H	α-helix	trans	-62.3	-36.6	175.2	-74.3	-71.8	-81	0	0	112.6	E216 Q217 S224	E216-M220 WeakPolarHBondContact O-CB 3.38Å; E216-M220 VanDerWaalsContact O-CG 3.28Å; E216-M220 WeakPolarHBondContact O-CG 3.13Å; E216-M220 PolarHBondContact O-N 2.65Å; Q217-M220 PolarHBondContact O-N 3.42Å; M220-S224 PolarHBondContact O-N 3.3Å; M220-S224 VanDerWaalsContact O-N 3.16Å
221	I	81.9	Confident	78.7	Confident	69 Å²	69	109.3 Å²	109.3	35%	0.354	54%	0.536	S	S	.	.	H	α-helix	trans	-71.3	-40.6	174.4	-68.6	165.3	0	0	0	111	L213 Q217 K218 Q219 L223 S224 F227	L213-I221 HydrophobicContact CD1-CD1 4.4Å; L213-I221 HydrophobicContact CD2-CD1 3.54Å; Q217-I221 WeakPolarHBondContact O-CB 3.13Å; Q217-I221 WeakPolarHBondContact O-CD1 3.31Å; Q217-I221 WeakPolarHBondContact O-CG1 3.47Å; Q217-I221 PolarHBondContact O-N 3Å; K218-I221 PolarHBondContact O-N 3.22Å; Q219-I221 VanDerWaalsContact C-N 3.31Å; Q219-I221 PolarHBondContact O-N 3.34Å; I221-L223 VanDerWaalsContact C-N 3.28Å; I221-L223 PolarHBondContact O-N 3.02Å; I221-S224 WeakPolarHBondContact O-CB 3.35Å; I221-S224 PolarHBondContact O-N 3.11Å; I221-F227 HydrophobicContact CG2-CB 4.28Å; I221-F227 HydrophobicContact CG2-CD2 3.93Å; I221-F227 HydrophobicContact CG2-CE2 4.41Å; I221-F227 HydrophobicContact CG2-CG 4.01Å; I221-F227 WeakPolarHBondContact O-CB 3.41Å; I221-F227 WeakPolarHBondContact O-CG 3.38Å
222	I	83.6	Confident	79.7	Confident	96 Å²	96	106.3 Å²	106.3	49%	0.492	52%	0.522	S	S	.	.	H	α-helix	trans	-62.7	-36.6	177.1	-69.7	162.7	0	0	0	111.5	K218 Q219 S224 F227 Q228	K218-I222 WeakPolarHBondContact O-CB 3.36Å; K218-I222 WeakPolarHBondContact O-CD1 3.44Å; K218-I222 WeakPolarHBondContact O-CG1 3.34Å; K218-I222 PolarHBondContact O-N 3.23Å; Q219-I222 PolarHBondContact O-N 3.49Å; I222-S224 VanDerWaalsContact C-N 3.28Å; I222-F227 HydrophobicContact CG1-CE1 4.01Å; I222-Q228 WeakPolarHBondContact O-CG 3.44Å; I222-Q228 PolarHBondContact O-NE2 3.05Å
223	L	84.7	Confident	80.5	Confident	124 Å²	124	107.2 Å²	107.2	65%	0.649	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-14.3	174.6	-79.9	154.9	0	0	0	113.2	Q219 I221 E225	Q219-L223 WeakPolarHBondContact O-CB 3.48Å; Q219-L223 WeakPolarHBondContact O-CD1 3.46Å; Q219-L223 PolarHBondContact O-N 3.21Å; I221-L223 VanDerWaalsContact C-N 3.28Å; I221-L223 PolarHBondContact O-N 3.02Å; L223-E225 PolarHBondContact O-N 3.09Å
224	S	90.6	Very high	81.3	Confident	50 Å²	50	105.1 Å²	105.1	35%	0.35	51%	0.512	S	S	.	.			trans	-64.5	129.2	178	-172	0	0	0	0	111	M220 I221 I222 N226 F227 Q228	M220-S224 PolarHBondContact O-N 3.3Å; M220-S224 VanDerWaalsContact O-N 3.16Å; I221-S224 WeakPolarHBondContact O-CB 3.35Å; I221-S224 PolarHBondContact O-N 3.11Å; I222-S224 VanDerWaalsContact C-N 3.28Å; S224-N226 PolarHBondContact O-N 2.83Å; S224-F227 PolarHBondContact O-N 3.07Å; S224-Q228 PolarHBondContact O-N 3.06Å
225	E	81.1	Confident	81.5	Confident	118 Å²	118	103.5 Å²	103.5	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-58.7	-35	-179.8	-164.4	-174.3	173.2	0	0	112.3	L223 Q228 R229	L223-E225 PolarHBondContact O-N 3.09Å; E225-Q228 PolarHBondContact O-N 3.35Å; E225-R229 VanDerWaalsContact CD-NH2 3.26Å; E225-R229 WeakPolarHBondContact O-CB 3.27Å; E225-R229 VanDerWaalsContact O-CG 3.24Å; E225-R229 WeakPolarHBondContact O-CG 3.49Å; E225-R229 PolarHBondContact O-N 3.35Å; E225-R229 IonicContact OE1-CZ 3.07Å; E225-R229 IonicContact OE1-NE 3.56Å; E225-R229 IonicContact OE1-NH2 2.65Å; E225-R229 PolarHBondContact OE1-NH2 3.18Å; E225-R229 IonicContact OE2-NH2 2.69Å
226	N	83.6	Confident	81.3	Confident	114 Å²	114	98.5 Å²	98.5	61%	0.61	48%	0.48	S	S	*	.	H	α-helix	trans	-67.5	-38.3	177.5	-74.7	-17.2	0	0	0	112.2	S224 F230	S224-N226 PolarHBondContact O-N 2.83Å; N226-F230 PolarHBondContact O-N 3.07Å
227	F	85.4	Confident	81.3	Confident	78 Å²	78	96.1 Å²	96.1	34%	0.342	48%	0.475	S	S	.	.	H	α-helix	trans	-71.1	-41.8	177.5	-175.6	-100.6	0	0	0	110.9	I221 I222 S224 R229 F230 V231	I221-F227 HydrophobicContact CG2-CB 4.28Å; I221-F227 HydrophobicContact CG2-CD2 3.93Å; I221-F227 HydrophobicContact CG2-CE2 4.41Å; I221-F227 HydrophobicContact CG2-CG 4.01Å; I221-F227 WeakPolarHBondContact O-CB 3.41Å; I221-F227 WeakPolarHBondContact O-CG 3.38Å; I222-F227 HydrophobicContact CG1-CE1 4.01Å; S224-F227 PolarHBondContact O-N 3.07Å; F227-R229 VanDerWaalsContact C-N 3.34Å; F227-R229 PolarHBondContact O-N 3.12Å; F227-F230 PolarHBondContact O-N 3.18Å; F227-F230 VanDerWaalsContact O-N 3.14Å; F227-V231 HydrophobicContact CD1-CG2 3.84Å; F227-V231 HydrophobicContact CD2-CG2 4.42Å; F227-V231 HydrophobicContact CE1-CG2 3.45Å; F227-V231 VanDerWaalsContact CE1-CG2 3.45Å; F227-V231 HydrophobicContact CE2-CG2 4.06Å; F227-V231 HydrophobicContact CG-CG2 4.33Å; F227-V231 HydrophobicContact CZ-CG2 3.57Å; F227-V231 WeakPolarHBondContact O-CG2 3.39Å; F227-V231 PolarHBondContact O-N 3.01Å
228	Q	80.8	Confident	81.3	Confident	96 Å²	96	95.7 Å²	95.7	45%	0.449	48%	0.475	S	S	.	.	H	α-helix	trans	-59.3	-44.2	173.6	-68.6	-177.5	-3.2	0	0	111.8	I222 S224 E225 F230 V231 V232	I222-Q228 WeakPolarHBondContact O-CG 3.44Å; I222-Q228 PolarHBondContact O-NE2 3.05Å; S224-Q228 PolarHBondContact O-N 3.06Å; E225-Q228 PolarHBondContact O-N 3.35Å; Q228-F230 VanDerWaalsContact C-N 3.32Å; Q228-F230 PolarHBondContact O-N 3.41Å; Q228-V231 PolarHBondContact O-N 3.37Å; Q228-V232 WeakPolarHBondContact O-CB 3.4Å; Q228-V232 VanDerWaalsContact O-CG2 3.24Å; Q228-V232 WeakPolarHBondContact O-CG2 3.02Å; Q228-V232 PolarHBondContact O-N 3.02Å
229	R	78.9	Confident	80.9	Confident	137 Å²	137	94.8 Å²	94.8	52%	0.517	47%	0.472	S	S	.	.	H	α-helix	trans	-59.4	-42.3	174	-73.1	172.7	-172.6	177.2	2	112.1	E225 F227 R233	E225-R229 VanDerWaalsContact CD-NH2 3.26Å; E225-R229 WeakPolarHBondContact O-CB 3.27Å; E225-R229 VanDerWaalsContact O-CG 3.24Å; E225-R229 WeakPolarHBondContact O-CG 3.49Å; E225-R229 PolarHBondContact O-N 3.35Å; E225-R229 IonicContact OE1-CZ 3.07Å; E225-R229 IonicContact OE1-NE 3.56Å; E225-R229 IonicContact OE1-NH2 2.65Å; E225-R229 PolarHBondContact OE1-NH2 3.18Å; E225-R229 IonicContact OE2-NH2 2.69Å; F227-R229 VanDerWaalsContact C-N 3.34Å; F227-R229 PolarHBondContact O-N 3.12Å; R229-R233 WeakPolarHBondContact O-CB 3.23Å; R229-R233 PolarHBondContact O-N 3.07Å
230	F	84.8	Confident	80.3	Confident	136 Å²	136	92.2 Å²	92.2	60%	0.596	46%	0.457	S	S	*	.	H	α-helix	trans	-66.1	-46.9	177.7	177.8	-98.3	0	0	0	112	N226 F227 Q228 R233 A234	N226-F230 PolarHBondContact O-N 3.07Å; F227-F230 PolarHBondContact O-N 3.18Å; F227-F230 VanDerWaalsContact O-N 3.14Å; Q228-F230 VanDerWaalsContact C-N 3.32Å; Q228-F230 PolarHBondContact O-N 3.41Å; F230-R233 PolarHBondContact O-N 3.03Å; F230-A234 HydrophobicContact CE1-CB 4.37Å; F230-A234 HydrophobicContact CZ-CB 4.47Å; F230-A234 VanDerWaalsContact O-CB 3.31Å; F230-A234 WeakPolarHBondContact O-CB 3.44Å; F230-A234 PolarHBondContact O-N 3.23Å
231	V	85.1	Confident	79.7	Confident	71 Å²	71	88.5 Å²	88.5	43%	0.43	45%	0.449	S	S	.	.	H	α-helix	trans	-64.4	-40.7	179.6	172.1	0	0	0	0	111.2	F227 Q228 A234 G235	F227-V231 HydrophobicContact CD1-CG2 3.84Å; F227-V231 HydrophobicContact CD2-CG2 4.42Å; F227-V231 HydrophobicContact CE1-CG2 3.45Å; F227-V231 VanDerWaalsContact CE1-CG2 3.45Å; F227-V231 HydrophobicContact CE2-CG2 4.06Å; F227-V231 HydrophobicContact CG-CG2 4.33Å; F227-V231 HydrophobicContact CZ-CG2 3.57Å; F227-V231 WeakPolarHBondContact O-CG2 3.39Å; F227-V231 PolarHBondContact O-N 3.01Å; Q228-V231 PolarHBondContact O-N 3.37Å; V231-A234 PolarHBondContact O-N 3.25Å; V231-G235 WeakPolarHBondContact O-CA 3.31Å; V231-G235 PolarHBondContact O-N 3.29Å
232	V	78.3	Confident	79	Confident	72 Å²	72	90.8 Å²	90.8	44%	0.436	46%	0.461	S	S	.	.	H	α-helix	trans	-62.3	-46.1	174.5	170.6	0	0	0	0	110.5	Q228 G235 R236	Q228-V232 WeakPolarHBondContact O-CB 3.4Å; Q228-V232 VanDerWaalsContact O-CG2 3.24Å; Q228-V232 WeakPolarHBondContact O-CG2 3.02Å; Q228-V232 PolarHBondContact O-N 3.02Å; V232-G235 PolarHBondContact O-N 3.16Å; V232-R236 VanDerWaalsContact O-CG 3.27Å; V232-R236 WeakPolarHBondContact O-CG 3.29Å; V232-R236 PolarHBondContact O-N 2.85Å
233	R	76.9	Confident	78	Confident	191 Å²	191	87.4 Å²	87.4	72%	0.721	45%	0.446	S	S	*	.	H	α-helix	trans	-63.7	-45.8	178.2	-175	176.9	-177.6	165.2	1.7	112.5	R229 F230 R236 V237	R229-R233 WeakPolarHBondContact O-CB 3.23Å; R229-R233 PolarHBondContact O-N 3.07Å; F230-R233 PolarHBondContact O-N 3.03Å; R233-R236 PolarHBondContact O-N 2.58Å; R233-V237 WeakPolarHBondContact O-CG2 3.05Å; R233-V237 PolarHBondContact O-N 3Å
234	A	82.8	Confident	76.9	Confident	31 Å²	31	86.6 Å²	86.6	26%	0.256	44%	0.439	S	S	.	.	H	α-helix	trans	-67	-42.7	178.6	0	0	0	0	0	111.1	F230 V231 R236 V237 I238	F230-A234 HydrophobicContact CE1-CB 4.37Å; F230-A234 HydrophobicContact CZ-CB 4.47Å; F230-A234 VanDerWaalsContact O-CB 3.31Å; F230-A234 WeakPolarHBondContact O-CB 3.44Å; F230-A234 PolarHBondContact O-N 3.23Å; V231-A234 PolarHBondContact O-N 3.25Å; A234-R236 VanDerWaalsContact C-N 3.34Å; A234-R236 PolarHBondContact O-N 3.12Å; A234-V237 PolarHBondContact O-N 2.87Å; A234-I238 WeakPolarHBondContact O-CB 3.24Å; A234-I238 VanDerWaalsContact O-CG1 3.27Å; A234-I238 WeakPolarHBondContact O-CG1 3.41Å; A234-I238 PolarHBondContact O-N 3.4Å
235	G	81.2	Confident	75.4	Confident	27 Å²	27	90.3 Å²	90.3	28%	0.278	46%	0.455	S	S	.	.	H	α-helix	trans	-56.2	-46	174.5	0	0	0	0	0	111.9	V231 V232 V237 I238 E239	V231-G235 WeakPolarHBondContact O-CA 3.31Å; V231-G235 PolarHBondContact O-N 3.29Å; V232-G235 PolarHBondContact O-N 3.16Å; G235-V237 PolarHBondContact O-N 3.27Å; G235-I238 PolarHBondContact O-N 2.97Å; G235-E239 WeakPolarHBondContact O-CB 3.36Å; G235-E239 WeakPolarHBondContact O-CG 3.5Å; G235-E239 PolarHBondContact O-N 2.99Å
236	R	72.8	Confident	74.4	Confident	45 Å²	45	90.1 Å²	90.1	17%	0.17	46%	0.462	C	S	.	.	H	α-helix	trans	-58.3	-46.2	175.3	-73.9	174.4	-175	-168.6	-0.7	112.7	V232 R233 A234 I238 E239 R240 F325 E331 D332	V232-R236 VanDerWaalsContact O-CG 3.27Å; V232-R236 WeakPolarHBondContact O-CG 3.29Å; V232-R236 PolarHBondContact O-N 2.85Å; R233-R236 PolarHBondContact O-N 2.58Å; A234-R236 VanDerWaalsContact C-N 3.34Å; A234-R236 PolarHBondContact O-N 3.12Å; R236-I238 VanDerWaalsContact C-N 3.35Å; R236-I238 PolarHBondContact O-N 3.35Å; R236-E239 PolarHBondContact O-N 3.35Å; R236-R240 WeakPolarHBondContact O-CB 3.29Å; R236-R240 PolarHBondContact O-N 2.87Å; R236-F325 HydrophobicContact CB-CZ 4.26Å; R236-F325 WeakPolarHBondContact O-CE1 3.35Å; R236-F325 WeakPolarHBondContact O-CZ 3.04Å; R236-E331 PolarHBondContact NH2-O 2.75Å; R236-D332 IonicContact CZ-OD1 3.91Å; R236-D332 IonicContact CZ-OD2 2.73Å; R236-D332 IonicContact NH1-OD1 3.14Å; R236-D332 PolarHBondContact NH1-OD1 3.36Å; R236-D332 IonicContact NH1-OD2 3.97Å; R236-D332 PolarHBondContact NH1-OD2 3.02Å; R236-D332 VanDerWaalsContact NH1-OD2 3.16Å; R236-D332 IonicContact NH2-OD1 2.67Å; R236-D332 PolarHBondContact NH2-OD1 2.79Å
237	V	76	Confident	73.4	Confident	95 Å²	95	89.3 Å²	89.3	58%	0.576	46%	0.457	S	S	*	.	H	α-helix	trans	-65.2	-41	179.1	176.6	0	0	0	0	111.2	R233 A234 G235 R240 A241	R233-V237 WeakPolarHBondContact O-CG2 3.05Å; R233-V237 PolarHBondContact O-N 3Å; A234-V237 PolarHBondContact O-N 2.87Å; G235-V237 PolarHBondContact O-N 3.27Å; V237-R240 WeakPolarHBondContact O-CB 3.39Å; V237-R240 PolarHBondContact O-N 3.17Å; V237-A241 PolarHBondContact O-N 3.16Å
238	I	78.5	Confident	72.6	Confident	98 Å²	98	92.8 Å²	92.8	50%	0.503	48%	0.478	S	S	.	.	H	α-helix	trans	-67.7	-45.3	178.7	-68.5	166.2	0	0	0	110.8	A234 G235 R236 R240 A241 L242	A234-I238 WeakPolarHBondContact O-CB 3.24Å; A234-I238 VanDerWaalsContact O-CG1 3.27Å; A234-I238 WeakPolarHBondContact O-CG1 3.41Å; A234-I238 PolarHBondContact O-N 3.4Å; G235-I238 PolarHBondContact O-N 2.97Å; R236-I238 VanDerWaalsContact C-N 3.35Å; R236-I238 PolarHBondContact O-N 3.35Å; I238-R240 PolarHBondContact O-N 2.87Å; I238-A241 PolarHBondContact O-N 3.1Å; I238-L242 HydrophobicContact CG2-CD1 3.67Å; I238-L242 HydrophobicContact CG2-CG 4.3Å; I238-L242 WeakPolarHBondContact O-CB 3.39Å; I238-L242 WeakPolarHBondContact O-CG 3.24Å; I238-L242 PolarHBondContact O-N 3.01Å
239	E	71.3	Confident	72.1	Confident	75 Å²	75	98.1 Å²	98.1	35%	0.35	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-32.4	176.4	-76.9	-172.2	149.1	0	0	111.6	G235 R236 S243 F325 K327	G235-E239 WeakPolarHBondContact O-CB 3.36Å; G235-E239 WeakPolarHBondContact O-CG 3.5Å; G235-E239 PolarHBondContact O-N 2.99Å; R236-E239 PolarHBondContact O-N 3.35Å; E239-S243 PolarHBondContact O-N 2.67Å; E239-S243 VanDerWaalsContact O-N 3.16Å; E239-F325 HydrophobicContact CB-CD1 3.82Å; E239-F325 HydrophobicContact CB-CE1 3.36Å; E239-F325 HydrophobicContact CB-CZ 4.43Å; E239-K327 IonicContact OE1-NZ 2.7Å; E239-K327 PolarHBondContact OE1-NZ 3.03Å
240	R	67.8	Low	71.5	Confident	72 Å²	72	95 Å²	95	27%	0.272	49%	0.492	S	S	.	.	H	α-helix	trans	-66.9	-46.2	174.4	179.3	-177.8	174.5	129.8	0.9	110.6	R236 V237 I238 S243 E298 K324 F325	R236-R240 WeakPolarHBondContact O-CB 3.29Å; R236-R240 PolarHBondContact O-N 2.87Å; V237-R240 WeakPolarHBondContact O-CB 3.39Å; V237-R240 PolarHBondContact O-N 3.17Å; I238-R240 PolarHBondContact O-N 2.87Å; R240-S243 PolarHBondContact O-N 3.18Å; R240-S243 PolarHBondContact O-OG 3.33Å; R240-E298 IonicContact CZ-OE1 2.72Å; R240-E298 IonicContact NH1-OE1 3.58Å; R240-E298 PolarHBondContact NH1-OE1 3.17Å; R240-E298 IonicContact NH2-OE1 3.72Å; R240-E298 PolarHBondContact NH2-OE1 2.84Å; R240-E298 IonicContact NH2-OE2 3.55Å; R240-K324 HydrophobicContact CG-CD 4.29Å; R240-F325 HydrophobicContact CB-CE1 4.1Å; R240-F325 HydrophobicContact CB-CZ 4.37Å; R240-F325 VanDerWaalsContact N-CE1 3.34Å
241	A	67.2	Low	70.7	Confident	64 Å²	64	95.1 Å²	95.1	53%	0.529	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-40.5	176.4	0	0	0	0	0	112.2	V237 I238 S243 E244	V237-A241 PolarHBondContact O-N 3.16Å; I238-A241 PolarHBondContact O-N 3.1Å; A241-S243 PolarHBondContact O-N 3.05Å; A241-E244 PolarHBondContact O-N 3.37Å
242	L	68	Low	69.6	Low	117 Å²	117	102 Å²	102	61%	0.613	52%	0.518	S	S	*	.	H	α-helix	trans	-65.7	-23	177.9	-76.9	163.4	0	0	0	113.6	I238 N245	I238-L242 HydrophobicContact CG2-CD1 3.67Å; I238-L242 HydrophobicContact CG2-CG 4.3Å; I238-L242 WeakPolarHBondContact O-CB 3.39Å; I238-L242 WeakPolarHBondContact O-CG 3.24Å; I238-L242 PolarHBondContact O-N 3.01Å; L242-N245 PolarHBondContact O-ND2 3.5Å
243	S	61.6	Low	69.2	Low	25 Å²	25	106.7 Å²	106.7	18%	0.175	54%	0.539	C	S	.	.	H	α-helix	trans	-77.4	-23	178.5	71.1	0	0	0	0	113.6	E239 R240 A241 N245 K324	E239-S243 PolarHBondContact O-N 2.67Å; E239-S243 VanDerWaalsContact O-N 3.16Å; R240-S243 PolarHBondContact O-N 3.18Å; R240-S243 PolarHBondContact O-OG 3.33Å; A241-S243 PolarHBondContact O-N 3.05Å; S243-N245 VanDerWaalsContact C-N 3.31Å; S243-N245 PolarHBondContact O-N 2.93Å; S243-K324 WeakPolarHBondContact CB-O 3.34Å; S243-K324 PolarHBondContact OG-O 2.85Å; S243-K324 VanDerWaalsContact OG-O 3.1Å
244	E	62	Low	68.2	Low	107 Å²	107	100.8 Å²	100.8	50%	0.5	54%	0.538	S	S	.	.			trans	-79.1	80.6	171	-70.4	178.9	-177.5	0	0	109	A241 V246 K324	A241-E244 PolarHBondContact O-N 3.37Å; E244-V246 PolarHBondContact O-N 3.27Å; E244-K324 IonicContact OE1-NZ 3.91Å; E244-K324 PolarHBondContact OE1-NZ 3Å
245	N	58.6	Low	66.6	Low	127 Å²	127	102.1 Å²	102.1	68%	0.679	55%	0.554	S	S	*	*			trans	-81.4	68.2	169.6	-65.8	-78	0	0	0	108.7	L242 S243 D247	L242-N245 PolarHBondContact O-ND2 3.5Å; S243-N245 VanDerWaalsContact C-N 3.31Å; S243-N245 PolarHBondContact O-N 2.93Å; N245-D247 PolarHBondContact O-N 3.02Å
246	V	60.6	Low	65.2	Low	115 Å²	115	104.6 Å²	104.6	70%	0.697	58%	0.58	S	S	*	*			trans	-81.6	102.8	165.4	-179.5	0	0	0	0	106.2	E244 I248	E244-V246 PolarHBondContact O-N 3.27Å; V246-I248 HydrophobicContact CG1-CG1 4.48Å; V246-I248 PolarHBondContact O-N 2.87Å
247	D	62.5	Low	64	Low	96 Å²	96	110 Å²	110	51%	0.513	61%	0.612	S	S	.	*			trans	-76.5	95.2	176.6	-165.6	-3.5	0	0	0	109.3	N245 Y249 T250	N245-D247 PolarHBondContact O-N 3.02Å; D247-Y249 PolarHBondContact O-N 2.82Å; D247-Y249 VanDerWaalsContact OD1-CB 3.31Å; D247-Y249 WeakPolarHBondContact OD1-CB 3.37Å; D247-Y249 WeakPolarHBondContact OD1-CD2 3.47Å; D247-Y249 PolarHBondContact OD1-N 2.86Å; D247-T250 WeakPolarHBondContact O-CB 3.35Å; D247-T250 PolarHBondContact O-N 2.78Å; D247-T250 VanDerWaalsContact O-N 3.12Å; D247-T250 PolarHBondContact O-OG1 3.22Å
248	I	69.1	Low	62.8	Low	151 Å²	151	109.4 Å²	109.4	77%	0.774	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-14.2	176.7	-55.7	169.5	0	0	0	110.7	V246 T250	V246-I248 HydrophobicContact CG1-CG1 4.48Å; V246-I248 PolarHBondContact O-N 2.87Å; I248-T250 VanDerWaalsContact C-N 3.29Å
249	Y	69.3	Low	61.5	Low	209 Å²	209	112.4 Å²	112.4	82%	0.82	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	4	175.7	-57.3	-77.8	0	0	0	113.7	D247 D251	D247-Y249 PolarHBondContact O-N 2.82Å; D247-Y249 VanDerWaalsContact OD1-CB 3.31Å; D247-Y249 WeakPolarHBondContact OD1-CB 3.37Å; D247-Y249 WeakPolarHBondContact OD1-CD2 3.47Å; D247-Y249 PolarHBondContact OD1-N 2.86Å; Y249-D251 PolarHBondContact O-N 3.26Å; Y249-D251 VanDerWaalsContact O-N 3.07Å
250	T	67.9	Low	60.4	Low	71 Å²	71	117.1 Å²	117.1	44%	0.436	65%	0.646	S	S	.	*			trans	-73.8	100.8	172.7	-41.3	0	0	0	0	109	D247 I248 Y252	D247-T250 WeakPolarHBondContact O-CB 3.35Å; D247-T250 PolarHBondContact O-N 2.78Å; D247-T250 VanDerWaalsContact O-N 3.12Å; D247-T250 PolarHBondContact O-OG1 3.22Å; I248-T250 VanDerWaalsContact C-N 3.29Å; T250-Y252 WeakPolarHBondContact O-CD2 3.43Å; T250-Y252 PolarHBondContact O-N 3.44Å; T250-Y252 VanDerWaalsContact O-N 3.13Å
251	D	68	Low	59.4	Low	139 Å²	139	117.1 Å²	117.1	74%	0.743	66%	0.661	S	S	*	*			trans	-69.2	105.2	173.9	-87.5	-21.1	0	0	0	110.3	Y249 I253	Y249-D251 PolarHBondContact O-N 3.26Å; Y249-D251 VanDerWaalsContact O-N 3.07Å; D251-I253 PolarHBondContact O-N 2.95Å; D251-I253 VanDerWaalsContact O-N 3.09Å
252	Y	62	Low	58.5	Low	215 Å²	215	119.3 Å²	119.3	84%	0.843	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	6.9	174.4	-72.7	-88.9	0	0	0	114	T250	T250-Y252 WeakPolarHBondContact O-CD2 3.43Å; T250-Y252 PolarHBondContact O-N 3.44Å; T250-Y252 VanDerWaalsContact O-N 3.13Å
253	I	68.4	Low	57.5	Low	171 Å²	171	117.9 Å²	117.9	88%	0.877	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	-1.8	-174.1	-61.5	178.1	0	0	0	112.4	D251	D251-I253 PolarHBondContact O-N 2.95Å; D251-I253 VanDerWaalsContact O-N 3.09Å
254	G	56.7	Low	56.8	Low	67 Å²	67	124.7 Å²	124.7	69%	0.691	69%	0.686	S	S	*	*	S	Bend	trans	-149.4	79.7	-175.9	0	0	0	0	0	114.9
255	G	48.8	Very low	56.1	Low	58 Å²	58	128.7 Å²	128.7	60%	0.598	70%	0.697	S	S	*	*			trans	169.7	76.9	168.2	0	0	0	0	0	113.4	D257	G255-D257 PolarHBondContact O-N 3.48Å
256	G	51.5	Low	55.5	Low	79 Å²	79	125.1 Å²	125.1	81%	0.814	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	22.3	175.2	0	0	0	0	0	115.8
257	D	48	Very low	54.5	Low	160 Å²	160	127 Å²	127	86%	0.856	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.3	20.3	-177	-76.3	-17.7	0	0	0	113.1	G255	G255-D257 PolarHBondContact O-N 3.48Å
258	S	50.3	Low	54.1	Low	82 Å²	82	124.5 Å²	124.5	57%	0.573	68%	0.675	S	S	*	*			trans	-107.9	5.9	175.3	59	0	0	0	0	114.6
259	E	52.5	Low	53.8	Low	160 Å²	160	123.4 Å²	123.4	75%	0.748	66%	0.661	S	S	*	*	H	α-helix	trans	-74	-35.4	172.3	-68.7	-162.8	156.3	0	0	111.9	A261 N262 D263	E259-A261 VanDerWaalsContact C-N 3.31Å; E259-A261 PolarHBondContact O-N 3.41Å; E259-N262 PolarHBondContact O-N 3.49Å; E259-D263 PolarHBondContact O-N 2.8Å; E259-D263 VanDerWaalsContact O-N 3.11Å
260	E	47.7	Very low	54	Low	175 Å²	175	113.9 Å²	113.9	82%	0.818	62%	0.624	S	S	*	*	H	α-helix	trans	-66.5	-29.1	-179.7	-69.9	-171.2	160.8	0	0	113.5
261	A	47.5	Very low	54.3	Low	72 Å²	72	112.6 Å²	112.6	60%	0.595	62%	0.619	S	S	*	*	H	α-helix	trans	-83	-22.3	177.1	0	0	0	0	0	113.2	E259	E259-A261 VanDerWaalsContact C-N 3.31Å; E259-A261 PolarHBondContact O-N 3.41Å
262	N	47	Very low	54.9	Low	110 Å²	110	110.2 Å²	110.2	59%	0.588	61%	0.605	S	S	*	*	H	α-helix	trans	-82.1	-25.3	175.9	-144	16.6	0	0	0	111.1	E259 R265 S266	E259-N262 PolarHBondContact O-N 3.49Å; N262-R265 PolarHBondContact O-N 3.16Å; N262-S266 WeakPolarHBondContact O-CB 3.35Å; N262-S266 PolarHBondContact O-N 3.38Å; N262-S266 PolarHBondContact O-OG 2.83Å
263	D	46.8	Very low	55.5	Low	87 Å²	87	103.2 Å²	103.2	47%	0.465	58%	0.582	S	S	.	*	H	α-helix	trans	-66.9	-35.5	177.4	-85.2	-14.6	0	0	0	113.7	E259 R265 S266 H267	E259-D263 PolarHBondContact O-N 2.8Å; E259-D263 VanDerWaalsContact O-N 3.11Å; D263-R265 VanDerWaalsContact C-N 3.32Å; D263-R265 PolarHBondContact O-N 2.84Å; D263-S266 VanDerWaalsContact CA-OG 3.26Å; D263-S266 WeakPolarHBondContact CA-OG 3.42Å; D263-S266 PolarHBondContact O-N 3.2Å; D263-S266 PolarHBondContact O-OG 3.06Å; D263-H267 WeakPolarHBondContact O-CB 3.49Å; D263-H267 PolarHBondContact O-CD2 3.16Å; D263-H267 PolarHBondContact O-N 3.02Å
264	E	48.5	Very low	55.8	Low	168 Å²	168	99.1 Å²	99.1	79%	0.785	56%	0.556	S	S	*	*	H	α-helix	trans	-70.2	-29.2	177.6	-132.1	175.1	-168.3	0	0	112.7
265	R	45.5	Very low	57	Low	191 Å²	191	98.6 Å²	98.6	72%	0.721	54%	0.539	S	S	*	.	H	α-helix	trans	-81.4	-33	171.9	-74.7	-175.5	178.6	177.6	1.3	112.8	N262 D263 H267 A268	N262-R265 PolarHBondContact O-N 3.16Å; D263-R265 VanDerWaalsContact C-N 3.32Å; D263-R265 PolarHBondContact O-N 2.84Å; R265-H267 VanDerWaalsContact C-N 3.32Å; R265-A268 PolarHBondContact O-N 3.05Å
266	S	46.1	Very low	58.4	Low	52 Å²	52	96 Å²	96	36%	0.364	51%	0.512	S	S	.	.	H	α-helix	trans	-73.4	-25.9	176.6	75.6	0	0	0	0	112.1	N262 D263	N262-S266 WeakPolarHBondContact O-CB 3.35Å; N262-S266 PolarHBondContact O-N 3.38Å; N262-S266 PolarHBondContact O-OG 2.83Å; D263-S266 VanDerWaalsContact CA-OG 3.26Å; D263-S266 WeakPolarHBondContact CA-OG 3.42Å; D263-S266 PolarHBondContact O-N 3.2Å; D263-S266 PolarHBondContact O-OG 3.06Å
267	H	39.5	Very low	59.6	Low	154 Å²	154	95.6 Å²	95.6	71%	0.713	49%	0.486	S	S	*	.	H	α-helix	trans	-74	-27	170	-82.1	-62.7	0	0	0	113.6	D263 R265 R269	D263-H267 WeakPolarHBondContact O-CB 3.49Å; D263-H267 PolarHBondContact O-CD2 3.16Å; D263-H267 PolarHBondContact O-N 3.02Å; R265-H267 VanDerWaalsContact C-N 3.32Å; H267-R269 PolarHBondContact O-N 3.03Å; H267-R269 VanDerWaalsContact O-N 3.1Å
268	A	55	Low	60.8	Low	43 Å²	43	89.6 Å²	89.6	36%	0.355	45%	0.454	S	S	.	.			trans	-79.4	87.3	168.2	0	0	0	0	0	109.3	R265 L270	R265-A268 PolarHBondContact O-N 3.05Å; A268-L270 CarbonylContact O-C 3.57Å; A268-L270 PolarHBondContact O-N 3.26Å
269	R	62.9	Low	61.6	Low	129 Å²	129	92.9 Å²	92.9	49%	0.487	46%	0.46	S	S	.	.	S	Bend	trans	-49.8	-23.2	178.2	-67.9	-178.8	174.7	138.8	1.2	114.1	H267 T567 A568 A605	H267-R269 PolarHBondContact O-N 3.03Å; H267-R269 VanDerWaalsContact O-N 3.1Å; R269-T567 PolarHBondContact NH1-O 2.92Å; R269-A568 HydrophobicContact CB-CB 4Å; R269-A605 PolarHBondContact O-N 2.82Å
270	L	73.1	Confident	62.4	Low	8 Å²	8	93.3 Å²	93.3	4%	0.042	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	128.1	171.9	-76.7	162.4	0	0	0	108.2	A268 L554 L556 A568 I570 D603 V604	A268-L270 CarbonylContact O-C 3.57Å; A268-L270 PolarHBondContact O-N 3.26Å; L270-L554 HydrophobicContact CD1-CD2 4.26Å; L270-L554 HydrophobicContact CD2-CD2 4.4Å; L270-L556 HydrophobicContact CD1-CB 4.11Å; L270-L556 HydrophobicContact CD1-CD2 4.34Å; L270-L556 HydrophobicContact CD2-CD2 4.43Å; L270-L556 HydrophobicContact CG-CD2 4.3Å; L270-A568 HydrophobicContact CD1-CB 3.69Å; L270-A568 HydrophobicContact CG-CB 4.27Å; L270-I570 HydrophobicContact CB-CD1 3.23Å; L270-I570 HydrophobicContact CB-CG1 4.07Å; L270-I570 HydrophobicContact CD1-CD1 4.07Å; L270-I570 HydrophobicContact CD1-CG1 4.06Å; L270-I570 HydrophobicContact CG-CD1 4.28Å; L270-I570 WeakPolarHBondContact O-CD1 3.38Å; L270-D603 CarbonylContact C-O 3.59Å; L270-D603 WeakPolarHBondContact CA-O 3.2Å; L270-V604 HydrophobicContact CD2-CB 4.43Å; L270-V604 HydrophobicContact CD2-CG2 3.64Å
271	S	75.1	Confident	63.4	Low	45 Å²	45	86.1 Å²	86.1	32%	0.315	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	137.8	174.2	71.6	0	0	0	0	110.5	N273 Y602 D603	S271-N273 PolarHBondContact O-N 3.14Å; S271-N273 VanDerWaalsContact O-N 3.17Å; S271-Y602 CarbonylContact O-C 3.59Å; S271-Y602 WeakPolarHBondContact O-CA 3.2Å; S271-D603 PolarHBondContact N-O 3.06Å; S271-D603 PolarHBondContact O-N 3.4Å
272	L	79.2	Confident	64.3	Low	89 Å²	89	82.7 Å²	82.7	47%	0.466	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	113	175.3	178.6	67.4	0	0	0	108.2	V275 Y600 Y602	L272-V275 HydrophobicContact CD1-CG2 4.3Å; L272-V275 HydrophobicContact CD2-CG2 4.12Å; L272-Y600 HydrophobicContact CD1-CD1 4.04Å; L272-Y602 HydrophobicContact CB-CD1 4.21Å; L272-Y602 HydrophobicContact CB-CE1 3.85Å; L272-Y602 HydrophobicContact CD1-CD1 4.18Å; L272-Y602 HydrophobicContact CD1-CE1 3.73Å; L272-Y602 HydrophobicContact CD1-CE2 4.18Å; L272-Y602 HydrophobicContact CG-CE1 4.38Å
273	N	76.4	Confident	65.6	Low	67 Å²	67	82.2 Å²	82.2	36%	0.358	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-59.1	175.6	-161.8	-41.8	0	0	0	109.1	S271 V601 D603	S271-N273 PolarHBondContact O-N 3.14Å; S271-N273 VanDerWaalsContact O-N 3.17Å; N273-V601 WeakPolarHBondContact CA-O 3.5Å; N273-V601 HydrophobicContact CB-CG1 4.44Å; N273-V601 WeakPolarHBondContact CB-O 3.33Å; N273-V601 PolarHBondContact N-O 3.08Å; N273-D603 HydrophobicContact CB-CB 4.41Å
274	R	74.1	Confident	66.8	Low	85 Å²	85	81.8 Å²	81.8	32%	0.321	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	160.3	-173.5	-61.8	-176	-161	-173.9	6.1	113.7	T323 K324 F325 V601	R274-T323 PolarHBondContact NH1-O 3.32Å; R274-K324 PolarHBondContact NH1-O 3.03Å; R274-K324 VanDerWaalsContact NH1-O 3.16Å; R274-F325 PolarHBondContact NH1-O 2.65Å; R274-V601 PolarHBondContact N-O 3.4Å; R274-V601 PolarHBondContact O-N 2.9Å
275	V	81.7	Confident	68.2	Low	56 Å²	56	73.9 Å²	73.9	34%	0.339	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	120.8	168.4	-171	0	0	0	0	107.8	L272 K598 L599 Y600	L272-V275 HydrophobicContact CD1-CG2 4.3Å; L272-V275 HydrophobicContact CD2-CG2 4.12Å; V275-K598 HydrophobicContact CG1-CB 3.95Å; V275-K598 HydrophobicContact CG1-CD 4.33Å; V275-K598 HydrophobicContact CG1-CG 4.26Å; V275-L599 CarbonylContact C-O 3.52Å; V275-L599 WeakPolarHBondContact CA-O 3.42Å; V275-Y600 HydrophobicContact CB-CD1 4.26Å; V275-Y600 HydrophobicContact CB-CE1 4.28Å; V275-Y600 HydrophobicContact CG1-CD1 3.97Å; V275-Y600 HydrophobicContact CG1-CE1 3.7Å; V275-Y600 HydrophobicContact CG2-CD1 3.49Å; V275-Y600 VanDerWaalsContact CG2-CD1 3.49Å; V275-Y600 HydrophobicContact CG2-CE1 3.56Å
276	F	79.1	Confident	69.9	Low	5 Å²	5	65.8 Å²	65.8	2%	0.022	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.7	168.3	-57.4	-73.3	0	0	0	109.2	W321 N322 T323 K598 L599 V601	F276-W321 HydrophobicContact CB-CD2 3.8Å; F276-W321 HydrophobicContact CB-CE3 3.67Å; F276-W321 HydrophobicContact CB-CG 4.38Å; F276-W321 HydrophobicContact CB-CH2 4.22Å; F276-W321 HydrophobicContact CB-CZ2 4.36Å; F276-W321 HydrophobicContact CB-CZ3 3.89Å; F276-W321 HydrophobicContact CD1-CB 4.35Å; F276-W321 HydrophobicContact CD1-CD2 4.27Å; F276-W321 AromaticContact CD1-CE3 3.73Å; F276-W321 HydrophobicContact CD1-CE3 3.73Å; F276-W321 HydrophobicContact CD1-CZ3 4.37Å; F276-W321 HydrophobicContact CD2-CB 4.24Å; F276-W321 HydrophobicContact CD2-CG 4.35Å; F276-W321 HydrophobicContact CE1-CB 4.36Å; F276-W321 HydrophobicContact CE2-CB 4.18Å; F276-W321 HydrophobicContact CG-CB 4.28Å; F276-W321 AromaticContact CG-CD2 4Å; F276-W321 HydrophobicContact CG-CD2 4Å; F276-W321 AromaticContact CG-CE3 3.85Å; F276-W321 HydrophobicContact CG-CE3 3.85Å; F276-W321 HydrophobicContact CG-CG 4.21Å; F276-W321 HydrophobicContact CG-CZ3 4.47Å; F276-W321 HydrophobicContact CZ-CB 4.25Å; F276-N322 WeakPolarHBondContact CE1-O 3.43Å; F276-T323 HydrophobicContact CZ-CG2 4.3Å; F276-K598 WeakPolarHBondContact O-CA 3.45Å; F276-L599 HydrophobicContact CB-CB 4.16Å; F276-L599 HydrophobicContact CD2-CB 4.18Å; F276-L599 HydrophobicContact CD2-CD2 3.59Å; F276-L599 HydrophobicContact CD2-CG 4.4Å; F276-L599 HydrophobicContact CE2-CD2 4.01Å; F276-L599 PolarHBondContact N-O 3.34Å; F276-L599 PolarHBondContact O-N 2.89Å; F276-V601 HydrophobicContact CD2-CG2 3.92Å; F276-V601 HydrophobicContact CE2-CG2 3.31Å; F276-V601 HydrophobicContact CZ-CG2 4.17Å
277	Y	75.6	Confident	71.8	Confident	70 Å²	70	63.3 Å²	63.3	28%	0.275	30%	0.3	S	S	.	.			trans	-154.1	126	175.8	-179	-100.9	0	0	0	108.1	E279 S282 K283 S328 K598	Y277-E279 HydrophobicContact CE1-CB 4.34Å; Y277-S282 WeakPolarHBondContact CD2-OG 3.31Å; Y277-S282 VanDerWaalsContact CE2-OG 3.29Å; Y277-S282 WeakPolarHBondContact CE2-OG 3.45Å; Y277-K283 WeakPolarHBondContact OH-CB 3.47Å; Y277-S328 WeakPolarHBondContact O-CB 3.48Å; Y277-S328 PolarHBondContact O-OG 2.92Å; Y277-K598 HydrophobicContact CD2-CD 4.47Å; Y277-K598 HydrophobicContact CD2-CG 3.54Å; Y277-K598 HydrophobicContact CE2-CG 4.32Å; Y277-K598 HydrophobicContact CG-CG 4.16Å
278	D	72.4	Confident	73.9	Confident	33 Å²	33	56.8 Å²	56.8	18%	0.176	27%	0.271	C	S	.	.			trans	-114.3	121.3	170.7	-172	-6.4	0	0	0	109.7	R280 W281 S282 M319 W321 P330	D278-R280 PolarHBondContact O-N 2.74Å; D278-R280 VanDerWaalsContact O-N 3.16Å; D278-R280 PolarHBondContact OD1-N 3.02Å; D278-W281 PolarHBondContact O-N 2.83Å; D278-S282 VanDerWaalsContact C-OG 3.27Å; D278-S282 PolarHBondContact N-OG 2.9Å; D278-S282 WeakPolarHBondContact O-CB 3.48Å; D278-S282 PolarHBondContact O-N 3.23Å; D278-S282 PolarHBondContact O-OG 2.83Å; D278-M319 HydrophobicContact CB-CE 4.06Å; D278-W321 HydrophobicContact CB-CH2 3.99Å; D278-P330 VanDerWaalsContact OD2-CD 3.31Å; D278-P330 WeakPolarHBondContact OD2-CD 3.46Å
279	E	67.9	Low	75.2	Confident	152 Å²	152	54.9 Å²	54.9	71%	0.71	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.5	-175.2	-170.2	173.8	-174.2	0	0	112.9	Y277	Y277-E279 HydrophobicContact CE1-CB 4.34Å
280	R	69.7	Low	76.4	Confident	168 Å²	168	49.5 Å²	49.5	63%	0.634	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-40.5	-179.7	-173.7	173.7	-179.2	174.4	3.2	113.4	D278	D278-R280 PolarHBondContact O-N 2.74Å; D278-R280 VanDerWaalsContact O-N 3.16Å; D278-R280 PolarHBondContact OD1-N 3.02Å
281	W	67.8	Low	77	Confident	24 Å²	24	51.1 Å²	51.1	9%	0.091	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-19.9	-168.1	-61	106.4	0	0	0	114.3	D278 R285 V317 M319 V333 H335	D278-W281 PolarHBondContact O-N 2.83Å; W281-R285 WeakPolarHBondContact O-CD 3.39Å; W281-R285 PolarHBondContact O-NH1 3.25Å; W281-V317 HydrophobicContact CE3-CG2 4.22Å; W281-M319 HydrophobicContact CB-CE 3.6Å; W281-M319 HydrophobicContact CB-SD 3.92Å; W281-M319 HydrophobicContact CG-CE 4.35Å; W281-V333 HydrophobicContact CD2-CG1 4.16Å; W281-V333 HydrophobicContact CE3-CG1 4.47Å; W281-V333 HydrophobicContact CG-CG1 4.36Å; W281-H335 AromaticContact CH2-CD2 3.89Å; W281-H335 AromaticContact CH2-NE2 3.43Å; W281-H335 WeakPolarHBondContact CH2-NE2 3.37Å; W281-H335 AromaticContact CZ2-NE2 3.91Å; W281-H335 AromaticContact CZ3-CD2 3.96Å; W281-H335 AromaticContact CZ3-NE2 3.86Å
282	S	67.3	Low	77.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-9	-176	71.7	0	0	0	0	114.2	Y277 D278 N284 R285 G597	Y277-S282 WeakPolarHBondContact CD2-OG 3.31Å; Y277-S282 VanDerWaalsContact CE2-OG 3.29Å; Y277-S282 WeakPolarHBondContact CE2-OG 3.45Å; D278-S282 VanDerWaalsContact C-OG 3.27Å; D278-S282 PolarHBondContact N-OG 2.9Å; D278-S282 WeakPolarHBondContact O-CB 3.48Å; D278-S282 PolarHBondContact O-N 3.23Å; D278-S282 PolarHBondContact O-OG 2.83Å; S282-N284 PolarHBondContact O-N 2.85Å; S282-R285 PolarHBondContact O-N 3.03Å; S282-G597 WeakPolarHBondContact CB-O 3.04Å
283	K	73.3	Confident	77.7	Confident	101 Å²	101	45.1 Å²	45.1	44%	0.439	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	121.4	-179.7	-171.6	177.5	177.9	-173.7	0	110.8	Y277 R285	Y277-K283 WeakPolarHBondContact OH-CB 3.47Å; K283-R285 PolarHBondContact O-N 2.81Å
284	N	72.8	Confident	77.6	Confident	78 Å²	78	45 Å²	45	42%	0.417	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	32.2	177.4	-68.3	-10.3	0	0	0	114.2	S282 N307 E309	S282-N284 PolarHBondContact O-N 2.85Å; N284-N307 PolarHBondContact O-OD1 3.4Å; N284-E309 PolarHBondContact ND2-OE2 2.88Å
285	R	78	Confident	77.8	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.008	22%	0.216	C	C	.	.			trans	-113.3	111.4	168	-67.6	-169.5	177.2	132.2	3.3	110.1	W281 S282 K283 Y304 H305 N307 E313 E595 G597	W281-R285 WeakPolarHBondContact O-CD 3.39Å; W281-R285 PolarHBondContact O-NH1 3.25Å; S282-R285 PolarHBondContact O-N 3.03Å; K283-R285 PolarHBondContact O-N 2.81Å; R285-Y304 HydrophobicContact CB-CD1 3.82Å; R285-Y304 HydrophobicContact CB-CG 4.36Å; R285-Y304 WeakPolarHBondContact O-CD1 3.27Å; R285-H305 WeakPolarHBondContact CD-O 3.47Å; R285-N307 HydrophobicContact CG-CB 3.89Å; R285-E313 IonicContact CZ-OE2 2.64Å; R285-E313 IonicContact NH1-OE2 3.39Å; R285-E313 IonicContact NH2-OE2 3.15Å; R285-E313 PolarHBondContact NH2-OE2 2.88Å; R285-E595 CarbonylContact C-O 3.54Å; R285-G597 WeakPolarHBondContact O-CA 3.46Å; R285-G597 PolarHBondContact O-N 3.11Å
286	C	80.8	Confident	77.5	Confident	21 Å²	21	46.7 Å²	46.7	14%	0.142	22%	0.217	C	C	.	.			trans	-53.8	135.6	166.1	100.5	0	0	0	0	112.8	Y304 H305 E595	C286-Y304 WeakPolarHBondContact O-CA 3.46Å; C286-H305 WeakPolarHBondContact CA-CD2 3.36Å; C286-H305 WeakPolarHBondContact CB-CD2 3.47Å; C286-H305 WeakPolarHBondContact CB-NE2 3.32Å; C286-H305 PolarHBondContact N-CD2 3.44Å; C286-H305 PolarHBondContact N-NE2 2.85Å; C286-H305 PolarHBondContact O-CD2 3.11Å; C286-H305 VanDerWaalsContact O-CD2 3.23Å; C286-H305 PolarHBondContact O-N 2.88Å; C286-H305 PolarHBondContact SG-CD2 3.3Å; C286-E595 WeakPolarHBondContact CA-O 3.34Å; C286-E595 HydrophobicContact CB-CB 4.5Å; C286-E595 HydrophobicContact CB-CG 4.07Å; C286-E595 PolarHBondContact N-O 2.72Å
287	I	86.6	Confident	77.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.5	170.2	-65.6	165.8	0	0	0	107.7	M290 S303 Y304 N579 D594 K598 L599	I287-M290 HydrophobicContact CG2-CG 3.66Å; I287-M290 HydrophobicContact CG2-SD 4.19Å; I287-S303 CarbonylContact C-O 3.59Å; I287-S303 VanDerWaalsContact CA-O 3.32Å; I287-S303 WeakPolarHBondContact CA-O 3.36Å; I287-Y304 HydrophobicContact CD1-CE1 4.01Å; I287-Y304 HydrophobicContact CG1-CD1 3.91Å; I287-Y304 HydrophobicContact CG1-CE1 3.48Å; I287-Y304 VanDerWaalsContact CG1-CE1 3.48Å; I287-N579 WeakPolarHBondContact O-CB 3.43Å; I287-N579 PolarHBondContact O-ND2 3.09Å; I287-D594 PolarHBondContact N-O 2.95Å; I287-D594 VanDerWaalsContact N-O 3.14Å; I287-K598 WeakPolarHBondContact CD1-O 3.44Å; I287-L599 HydrophobicContact CD1-CB 4.01Å
288	T	83	Confident	77.2	Confident	16 Å²	16	46.3 Å²	46.3	10%	0.098	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-31.9	-176.7	49.1	0	0	0	0	112.9	S303 H305 V340 M341 R580	T288-S303 PolarHBondContact N-O 3.34Å; T288-S303 PolarHBondContact OG1-O 2.68Å; T288-S303 PolarHBondContact OG1-OG 3.09Å; T288-H305 HydrophobicContact CG2-CB 3.79Å; T288-V340 PolarHBondContact OG1-O 3.08Å; T288-M341 HydrophobicContact CG2-SD 4.47Å; T288-R580 WeakPolarHBondContact O-CG 3.38Å; T288-R580 PolarHBondContact O-NE 3.07Å; T288-R580 PolarHBondContact O-NH2 2.79Å
289	S	82.5	Confident	77.8	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	154.3	177.4	75.1	0	0	0	0	110.7	S303 S342 T343	S289-S303 WeakPolarHBondContact CB-OG 3.17Å; S289-S303 PolarHBondContact N-OG 3.39Å; S289-S303 PolarHBondContact O-N 3.1Å; S289-S303 PolarHBondContact O-OG 3.45Å; S289-S303 PolarHBondContact OG-OG 3.32Å; S289-S342 VanDerWaalsContact OG-CA 3.3Å; S289-S342 WeakPolarHBondContact OG-CA 3.21Å; S289-T343 PolarHBondContact OG-N 2.64Å
290	M	87.3	Confident	78.7	Confident	17 Å²	17	38.1 Å²	38.1	8%	0.084	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	143	174.3	-62.2	-176.1	-66.1	0	0	109.7	I287 V301 R580 C591 L599	I287-M290 HydrophobicContact CG2-CG 3.66Å; I287-M290 HydrophobicContact CG2-SD 4.19Å; M290-V301 VanDerWaalsContact CA-O 3.22Å; M290-V301 WeakPolarHBondContact CA-O 3.39Å; M290-R580 HydrophobicContact CE-CB 3.75Å; M290-R580 WeakPolarHBondContact CE-O 3.4Å; M290-C591 HydrophobicContact SD-CB 4.44Å; M290-L599 HydrophobicContact CG-CD1 4.3Å; M290-L599 HydrophobicContact SD-CD1 3.52Å; M290-L599 VanDerWaalsContact SD-CD1 3.52Å; M290-L599 HydrophobicContact SD-CG 3.85Å
291	D	86.4	Confident	79.5	Confident	42 Å²	42	30.1 Å²	30.1	23%	0.225	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	151.6	173.4	-166.4	22.9	0	0	0	111	V301 C344 F345	D291-V301 PolarHBondContact N-O 2.88Å; D291-V301 PolarHBondContact O-N 3.34Å; D291-C344 VanDerWaalsContact OD2-CA 3.26Å; D291-C344 WeakPolarHBondContact OD2-CA 3.3Å; D291-C344 PolarHBondContact OD2-SG 3.13Å; D291-F345 PolarHBondContact OD2-N 3.43Å
292	W	86.3	Confident	80.3	Confident	8 Å²	8	29 Å²	29	3%	0.03	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	145.9	179.6	-73.3	98.4	0	0	0	111.4	P297 L299 V300 T323 S582 W583 T584 P585 C591	W292-P297 VanDerWaalsContact CE3-O 3.3Å; W292-P297 WeakPolarHBondContact CZ3-O 3.46Å; W292-L299 VanDerWaalsContact CE3-O 3.32Å; W292-V300 HydrophobicContact CD2-CB 3.91Å; W292-V300 HydrophobicContact CD2-CG2 4.08Å; W292-V300 HydrophobicContact CE3-CB 3.7Å; W292-V300 HydrophobicContact CE3-CG2 4.38Å; W292-V300 HydrophobicContact CH2-CB 3.94Å; W292-V300 HydrophobicContact CH2-CG1 4.36Å; W292-V300 HydrophobicContact CZ2-CB 4.2Å; W292-V300 HydrophobicContact CZ2-CG2 4.33Å; W292-V300 HydrophobicContact CZ3-CB 3.69Å; W292-V300 HydrophobicContact CZ3-CG1 4.34Å; W292-T323 HydrophobicContact CH2-CG2 3.62Å; W292-T323 HydrophobicContact CZ3-CG2 3.86Å; W292-S582 VanDerWaalsContact CD1-OG 3.25Å; W292-S582 PolarHBondContact NE1-O 2.68Å; W292-W583 PolarHBondContact NE1-O 2.75Å; W292-T584 HydrophobicContact CD2-CG2 4.12Å; W292-T584 HydrophobicContact CE3-CG2 4.17Å; W292-T584 HydrophobicContact CH2-CG2 3.4Å; W292-T584 HydrophobicContact CZ2-CG2 3.23Å; W292-T584 HydrophobicContact CZ3-CG2 3.87Å; W292-P585 HydrophobicContact CB-CG 4.23Å; W292-C591 HydrophobicContact CZ2-CB 3.99Å; W292-C591 WeakPolarHBondContact CZ2-SG 3.46Å
293	S	83.5	Confident	81.2	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.			trans	-76.1	129.3	169.1	-172.1	0	0	0	0	110.4	H295 F296 L299	S293-H295 VanDerWaalsContact C-N 3.32Å; S293-F296 WeakPolarHBondContact CB-O 3.31Å; S293-F296 CarbonylContact O-C 3.58Å; S293-F296 PolarHBondContact OG-N 3.03Å; S293-L299 PolarHBondContact N-O 2.92Å
294	T	74.6	Confident	81.7	Confident	65 Å²	65	24.2 Å²	24.2	40%	0.399	13%	0.129	S	C	.	.	S	Bend	trans	-73.3	-24.5	174.8	50.5	0	0	0	0	113	K347	T294-K347 HydrophobicContact CG2-CG 4.31Å; T294-K347 PolarHBondContact OG1-O 3.47Å
295	H	76.9	Confident	82.1	Confident	93 Å²	93	22.4 Å²	22.4	43%	0.431	12%	0.118	S	C	.	.	S	Bend	trans	-86.1	-33.8	179.2	-74.3	-64.7	0	0	0	112.6	S293 K347 F348 P350	S293-H295 VanDerWaalsContact C-N 3.32Å; H295-K347 PolarHBondContact CD2-O 2.77Å; H295-K347 PolarHBondContact NE2-O 3.34Å; H295-F348 PolarHBondContact NE2-O 3.13Å; H295-P350 HydrophobicContact CB-CB 3.97Å
296	F	75.4	Confident	81.9	Confident	82 Å²	82	25.4 Å²	25.4	36%	0.36	13%	0.134	S	C	.	.			trans	-126.7	87.6	-177.8	-69.3	-56.2	0	0	0	108	S293 E298 L299 P350	S293-F296 WeakPolarHBondContact CB-O 3.31Å; S293-F296 CarbonylContact O-C 3.58Å; S293-F296 PolarHBondContact OG-N 3.03Å; F296-E298 VanDerWaalsContact CB-OE1 3.26Å; F296-E298 WeakPolarHBondContact CB-OE1 3.04Å; F296-E298 WeakPolarHBondContact CD1-OE1 3.11Å; F296-E298 PolarHBondContact O-N 3.01Å; F296-L299 HydrophobicContact CB-CB 4.3Å; F296-L299 HydrophobicContact CB-CD1 3.75Å; F296-L299 HydrophobicContact CB-CG 3.89Å; F296-L299 HydrophobicContact CD2-CD1 4.04Å; F296-L299 HydrophobicContact CG-CD1 4.18Å; F296-L299 PolarHBondContact O-N 3.37Å; F296-P350 HydrophobicContact CD2-CB 3.94Å; F296-P350 HydrophobicContact CE2-CB 3.75Å; F296-P350 HydrophobicContact CE2-CG 4.27Å
297	P	71.8	Confident	81.3	Confident	56 Å²	56	25.7 Å²	25.7	36%	0.364	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-10.4	-174.6	27.9	-35.9	0	0	0	113.1	W292	W292-P297 VanDerWaalsContact CE3-O 3.3Å; W292-P297 WeakPolarHBondContact CZ3-O 3.46Å
298	E	77.9	Confident	80.2	Confident	12 Å²	12	34 Å²	34	6%	0.056	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-15.9	171.3	66.3	-78.2	-179.4	0	0	115.1	R240 F296 N322 T323 K324	R240-E298 IonicContact CZ-OE1 2.72Å; R240-E298 IonicContact NH1-OE1 3.58Å; R240-E298 PolarHBondContact NH1-OE1 3.17Å; R240-E298 IonicContact NH2-OE1 3.72Å; R240-E298 PolarHBondContact NH2-OE1 2.84Å; R240-E298 IonicContact NH2-OE2 3.55Å; F296-E298 VanDerWaalsContact CB-OE1 3.26Å; F296-E298 WeakPolarHBondContact CB-OE1 3.04Å; F296-E298 WeakPolarHBondContact CD1-OE1 3.11Å; F296-E298 PolarHBondContact O-N 3.01Å; E298-N322 CarbonylContact O-C 3.57Å; E298-N322 WeakPolarHBondContact O-CA 3.36Å; E298-T323 VanDerWaalsContact CA-OG1 3.3Å; E298-T323 WeakPolarHBondContact CA-OG1 3.46Å; E298-T323 WeakPolarHBondContact CB-OG1 3.37Å; E298-T323 PolarHBondContact O-N 2.94Å; E298-T323 PolarHBondContact O-OG1 2.85Å; E298-K324 HydrophobicContact CB-CD 4.35Å; E298-K324 HydrophobicContact CB-CG 3.94Å; E298-K324 HydrophobicContact CG-CD 4.44Å; E298-K324 HydrophobicContact CG-CG 4.42Å
299	L	84.3	Confident	79	Confident	13 Å²	13	39.1 Å²	39.1	7%	0.068	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	118.8	-177.3	-64.3	-179.8	0	0	0	110.7	W292 S293 F296 V320 W321 N322 E331 F345	W292-L299 VanDerWaalsContact CE3-O 3.32Å; S293-L299 PolarHBondContact N-O 2.92Å; F296-L299 HydrophobicContact CB-CB 4.3Å; F296-L299 HydrophobicContact CB-CD1 3.75Å; F296-L299 HydrophobicContact CB-CG 3.89Å; F296-L299 HydrophobicContact CD2-CD1 4.04Å; F296-L299 HydrophobicContact CG-CD1 4.18Å; F296-L299 PolarHBondContact O-N 3.37Å; L299-V320 HydrophobicContact CB-CG1 4.49Å; L299-V320 HydrophobicContact CD2-CG1 4.06Å; L299-W321 WeakPolarHBondContact CA-O 3.2Å; L299-N322 HydrophobicContact CD2-CB 3.95Å; L299-E331 WeakPolarHBondContact CD2-OE2 3.04Å; L299-F345 HydrophobicContact CB-CZ 4.3Å
300	V	86.7	Confident	77.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137.1	170.3	63.9	0	0	0	0	109.2	W292 W321 L599	W292-V300 HydrophobicContact CD2-CB 3.91Å; W292-V300 HydrophobicContact CD2-CG2 4.08Å; W292-V300 HydrophobicContact CE3-CB 3.7Å; W292-V300 HydrophobicContact CE3-CG2 4.38Å; W292-V300 HydrophobicContact CH2-CB 3.94Å; W292-V300 HydrophobicContact CH2-CG1 4.36Å; W292-V300 HydrophobicContact CZ2-CB 4.2Å; W292-V300 HydrophobicContact CZ2-CG2 4.33Å; W292-V300 HydrophobicContact CZ3-CB 3.69Å; W292-V300 HydrophobicContact CZ3-CG1 4.34Å; V300-W321 HydrophobicContact CG1-CB 3.63Å; V300-W321 HydrophobicContact CG1-CG 4.38Å; V300-W321 PolarHBondContact N-O 2.8Å; V300-W321 PolarHBondContact O-N 2.77Å; V300-L599 HydrophobicContact CG1-CD1 4.4Å; V300-L599 HydrophobicContact CG1-CD2 4.49Å; V300-L599 HydrophobicContact CG2-CD1 4.4Å
301	V	86.6	Confident	76.6	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.2	171.8	164.3	0	0	0	0	109.1	M290 D291 V318 M319 V320 T343 F345 I353	M290-V301 VanDerWaalsContact CA-O 3.22Å; M290-V301 WeakPolarHBondContact CA-O 3.39Å; D291-V301 PolarHBondContact N-O 2.88Å; D291-V301 PolarHBondContact O-N 3.34Å; V301-V318 HydrophobicContact CG1-CG1 3.43Å; V301-V318 VanDerWaalsContact CG1-CG1 3.43Å; V301-M319 WeakPolarHBondContact CA-O 3.42Å; V301-V320 HydrophobicContact CG2-CB 4.1Å; V301-V320 HydrophobicContact CG2-CG1 4.19Å; V301-V320 HydrophobicContact CG2-CG2 3.56Å; V301-T343 HydrophobicContact CB-CG2 4.38Å; V301-T343 HydrophobicContact CG1-CG2 3.24Å; V301-F345 HydrophobicContact CB-CD2 4.17Å; V301-F345 HydrophobicContact CB-CE2 3.54Å; V301-F345 HydrophobicContact CB-CZ 4.02Å; V301-F345 HydrophobicContact CG2-CD2 4.08Å; V301-F345 HydrophobicContact CG2-CE1 3.94Å; V301-F345 HydrophobicContact CG2-CE2 3.16Å; V301-F345 HydrophobicContact CG2-CZ 3.09Å; V301-I353 HydrophobicContact CG1-CG2 4.45Å; V301-I353 HydrophobicContact CG2-CD1 4.19Å
302	G	84.8	Confident	75.5	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.6	169.4	0	0	0	0	0	110.4	M319	G302-M319 PolarHBondContact N-O 3.19Å; G302-M319 PolarHBondContact O-N 2.78Å
303	S	85.4	Confident	74.6	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	136.2	167.2	61.7	0	0	0	0	110.7	I287 T288 S289 T343	I287-S303 CarbonylContact C-O 3.59Å; I287-S303 VanDerWaalsContact CA-O 3.32Å; I287-S303 WeakPolarHBondContact CA-O 3.36Å; T288-S303 PolarHBondContact N-O 3.34Å; T288-S303 PolarHBondContact OG1-O 2.68Å; T288-S303 PolarHBondContact OG1-OG 3.09Å; S289-S303 WeakPolarHBondContact CB-OG 3.17Å; S289-S303 PolarHBondContact N-OG 3.39Å; S289-S303 PolarHBondContact O-N 3.1Å; S289-S303 PolarHBondContact O-OG 3.45Å; S289-S303 PolarHBondContact OG-OG 3.32Å; S303-T343 WeakPolarHBondContact CB-OG1 3.35Å
304	Y	84.8	Confident	73.9	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.2	179.9	-65.9	-91.5	0	0	0	109.6	R285 C286 I287 V317 M319 W321 G597	R285-Y304 HydrophobicContact CB-CD1 3.82Å; R285-Y304 HydrophobicContact CB-CG 4.36Å; R285-Y304 WeakPolarHBondContact O-CD1 3.27Å; C286-Y304 WeakPolarHBondContact O-CA 3.46Å; I287-Y304 HydrophobicContact CD1-CE1 4.01Å; I287-Y304 HydrophobicContact CG1-CD1 3.91Å; I287-Y304 HydrophobicContact CG1-CE1 3.48Å; I287-Y304 VanDerWaalsContact CG1-CE1 3.48Å; Y304-V317 WeakPolarHBondContact CB-O 3.23Å; Y304-V317 PolarHBondContact N-O 3.01Å; Y304-V317 PolarHBondContact O-N 2.69Å; Y304-M319 HydrophobicContact CD2-CB 4.32Å; Y304-M319 HydrophobicContact CD2-CG 3.72Å; Y304-M319 HydrophobicContact CD2-SD 3.62Å; Y304-M319 HydrophobicContact CE1-SD 4.44Å; Y304-M319 HydrophobicContact CE2-CB 3.74Å; Y304-M319 HydrophobicContact CE2-CG 3.5Å; Y304-M319 HydrophobicContact CE2-SD 3.23Å; Y304-M319 WeakPolarHBondContact CE2-SD 3.35Å; Y304-M319 HydrophobicContact CG-SD 4.39Å; Y304-W321 HydrophobicContact CE2-CZ2 4.44Å; Y304-W321 WeakPolarHBondContact OH-CZ2 3.3Å; Y304-W321 PolarHBondContact OH-NE1 2.77Å; Y304-W321 VanDerWaalsContact OH-NE1 3.16Å; Y304-G597 WeakPolarHBondContact CE1-O 3.38Å
305	H	80.4	Confident	73.7	Confident	40 Å²	40	55.9 Å²	55.9	19%	0.185	29%	0.293	C	S	.	.			trans	-76.4	-175.9	173.1	85.3	115.1	0	0	0	112.5	R285 C286 T288 D315	R285-H305 WeakPolarHBondContact CD-O 3.47Å; C286-H305 WeakPolarHBondContact CA-CD2 3.36Å; C286-H305 WeakPolarHBondContact CB-CD2 3.47Å; C286-H305 WeakPolarHBondContact CB-NE2 3.32Å; C286-H305 PolarHBondContact N-CD2 3.44Å; C286-H305 PolarHBondContact N-NE2 2.85Å; C286-H305 PolarHBondContact O-CD2 3.11Å; C286-H305 VanDerWaalsContact O-CD2 3.23Å; C286-H305 PolarHBondContact O-N 2.88Å; C286-H305 PolarHBondContact SG-CD2 3.3Å; T288-H305 HydrophobicContact CG2-CB 3.79Å; H305-D315 CarbonylContact C-O 3.55Å
306	N	73.4	Confident	73.6	Confident	66 Å²	66	51.5 Å²	51.5	35%	0.353	27%	0.273	S	S	.	.			trans	-65.1	136.6	178.3	61.2	-32.9	0	0	0	112.3	D315 A339	N306-D315 WeakPolarHBondContact CA-O 3.41Å; N306-D315 HydrophobicContact CB-CB 4.42Å; N306-D315 WeakPolarHBondContact CB-O 3.25Å; N306-D315 PolarHBondContact N-O 2.93Å; N306-D315 VanDerWaalsContact N-O 3.09Å; N306-A339 HydrophobicContact CB-CB 4.49Å
307	N	68.4	Low	74	Confident	27 Å²	27	47.6 Å²	47.6	14%	0.144	26%	0.256	C	S	.	.			trans	-86.7	123.2	169.8	-171.5	7.3	0	0	0	109.4	N284 R285 E309 S310	N284-N307 PolarHBondContact O-OD1 3.4Å; R285-N307 HydrophobicContact CG-CB 3.89Å; N307-E309 VanDerWaalsContact C-N 3.29Å; N307-E309 WeakPolarHBondContact OD1-CB 3.43Å; N307-E309 PolarHBondContact OD1-N 3.34Å; N307-S310 PolarHBondContact ND2-OG 3.49Å
308	E	63	Low	74.7	Confident	173 Å²	173	44.9 Å²	44.9	81%	0.808	24%	0.238	S	C	*	.	S	Bend	trans	-74.9	-19.4	173.8	-64.9	-167.4	160.1	0	0	112.6
309	E	58.8	Low	75.1	Confident	125 Å²	125	44.3 Å²	44.3	58%	0.584	24%	0.236	S	C	*	.	S	Bend	trans	-86.3	-18.7	-173.1	-148.5	179.6	-171.4	0	0	113.4	N284 N307	N284-E309 PolarHBondContact ND2-OE2 2.88Å; N307-E309 VanDerWaalsContact C-N 3.29Å; N307-E309 WeakPolarHBondContact OD1-CB 3.43Å; N307-E309 PolarHBondContact OD1-N 3.34Å
310	S	57.2	Low	75.2	Confident	35 Å²	35	43.8 Å²	43.8	25%	0.245	23%	0.233	C	C	.	.			trans	-138.2	90.5	-178.8	68.2	0	0	0	0	113	N307 N312 E313	N307-S310 PolarHBondContact ND2-OG 3.49Å; S310-N312 PolarHBondContact O-N 3.25Å; S310-N312 VanDerWaalsContact O-N 3.13Å; S310-E313 PolarHBondContact O-N 2.94Å
311	P	63	Low	75.1	Confident	109 Å²	109	43.8 Å²	43.8	71%	0.708	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-10.7	-177	-20.4	31.9	0	0	0	115.6
312	N	62.9	Low	74.9	Confident	166 Å²	166	44 Å²	44	89%	0.888	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-8.9	-175.5	-67.3	-17.8	0	0	0	113.2	S310	S310-N312 PolarHBondContact O-N 3.25Å; S310-N312 VanDerWaalsContact O-N 3.13Å
313	E	66.6	Low	74.4	Confident	50 Å²	50	45.2 Å²	45.2	23%	0.234	24%	0.241	C	C	.	.	S	Bend	trans	-96.9	149.2	177.3	-62.8	-161.1	162.4	0	0	110.6	R285 S310 D315	R285-E313 IonicContact CZ-OE2 2.64Å; R285-E313 IonicContact NH1-OE2 3.39Å; R285-E313 IonicContact NH2-OE2 3.15Å; R285-E313 PolarHBondContact NH2-OE2 2.88Å; S310-E313 PolarHBondContact O-N 2.94Å; E313-D315 PolarHBondContact O-N 3.38Å
314	P	68.4	Low	73.7	Confident	44 Å²	44	48.2 Å²	48.2	29%	0.286	25%	0.254	S	S	.	.			trans	-59.3	135.8	-178.7	19.9	-28.5	0	0	0	112.3	G316 V317 H335 C336	P314-G316 PolarHBondContact O-N 2.79Å; P314-G316 VanDerWaalsContact O-N 3.08Å; P314-V317 HydrophobicContact CG-CG2 4.4Å; P314-H335 HydrophobicContact CB-CB 4.27Å; P314-H335 HydrophobicContact CG-CB 3.87Å; P314-C336 WeakPolarHBondContact CB-O 3.33Å
315	D	71.8	Confident	72.6	Confident	83 Å²	83	49 Å²	49	44%	0.444	26%	0.258	S	S	.	.	S	Bend	trans	-57.8	-22.5	-172.6	-66.1	-3	0	0	0	115.4	H305 N306 E313 A339	H305-D315 CarbonylContact C-O 3.55Å; N306-D315 WeakPolarHBondContact CA-O 3.41Å; N306-D315 HydrophobicContact CB-CB 4.42Å; N306-D315 WeakPolarHBondContact CB-O 3.25Å; N306-D315 PolarHBondContact N-O 2.93Å; N306-D315 VanDerWaalsContact N-O 3.09Å; E313-D315 PolarHBondContact O-N 3.38Å; D315-A339 WeakPolarHBondContact O-CA 3.12Å
316	G	74.3	Confident	71.6	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	126.9	178.4	0	0	0	0	0	110.9	P314 C336	P314-G316 PolarHBondContact O-N 2.79Å; P314-G316 VanDerWaalsContact O-N 3.08Å; G316-C336 PolarHBondContact N-O 3.15Å; G316-C336 WeakPolarHBondContact O-CA 3.46Å; G316-C336 WeakPolarHBondContact O-CB 2.85Å; G316-C336 PolarHBondContact O-N 3.06Å
317	V	84.6	Confident	71.1	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	136	177.3	-180	0	0	0	0	109	W281 Y304 P314 M319 V333 F334	W281-V317 HydrophobicContact CE3-CG2 4.22Å; Y304-V317 WeakPolarHBondContact CB-O 3.23Å; Y304-V317 PolarHBondContact N-O 3.01Å; Y304-V317 PolarHBondContact O-N 2.69Å; P314-V317 HydrophobicContact CG-CG2 4.4Å; V317-M319 HydrophobicContact CG1-CG 3.82Å; V317-M319 HydrophobicContact CG1-SD 4.41Å; V317-V333 HydrophobicContact CG1-CG1 3.49Å; V317-V333 VanDerWaalsContact CG1-CG1 3.49Å; V317-F334 CarbonylContact C-O 3.56Å; V317-F334 WeakPolarHBondContact CA-O 3.48Å; V317-F334 WeakPolarHBondContact CG1-O 3.15Å
318	V	85.7	Confident	71	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.9	171.1	175.8	0	0	0	0	107.7	V301 F334 V340 T343 W365	V301-V318 HydrophobicContact CG1-CG1 3.43Å; V301-V318 VanDerWaalsContact CG1-CG1 3.43Å; V318-F334 HydrophobicContact CB-CB 4.28Å; V318-F334 PolarHBondContact N-O 2.92Å; V318-F334 PolarHBondContact O-N 3.37Å; V318-V340 HydrophobicContact CG2-CB 4.08Å; V318-V340 HydrophobicContact CG2-CG1 3.86Å; V318-V340 HydrophobicContact CG2-CG2 3.94Å; V318-T343 HydrophobicContact CG1-CG2 3.96Å; V318-W365 HydrophobicContact CB-CH2 4.11Å; V318-W365 HydrophobicContact CB-CZ2 4.48Å; V318-W365 HydrophobicContact CB-CZ3 4.26Å; V318-W365 HydrophobicContact CG1-CZ3 4.3Å; V318-W365 HydrophobicContact CG2-CH2 3.32Å; V318-W365 HydrophobicContact CG2-CZ2 3.93Å; V318-W365 HydrophobicContact CG2-CZ3 3.75Å
319	M	85.2	Confident	71.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	130.9	-178.1	-50.2	173.1	73.7	0	0	109.1	D278 W281 V301 G302 Y304 V317 W321 P330 D332 V333	D278-M319 HydrophobicContact CB-CE 4.06Å; W281-M319 HydrophobicContact CB-CE 3.6Å; W281-M319 HydrophobicContact CB-SD 3.92Å; W281-M319 HydrophobicContact CG-CE 4.35Å; V301-M319 WeakPolarHBondContact CA-O 3.42Å; G302-M319 PolarHBondContact N-O 3.19Å; G302-M319 PolarHBondContact O-N 2.78Å; Y304-M319 HydrophobicContact CD2-CB 4.32Å; Y304-M319 HydrophobicContact CD2-CG 3.72Å; Y304-M319 HydrophobicContact CD2-SD 3.62Å; Y304-M319 HydrophobicContact CE1-SD 4.44Å; Y304-M319 HydrophobicContact CE2-CB 3.74Å; Y304-M319 HydrophobicContact CE2-CG 3.5Å; Y304-M319 HydrophobicContact CE2-SD 3.23Å; Y304-M319 WeakPolarHBondContact CE2-SD 3.35Å; Y304-M319 HydrophobicContact CG-SD 4.39Å; V317-M319 HydrophobicContact CG1-CG 3.82Å; V317-M319 HydrophobicContact CG1-SD 4.41Å; M319-W321 HydrophobicContact CB-CZ2 4.08Å; M319-W321 HydrophobicContact CE-CH2 3.53Å; M319-W321 HydrophobicContact CE-CZ2 3.44Å; M319-W321 VanDerWaalsContact CE-CZ2 3.44Å; M319-W321 HydrophobicContact SD-CH2 4.39Å; M319-W321 HydrophobicContact SD-CZ2 3.71Å; M319-P330 HydrophobicContact CB-CB 4.2Å; M319-P330 HydrophobicContact CE-CB 3.69Å; M319-P330 HydrophobicContact CE-CG 3.42Å; M319-P330 VanDerWaalsContact CE-CG 3.42Å; M319-D332 WeakPolarHBondContact CA-O 3.49Å; M319-V333 HydrophobicContact CE-CG2 4.27Å
320	V	87.1	Confident	72.2	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	118.3	169.4	-175.3	0	0	0	0	107.1	L299 V301 E331 D332 F334 F345 I353	L299-V320 HydrophobicContact CB-CG1 4.49Å; L299-V320 HydrophobicContact CD2-CG1 4.06Å; V301-V320 HydrophobicContact CG2-CB 4.1Å; V301-V320 HydrophobicContact CG2-CG1 4.19Å; V301-V320 HydrophobicContact CG2-CG2 3.56Å; V320-E331 PolarHBondContact O-N 2.92Å; V320-D332 HydrophobicContact CB-CB 4.23Å; V320-D332 HydrophobicContact CG2-CB 4.08Å; V320-D332 PolarHBondContact N-O 2.86Å; V320-F334 HydrophobicContact CG2-CD2 4.46Å; V320-F334 HydrophobicContact CG2-CE2 3.84Å; V320-F345 HydrophobicContact CG1-CZ 4.43Å; V320-I353 HydrophobicContact CG2-CD1 3.56Å
321	W	85.4	Confident	73	Confident	1 Å²	1	50.1 Å²	50.1	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	149.8	172.4	-52.3	98.1	0	0	0	109.9	F276 D278 L299 V300 Y304 M319 S328 P330	F276-W321 HydrophobicContact CB-CD2 3.8Å; F276-W321 HydrophobicContact CB-CE3 3.67Å; F276-W321 HydrophobicContact CB-CG 4.38Å; F276-W321 HydrophobicContact CB-CH2 4.22Å; F276-W321 HydrophobicContact CB-CZ2 4.36Å; F276-W321 HydrophobicContact CB-CZ3 3.89Å; F276-W321 HydrophobicContact CD1-CB 4.35Å; F276-W321 HydrophobicContact CD1-CD2 4.27Å; F276-W321 AromaticContact CD1-CE3 3.73Å; F276-W321 HydrophobicContact CD1-CE3 3.73Å; F276-W321 HydrophobicContact CD1-CZ3 4.37Å; F276-W321 HydrophobicContact CD2-CB 4.24Å; F276-W321 HydrophobicContact CD2-CG 4.35Å; F276-W321 HydrophobicContact CE1-CB 4.36Å; F276-W321 HydrophobicContact CE2-CB 4.18Å; F276-W321 HydrophobicContact CG-CB 4.28Å; F276-W321 AromaticContact CG-CD2 4Å; F276-W321 HydrophobicContact CG-CD2 4Å; F276-W321 AromaticContact CG-CE3 3.85Å; F276-W321 HydrophobicContact CG-CE3 3.85Å; F276-W321 HydrophobicContact CG-CG 4.21Å; F276-W321 HydrophobicContact CG-CZ3 4.47Å; F276-W321 HydrophobicContact CZ-CB 4.25Å; D278-W321 HydrophobicContact CB-CH2 3.99Å; L299-W321 WeakPolarHBondContact CA-O 3.2Å; V300-W321 HydrophobicContact CG1-CB 3.63Å; V300-W321 HydrophobicContact CG1-CG 4.38Å; V300-W321 PolarHBondContact N-O 2.8Å; V300-W321 PolarHBondContact O-N 2.77Å; Y304-W321 HydrophobicContact CE2-CZ2 4.44Å; Y304-W321 WeakPolarHBondContact OH-CZ2 3.3Å; Y304-W321 PolarHBondContact OH-NE1 2.77Å; Y304-W321 VanDerWaalsContact OH-NE1 3.16Å; M319-W321 HydrophobicContact CB-CZ2 4.08Å; M319-W321 HydrophobicContact CE-CH2 3.53Å; M319-W321 HydrophobicContact CE-CZ2 3.44Å; M319-W321 VanDerWaalsContact CE-CZ2 3.44Å; M319-W321 HydrophobicContact SD-CH2 4.39Å; M319-W321 HydrophobicContact SD-CZ2 3.71Å; W321-S328 VanDerWaalsContact CZ3-O 3.29Å; W321-S328 WeakPolarHBondContact CZ3-O 3.41Å; W321-P330 HydrophobicContact CD2-CB 4.39Å; W321-P330 HydrophobicContact CE3-CB 3.96Å; W321-P330 HydrophobicContact CH2-CB 4.03Å; W321-P330 HydrophobicContact CH2-CG 4.34Å; W321-P330 HydrophobicContact CZ2-CB 4.43Å; W321-P330 HydrophobicContact CZ3-CB 3.77Å; W321-P330 HydrophobicContact CZ3-CG 4.27Å; W321-P330 VanDerWaalsContact CZ3-N 3.32Å
322	N	81.9	Confident	73.8	Confident	4 Å²	4	45 Å²	45	2%	0.021	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.9	177.2	-168.9	-37.9	0	0	0	108.5	F276 E298 L299 K324 F325 E331	F276-N322 WeakPolarHBondContact CE1-O 3.43Å; E298-N322 CarbonylContact O-C 3.57Å; E298-N322 WeakPolarHBondContact O-CA 3.36Å; L299-N322 HydrophobicContact CD2-CB 3.95Å; N322-K324 VanDerWaalsContact C-N 3.3Å; N322-K324 PolarHBondContact O-N 2.94Å; N322-K324 WeakPolarHBondContact OD1-CB 3.46Å; N322-K324 PolarHBondContact OD1-N 2.83Å; N322-F325 HydrophobicContact CB-CB 4.48Å; N322-F325 HydrophobicContact CB-CD2 3.41Å; N322-F325 VanDerWaalsContact CB-CD2 3.41Å; N322-F325 HydrophobicContact CB-CE2 3.91Å; N322-F325 HydrophobicContact CB-CG 4.26Å; N322-F325 WeakPolarHBondContact ND2-CE2 3.42Å; N322-E331 PolarHBondContact ND2-OE2 3.46Å
323	T	74.6	Confident	74.8	Confident	26 Å²	26	38 Å²	38	16%	0.16	20%	0.195	C	C	.	.	S	Bend	trans	-73.2	-21	179.9	59.5	0	0	0	0	113.8	R274 F276 W292 E298	R274-T323 PolarHBondContact NH1-O 3.32Å; F276-T323 HydrophobicContact CZ-CG2 4.3Å; W292-T323 HydrophobicContact CH2-CG2 3.62Å; W292-T323 HydrophobicContact CZ3-CG2 3.86Å; E298-T323 VanDerWaalsContact CA-OG1 3.3Å; E298-T323 WeakPolarHBondContact CA-OG1 3.46Å; E298-T323 WeakPolarHBondContact CB-OG1 3.37Å; E298-T323 PolarHBondContact O-N 2.94Å; E298-T323 PolarHBondContact O-OG1 2.85Å
324	K	69.3	Low	75.6	Confident	63 Å²	63	35.8 Å²	35.8	27%	0.274	19%	0.185	S	C	.	.	S	Bend	trans	-74.9	-43.5	177.4	-65.1	-167.8	174.9	-159.6	0	111	R240 S243 E244 R274 E298 N322 K326	R240-K324 HydrophobicContact CG-CD 4.29Å; S243-K324 WeakPolarHBondContact CB-O 3.34Å; S243-K324 PolarHBondContact OG-O 2.85Å; S243-K324 VanDerWaalsContact OG-O 3.1Å; E244-K324 IonicContact OE1-NZ 3.91Å; E244-K324 PolarHBondContact OE1-NZ 3Å; R274-K324 PolarHBondContact NH1-O 3.03Å; R274-K324 VanDerWaalsContact NH1-O 3.16Å; E298-K324 HydrophobicContact CB-CD 4.35Å; E298-K324 HydrophobicContact CB-CG 3.94Å; E298-K324 HydrophobicContact CG-CD 4.44Å; E298-K324 HydrophobicContact CG-CG 4.42Å; N322-K324 VanDerWaalsContact C-N 3.3Å; N322-K324 PolarHBondContact O-N 2.94Å; N322-K324 WeakPolarHBondContact OD1-CB 3.46Å; N322-K324 PolarHBondContact OD1-N 2.83Å; K324-K326 PolarHBondContact O-N 3.16Å
325	F	63.6	Low	76.4	Confident	17 Å²	17	34.9 Å²	34.9	8%	0.075	18%	0.177	C	C	.	.			trans	-56.5	129.1	-179.5	-72.3	-49.3	0	0	0	112.3	R236 E239 R240 R274 N322 K327 E331	R236-F325 HydrophobicContact CB-CZ 4.26Å; R236-F325 WeakPolarHBondContact O-CE1 3.35Å; R236-F325 WeakPolarHBondContact O-CZ 3.04Å; E239-F325 HydrophobicContact CB-CD1 3.82Å; E239-F325 HydrophobicContact CB-CE1 3.36Å; E239-F325 HydrophobicContact CB-CZ 4.43Å; R240-F325 HydrophobicContact CB-CE1 4.1Å; R240-F325 HydrophobicContact CB-CZ 4.37Å; R240-F325 VanDerWaalsContact N-CE1 3.34Å; R274-F325 PolarHBondContact NH1-O 2.65Å; N322-F325 HydrophobicContact CB-CB 4.48Å; N322-F325 HydrophobicContact CB-CD2 3.41Å; N322-F325 VanDerWaalsContact CB-CD2 3.41Å; N322-F325 HydrophobicContact CB-CE2 3.91Å; N322-F325 HydrophobicContact CB-CG 4.26Å; N322-F325 WeakPolarHBondContact ND2-CE2 3.42Å; F325-K327 VanDerWaalsContact C-N 3.28Å; F325-E331 HydrophobicContact CE2-CB 4.43Å; F325-E331 HydrophobicContact CE2-CG 4.21Å
326	K	59	Low	76.7	Confident	175 Å²	175	31.2 Å²	31.2	76%	0.761	16%	0.157	S	C	*	.	S	Bend	trans	-78.1	-13.1	178.7	-164.6	172	-178.7	178	0	112.7	K324	K324-K326 PolarHBondContact O-N 3.16Å
327	K	62.6	Low	76.9	Confident	119 Å²	119	37.8 Å²	37.8	52%	0.517	19%	0.188	S	C	.	.	S	Bend	trans	-88.5	143.5	176.6	-67.3	176.6	-178.3	166.7	0	110.1	E239 F325 T329	E239-K327 IonicContact OE1-NZ 2.7Å; E239-K327 PolarHBondContact OE1-NZ 3.03Å; F325-K327 VanDerWaalsContact C-N 3.28Å; K327-T329 PolarHBondContact O-N 2.95Å; K327-T329 VanDerWaalsContact O-N 3.13Å
328	S	65.5	Low	76.7	Confident	61 Å²	61	38.9 Å²	38.9	43%	0.427	20%	0.196	S	C	.	.	S	Bend	trans	-77	16.2	174.5	64.5	0	0	0	0	113.5	Y277 W321	Y277-S328 WeakPolarHBondContact O-CB 3.48Å; Y277-S328 PolarHBondContact O-OG 2.92Å; W321-S328 VanDerWaalsContact CZ3-O 3.29Å; W321-S328 WeakPolarHBondContact CZ3-O 3.41Å
329	T	72.7	Confident	76.6	Confident	73 Å²	73	39.5 Å²	39.5	45%	0.448	20%	0.201	S	C	.	.	S	Bend	trans	-90.4	136.2	179.5	51.8	0	0	0	0	110.3	K327	K327-T329 PolarHBondContact O-N 2.95Å; K327-T329 VanDerWaalsContact O-N 3.13Å
330	P	74.7	Confident	76.7	Confident	21 Å²	21	39.5 Å²	39.5	14%	0.136	20%	0.201	C	C	.	.			trans	-65.8	149.1	175.5	31.5	-39.6	0	0	0	111.3	D278 M319 W321 V333	D278-P330 VanDerWaalsContact OD2-CD 3.31Å; D278-P330 WeakPolarHBondContact OD2-CD 3.46Å; M319-P330 HydrophobicContact CB-CB 4.2Å; M319-P330 HydrophobicContact CE-CB 3.69Å; M319-P330 HydrophobicContact CE-CG 3.42Å; M319-P330 VanDerWaalsContact CE-CG 3.42Å; W321-P330 HydrophobicContact CD2-CB 4.39Å; W321-P330 HydrophobicContact CE3-CB 3.96Å; W321-P330 HydrophobicContact CH2-CB 4.03Å; W321-P330 HydrophobicContact CH2-CG 4.34Å; W321-P330 HydrophobicContact CZ2-CB 4.43Å; W321-P330 HydrophobicContact CZ3-CB 3.77Å; W321-P330 HydrophobicContact CZ3-CG 4.27Å; W321-P330 VanDerWaalsContact CZ3-N 3.32Å; P330-V333 HydrophobicContact CB-CG2 3.93Å; P330-V333 HydrophobicContact CG-CG2 3.44Å; P330-V333 VanDerWaalsContact CG-CG2 3.44Å
331	E	75.2	Confident	76.6	Confident	40 Å²	40	41.1 Å²	41.1	19%	0.187	21%	0.209	C	C	.	.	S	Bend	trans	-74.1	-47.4	176.8	-174.4	169.8	170.2	0	0	110.7	R236 L299 V320 N322 F325	R236-E331 PolarHBondContact NH2-O 2.75Å; L299-E331 WeakPolarHBondContact CD2-OE2 3.04Å; V320-E331 PolarHBondContact O-N 2.92Å; N322-E331 PolarHBondContact ND2-OE2 3.46Å; F325-E331 HydrophobicContact CE2-CB 4.43Å; F325-E331 HydrophobicContact CE2-CG 4.21Å
332	D	78	Confident	76.5	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.011	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	139	177	-69.2	-60.3	0	0	0	111.3	R236 M319 V320 F334 N367 Q370	R236-D332 IonicContact CZ-OD1 3.91Å; R236-D332 IonicContact CZ-OD2 2.73Å; R236-D332 IonicContact NH1-OD1 3.14Å; R236-D332 PolarHBondContact NH1-OD1 3.36Å; R236-D332 IonicContact NH1-OD2 3.97Å; R236-D332 PolarHBondContact NH1-OD2 3.02Å; R236-D332 VanDerWaalsContact NH1-OD2 3.16Å; R236-D332 IonicContact NH2-OD1 2.67Å; R236-D332 PolarHBondContact NH2-OD1 2.79Å; M319-D332 WeakPolarHBondContact CA-O 3.49Å; V320-D332 HydrophobicContact CB-CB 4.23Å; V320-D332 HydrophobicContact CG2-CB 4.08Å; V320-D332 PolarHBondContact N-O 2.86Å; D332-F334 HydrophobicContact CB-CE2 3.82Å; D332-F334 HydrophobicContact CB-CZ 3.92Å; D332-N367 PolarHBondContact OD2-ND2 3.17Å; D332-N367 PolarHBondContact OD2-OD1 2.96Å; D332-N367 VanDerWaalsContact OD2-OD1 3.06Å; D332-Q370 PolarHBondContact OD1-NE2 3.27Å
333	V	85.1	Confident	76.7	Confident	17 Å²	17	41.3 Å²	41.3	10%	0.103	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	114.6	178.2	-176.9	0	0	0	0	108.3	W281 V317 M319 P330 H335	W281-V333 HydrophobicContact CD2-CG1 4.16Å; W281-V333 HydrophobicContact CE3-CG1 4.47Å; W281-V333 HydrophobicContact CG-CG1 4.36Å; V317-V333 HydrophobicContact CG1-CG1 3.49Å; V317-V333 VanDerWaalsContact CG1-CG1 3.49Å; M319-V333 HydrophobicContact CE-CG2 4.27Å; P330-V333 HydrophobicContact CB-CG2 3.93Å; P330-V333 HydrophobicContact CG-CG2 3.44Å; P330-V333 VanDerWaalsContact CG-CG2 3.44Å; V333-H335 PolarHBondContact O-CE1 3.25Å; V333-H335 PolarHBondContact O-ND1 2.92Å
334	F	83.6	Confident	77.2	Confident	5 Å²	5	40.3 Å²	40.3	2%	0.022	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	141.2	175.9	-57.9	-73	0	0	0	110.2	V317 V318 V320 D332 I353 W365	V317-F334 CarbonylContact C-O 3.56Å; V317-F334 WeakPolarHBondContact CA-O 3.48Å; V317-F334 WeakPolarHBondContact CG1-O 3.15Å; V318-F334 HydrophobicContact CB-CB 4.28Å; V318-F334 PolarHBondContact N-O 2.92Å; V318-F334 PolarHBondContact O-N 3.37Å; V320-F334 HydrophobicContact CG2-CD2 4.46Å; V320-F334 HydrophobicContact CG2-CE2 3.84Å; D332-F334 HydrophobicContact CB-CE2 3.82Å; D332-F334 HydrophobicContact CB-CZ 3.92Å; F334-I353 HydrophobicContact CD2-CD1 4.28Å; F334-I353 HydrophobicContact CE2-CD1 3.56Å; F334-I353 HydrophobicContact CZ-CD1 4.26Å; F334-W365 HydrophobicContact CB-CD2 4.18Å; F334-W365 HydrophobicContact CB-CG 4.05Å; F334-W365 HydrophobicContact CD1-CB 3.95Å; F334-W365 AromaticContact CD1-CD1 3.76Å; F334-W365 AromaticContact CD1-CG 3.96Å; F334-W365 HydrophobicContact CD1-CG 3.96Å; F334-W365 HydrophobicContact CD2-CB 4.46Å; F334-W365 HydrophobicContact CD2-CG 4.46Å; F334-W365 HydrophobicContact CE1-CB 4.08Å; F334-W365 HydrophobicContact CG-CB 4.15Å; F334-W365 AromaticContact CG-CD1 3.86Å; F334-W365 HydrophobicContact CG-CD2 4.37Å; F334-W365 AromaticContact CG-CG 3.89Å; F334-W365 HydrophobicContact CG-CG 3.89Å; F334-W365 HydrophobicContact CZ-CB 4.39Å
335	H	83.6	Confident	77.9	Confident	25 Å²	25	37.5 Å²	37.5	12%	0.116	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.6	-171.4	-48.4	52.6	0	0	0	107.1	W281 P314 V333 R372 P374	W281-H335 AromaticContact CH2-CD2 3.89Å; W281-H335 AromaticContact CH2-NE2 3.43Å; W281-H335 WeakPolarHBondContact CH2-NE2 3.37Å; W281-H335 AromaticContact CZ2-NE2 3.91Å; W281-H335 AromaticContact CZ3-CD2 3.96Å; W281-H335 AromaticContact CZ3-NE2 3.86Å; P314-H335 HydrophobicContact CB-CB 4.27Å; P314-H335 HydrophobicContact CG-CB 3.87Å; V333-H335 PolarHBondContact O-CE1 3.25Å; V333-H335 PolarHBondContact O-ND1 2.92Å; H335-R372 WeakPolarHBondContact CE1-CD 3.22Å; H335-R372 VanDerWaalsContact CE1-CG 3.42Å; H335-R372 WeakPolarHBondContact CE1-CG 3.26Å; H335-R372 PolarHBondContact CE1-NH1 3.05Å; H335-R372 PolarHBondContact N-O 3.01Å; H335-R372 WeakPolarHBondContact ND1-CB 3.32Å; H335-R372 PolarHBondContact ND1-O 3.04Å; H335-R372 PolarHBondContact NE2-NH1 3.02Å; H335-P374 WeakPolarHBondContact O-CD 3.39Å
336	C	78.5	Confident	78.7	Confident	5 Å²	5	36.7 Å²	36.7	3%	0.034	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	148.8	175.2	-163.5	0	0	0	0	109.6	P314 G316 S338 V340 T357 W365	P314-C336 WeakPolarHBondContact CB-O 3.33Å; G316-C336 PolarHBondContact N-O 3.15Å; G316-C336 WeakPolarHBondContact O-CA 3.46Å; G316-C336 WeakPolarHBondContact O-CB 2.85Å; G316-C336 PolarHBondContact O-N 3.06Å; C336-S338 WeakPolarHBondContact CB-O 3.36Å; C336-S338 PolarHBondContact O-N 2.81Å; C336-S338 PolarHBondContact SG-O 2.91Å; C336-S338 VanDerWaalsContact SG-O 3.37Å; C336-V340 HydrophobicContact CB-CG2 3.8Å; C336-T357 WeakPolarHBondContact SG-CG2 3.43Å; C336-W365 HydrophobicContact CB-CZ2 4.36Å
337	Q	78.3	Confident	79.4	Confident	138 Å²	138	31.4 Å²	31.4	65%	0.645	17%	0.166	S	C	*	.	S	Bend	trans	-76.1	-12.2	176.4	-74.4	173.4	-12.6	0	0	113
338	S	81.9	Confident	80.2	Confident	24 Å²	24	28 Å²	28	17%	0.168	15%	0.151	C	C	.	.	S	Bend	trans	-132.4	146.9	179.2	-179.6	0	0	0	0	108.1	C336 V340 S359	C336-S338 WeakPolarHBondContact CB-O 3.36Å; C336-S338 PolarHBondContact O-N 2.81Å; C336-S338 PolarHBondContact SG-O 2.91Å; C336-S338 VanDerWaalsContact SG-O 3.37Å; S338-V340 PolarHBondContact O-N 2.73Å; S338-S359 PolarHBondContact OG-N 3.39Å
339	A	83.4	Confident	80.8	Confident	13 Å²	13	28.4 Å²	28.4	11%	0.107	15%	0.148	C	C	.	.			trans	-51.6	135.2	176.9	0	0	0	0	0	111	N306 D315 T357 Y358	N306-A339 HydrophobicContact CB-CB 4.49Å; D315-A339 WeakPolarHBondContact O-CA 3.12Å; A339-T357 CarbonylContact O-C 3.56Å; A339-T357 WeakPolarHBondContact O-CA 3.33Å; A339-Y358 PolarHBondContact O-N 3.24Å
340	V	86.1	Confident	80.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	120.9	-179.6	-178.3	0	0	0	0	108	T288 V318 C336 S338 S342 T343 W365	T288-V340 PolarHBondContact OG1-O 3.08Å; V318-V340 HydrophobicContact CG2-CB 4.08Å; V318-V340 HydrophobicContact CG2-CG1 3.86Å; V318-V340 HydrophobicContact CG2-CG2 3.94Å; C336-V340 HydrophobicContact CB-CG2 3.8Å; S338-V340 PolarHBondContact O-N 2.73Å; V340-S342 VanDerWaalsContact CG1-O 3.28Å; V340-S342 WeakPolarHBondContact CG1-O 2.96Å; V340-T343 VanDerWaalsContact CG1-OG1 3.31Å; V340-T343 WeakPolarHBondContact CG1-OG1 3.48Å; V340-W365 HydrophobicContact CG1-CH2 4.24Å; V340-W365 HydrophobicContact CG2-CH2 4.06Å; V340-W365 HydrophobicContact CG2-CZ2 4.36Å
341	M	84.7	Confident	81.3	Confident	34 Å²	34	27.5 Å²	27.5	17%	0.167	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-36.2	-177	-70.5	-59.5	-65.1	0	0	111.8	T288 G356 Y358 P388 V389 Y390	T288-M341 HydrophobicContact CG2-SD 4.47Å; M341-G356 PolarHBondContact N-O 3.38Å; M341-Y358 HydrophobicContact CG-CD2 4.36Å; M341-Y358 HydrophobicContact SD-CD2 4.3Å; M341-P388 HydrophobicContact CG-CB 4.37Å; M341-V389 WeakPolarHBondContact CB-O 3.41Å; M341-Y390 HydrophobicContact CE-CD1 3.54Å; M341-Y390 HydrophobicContact CE-CE1 3.43Å; M341-Y390 VanDerWaalsContact CE-CE1 3.43Å
342	S	83.3	Confident	81.8	Confident	4 Å²	4	27.1 Å²	27.1	3%	0.028	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	145.7	179	49.8	0	0	0	0	110.5	S289 V340 G355 G356 V389 Y390	S289-S342 VanDerWaalsContact OG-CA 3.3Å; S289-S342 WeakPolarHBondContact OG-CA 3.21Å; V340-S342 VanDerWaalsContact CG1-O 3.28Å; V340-S342 WeakPolarHBondContact CG1-O 2.96Å; S342-G355 CarbonylContact O-C 3.56Å; S342-G355 VanDerWaalsContact O-CA 3.31Å; S342-G355 WeakPolarHBondContact O-CA 3.4Å; S342-G356 PolarHBondContact N-O 2.69Å; S342-G356 PolarHBondContact O-N 3.33Å; S342-V389 PolarHBondContact OG-O 2.94Å; S342-Y390 WeakPolarHBondContact CB-O 3.5Å
343	T	87.1	Confident	82.3	Confident	6 Å²	6	27.1 Å²	27.1	4%	0.037	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	140.8	173.4	-64	0	0	0	0	109	S289 V301 S303 V318 V340 I353 L354 W365	S289-T343 PolarHBondContact OG-N 2.64Å; V301-T343 HydrophobicContact CB-CG2 4.38Å; V301-T343 HydrophobicContact CG1-CG2 3.24Å; S303-T343 WeakPolarHBondContact CB-OG1 3.35Å; V318-T343 HydrophobicContact CG1-CG2 3.96Å; V340-T343 VanDerWaalsContact CG1-OG1 3.31Å; V340-T343 WeakPolarHBondContact CG1-OG1 3.48Å; T343-I353 HydrophobicContact CG2-CG2 3.65Å; T343-L354 CarbonylContact C-O 3.59Å; T343-L354 VanDerWaalsContact CA-O 3.28Å; T343-L354 WeakPolarHBondContact CA-O 3.43Å; T343-L354 WeakPolarHBondContact CG2-O 3.41Å; T343-W365 HydrophobicContact CG2-CZ3 4.39Å
344	C	84.2	Confident	82.4	Confident	4 Å²	4	26.3 Å²	26.3	3%	0.027	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	139.3	178.7	-177.4	0	0	0	0	109.8	D291 L354 L392	D291-C344 VanDerWaalsContact OD2-CA 3.26Å; D291-C344 WeakPolarHBondContact OD2-CA 3.3Å; D291-C344 PolarHBondContact OD2-SG 3.13Å; C344-L354 PolarHBondContact N-O 3.2Å; C344-L354 PolarHBondContact O-N 3.38Å; C344-L392 HydrophobicContact CB-CD2 4.08Å; C344-L392 HydrophobicContact CB-CG 4.46Å; C344-L392 WeakPolarHBondContact CB-O 3.43Å
345	F	84.8	Confident	82.6	Confident	5 Å²	5	26 Å²	26	2%	0.022	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	143.7	168.7	-88.1	-73.5	0	0	0	111	D291 L299 V301 V320 K347 I353	D291-F345 PolarHBondContact OD2-N 3.43Å; L299-F345 HydrophobicContact CB-CZ 4.3Å; V301-F345 HydrophobicContact CB-CD2 4.17Å; V301-F345 HydrophobicContact CB-CE2 3.54Å; V301-F345 HydrophobicContact CB-CZ 4.02Å; V301-F345 HydrophobicContact CG2-CD2 4.08Å; V301-F345 HydrophobicContact CG2-CE1 3.94Å; V301-F345 HydrophobicContact CG2-CE2 3.16Å; V301-F345 HydrophobicContact CG2-CZ 3.09Å; V320-F345 HydrophobicContact CG1-CZ 4.43Å; F345-K347 PolarHBondContact O-N 2.84Å; F345-K347 VanDerWaalsContact O-N 3.15Å; F345-I353 HydrophobicContact CD1-CG1 3.81Å; F345-I353 HydrophobicContact CE1-CD1 3.93Å; F345-I353 HydrophobicContact CE1-CG1 3.62Å; F345-I353 HydrophobicContact CZ-CD1 4.49Å
346	A	81.1	Confident	82.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.129	C	C	.	.			trans	-72	111.3	167.5	0	0	0	0	0	109.8	F348 N349 L352 M394	A346-F348 PolarHBondContact O-N 3.13Å; A346-N349 HydrophobicContact CB-CB 4.12Å; A346-N349 CarbonylContact O-C 3.6Å; A346-N349 PolarHBondContact O-N 3.37Å; A346-L352 HydrophobicContact CB-CB 3.83Å; A346-L352 WeakPolarHBondContact CB-O 3.34Å; A346-L352 PolarHBondContact N-O 3.43Å; A346-L352 VanDerWaalsContact N-O 3.12Å; A346-M394 VanDerWaalsContact CA-SD 3.58Å; A346-M394 HydrophobicContact CB-CE 4.07Å; A346-M394 HydrophobicContact CB-SD 3.92Å
347	K	73.8	Confident	83.2	Confident	64 Å²	64	24.7 Å²	24.7	28%	0.278	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-24.5	-177.9	-70.4	178	178.1	162.4	0	115.1	T294 H295 F345 M394	T294-K347 HydrophobicContact CG2-CG 4.31Å; T294-K347 PolarHBondContact OG1-O 3.47Å; H295-K347 PolarHBondContact CD2-O 2.77Å; H295-K347 PolarHBondContact NE2-O 3.34Å; F345-K347 PolarHBondContact O-N 2.84Å; F345-K347 VanDerWaalsContact O-N 3.15Å; K347-M394 HydrophobicContact CB-SD 4.36Å; K347-M394 PolarHBondContact N-SD 2.8Å; K347-M394 VanDerWaalsContact N-SD 3.4Å; K347-M394 PolarHBondContact NZ-O 2.83Å
348	F	77.6	Confident	83.7	Confident	48 Å²	48	24.7 Å²	24.7	21%	0.211	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-19.3	-176.5	-56.2	-66.6	0	0	0	113.6	H295 A346 M394 G396 T397 Q398 H401	H295-F348 PolarHBondContact NE2-O 3.13Å; A346-F348 PolarHBondContact O-N 3.13Å; F348-M394 HydrophobicContact CD2-SD 4.02Å; F348-M394 HydrophobicContact CE2-SD 4.45Å; F348-G396 VanDerWaalsContact CZ-O 3.24Å; F348-G396 WeakPolarHBondContact CZ-O 3.38Å; F348-T397 WeakPolarHBondContact CE2-O 3.43Å; F348-Q398 HydrophobicContact CB-CG 4.41Å; F348-Q398 HydrophobicContact CD1-CB 3.83Å; F348-Q398 HydrophobicContact CD1-CG 4.19Å; F348-Q398 HydrophobicContact CE1-CB 4.17Å; F348-Q398 HydrophobicContact CG-CB 4.32Å; F348-Q398 HydrophobicContact CG-CG 4.45Å; F348-H401 HydrophobicContact CD2-CB 3.73Å; F348-H401 HydrophobicContact CE2-CB 3.8Å
349	N	78.3	Confident	83.8	Confident	68 Å²	68	25.4 Å²	25.4	36%	0.364	13%	0.128	S	C	.	.			trans	-127.5	96.7	-174.1	-79.2	-39.8	0	0	0	108.5	A346 N351 L352	A346-N349 HydrophobicContact CB-CB 4.12Å; A346-N349 CarbonylContact O-C 3.6Å; A346-N349 PolarHBondContact O-N 3.37Å; N349-N351 PolarHBondContact O-N 3.37Å; N349-L352 HydrophobicContact CB-CB 4.23Å; N349-L352 HydrophobicContact CB-CD1 3.81Å; N349-L352 HydrophobicContact CB-CG 4.03Å; N349-L352 PolarHBondContact O-N 3.49Å
350	P	75.4	Confident	83.8	Confident	34 Å²	34	24.8 Å²	24.8	22%	0.221	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-14.5	-170	24.4	-34.3	0	0	0	114.4	H295 F296	H295-P350 HydrophobicContact CB-CB 3.97Å; F296-P350 HydrophobicContact CD2-CB 3.94Å; F296-P350 HydrophobicContact CE2-CB 3.75Å; F296-P350 HydrophobicContact CE2-CG 4.27Å
351	N	83.1	Confident	83.8	Confident	42 Å²	42	27 Å²	27	23%	0.225	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-12.2	-179.3	-56	-75.7	0	0	0	112.7	N349 D366 N367 R368	N349-N351 PolarHBondContact O-N 3.37Å; N351-D366 WeakPolarHBondContact CB-OD1 3.2Å; N351-D366 CarbonylContact O-C 3.49Å; N351-D366 WeakPolarHBondContact O-CA 3.29Å; N351-N367 PolarHBondContact O-N 3.4Å; N351-R368 HydrophobicContact CB-CG 3.95Å; N351-R368 VanDerWaalsContact CG-NE 3.32Å; N351-R368 PolarHBondContact ND2-NE 2.98Å; N351-R368 PolarHBondContact ND2-NH2 3.35Å
352	L	86.6	Confident	84	Confident	32 Å²	32	25.4 Å²	25.4	17%	0.168	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	130.4	-177.2	-63.3	179.8	0	0	0	110.4	A346 N349 L364 W365 D366 L417	A346-L352 HydrophobicContact CB-CB 3.83Å; A346-L352 WeakPolarHBondContact CB-O 3.34Å; A346-L352 PolarHBondContact N-O 3.43Å; A346-L352 VanDerWaalsContact N-O 3.12Å; N349-L352 HydrophobicContact CB-CB 4.23Å; N349-L352 HydrophobicContact CB-CD1 3.81Å; N349-L352 HydrophobicContact CB-CG 4.03Å; N349-L352 PolarHBondContact O-N 3.49Å; L352-L364 HydrophobicContact CD2-CD2 4.18Å; L352-W365 WeakPolarHBondContact CA-O 3.1Å; L352-D366 HydrophobicContact CD2-CB 3.97Å; L352-L417 HydrophobicContact CD1-CD1 4.08Å
353	I	87.8	Confident	84.2	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.7	175.9	-55.4	167.3	0	0	0	107.3	V301 V320 F334 T343 F345 W365	V301-I353 HydrophobicContact CG1-CG2 4.45Å; V301-I353 HydrophobicContact CG2-CD1 4.19Å; V320-I353 HydrophobicContact CG2-CD1 3.56Å; F334-I353 HydrophobicContact CD2-CD1 4.28Å; F334-I353 HydrophobicContact CE2-CD1 3.56Å; F334-I353 HydrophobicContact CZ-CD1 4.26Å; T343-I353 HydrophobicContact CG2-CG2 3.65Å; F345-I353 HydrophobicContact CD1-CG1 3.81Å; F345-I353 HydrophobicContact CE1-CD1 3.93Å; F345-I353 HydrophobicContact CE1-CG1 3.62Å; F345-I353 HydrophobicContact CZ-CD1 4.49Å; I353-W365 HydrophobicContact CB-CB 4.34Å; I353-W365 HydrophobicContact CB-CE3 4.1Å; I353-W365 HydrophobicContact CG2-CE3 3.75Å; I353-W365 HydrophobicContact CG2-CZ3 4.18Å; I353-W365 PolarHBondContact N-O 2.98Å; I353-W365 PolarHBondContact O-N 2.88Å
354	L	87.8	Confident	84.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.7	-179	-55.9	163.1	0	0	0	109.2	T343 C344 V363 L364 L392 V403 L417	T343-L354 CarbonylContact C-O 3.59Å; T343-L354 VanDerWaalsContact CA-O 3.28Å; T343-L354 WeakPolarHBondContact CA-O 3.43Å; T343-L354 WeakPolarHBondContact CG2-O 3.41Å; C344-L354 PolarHBondContact N-O 3.2Å; C344-L354 PolarHBondContact O-N 3.38Å; L354-V363 WeakPolarHBondContact CA-O 3.43Å; L354-L364 HydrophobicContact CD2-CB 4.13Å; L354-L364 HydrophobicContact CD2-CD1 3.65Å; L354-L364 HydrophobicContact CD2-CG 4.02Å; L354-L392 HydrophobicContact CB-CD2 3.42Å; L354-L392 VanDerWaalsContact CB-CD2 3.42Å; L354-L392 HydrophobicContact CD1-CD2 4.5Å; L354-V403 HydrophobicContact CD1-CB 4.33Å; L354-V403 HydrophobicContact CD1-CG1 3.93Å; L354-V403 HydrophobicContact CD1-CG2 3.41Å; L354-V403 VanDerWaalsContact CD1-CG2 3.41Å; L354-L417 HydrophobicContact CD1-CD2 4.09Å; L354-L417 HydrophobicContact CD2-CD2 3.66Å; L354-L417 HydrophobicContact CG-CD2 4.42Å
355	G	87.1	Confident	84.4	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	142.5	175	0	0	0	0	0	111.8	S342 I362 V363 W365	S342-G355 CarbonylContact O-C 3.56Å; S342-G355 VanDerWaalsContact O-CA 3.31Å; S342-G355 WeakPolarHBondContact O-CA 3.4Å; G355-I362 CarbonylContact O-C 3.45Å; G355-I362 WeakPolarHBondContact O-CA 3.47Å; G355-V363 PolarHBondContact N-O 3.23Å; G355-V363 WeakPolarHBondContact O-CG2 3.21Å; G355-V363 PolarHBondContact O-N 2.85Å; G355-W365 VanDerWaalsContact CA-CZ3 3.46Å
356	G	88.3	Confident	84.5	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.7	165.5	0	0	0	0	0	110	M341 S342	M341-G356 PolarHBondContact N-O 3.38Å; S342-G356 PolarHBondContact N-O 2.69Å; S342-G356 PolarHBondContact O-N 3.33Å
357	T	87.5	Confident	84.4	Confident	1 Å²	1	28 Å²	28	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	161.7	177.7	66.4	0	0	0	0	112	C336 A339 S359 G360 Q361 V363 V389	C336-T357 WeakPolarHBondContact SG-CG2 3.43Å; A339-T357 CarbonylContact O-C 3.56Å; A339-T357 WeakPolarHBondContact O-CA 3.33Å; T357-S359 PolarHBondContact O-N 2.96Å; T357-S359 PolarHBondContact OG1-OG 3.3Å; T357-G360 PolarHBondContact O-N 3.21Å; T357-Q361 PolarHBondContact N-O 3.02Å; T357-Q361 WeakPolarHBondContact OG1-CB 3.39Å; T357-Q361 PolarHBondContact OG1-N 3.45Å; T357-Q361 VanDerWaalsContact OG1-N 3.12Å; T357-Q361 PolarHBondContact OG1-O 2.84Å; T357-V363 HydrophobicContact CG2-CG1 3.86Å; T357-V363 HydrophobicContact CG2-CG2 4.19Å; T357-V389 PolarHBondContact O-N 3.07Å
358	Y	86.9	Confident	84.6	Confident	138 Å²	138	33.9 Å²	33.9	54%	0.541	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.6	171.6	-175.4	-94.4	0	0	0	112.4	A339 M341 G360 P388	A339-Y358 PolarHBondContact O-N 3.24Å; M341-Y358 HydrophobicContact CG-CD2 4.36Å; M341-Y358 HydrophobicContact SD-CD2 4.3Å; Y358-G360 PolarHBondContact O-N 2.79Å; Y358-P388 HydrophobicContact CD1-CG 4.33Å; Y358-P388 HydrophobicContact CD2-CB 3.65Å; Y358-P388 HydrophobicContact CD2-CG 3.33Å; Y358-P388 HydrophobicContact CE1-CG 4.24Å; Y358-P388 HydrophobicContact CE2-CB 3.98Å; Y358-P388 HydrophobicContact CE2-CG 3.21Å; Y358-P388 HydrophobicContact CG-CB 4.25Å; Y358-P388 HydrophobicContact CG-CG 3.9Å; Y358-P388 VanDerWaalsContact O-CA 3.27Å; Y358-P388 WeakPolarHBondContact O-CA 3.45Å; Y358-P388 WeakPolarHBondContact O-CG 3.44Å
359	S	85.4	Confident	84.5	Confident	39 Å²	39	34.3 Å²	34.3	27%	0.273	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	0.1	177.2	60	0	0	0	0	115.3	S338 T357 Q361 L380	S338-S359 PolarHBondContact OG-N 3.39Å; T357-S359 PolarHBondContact O-N 2.96Å; T357-S359 PolarHBondContact OG1-OG 3.3Å; S359-Q361 VanDerWaalsContact C-N 3.33Å; S359-L380 WeakPolarHBondContact O-CD1 3.11Å
360	G	83.9	Confident	84	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.17	C	C	.	.	S	Bend	trans	84.4	3.3	-176.7	0	0	0	0	0	114.4	T357 Y358 H387	T357-G360 PolarHBondContact O-N 3.21Å; Y358-G360 PolarHBondContact O-N 2.79Å; G360-H387 VanDerWaalsContact CA-O 3.3Å; G360-H387 WeakPolarHBondContact CA-O 3.5Å
361	Q	86.1	Confident	83.9	Confident	46 Å²	46	40.7 Å²	40.7	22%	0.215	19%	0.188	C	C	.	.			trans	-85.8	144.5	175.2	-63	178.1	4.5	0	0	110.1	T357 S359	T357-Q361 PolarHBondContact N-O 3.02Å; T357-Q361 WeakPolarHBondContact OG1-CB 3.39Å; T357-Q361 PolarHBondContact OG1-N 3.45Å; T357-Q361 VanDerWaalsContact OG1-N 3.12Å; T357-Q361 PolarHBondContact OG1-O 2.84Å; S359-Q361 VanDerWaalsContact C-N 3.33Å
362	I	88	Confident	83.4	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.9	168.6	-57.9	171.9	0	0	0	106.8	G355 R377 T378 L392 W415	G355-I362 CarbonylContact O-C 3.45Å; G355-I362 WeakPolarHBondContact O-CA 3.47Å; I362-R377 WeakPolarHBondContact O-CA 3.4Å; I362-T378 HydrophobicContact CB-CG2 3.74Å; I362-T378 PolarHBondContact N-OG1 3.23Å; I362-T378 PolarHBondContact O-N 3.25Å; I362-L392 HydrophobicContact CD1-CD1 4.1Å; I362-L392 HydrophobicContact CG1-CD1 4.41Å; I362-L392 HydrophobicContact CG2-CD1 4.31Å; I362-W415 HydrophobicContact CD1-CD2 4.11Å; I362-W415 HydrophobicContact CD1-CG 3.98Å; I362-W415 HydrophobicContact CD1-CZ2 4.24Å
363	V	87.4	Confident	83.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	143.7	-177.2	-63	0	0	0	0	109.3	L354 G355 T357 W365 P374 R377	L354-V363 WeakPolarHBondContact CA-O 3.43Å; G355-V363 PolarHBondContact N-O 3.23Å; G355-V363 WeakPolarHBondContact O-CG2 3.21Å; G355-V363 PolarHBondContact O-N 2.85Å; T357-V363 HydrophobicContact CG2-CG1 3.86Å; T357-V363 HydrophobicContact CG2-CG2 4.19Å; V363-W365 HydrophobicContact CB-CZ2 4.31Å; V363-W365 HydrophobicContact CG2-CH2 3.36Å; V363-W365 HydrophobicContact CG2-CZ2 3.32Å; V363-W365 HydrophobicContact CG2-CZ3 4Å; V363-P374 HydrophobicContact CB-CB 4.06Å; V363-P374 HydrophobicContact CG1-CB 4.44Å; V363-R377 HydrophobicContact CG1-CG 4.02Å
364	L	88	Confident	82.8	Confident	13 Å²	13	47.8 Å²	47.8	7%	0.068	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.7	178.4	179.9	147	0	0	0	109.5	L352 L354 I375 Q376 L417 L420	L352-L364 HydrophobicContact CD2-CD2 4.18Å; L354-L364 HydrophobicContact CD2-CB 4.13Å; L354-L364 HydrophobicContact CD2-CD1 3.65Å; L354-L364 HydrophobicContact CD2-CG 4.02Å; L364-I375 PolarHBondContact O-N 2.67Å; L364-Q376 HydrophobicContact CB-CB 4.36Å; L364-Q376 PolarHBondContact N-O 3.05Å; L364-Q376 PolarHBondContact O-N 2.79Å; L364-L417 HydrophobicContact CD1-CD2 4.03Å; L364-L420 HydrophobicContact CB-CD1 4.04Å; L364-L420 HydrophobicContact CD1-CD1 3.87Å
365	W	87.3	Confident	82.4	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	143.3	175.5	-55.7	-77	0	0	0	109.8	V318 F334 C336 V340 T343 L352 I353 G355 V363 P374	V318-W365 HydrophobicContact CB-CH2 4.11Å; V318-W365 HydrophobicContact CB-CZ2 4.48Å; V318-W365 HydrophobicContact CB-CZ3 4.26Å; V318-W365 HydrophobicContact CG1-CZ3 4.3Å; V318-W365 HydrophobicContact CG2-CH2 3.32Å; V318-W365 HydrophobicContact CG2-CZ2 3.93Å; V318-W365 HydrophobicContact CG2-CZ3 3.75Å; F334-W365 HydrophobicContact CB-CD2 4.18Å; F334-W365 HydrophobicContact CB-CG 4.05Å; F334-W365 HydrophobicContact CD1-CB 3.95Å; F334-W365 AromaticContact CD1-CD1 3.76Å; F334-W365 AromaticContact CD1-CG 3.96Å; F334-W365 HydrophobicContact CD1-CG 3.96Å; F334-W365 HydrophobicContact CD2-CB 4.46Å; F334-W365 HydrophobicContact CD2-CG 4.46Å; F334-W365 HydrophobicContact CE1-CB 4.08Å; F334-W365 HydrophobicContact CG-CB 4.15Å; F334-W365 AromaticContact CG-CD1 3.86Å; F334-W365 HydrophobicContact CG-CD2 4.37Å; F334-W365 AromaticContact CG-CG 3.89Å; F334-W365 HydrophobicContact CG-CG 3.89Å; F334-W365 HydrophobicContact CZ-CB 4.39Å; C336-W365 HydrophobicContact CB-CZ2 4.36Å; V340-W365 HydrophobicContact CG1-CH2 4.24Å; V340-W365 HydrophobicContact CG2-CH2 4.06Å; V340-W365 HydrophobicContact CG2-CZ2 4.36Å; T343-W365 HydrophobicContact CG2-CZ3 4.39Å; L352-W365 WeakPolarHBondContact CA-O 3.1Å; I353-W365 HydrophobicContact CB-CB 4.34Å; I353-W365 HydrophobicContact CB-CE3 4.1Å; I353-W365 HydrophobicContact CG2-CE3 3.75Å; I353-W365 HydrophobicContact CG2-CZ3 4.18Å; I353-W365 PolarHBondContact N-O 2.98Å; I353-W365 PolarHBondContact O-N 2.88Å; G355-W365 VanDerWaalsContact CA-CZ3 3.46Å; V363-W365 HydrophobicContact CB-CZ2 4.31Å; V363-W365 HydrophobicContact CG2-CH2 3.36Å; V363-W365 HydrophobicContact CG2-CZ2 3.32Å; V363-W365 HydrophobicContact CG2-CZ3 4Å; W365-P374 VanDerWaalsContact CD1-CA 3.48Å
366	D	87.3	Confident	82.1	Confident	30 Å²	30	55.3 Å²	55.3	16%	0.16	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.5	170.5	-174.2	-7.8	0	0	0	108	N351 L352 R368 V369 I375	N351-D366 WeakPolarHBondContact CB-OD1 3.2Å; N351-D366 CarbonylContact O-C 3.49Å; N351-D366 WeakPolarHBondContact O-CA 3.29Å; L352-D366 HydrophobicContact CD2-CB 3.97Å; D366-R368 PolarHBondContact O-N 2.91Å; D366-R368 WeakPolarHBondContact OD1-CB 3.4Å; D366-R368 WeakPolarHBondContact OD1-CG 3.35Å; D366-R368 PolarHBondContact OD1-N 2.98Å; D366-V369 PolarHBondContact O-N 2.87Å; D366-I375 HydrophobicContact CB-CD1 3.24Å
367	N	78.8	Confident	81.9	Confident	31 Å²	31	59.3 Å²	59.3	17%	0.166	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-28.3	177	-170.6	-31	0	0	0	111.8	D332 N351 V369	D332-N367 PolarHBondContact OD2-ND2 3.17Å; D332-N367 PolarHBondContact OD2-OD1 2.96Å; D332-N367 VanDerWaalsContact OD2-OD1 3.06Å; N351-N367 PolarHBondContact O-N 3.4Å; N367-V369 PolarHBondContact O-N 3.33Å
368	R	78.9	Confident	81.7	Confident	187 Å²	187	59.3 Å²	59.3	71%	0.706	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-30.2	-180	-64.1	169.8	176.5	-176.9	1.4	112.9	N351 D366	N351-R368 HydrophobicContact CB-CG 3.95Å; N351-R368 VanDerWaalsContact CG-NE 3.32Å; N351-R368 PolarHBondContact ND2-NE 2.98Å; N351-R368 PolarHBondContact ND2-NH2 3.35Å; D366-R368 PolarHBondContact O-N 2.91Å; D366-R368 WeakPolarHBondContact OD1-CB 3.4Å; D366-R368 WeakPolarHBondContact OD1-CG 3.35Å; D366-R368 PolarHBondContact OD1-N 2.98Å
369	V	75.4	Confident	81.2	Confident	57 Å²	57	55.9 Å²	55.9	35%	0.345	27%	0.267	S	S	.	.	S	Bend	trans	-99.9	101.8	179.3	-176.2	0	0	0	0	105.7	D366 N367 K371 I375	D366-V369 PolarHBondContact O-N 2.87Å; N367-V369 PolarHBondContact O-N 3.33Å; V369-K371 HydrophobicContact CG1-CB 4.01Å; V369-K371 HydrophobicContact CG1-CD 3.85Å; V369-K371 HydrophobicContact CG1-CG 3.73Å; V369-K371 PolarHBondContact O-N 2.92Å; V369-I375 HydrophobicContact CB-CD1 4.05Å; V369-I375 HydrophobicContact CG2-CD1 4.32Å
370	Q	67.6	Low	80.6	Confident	100 Å²	100	58.9 Å²	58.9	47%	0.467	28%	0.279	S	S	.	.			trans	-67.9	37.4	177.4	-158.8	75.7	49	0	0	112.9	D332	D332-Q370 PolarHBondContact OD1-NE2 3.27Å
371	K	72	Confident	79.9	Confident	135 Å²	135	61.9 Å²	61.9	59%	0.587	30%	0.3	S	S	*	.			trans	-82.5	122.8	164.9	-75	-177.9	-179.2	-175.7	0	107.3	V369 T373	V369-K371 HydrophobicContact CG1-CB 4.01Å; V369-K371 HydrophobicContact CG1-CD 3.85Å; V369-K371 HydrophobicContact CG1-CG 3.73Å; V369-K371 PolarHBondContact O-N 2.92Å; K371-T373 PolarHBondContact O-N 3.11Å
372	R	74.3	Confident	78.8	Confident	131 Å²	131	63.2 Å²	63.2	49%	0.494	32%	0.319	S	S	.	.	S	Bend	trans	-66	-22.1	176.1	-80.7	178.9	179.4	-126.6	4	113	H335	H335-R372 WeakPolarHBondContact CE1-CD 3.22Å; H335-R372 VanDerWaalsContact CE1-CG 3.42Å; H335-R372 WeakPolarHBondContact CE1-CG 3.26Å; H335-R372 PolarHBondContact CE1-NH1 3.05Å; H335-R372 PolarHBondContact N-O 3.01Å; H335-R372 WeakPolarHBondContact ND1-CB 3.32Å; H335-R372 PolarHBondContact ND1-O 3.04Å; H335-R372 PolarHBondContact NE2-NH1 3.02Å
373	T	80.9	Confident	77.9	Confident	81 Å²	81	65.3 Å²	65.3	50%	0.497	34%	0.336	S	S	.	.	S	Bend	trans	-89.6	151.2	177.6	56.2	0	0	0	0	111.8	K371	K371-T373 PolarHBondContact O-N 3.11Å
374	P	79.9	Confident	77.4	Confident	13 Å²	13	65.3 Å²	65.3	8%	0.084	34%	0.337	C	S	.	.			trans	-57.5	144.5	173.5	26.8	-37.7	0	0	0	111.8	H335 V363 W365 R377	H335-P374 WeakPolarHBondContact O-CD 3.39Å; V363-P374 HydrophobicContact CB-CB 4.06Å; V363-P374 HydrophobicContact CG1-CB 4.44Å; W365-P374 VanDerWaalsContact CD1-CA 3.48Å; P374-R377 HydrophobicContact CB-CG 4.42Å; P374-R377 HydrophobicContact CG-CG 4.27Å
375	I	80.2	Confident	77.1	Confident	83 Å²	83	64.7 Å²	64.7	43%	0.426	33%	0.333	S	S	.	.	S	Bend	trans	-84	-40.9	-176.9	-62.9	172.5	0	0	0	110	L364 D366 V369	L364-I375 PolarHBondContact O-N 2.67Å; D366-I375 HydrophobicContact CB-CD1 3.24Å; V369-I375 HydrophobicContact CB-CD1 4.05Å; V369-I375 HydrophobicContact CG2-CD1 4.32Å
376	Q	79.7	Confident	76.9	Confident	74 Å²	74	68.2 Å²	68.2	35%	0.346	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	146.4	179.9	-167.9	169.5	15	0	0	110	L364 L420	L364-Q376 HydrophobicContact CB-CB 4.36Å; L364-Q376 PolarHBondContact N-O 3.05Å; L364-Q376 PolarHBondContact O-N 2.79Å; Q376-L420 HydrophobicContact CB-CD1 4.47Å; Q376-L420 HydrophobicContact CG-CB 4.35Å; Q376-L420 HydrophobicContact CG-CD1 4.12Å
377	R	84.2	Confident	76.8	Confident	84 Å²	84	71.1 Å²	71.1	32%	0.317	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	143	175.9	-52.6	-169.8	-179.3	170.8	-0.6	109.1	I362 V363 P374	I362-R377 WeakPolarHBondContact O-CA 3.4Å; V363-R377 HydrophobicContact CG1-CG 4.02Å; P374-R377 HydrophobicContact CB-CG 4.42Å; P374-R377 HydrophobicContact CG-CG 4.27Å
378	T	84.4	Confident	77.2	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.012	36%	0.363	C	S	.	.			trans	-75.9	146.2	170.3	64	0	0	0	0	110.2	I362 W415 L420	I362-T378 HydrophobicContact CB-CG2 3.74Å; I362-T378 PolarHBondContact N-OG1 3.23Å; I362-T378 PolarHBondContact O-N 3.25Å; T378-W415 HydrophobicContact CG2-CD2 4.4Å; T378-W415 HydrophobicContact CG2-CE3 3.97Å; T378-W415 HydrophobicContact CG2-CH2 4.12Å; T378-W415 HydrophobicContact CG2-CZ3 3.81Å; T378-L420 HydrophobicContact CG2-CB 4.06Å; T378-L420 HydrophobicContact CG2-CD2 4.35Å; T378-L420 VanDerWaalsContact CG2-O 3.3Å; T378-L420 WeakPolarHBondContact CG2-O 3.31Å
379	P	76	Confident	77.6	Confident	66 Å²	66	61.3 Å²	61.3	43%	0.429	33%	0.329	S	S	.	.			trans	-72.6	143.4	173.9	29.4	-32.6	0	0	0	111	S381 A384 S421	P379-S381 PolarHBondContact O-N 3.08Å; P379-S381 VanDerWaalsContact O-N 3.13Å; P379-A384 WeakPolarHBondContact O-CB 3.28Å; P379-S421 WeakPolarHBondContact CD-O 3.4Å; P379-S421 WeakPolarHBondContact CG-O 3.46Å
380	L	72.3	Confident	78.1	Confident	101 Å²	101	62 Å²	62	53%	0.529	33%	0.326	S	S	.	.			trans	-75.1	99.2	170.6	-169.5	64.5	0	0	0	108.5	S359 H385	S359-L380 WeakPolarHBondContact O-CD1 3.11Å; L380-H385 WeakPolarHBondContact CD1-O 3Å
381	S	70	Confident	78.8	Confident	64 Å²	64	58 Å²	58	45%	0.448	31%	0.31	S	S	.	.			trans	-132.5	160.1	179.9	-179	0	0	0	0	109.4	P379 A383 A384	P379-S381 PolarHBondContact O-N 3.08Å; P379-S381 VanDerWaalsContact O-N 3.13Å; S381-A383 PolarHBondContact O-N 3.31Å; S381-A384 CarbonylContact O-C 3.56Å; S381-A384 VanDerWaalsContact O-CA 3.31Å; S381-A384 WeakPolarHBondContact O-CA 3.49Å; S381-A384 WeakPolarHBondContact O-CB 3.34Å; S381-A384 PolarHBondContact O-N 2.97Å; S381-A384 VanDerWaalsContact O-O 3.11Å
382	A	62.5	Low	79.5	Confident	74 Å²	74	52.1 Å²	52.1	61%	0.612	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.1	179.6	0	0	0	0	0	114.2	K411	A382-K411 PolarHBondContact O-NZ 3.43Å
383	A	68.2	Low	80	Confident	44 Å²	44	48.1 Å²	48.1	36%	0.364	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-24.3	170.1	0	0	0	0	0	112.2	S381 P423 T426	S381-A383 PolarHBondContact O-N 3.31Å; A383-P423 HydrophobicContact CB-CG 3.9Å; A383-P423 VanDerWaalsContact O-CG 3.31Å; A383-P423 WeakPolarHBondContact O-CG 3.39Å; A383-T426 PolarHBondContact O-OG1 2.72Å; A383-T426 VanDerWaalsContact O-OG1 3.14Å
384	A	76.9	Confident	80.2	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.008	25%	0.248	C	C	.	.	S	Bend	trans	-88.2	-175.8	171.5	0	0	0	0	0	110.1	P379 S381 W415	P379-A384 WeakPolarHBondContact O-CB 3.28Å; S381-A384 CarbonylContact O-C 3.56Å; S381-A384 VanDerWaalsContact O-CA 3.31Å; S381-A384 WeakPolarHBondContact O-CA 3.49Å; S381-A384 WeakPolarHBondContact O-CB 3.34Å; S381-A384 PolarHBondContact O-N 2.97Å; S381-A384 VanDerWaalsContact O-O 3.11Å; A384-W415 HydrophobicContact CB-CH2 3.7Å; A384-W415 HydrophobicContact CB-CZ2 3.96Å
385	H	83.3	Confident	80.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.246	C	C	.	.			trans	-74	138.3	177.9	-62.3	-50	0	0	0	111.3	L380 V389 S405 S407 K411 C413	L380-H385 WeakPolarHBondContact CD1-O 3Å; H385-V389 HydrophobicContact CB-CG2 4.11Å; H385-S405 PolarHBondContact CE1-O 3.49Å; H385-S405 VanDerWaalsContact NE2-CB 3.26Å; H385-S405 WeakPolarHBondContact NE2-CB 3.18Å; H385-S405 PolarHBondContact NE2-O 2.95Å; H385-S405 PolarHBondContact NE2-OG 3.27Å; H385-S407 VanDerWaalsContact CG-CB 3.44Å; H385-S407 WeakPolarHBondContact ND1-CB 3.4Å; H385-K411 PolarHBondContact CE1-O 2.89Å; H385-C413 PolarHBondContact CE1-SG 3.45Å
386	T	82.2	Confident	80	Confident	74 Å²	74	41.2 Å²	41.2	45%	0.454	24%	0.237	S	C	.	.	S	Bend	trans	-104.9	-12.6	175.1	56.5	0	0	0	0	112.6	D409	T386-D409 PolarHBondContact N-OD2 2.97Å; T386-D409 VanDerWaalsContact N-OD2 3.1Å; T386-D409 PolarHBondContact OG1-OD2 2.85Å
387	H	86	Confident	79.8	Confident	91 Å²	91	41.3 Å²	41.3	42%	0.421	24%	0.243	S	C	.	.	S	Bend	trans	-122	171.7	-176.4	-73.2	71.8	0	0	0	110.2	G360 V389 S407 D409	G360-H387 VanDerWaalsContact CA-O 3.3Å; G360-H387 WeakPolarHBondContact CA-O 3.5Å; H387-V389 PolarHBondContact O-N 3.06Å; H387-S407 WeakPolarHBondContact CB-OG 3.34Å; H387-S407 PolarHBondContact O-OG 3.34Å; H387-D409 HydrophobicContact CB-CB 4.23Å
388	P	86	Confident	79.3	Confident	12 Å²	12	43.7 Å²	43.7	8%	0.078	26%	0.258	C	S	.	.			trans	-57.8	136.1	-179.1	-26.2	35.9	0	0	0	113.4	M341 Y358 Y390 S407 S408	M341-P388 HydrophobicContact CG-CB 4.37Å; Y358-P388 HydrophobicContact CD1-CG 4.33Å; Y358-P388 HydrophobicContact CD2-CB 3.65Å; Y358-P388 HydrophobicContact CD2-CG 3.33Å; Y358-P388 HydrophobicContact CE1-CG 4.24Å; Y358-P388 HydrophobicContact CE2-CB 3.98Å; Y358-P388 HydrophobicContact CE2-CG 3.21Å; Y358-P388 HydrophobicContact CG-CB 4.25Å; Y358-P388 HydrophobicContact CG-CG 3.9Å; Y358-P388 VanDerWaalsContact O-CA 3.27Å; Y358-P388 WeakPolarHBondContact O-CA 3.45Å; Y358-P388 WeakPolarHBondContact O-CG 3.44Å; P388-Y390 PolarHBondContact O-N 2.99Å; P388-S407 WeakPolarHBondContact O-CA 3.44Å; P388-S408 PolarHBondContact O-N 3.25Å; P388-S408 PolarHBondContact O-OG 3.31Å
389	V	88	Confident	78.8	Confident	0 Å²	0	51 Å²	51	0%	0	30%	0.296	C	S	.	.			trans	-87.8	91.3	178	-174.4	0	0	0	0	110.1	M341 S342 T357 H385 H387 C391 I406	M341-V389 WeakPolarHBondContact CB-O 3.41Å; S342-V389 PolarHBondContact OG-O 2.94Å; T357-V389 PolarHBondContact O-N 3.07Å; H385-V389 HydrophobicContact CB-CG2 4.11Å; H387-V389 PolarHBondContact O-N 3.06Å; V389-C391 PolarHBondContact O-N 2.99Å; V389-I406 CarbonylContact C-O 3.53Å; V389-I406 VanDerWaalsContact CA-O 3.3Å; V389-I406 WeakPolarHBondContact CA-O 3.36Å; V389-I406 WeakPolarHBondContact CG1-O 3.44Å
390	Y	85.6	Confident	78.8	Confident	71 Å²	71	50.7 Å²	50.7	28%	0.278	30%	0.3	S	S	.	.			trans	-67.5	-32.6	-177.4	-76	-62.7	0	0	0	114.1	M341 S342 P388 I406 S408 I439 T440	M341-Y390 HydrophobicContact CE-CD1 3.54Å; M341-Y390 HydrophobicContact CE-CE1 3.43Å; M341-Y390 VanDerWaalsContact CE-CE1 3.43Å; S342-Y390 WeakPolarHBondContact CB-O 3.5Å; P388-Y390 PolarHBondContact O-N 2.99Å; Y390-I406 PolarHBondContact N-O 3.22Å; Y390-S408 WeakPolarHBondContact CD2-OG 3.4Å; Y390-S408 WeakPolarHBondContact CE2-OG 3.14Å; Y390-I439 WeakPolarHBondContact CD2-O 3.18Å; Y390-T440 VanDerWaalsContact CB-O 3.31Å; Y390-T440 WeakPolarHBondContact CB-O 3.46Å
391	C	82.4	Confident	79.1	Confident	18 Å²	18	47.1 Å²	47.1	12%	0.122	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	137.6	-177.7	-167.7	0	0	0	0	111.5	V389 I406	V389-C391 PolarHBondContact O-N 2.99Å; C391-I406 PolarHBondContact O-N 2.95Å
392	L	86.8	Confident	79.8	Confident	10 Å²	10	45 Å²	45	5%	0.052	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	128.4	177.9	-171.2	85.3	0	0	0	107.8	C344 L354 I362 V403 I404	C344-L392 HydrophobicContact CB-CD2 4.08Å; C344-L392 HydrophobicContact CB-CG 4.46Å; C344-L392 WeakPolarHBondContact CB-O 3.43Å; L354-L392 HydrophobicContact CB-CD2 3.42Å; L354-L392 VanDerWaalsContact CB-CD2 3.42Å; L354-L392 HydrophobicContact CD1-CD2 4.5Å; I362-L392 HydrophobicContact CD1-CD1 4.1Å; I362-L392 HydrophobicContact CG1-CD1 4.41Å; I362-L392 HydrophobicContact CG2-CD1 4.31Å; L392-V403 HydrophobicContact CD1-CG1 3.53Å; L392-V403 HydrophobicContact CD2-CG1 4.21Å; L392-V403 HydrophobicContact CG-CG1 3.85Å; L392-I404 WeakPolarHBondContact CA-O 3.26Å
393	Q	85.3	Confident	81	Confident	47 Å²	47	41.5 Å²	41.5	22%	0.22	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	135.9	176.8	-165.3	167.7	8	0	0	111.6	I404 F444	Q393-I404 PolarHBondContact N-O 2.97Å; Q393-I404 PolarHBondContact O-N 3.04Å; Q393-F444 HydrophobicContact CB-CD2 4.39Å; Q393-F444 HydrophobicContact CB-CE2 4.15Å; Q393-F444 HydrophobicContact CG-CD2 4.19Å; Q393-F444 HydrophobicContact CG-CE2 4.43Å
394	M	84.4	Confident	81.9	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	128.2	172.5	-172.3	179.9	-122.9	0	0	111.1	A346 K347 F348 H401 V403 L417	A346-M394 VanDerWaalsContact CA-SD 3.58Å; A346-M394 HydrophobicContact CB-CE 4.07Å; A346-M394 HydrophobicContact CB-SD 3.92Å; K347-M394 HydrophobicContact CB-SD 4.36Å; K347-M394 PolarHBondContact N-SD 2.8Å; K347-M394 VanDerWaalsContact N-SD 3.4Å; K347-M394 PolarHBondContact NZ-O 2.83Å; F348-M394 HydrophobicContact CD2-SD 4.02Å; F348-M394 HydrophobicContact CE2-SD 4.45Å; M394-H401 HydrophobicContact CE-CB 3.82Å; M394-H401 WeakPolarHBondContact CE-CD2 3.48Å; M394-H401 HydrophobicContact SD-CB 4.4Å; M394-V403 HydrophobicContact CE-CG2 4.34Å; M394-L417 HydrophobicContact CE-CD1 3.28Å; M394-L417 HydrophobicContact CE-CD2 4.22Å; M394-L417 HydrophobicContact CE-CG 3.7Å
395	V	80.4	Confident	82.4	Confident	9 Å²	9	39.4 Å²	39.4	6%	0.055	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136.5	-179.9	-172.8	0	0	0	0	110.8	N402 I404 F444 I449	V395-N402 PolarHBondContact N-O 3.42Å; V395-N402 PolarHBondContact O-N 2.85Å; V395-I404 HydrophobicContact CB-CD1 4.01Å; V395-I404 HydrophobicContact CG2-CD1 3.94Å; V395-F444 HydrophobicContact CG1-CD1 4.28Å; V395-F444 HydrophobicContact CG1-CE1 4.43Å; V395-F444 HydrophobicContact CG2-CD1 3.94Å; V395-F444 HydrophobicContact CG2-CD2 3.34Å; V395-F444 HydrophobicContact CG2-CE1 3.85Å; V395-F444 HydrophobicContact CG2-CE2 3.28Å; V395-F444 HydrophobicContact CG2-CG 3.7Å; V395-F444 HydrophobicContact CG2-CZ 3.56Å; V395-I449 HydrophobicContact CG1-CB 4.44Å; V395-I449 HydrophobicContact CG1-CG2 3.81Å
396	G	76.3	Confident	82.5	Confident	23 Å²	23	39.4 Å²	39.4	24%	0.237	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	142.2	-159.6	171.7	0	0	0	0	0	111.4	F348 A400	F348-G396 VanDerWaalsContact CZ-O 3.24Å; F348-G396 WeakPolarHBondContact CZ-O 3.38Å; G396-A400 CarbonylContact C-O 3.56Å; G396-A400 VanDerWaalsContact CA-O 3.24Å; G396-A400 WeakPolarHBondContact CA-O 3.21Å
397	T	75.4	Confident	82.7	Confident	76 Å²	76	35.9 Å²	35.9	47%	0.466	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	172.1	173.9	64.4	0	0	0	0	109.4	F348 N399 A400 H401	F348-T397 WeakPolarHBondContact CE2-O 3.43Å; T397-N399 PolarHBondContact O-N 2.91Å; T397-N399 VanDerWaalsContact O-N 3.09Å; T397-A400 PolarHBondContact N-O 2.88Å; T397-A400 CarbonylContact O-C 3.45Å; T397-A400 PolarHBondContact O-N 2.84Å; T397-A400 VanDerWaalsContact O-N 3.12Å; T397-H401 WeakPolarHBondContact O-CB 3.22Å; T397-H401 PolarHBondContact O-N 3.04Å
398	Q	72.9	Confident	82.5	Confident	134 Å²	134	32.5 Å²	32.5	63%	0.626	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-37.7	-178.5	-169.7	168.7	30	0	0	113.2	F348 H401	F348-Q398 HydrophobicContact CB-CG 4.41Å; F348-Q398 HydrophobicContact CD1-CB 3.83Å; F348-Q398 HydrophobicContact CD1-CG 4.19Å; F348-Q398 HydrophobicContact CE1-CB 4.17Å; F348-Q398 HydrophobicContact CG-CB 4.32Å; F348-Q398 HydrophobicContact CG-CG 4.45Å; Q398-H401 PolarHBondContact O-ND1 2.88Å
399	N	74.9	Confident	82.2	Confident	154 Å²	154	32.9 Å²	32.9	82%	0.824	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-19.7	-176.8	-61.6	-19.2	0	0	0	113.8	T397	T397-N399 PolarHBondContact O-N 2.91Å; T397-N399 VanDerWaalsContact O-N 3.09Å
400	A	74.6	Confident	81.7	Confident	60 Å²	60	33 Å²	33	50%	0.496	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	78.4	-179.2	0	0	0	0	0	108.1	G396 T397	G396-A400 CarbonylContact C-O 3.56Å; G396-A400 VanDerWaalsContact CA-O 3.24Å; G396-A400 WeakPolarHBondContact CA-O 3.21Å; T397-A400 PolarHBondContact N-O 2.88Å; T397-A400 CarbonylContact O-C 3.45Å; T397-A400 PolarHBondContact O-N 2.84Å; T397-A400 VanDerWaalsContact O-N 3.12Å
401	H	78.7	Confident	81.5	Confident	27 Å²	27	31.3 Å²	31.3	13%	0.125	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121.7	-179.9	55.9	-92.7	0	0	0	109.2	F348 M394 T397 Q398 L417	F348-H401 HydrophobicContact CD2-CB 3.73Å; F348-H401 HydrophobicContact CE2-CB 3.8Å; M394-H401 HydrophobicContact CE-CB 3.82Å; M394-H401 WeakPolarHBondContact CE-CD2 3.48Å; M394-H401 HydrophobicContact SD-CB 4.4Å; T397-H401 WeakPolarHBondContact O-CB 3.22Å; T397-H401 PolarHBondContact O-N 3.04Å; Q398-H401 PolarHBondContact O-ND1 2.88Å; H401-L417 VanDerWaalsContact CD2-CD1 3.44Å; H401-L417 WeakPolarHBondContact CD2-CD1 3.44Å; H401-L417 VanDerWaalsContact CD2-CG 3.46Å; H401-L417 WeakPolarHBondContact CD2-CG 3.36Å; H401-L417 WeakPolarHBondContact NE2-CB 3.3Å; H401-L417 WeakPolarHBondContact NE2-CD1 3.21Å
402	N	85.8	Confident	81.6	Confident	19 Å²	19	30.6 Å²	30.6	10%	0.102	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	142.5	175	-68.3	5.3	0	0	0	108.6	V395 S414 W415 R466	V395-N402 PolarHBondContact N-O 3.42Å; V395-N402 PolarHBondContact O-N 2.85Å; N402-S414 WeakPolarHBondContact CB-OG 3.17Å; N402-S414 PolarHBondContact ND2-OG 2.88Å; N402-S414 VanDerWaalsContact ND2-OG 3.11Å; N402-W415 CarbonylContact C-O 3.59Å; N402-W415 WeakPolarHBondContact CA-O 3.46Å; N402-R466 PolarHBondContact ND2-NH2 3.48Å
403	V	86.7	Confident	81.5	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.5	171.4	-178.6	0	0	0	0	106.9	L354 L392 M394 S414 W415 L417	L354-V403 HydrophobicContact CD1-CB 4.33Å; L354-V403 HydrophobicContact CD1-CG1 3.93Å; L354-V403 HydrophobicContact CD1-CG2 3.41Å; L354-V403 VanDerWaalsContact CD1-CG2 3.41Å; L392-V403 HydrophobicContact CD1-CG1 3.53Å; L392-V403 HydrophobicContact CD2-CG1 4.21Å; L392-V403 HydrophobicContact CG-CG1 3.85Å; M394-V403 HydrophobicContact CE-CG2 4.34Å; V403-S414 CarbonylContact O-C 3.6Å; V403-S414 WeakPolarHBondContact O-CA 3.16Å; V403-W415 HydrophobicContact CB-CB 4.25Å; V403-W415 PolarHBondContact N-O 2.89Å; V403-W415 PolarHBondContact O-N 2.81Å; V403-L417 HydrophobicContact CG2-CD2 3.61Å; V403-L417 HydrophobicContact CG2-CG 4.22Å
404	I	87.1	Confident	81.6	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	134.5	177.6	-60.6	174.5	0	0	0	107.6	L392 Q393 V395 L412 M442 F444	L392-I404 WeakPolarHBondContact CA-O 3.26Å; Q393-I404 PolarHBondContact N-O 2.97Å; Q393-I404 PolarHBondContact O-N 3.04Å; V395-I404 HydrophobicContact CB-CD1 4.01Å; V395-I404 HydrophobicContact CG2-CD1 3.94Å; I404-L412 HydrophobicContact CG2-CD1 3.7Å; I404-L412 HydrophobicContact CG2-CD2 3.95Å; I404-L412 HydrophobicContact CG2-CG 3.67Å; I404-M442 HydrophobicContact CG2-CE 3.51Å; I404-M442 HydrophobicContact CG2-SD 3.93Å; I404-F444 HydrophobicContact CB-CE2 4.4Å; I404-F444 HydrophobicContact CB-CZ 4.07Å; I404-F444 HydrophobicContact CD1-CE1 3.72Å; I404-F444 HydrophobicContact CD1-CE2 4.2Å; I404-F444 HydrophobicContact CD1-CZ 3.29Å; I404-F444 HydrophobicContact CG1-CZ 4.22Å; I404-F444 HydrophobicContact CG2-CZ 4.07Å
405	S	87	Confident	81.7	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	136.1	-175.3	53.1	0	0	0	0	109	H385 L412 C413 W415	H385-S405 PolarHBondContact CE1-O 3.49Å; H385-S405 VanDerWaalsContact NE2-CB 3.26Å; H385-S405 WeakPolarHBondContact NE2-CB 3.18Å; H385-S405 PolarHBondContact NE2-O 2.95Å; H385-S405 PolarHBondContact NE2-OG 3.27Å; S405-L412 WeakPolarHBondContact O-CA 3.42Å; S405-C413 PolarHBondContact N-O 3.12Å; S405-C413 PolarHBondContact O-N 3.21Å; S405-C413 PolarHBondContact OG-O 3.34Å; S405-W415 VanDerWaalsContact OG-CD1 3.24Å; S405-W415 PolarHBondContact OG-NE1 3.12Å
406	I	86.2	Confident	81.9	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.3	176.5	-65.4	-166.7	0	0	0	109.3	V389 Y390 C391 I439 M442 M454	V389-I406 CarbonylContact C-O 3.53Å; V389-I406 VanDerWaalsContact CA-O 3.3Å; V389-I406 WeakPolarHBondContact CA-O 3.36Å; V389-I406 WeakPolarHBondContact CG1-O 3.44Å; Y390-I406 PolarHBondContact N-O 3.22Å; C391-I406 PolarHBondContact O-N 2.95Å; I406-I439 HydrophobicContact CD1-CG2 3.82Å; I406-I439 HydrophobicContact CG2-CB 3.56Å; I406-I439 HydrophobicContact CG2-CD1 4.41Å; I406-I439 HydrophobicContact CG2-CG2 3.61Å; I406-M442 HydrophobicContact CD1-CB 3.31Å; I406-M442 HydrophobicContact CD1-CE 3.36Å; I406-M442 HydrophobicContact CD1-CG 3.96Å; I406-M442 HydrophobicContact CD1-SD 3.68Å; I406-M442 HydrophobicContact CG1-CB 4.32Å; I406-M442 HydrophobicContact CG1-CE 3.61Å; I406-M442 HydrophobicContact CG1-SD 3.84Å; I406-M454 HydrophobicContact CD1-CE 3.45Å; I406-M454 VanDerWaalsContact CD1-CE 3.45Å; I406-M454 HydrophobicContact CD1-CG 3.89Å; I406-M454 HydrophobicContact CD1-SD 4.47Å; I406-M454 HydrophobicContact CG1-CE 4.1Å
407	S	86.4	Confident	82	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.155	C	C	.	.			trans	-122.5	160.4	177	157.2	0	0	0	0	111.4	H385 H387 P388 D409 G410 K411	H385-S407 VanDerWaalsContact CG-CB 3.44Å; H385-S407 WeakPolarHBondContact ND1-CB 3.4Å; H387-S407 WeakPolarHBondContact CB-OG 3.34Å; H387-S407 PolarHBondContact O-OG 3.34Å; P388-S407 WeakPolarHBondContact O-CA 3.44Å; S407-D409 WeakPolarHBondContact CB-OD1 3.34Å; S407-D409 PolarHBondContact O-N 2.89Å; S407-D409 PolarHBondContact OG-N 2.97Å; S407-D409 PolarHBondContact OG-OD1 3.34Å; S407-D409 PolarHBondContact OG-OD2 3.29Å; S407-G410 PolarHBondContact O-N 3.19Å; S407-G410 VanDerWaalsContact O-N 3.16Å; S407-K411 PolarHBondContact N-O 2.81Å
408	S	82	Confident	82.1	Confident	21 Å²	21	31.3 Å²	31.3	15%	0.147	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.5	176.8	-26.7	0	0	0	0	113.6	P388 Y390 G410 A438	P388-S408 PolarHBondContact O-N 3.25Å; P388-S408 PolarHBondContact O-OG 3.31Å; Y390-S408 WeakPolarHBondContact CD2-OG 3.4Å; Y390-S408 WeakPolarHBondContact CE2-OG 3.14Å; S408-G410 PolarHBondContact O-N 3.1Å; S408-A438 WeakPolarHBondContact O-CA 3.47Å; S408-A438 WeakPolarHBondContact O-CB 3.39Å
409	D	79.7	Confident	82.2	Confident	20 Å²	20	29.9 Å²	29.9	11%	0.107	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	2.7	173.6	57.7	10.4	0	0	0	113.9	T386 H387 S407 K411	T386-D409 PolarHBondContact N-OD2 2.97Å; T386-D409 VanDerWaalsContact N-OD2 3.1Å; T386-D409 PolarHBondContact OG1-OD2 2.85Å; H387-D409 HydrophobicContact CB-CB 4.23Å; S407-D409 WeakPolarHBondContact CB-OD1 3.34Å; S407-D409 PolarHBondContact O-N 2.89Å; S407-D409 PolarHBondContact OG-N 2.97Å; S407-D409 PolarHBondContact OG-OD1 3.34Å; S407-D409 PolarHBondContact OG-OD2 3.29Å; D409-K411 PolarHBondContact O-N 3.02Å; D409-K411 WeakPolarHBondContact OD1-CB 3.28Å; D409-K411 PolarHBondContact OD1-N 3.32Å
410	G	77.3	Confident	82.2	Confident	2 Å²	2	22.6 Å²	22.6	2%	0.021	13%	0.128	C	C	.	.	S	Bend	trans	72.2	20.3	178.9	0	0	0	0	0	113.6	S407 S408 L429 I437	S407-G410 PolarHBondContact O-N 3.19Å; S407-G410 VanDerWaalsContact O-N 3.16Å; S408-G410 PolarHBondContact O-N 3.1Å; G410-L429 WeakPolarHBondContact O-CB 3.44Å; G410-L429 PolarHBondContact O-N 2.87Å; G410-I437 WeakPolarHBondContact CA-O 3.27Å; G410-I437 PolarHBondContact N-O 3.02Å
411	K	82.3	Confident	82.2	Confident	35 Å²	35	23 Å²	23	15%	0.152	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	133.8	172.3	-53	-164.9	-170.6	-160.2	0	110.1	A382 H385 S407 D409 T426 L427 E428	A382-K411 PolarHBondContact O-NZ 3.43Å; H385-K411 PolarHBondContact CE1-O 2.89Å; S407-K411 PolarHBondContact N-O 2.81Å; D409-K411 PolarHBondContact O-N 3.02Å; D409-K411 WeakPolarHBondContact OD1-CB 3.28Å; D409-K411 PolarHBondContact OD1-N 3.32Å; K411-T426 HydrophobicContact CD-CG2 4.29Å; K411-L427 WeakPolarHBondContact CA-O 3.35Å; K411-E428 HydrophobicContact CD-CG 4.07Å; K411-E428 WeakPolarHBondContact CE-OE1 3.31Å; K411-E428 HydrophobicContact CG-CG 4.09Å; K411-E428 IonicContact NZ-OE1 2.72Å; K411-E428 PolarHBondContact NZ-OE1 3.05Å
412	L	84.2	Confident	82	Confident	4 Å²	4	28 Å²	28	2%	0.021	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	120.9	163.8	175.8	154.8	0	0	0	108.1	I404 S405 L427 L429 M442 L452 M454	I404-L412 HydrophobicContact CG2-CD1 3.7Å; I404-L412 HydrophobicContact CG2-CD2 3.95Å; I404-L412 HydrophobicContact CG2-CG 3.67Å; S405-L412 WeakPolarHBondContact O-CA 3.42Å; L412-L427 HydrophobicContact CB-CB 4.29Å; L412-L427 HydrophobicContact CD2-CB 4.3Å; L412-L427 PolarHBondContact N-O 2.88Å; L412-L427 PolarHBondContact O-N 3.14Å; L412-L429 HydrophobicContact CB-CD1 4.29Å; L412-M442 HydrophobicContact CD1-CE 3.42Å; L412-M442 VanDerWaalsContact CD1-CE 3.42Å; L412-M442 HydrophobicContact CG-CE 4.41Å; L412-L452 HydrophobicContact CD1-CD1 4.32Å; L412-L452 HydrophobicContact CD1-CD2 3.41Å; L412-L452 VanDerWaalsContact CD1-CD2 3.41Å; L412-M454 HydrophobicContact CB-CE 3.96Å; L412-M454 HydrophobicContact CD1-CE 3.29Å; L412-M454 HydrophobicContact CG-CE 4.22Å
413	C	84.8	Confident	81.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	127.7	174.4	-61.4	0	0	0	0	109.9	H385 S405 W415 P423 D425	H385-C413 PolarHBondContact CE1-SG 3.45Å; S405-C413 PolarHBondContact N-O 3.12Å; S405-C413 PolarHBondContact O-N 3.21Å; S405-C413 PolarHBondContact OG-O 3.34Å; C413-W415 HydrophobicContact CB-CZ2 4.1Å; C413-P423 HydrophobicContact CB-CB 4.26Å; C413-D425 CarbonylContact C-O 3.53Å; C413-D425 WeakPolarHBondContact CA-O 3.46Å
414	S	86.5	Confident	81	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.5	170	173.6	0	0	0	0	109.1	N402 V403 Q424 D425	N402-S414 WeakPolarHBondContact CB-OG 3.17Å; N402-S414 PolarHBondContact ND2-OG 2.88Å; N402-S414 VanDerWaalsContact ND2-OG 3.11Å; V403-S414 CarbonylContact O-C 3.6Å; V403-S414 WeakPolarHBondContact O-CA 3.16Å; S414-Q424 PolarHBondContact O-N 3.08Å; S414-D425 PolarHBondContact N-O 3.13Å; S414-D425 PolarHBondContact O-N 3.4Å
415	W	86.4	Confident	80.5	Confident	1 Å²	1	36.7 Å²	36.7	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	146.5	179.4	-55.4	87.9	0	0	0	109.8	I362 T378 A384 N402 V403 S405 C413 L420 Q422 P423	I362-W415 HydrophobicContact CD1-CD2 4.11Å; I362-W415 HydrophobicContact CD1-CG 3.98Å; I362-W415 HydrophobicContact CD1-CZ2 4.24Å; T378-W415 HydrophobicContact CG2-CD2 4.4Å; T378-W415 HydrophobicContact CG2-CE3 3.97Å; T378-W415 HydrophobicContact CG2-CH2 4.12Å; T378-W415 HydrophobicContact CG2-CZ3 3.81Å; A384-W415 HydrophobicContact CB-CH2 3.7Å; A384-W415 HydrophobicContact CB-CZ2 3.96Å; N402-W415 CarbonylContact C-O 3.59Å; N402-W415 WeakPolarHBondContact CA-O 3.46Å; V403-W415 HydrophobicContact CB-CB 4.25Å; V403-W415 PolarHBondContact N-O 2.89Å; V403-W415 PolarHBondContact O-N 2.81Å; S405-W415 VanDerWaalsContact OG-CD1 3.24Å; S405-W415 PolarHBondContact OG-NE1 3.12Å; C413-W415 HydrophobicContact CB-CZ2 4.1Å; W415-L420 HydrophobicContact CB-CD2 4.04Å; W415-Q422 VanDerWaalsContact CZ3-C 3.42Å; W415-P423 HydrophobicContact CD2-CB 4.14Å; W415-P423 HydrophobicContact CE3-CB 4.02Å; W415-P423 HydrophobicContact CH2-CB 3.76Å; W415-P423 HydrophobicContact CH2-CG 3.92Å; W415-P423 HydrophobicContact CZ2-CB 3.87Å; W415-P423 HydrophobicContact CZ2-CG 4.34Å; W415-P423 HydrophobicContact CZ3-CB 3.85Å; W415-P423 HydrophobicContact CZ3-CG 4.19Å
416	S	85.5	Confident	80.2	Confident	13 Å²	13	39.4 Å²	39.4	9%	0.091	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	146	165.3	58.9	0	0	0	0	109.3	D418 M419 L420 Q424	S416-D418 VanDerWaalsContact C-N 3.26Å; S416-D418 PolarHBondContact O-N 3Å; S416-M419 CarbonylContact O-C 3.53Å; S416-M419 PolarHBondContact O-N 2.87Å; S416-M419 PolarHBondContact OG-N 3.33Å; S416-L420 WeakPolarHBondContact O-CD2 3.34Å; S416-Q424 PolarHBondContact OG-NE2 3.4Å
417	L	76.9	Confident	79.8	Confident	11 Å²	11	40.5 Å²	40.5	6%	0.058	22%	0.217	C	C	.	.	S	Bend	trans	-64.2	-33.3	179.9	-77.7	-168.7	0	0	0	112.7	L352 L354 L364 M394 H401 V403	L352-L417 HydrophobicContact CD1-CD1 4.08Å; L354-L417 HydrophobicContact CD1-CD2 4.09Å; L354-L417 HydrophobicContact CD2-CD2 3.66Å; L354-L417 HydrophobicContact CG-CD2 4.42Å; L364-L417 HydrophobicContact CD1-CD2 4.03Å; M394-L417 HydrophobicContact CE-CD1 3.28Å; M394-L417 HydrophobicContact CE-CD2 4.22Å; M394-L417 HydrophobicContact CE-CG 3.7Å; H401-L417 VanDerWaalsContact CD2-CD1 3.44Å; H401-L417 WeakPolarHBondContact CD2-CD1 3.44Å; H401-L417 VanDerWaalsContact CD2-CG 3.46Å; H401-L417 WeakPolarHBondContact CD2-CG 3.36Å; H401-L417 WeakPolarHBondContact NE2-CB 3.3Å; H401-L417 WeakPolarHBondContact NE2-CD1 3.21Å; V403-L417 HydrophobicContact CG2-CD2 3.61Å; V403-L417 HydrophobicContact CG2-CG 4.22Å
418	D	77.3	Confident	79.3	Confident	152 Å²	152	44.9 Å²	44.9	81%	0.813	24%	0.237	S	C	*	.	S	Bend	trans	-76.1	-29.7	-177.8	-62.3	-33.3	0	0	0	112.5	S416	S416-D418 VanDerWaalsContact C-N 3.26Å; S416-D418 PolarHBondContact O-N 3Å
419	M	76.8	Confident	78.8	Confident	104 Å²	104	44 Å²	44	51%	0.512	23%	0.231	S	C	.	.			trans	-126.4	78.7	-177.2	-169.1	175.6	-68	0	0	110.7	S416 S421	S416-M419 CarbonylContact O-C 3.53Å; S416-M419 PolarHBondContact O-N 2.87Å; S416-M419 PolarHBondContact OG-N 3.33Å; M419-S421 VanDerWaalsContact C-N 3.29Å
420	L	73.3	Confident	78.1	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	0.3	174	-67.1	176.7	0	0	0	113.5	L364 Q376 T378 W415 S416	L364-L420 HydrophobicContact CB-CD1 4.04Å; L364-L420 HydrophobicContact CD1-CD1 3.87Å; Q376-L420 HydrophobicContact CB-CD1 4.47Å; Q376-L420 HydrophobicContact CG-CB 4.35Å; Q376-L420 HydrophobicContact CG-CD1 4.12Å; T378-L420 HydrophobicContact CG2-CB 4.06Å; T378-L420 HydrophobicContact CG2-CD2 4.35Å; T378-L420 VanDerWaalsContact CG2-O 3.3Å; T378-L420 WeakPolarHBondContact CG2-O 3.31Å; W415-L420 HydrophobicContact CB-CD2 4.04Å; S416-L420 WeakPolarHBondContact O-CD2 3.34Å
421	S	74.5	Confident	77.3	Confident	68 Å²	68	52.1 Å²	52.1	48%	0.476	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-27.7	179.6	55.4	0	0	0	0	113.1	P379 M419	P379-S421 WeakPolarHBondContact CD-O 3.4Å; P379-S421 WeakPolarHBondContact CG-O 3.46Å; M419-S421 VanDerWaalsContact C-N 3.29Å
422	Q	76.3	Confident	76.1	Confident	134 Å²	134	62.7 Å²	62.7	63%	0.626	31%	0.307	S	S	*	.	S	Bend	trans	-141.3	142.2	178.4	-69.2	-177.6	-9	0	0	109.9	W415	W415-Q422 VanDerWaalsContact CZ3-C 3.42Å
423	P	75.3	Confident	74.5	Confident	25 Å²	25	70.3 Å²	70.3	16%	0.162	34%	0.343	C	S	.	.			trans	-67.9	137.6	172.1	26.3	-28.3	0	0	0	109	A383 C413 W415	A383-P423 HydrophobicContact CB-CG 3.9Å; A383-P423 VanDerWaalsContact O-CG 3.31Å; A383-P423 WeakPolarHBondContact O-CG 3.39Å; C413-P423 HydrophobicContact CB-CB 4.26Å; W415-P423 HydrophobicContact CD2-CB 4.14Å; W415-P423 HydrophobicContact CE3-CB 4.02Å; W415-P423 HydrophobicContact CH2-CB 3.76Å; W415-P423 HydrophobicContact CH2-CG 3.92Å; W415-P423 HydrophobicContact CZ2-CB 3.87Å; W415-P423 HydrophobicContact CZ2-CG 4.34Å; W415-P423 HydrophobicContact CZ3-CB 3.85Å; W415-P423 HydrophobicContact CZ3-CG 4.19Å
424	Q	74.6	Confident	73.1	Confident	105 Å²	105	75.7 Å²	75.7	49%	0.491	38%	0.38	S	S	.	.	S	Bend	trans	-74	-46.6	177.6	-74.6	-157.6	-24.3	0	0	111.2	S414 S416	S414-Q424 PolarHBondContact O-N 3.08Å; S416-Q424 PolarHBondContact OG-NE2 3.4Å
425	D	76.7	Confident	72.3	Confident	71 Å²	71	82.1 Å²	82.1	38%	0.38	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.4	174.2	-62.1	-49.9	0	0	0	108.8	C413 S414	C413-D425 CarbonylContact C-O 3.53Å; C413-D425 WeakPolarHBondContact CA-O 3.46Å; S414-D425 PolarHBondContact N-O 3.13Å; S414-D425 PolarHBondContact O-N 3.4Å
426	T	81.3	Confident	71.3	Confident	58 Å²	58	84.9 Å²	84.9	36%	0.356	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	117.6	169.5	-54.7	0	0	0	0	107.3	A383 K411	A383-T426 PolarHBondContact O-OG1 2.72Å; A383-T426 VanDerWaalsContact O-OG1 3.14Å; K411-T426 HydrophobicContact CD-CG2 4.29Å
427	L	77.9	Confident	70.8	Confident	23 Å²	23	84.6 Å²	84.6	12%	0.12	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	111.3	178.4	-177.7	67.3	0	0	0	108.2	K411 L412 L429 S471	K411-L427 WeakPolarHBondContact CA-O 3.35Å; L412-L427 HydrophobicContact CB-CB 4.29Å; L412-L427 HydrophobicContact CD2-CB 4.3Å; L412-L427 PolarHBondContact N-O 2.88Å; L412-L427 PolarHBondContact O-N 3.14Å; L427-L429 HydrophobicContact CD2-CD2 3.9Å; L427-L429 HydrophobicContact CG-CD2 4.2Å; L427-S471 WeakPolarHBondContact CD1-OG 3.47Å
428	E	75.6	Confident	70.9	Confident	91 Å²	91	85 Å²	85	43%	0.425	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	121.3	171.1	-58.5	-166.2	165.5	0	0	109.3	K411 Q430	K411-E428 HydrophobicContact CD-CG 4.07Å; K411-E428 WeakPolarHBondContact CE-OE1 3.31Å; K411-E428 HydrophobicContact CG-CG 4.09Å; K411-E428 IonicContact NZ-OE1 2.72Å; K411-E428 PolarHBondContact NZ-OE1 3.05Å; E428-Q430 HydrophobicContact CB-CG 4.32Å; E428-Q430 PolarHBondContact O-N 2.9Å; E428-Q430 VanDerWaalsContact O-N 3.14Å; E428-Q430 PolarHBondContact OE2-NE2 3.41Å
429	L	71.3	Confident	71	Confident	4 Å²	4	77.9 Å²	77.9	2%	0.021	40%	0.395	C	S	.	.			trans	-89.3	86.3	-178.5	-60.3	156.8	0	0	0	107.6	G410 L412 L427 I439 M454 A464 V473	G410-L429 WeakPolarHBondContact O-CB 3.44Å; G410-L429 PolarHBondContact O-N 2.87Å; L412-L429 HydrophobicContact CB-CD1 4.29Å; L427-L429 HydrophobicContact CD2-CD2 3.9Å; L427-L429 HydrophobicContact CG-CD2 4.2Å; L429-I439 HydrophobicContact CB-CD1 4.5Å; L429-I439 HydrophobicContact CD1-CD1 3.17Å; L429-I439 HydrophobicContact CG-CD1 4.44Å; L429-M454 HydrophobicContact CD1-CE 3.31Å; L429-M454 HydrophobicContact CD1-SD 3.4Å; L429-M454 WeakPolarHBondContact CD1-SD 3.41Å; L429-M454 HydrophobicContact CD2-SD 4.2Å; L429-M454 HydrophobicContact CG-SD 4.44Å; L429-A464 HydrophobicContact CD2-CB 4.01Å; L429-V473 HydrophobicContact CB-CG2 4.14Å; L429-V473 HydrophobicContact CD2-CG2 3.78Å
430	Q	66.1	Low	71.2	Confident	108 Å²	108	74.2 Å²	74.2	51%	0.505	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-102.5	124.3	175.2	-60.2	-174	9.4	0	0	109.1	E428	E428-Q430 HydrophobicContact CB-CG 4.32Å; E428-Q430 PolarHBondContact O-N 2.9Å; E428-Q430 VanDerWaalsContact O-N 3.14Å; E428-Q430 PolarHBondContact OE2-NE2 3.41Å
431	Q	59.2	Low	71.5	Confident	84 Å²	84	74.8 Å²	74.8	39%	0.393	38%	0.383	S	S	.	.			trans	-75.2	167.8	164.6	-162.9	162.8	2.8	0	0	109	Q433 I437 Y462	Q431-Q433 CarbonylContact O-C 3.31Å; Q431-Q433 VanDerWaalsContact O-C 3.31Å; Q431-Q433 PolarHBondContact O-N 2.84Å; Q431-I437 HydrophobicContact CB-CD1 4.09Å; Q431-Y462 PolarHBondContact OE1-OH 3.19Å
432	R	57.4	Low	72	Confident	256 Å²	256	71.9 Å²	71.9	97%	0.966	36%	0.362	S	S	*	.	S	Bend	trans	-46.9	-9.9	178.1	-86.7	-178.5	171.6	-174	-1.6	116.2
433	Q	51	Low	72.3	Confident	165 Å²	165	65.8 Å²	65.8	77%	0.771	33%	0.334	S	S	*	.	S	Bend	trans	-120.6	129.5	168.9	-63.8	178.5	1.8	0	0	108.3	Q431 K435	Q431-Q433 CarbonylContact O-C 3.31Å; Q431-Q433 VanDerWaalsContact O-C 3.31Å; Q431-Q433 PolarHBondContact O-N 2.84Å; Q433-K435 PolarHBondContact O-N 3.5Å
434	S	54.8	Low	72.5	Confident	112 Å²	112	65.3 Å²	65.3	78%	0.783	33%	0.33	S	S	*	.	S	Bend	trans	-55.1	21.6	-169.8	-172.3	0	0	0	0	118.3
435	K	69.4	Low	72.5	Confident	139 Å²	139	60.5 Å²	60.5	60%	0.604	31%	0.308	S	S	*	.			trans	-88.3	128.6	175.6	-165.3	-173.7	174.5	-152.5	0	109.3	Q433 I437 D458	Q433-K435 PolarHBondContact O-N 3.5Å; K435-I437 PolarHBondContact O-N 3.06Å; K435-D458 IonicContact NZ-OD1 3.94Å; K435-D458 IonicContact NZ-OD2 2.94Å
436	A	65.4	Low	71.8	Confident	59 Å²	59	59.7 Å²	59.7	49%	0.488	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-64.1	130.5	170.8	0	0	0	0	0	109.7
437	I	75.6	Confident	71	Confident	6 Å²	6	62.1 Å²	62.1	3%	0.031	32%	0.321	C	S	.	.			trans	-88.2	115.9	177.7	-65.4	162.5	0	0	0	107.8	G410 Q431 K435 I439 Y462	G410-I437 WeakPolarHBondContact CA-O 3.27Å; G410-I437 PolarHBondContact N-O 3.02Å; Q431-I437 HydrophobicContact CB-CD1 4.09Å; K435-I437 PolarHBondContact O-N 3.06Å; I437-I439 HydrophobicContact CG2-CG1 4.02Å; I437-I439 PolarHBondContact O-N 3.38Å; I437-Y462 HydrophobicContact CD1-CE1 4.04Å; I437-Y462 HydrophobicContact CD1-CE2 3.81Å; I437-Y462 WeakPolarHBondContact CD1-OH 3.46Å; I437-Y462 HydrophobicContact CG1-CE2 4.36Å; I437-Y462 HydrophobicContact CG2-CD2 4.11Å; I437-Y462 HydrophobicContact CG2-CE2 3.51Å
438	A	78.1	Confident	70.5	Confident	21 Å²	21	65.6 Å²	65.6	17%	0.174	34%	0.337	C	S	.	.			trans	-72	127.6	170	0	0	0	0	0	109.6	S408 S456 E457	S408-A438 WeakPolarHBondContact O-CA 3.47Å; S408-A438 WeakPolarHBondContact O-CB 3.39Å; A438-S456 VanDerWaalsContact O-CA 3.25Å; A438-S456 WeakPolarHBondContact O-CA 3.18Å; A438-S456 WeakPolarHBondContact O-CB 3.2Å; A438-E457 HydrophobicContact CB-CB 4.15Å; A438-E457 PolarHBondContact O-N 3.04Å
439	I	80.3	Confident	70.4	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.3	-177.9	-59.1	162.8	0	0	0	108.5	Y390 I406 L429 I437 M454 G455	Y390-I439 WeakPolarHBondContact CD2-O 3.18Å; I406-I439 HydrophobicContact CD1-CG2 3.82Å; I406-I439 HydrophobicContact CG2-CB 3.56Å; I406-I439 HydrophobicContact CG2-CD1 4.41Å; I406-I439 HydrophobicContact CG2-CG2 3.61Å; L429-I439 HydrophobicContact CB-CD1 4.5Å; L429-I439 HydrophobicContact CD1-CD1 3.17Å; L429-I439 HydrophobicContact CG-CD1 4.44Å; I437-I439 HydrophobicContact CG2-CG1 4.02Å; I437-I439 PolarHBondContact O-N 3.38Å; I439-M454 HydrophobicContact CD1-CB 4.4Å; I439-M454 HydrophobicContact CD1-CE 4.12Å; I439-M454 HydrophobicContact CD1-CG 4.31Å; I439-M454 HydrophobicContact CD1-SD 3.78Å; I439-M454 HydrophobicContact CG2-CB 3.92Å; I439-M454 HydrophobicContact CG2-CG 4.12Å; I439-G455 CarbonylContact C-O 3.55Å; I439-G455 VanDerWaalsContact CA-O 3.3Å; I439-G455 WeakPolarHBondContact CA-O 3.45Å; I439-G455 WeakPolarHBondContact CG2-O 3.48Å
440	T	80.2	Confident	70.7	Confident	26 Å²	26	68.8 Å²	68.8	16%	0.16	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-40.6	-173.6	51.1	0	0	0	0	111.8	Y390 G455 E457 I484	Y390-T440 VanDerWaalsContact CB-O 3.31Å; Y390-T440 WeakPolarHBondContact CB-O 3.46Å; T440-G455 PolarHBondContact N-O 3.01Å; T440-G455 PolarHBondContact OG1-O 3.27Å; T440-G455 VanDerWaalsContact OG1-O 3.14Å; T440-E457 HydrophobicContact CG2-CB 4.11Å; T440-I484 VanDerWaalsContact CB-O 3.31Å; T440-I484 WeakPolarHBondContact CB-O 3.13Å; T440-I484 PolarHBondContact OG1-O 2.86Å
441	S	79.7	Confident	71.3	Confident	14 Å²	14	64.1 Å²	64.1	10%	0.098	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	152.3	-175.3	-169	0	0	0	0	112	G455 I487	S441-G455 PolarHBondContact O-N 3.34Å; S441-I487 PolarHBondContact OG-N 3.03Å
442	M	85.7	Confident	72.4	Confident	7 Å²	7	60.1 Å²	60.1	3%	0.034	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	146.5	177.9	149.7	-166.2	-93.4	0	0	110.4	I404 I406 L412 F444 L452 V453 M454	I404-M442 HydrophobicContact CG2-CE 3.51Å; I404-M442 HydrophobicContact CG2-SD 3.93Å; I406-M442 HydrophobicContact CD1-CB 3.31Å; I406-M442 HydrophobicContact CD1-CE 3.36Å; I406-M442 HydrophobicContact CD1-CG 3.96Å; I406-M442 HydrophobicContact CD1-SD 3.68Å; I406-M442 HydrophobicContact CG1-CB 4.32Å; I406-M442 HydrophobicContact CG1-CE 3.61Å; I406-M442 HydrophobicContact CG1-SD 3.84Å; L412-M442 HydrophobicContact CD1-CE 3.42Å; L412-M442 VanDerWaalsContact CD1-CE 3.42Å; L412-M442 HydrophobicContact CG-CE 4.41Å; M442-F444 HydrophobicContact CE-CE2 4.03Å; M442-F444 HydrophobicContact CE-CZ 3.73Å; M442-F444 HydrophobicContact CG-CD2 4.47Å; M442-F444 HydrophobicContact CG-CE2 3.95Å; M442-F444 HydrophobicContact SD-CD2 4.48Å; M442-F444 HydrophobicContact SD-CE2 3.47Å; M442-F444 WeakPolarHBondContact SD-CE2 3.44Å; M442-F444 HydrophobicContact SD-CZ 3.83Å; M442-L452 HydrophobicContact CE-CD1 3.95Å; M442-L452 HydrophobicContact CE-CD2 4.02Å; M442-L452 HydrophobicContact CE-CG 4.39Å; M442-V453 WeakPolarHBondContact CA-O 3.48Å; M442-M454 HydrophobicContact CE-CE 3.84Å
443	A	82.8	Confident	73.7	Confident	6 Å²	6	48 Å²	48	5%	0.05	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	146.9	168.5	0	0	0	0	0	111.1	V453 I487 T489	A443-V453 PolarHBondContact N-O 3.17Å; A443-V453 PolarHBondContact O-N 3.36Å; A443-I487 HydrophobicContact CB-CB 4.38Å; A443-I487 HydrophobicContact CB-CG2 3.84Å; A443-T489 HydrophobicContact CB-CG2 3.62Å
444	F	79.1	Confident	75.3	Confident	15 Å²	15	40.1 Å²	40.1	7%	0.066	23%	0.234	C	C	.	.			trans	-101	125.1	171.6	-71.1	-87.8	0	0	0	110.4	Q393 V395 I404 M442 A446 L452 T489	Q393-F444 HydrophobicContact CB-CD2 4.39Å; Q393-F444 HydrophobicContact CB-CE2 4.15Å; Q393-F444 HydrophobicContact CG-CD2 4.19Å; Q393-F444 HydrophobicContact CG-CE2 4.43Å; V395-F444 HydrophobicContact CG1-CD1 4.28Å; V395-F444 HydrophobicContact CG1-CE1 4.43Å; V395-F444 HydrophobicContact CG2-CD1 3.94Å; V395-F444 HydrophobicContact CG2-CD2 3.34Å; V395-F444 HydrophobicContact CG2-CE1 3.85Å; V395-F444 HydrophobicContact CG2-CE2 3.28Å; V395-F444 HydrophobicContact CG2-CG 3.7Å; V395-F444 HydrophobicContact CG2-CZ 3.56Å; I404-F444 HydrophobicContact CB-CE2 4.4Å; I404-F444 HydrophobicContact CB-CZ 4.07Å; I404-F444 HydrophobicContact CD1-CE1 3.72Å; I404-F444 HydrophobicContact CD1-CE2 4.2Å; I404-F444 HydrophobicContact CD1-CZ 3.29Å; I404-F444 HydrophobicContact CG1-CZ 4.22Å; I404-F444 HydrophobicContact CG2-CZ 4.07Å; M442-F444 HydrophobicContact CE-CE2 4.03Å; M442-F444 HydrophobicContact CE-CZ 3.73Å; M442-F444 HydrophobicContact CG-CD2 4.47Å; M442-F444 HydrophobicContact CG-CE2 3.95Å; M442-F444 HydrophobicContact SD-CD2 4.48Å; M442-F444 HydrophobicContact SD-CE2 3.47Å; M442-F444 WeakPolarHBondContact SD-CE2 3.44Å; M442-F444 HydrophobicContact SD-CZ 3.83Å; F444-A446 PolarHBondContact O-N 2.6Å; F444-L452 HydrophobicContact CD1-CB 3.87Å; F444-L452 HydrophobicContact CE1-CB 3.54Å; F444-L452 HydrophobicContact CE1-CD2 4.09Å; F444-L452 HydrophobicContact CE1-CG 4.46Å; F444-L452 HydrophobicContact CZ-CB 4.08Å; F444-L452 HydrophobicContact CZ-CD2 4.33Å; F444-T489 PolarHBondContact O-OG1 3.13Å
445	P	74.3	Confident	76.8	Confident	4 Å²	4	34.8 Å²	34.8	3%	0.026	20%	0.197	C	C	.	.			trans	-56.3	129.1	165.7	-20.1	32.2	0	0	0	109.9	N447 E448 S451 V453 T489 L516	P445-N447 PolarHBondContact O-N 3.18Å; P445-E448 PolarHBondContact O-N 3.18Å; P445-E448 VanDerWaalsContact O-O 3.07Å; P445-S451 WeakPolarHBondContact CD-O 3.46Å; P445-V453 HydrophobicContact CG-CG2 4.43Å; P445-T489 HydrophobicContact CG-CG2 4.23Å; P445-L516 HydrophobicContact CB-CD1 4.45Å; P445-L516 HydrophobicContact CG-CD1 3.97Å
446	A	63.2	Low	77.6	Confident	54 Å²	54	28.1 Å²	28.1	45%	0.446	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.4	-173.1	0	0	0	0	0	114	F444 Y491	F444-A446 PolarHBondContact O-N 2.6Å; A446-Y491 HydrophobicContact CB-CD2 4.02Å; A446-Y491 HydrophobicContact CB-CE2 4.42Å
447	N	63	Low	78.4	Confident	108 Å²	108	30 Å²	30	58%	0.578	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-18.2	-179.7	-161	24.4	0	0	0	113.2	P445	P445-N447 PolarHBondContact O-N 3.18Å
448	E	69.1	Low	78.7	Confident	97 Å²	97	32.9 Å²	32.9	45%	0.453	18%	0.182	S	C	.	.			trans	-126.7	115.3	-173.5	-66.1	-169.1	-177.7	0	0	111.7	P445 N450 S451	P445-E448 PolarHBondContact O-N 3.18Å; P445-E448 VanDerWaalsContact O-O 3.07Å; E448-N450 VanDerWaalsContact C-N 3.27Å; E448-S451 WeakPolarHBondContact OE2-CB 3.35Å
449	I	72.3	Confident	78.9	Confident	82 Å²	82	31.9 Å²	31.9	42%	0.421	17%	0.174	S	C	.	.	S	Bend	trans	-77.6	-20.8	176.9	-66.3	163.6	0	0	0	111.3	V395 R466	V395-I449 HydrophobicContact CG1-CB 4.44Å; V395-I449 HydrophobicContact CG1-CG2 3.81Å; I449-R466 WeakPolarHBondContact O-CD 3.31Å
450	N	77.1	Confident	79.2	Confident	79 Å²	79	35.7 Å²	35.7	42%	0.422	19%	0.189	S	C	.	.	S	Bend	trans	-99.3	-37.1	-171.2	-69.3	-26.8	0	0	0	113.8	E448 S465 R466	E448-N450 VanDerWaalsContact C-N 3.27Å; N450-S465 CarbonylContact O-C 3.57Å; N450-S465 WeakPolarHBondContact O-CA 3.26Å; N450-R466 HydrophobicContact CB-CG 4.36Å; N450-R466 PolarHBondContact O-N 3.14Å
451	S	80.6	Confident	79.6	Confident	11 Å²	11	34.4 Å²	34.4	8%	0.077	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	139.6	174.5	-171.2	0	0	0	0	109.4	P445 E448 A464	P445-S451 WeakPolarHBondContact CD-O 3.46Å; E448-S451 WeakPolarHBondContact OE2-CB 3.35Å; S451-A464 CarbonylContact C-O 3.56Å; S451-A464 WeakPolarHBondContact CA-O 3.45Å
452	L	81.7	Confident	79.8	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.9	179	65.5	88.5	0	0	0	109	L412 M442 F444 M454 S463 A464	L412-L452 HydrophobicContact CD1-CD1 4.32Å; L412-L452 HydrophobicContact CD1-CD2 3.41Å; L412-L452 VanDerWaalsContact CD1-CD2 3.41Å; M442-L452 HydrophobicContact CE-CD1 3.95Å; M442-L452 HydrophobicContact CE-CD2 4.02Å; M442-L452 HydrophobicContact CE-CG 4.39Å; F444-L452 HydrophobicContact CD1-CB 3.87Å; F444-L452 HydrophobicContact CE1-CB 3.54Å; F444-L452 HydrophobicContact CE1-CD2 4.09Å; F444-L452 HydrophobicContact CE1-CG 4.46Å; F444-L452 HydrophobicContact CZ-CB 4.08Å; F444-L452 HydrophobicContact CZ-CD2 4.33Å; L452-M454 HydrophobicContact CD1-CE 3.33Å; L452-M454 HydrophobicContact CD1-CG 3.37Å; L452-M454 HydrophobicContact CD1-SD 3.3Å; L452-M454 WeakPolarHBondContact CD1-SD 3.41Å; L452-M454 HydrophobicContact CD2-CE 4.48Å; L452-S463 CarbonylContact O-C 3.55Å; L452-S463 WeakPolarHBondContact O-CA 3.26Å; L452-A464 HydrophobicContact CD1-CB 3.64Å; L452-A464 HydrophobicContact CD2-CB 4.48Å; L452-A464 HydrophobicContact CG-CB 3.96Å; L452-A464 WeakPolarHBondContact CG-O 3.31Å; L452-A464 PolarHBondContact N-O 3.15Å; L452-A464 PolarHBondContact O-N 2.74Å
453	V	85.2	Confident	79.7	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.3	177.6	-174.1	0	0	0	0	108.1	M442 A443 P445 V461 Y462 I487 F502 L516	M442-V453 WeakPolarHBondContact CA-O 3.48Å; A443-V453 PolarHBondContact N-O 3.17Å; A443-V453 PolarHBondContact O-N 3.36Å; P445-V453 HydrophobicContact CG-CG2 4.43Å; V453-V461 HydrophobicContact CG1-CG1 3.42Å; V453-V461 VanDerWaalsContact CG1-CG1 3.42Å; V453-Y462 CarbonylContact C-O 3.56Å; V453-Y462 WeakPolarHBondContact CA-O 3.41Å; V453-I487 HydrophobicContact CG1-CD1 4.2Å; V453-I487 HydrophobicContact CG1-CG2 4.17Å; V453-F502 HydrophobicContact CG1-CD2 3.98Å; V453-F502 HydrophobicContact CG1-CE2 3.91Å; V453-F502 HydrophobicContact CG1-CG 4.4Å; V453-F502 HydrophobicContact CG1-CZ 4.23Å; V453-F502 HydrophobicContact CG2-CD1 4.42Å; V453-L516 HydrophobicContact CG2-CD2 3.76Å
454	M	84.7	Confident	79.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.1	-175.4	-76.6	163.3	157.8	0	0	110.7	I406 L412 L429 I439 M442 L452 V461 Y462 A464 I487	I406-M454 HydrophobicContact CD1-CE 3.45Å; I406-M454 VanDerWaalsContact CD1-CE 3.45Å; I406-M454 HydrophobicContact CD1-CG 3.89Å; I406-M454 HydrophobicContact CD1-SD 4.47Å; I406-M454 HydrophobicContact CG1-CE 4.1Å; L412-M454 HydrophobicContact CB-CE 3.96Å; L412-M454 HydrophobicContact CD1-CE 3.29Å; L412-M454 HydrophobicContact CG-CE 4.22Å; L429-M454 HydrophobicContact CD1-CE 3.31Å; L429-M454 HydrophobicContact CD1-SD 3.4Å; L429-M454 WeakPolarHBondContact CD1-SD 3.41Å; L429-M454 HydrophobicContact CD2-SD 4.2Å; L429-M454 HydrophobicContact CG-SD 4.44Å; I439-M454 HydrophobicContact CD1-CB 4.4Å; I439-M454 HydrophobicContact CD1-CE 4.12Å; I439-M454 HydrophobicContact CD1-CG 4.31Å; I439-M454 HydrophobicContact CD1-SD 3.78Å; I439-M454 HydrophobicContact CG2-CB 3.92Å; I439-M454 HydrophobicContact CG2-CG 4.12Å; M442-M454 HydrophobicContact CE-CE 3.84Å; L452-M454 HydrophobicContact CD1-CE 3.33Å; L452-M454 HydrophobicContact CD1-CG 3.37Å; L452-M454 HydrophobicContact CD1-SD 3.3Å; L452-M454 WeakPolarHBondContact CD1-SD 3.41Å; L452-M454 HydrophobicContact CD2-CE 4.48Å; M454-V461 CarbonylContact O-C 3.45Å; M454-V461 WeakPolarHBondContact O-CA 3.43Å; M454-V461 WeakPolarHBondContact O-CG1 3.23Å; M454-Y462 PolarHBondContact N-O 3.12Å; M454-Y462 PolarHBondContact O-N 2.92Å; M454-A464 HydrophobicContact SD-CB 4.03Å; M454-I487 VanDerWaalsContact C-CD1 3.46Å
455	G	85.4	Confident	79.6	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.7	174.4	0	0	0	0	0	110	I439 T440 S441 I487	I439-G455 CarbonylContact C-O 3.55Å; I439-G455 VanDerWaalsContact CA-O 3.3Å; I439-G455 WeakPolarHBondContact CA-O 3.45Å; I439-G455 WeakPolarHBondContact CG2-O 3.48Å; T440-G455 PolarHBondContact N-O 3.01Å; T440-G455 PolarHBondContact OG1-O 3.27Å; T440-G455 VanDerWaalsContact OG1-O 3.14Å; S441-G455 PolarHBondContact O-N 3.34Å; G455-I487 VanDerWaalsContact CA-CD1 3.44Å
456	S	85.3	Confident	79.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	154.1	172.7	64.7	0	0	0	0	112.7	A438 D458 G459 Y460 Y462 I484	A438-S456 VanDerWaalsContact O-CA 3.25Å; A438-S456 WeakPolarHBondContact O-CA 3.18Å; A438-S456 WeakPolarHBondContact O-CB 3.2Å; S456-D458 PolarHBondContact O-N 2.97Å; S456-G459 PolarHBondContact O-N 3.2Å; S456-Y460 WeakPolarHBondContact CB-O 3.26Å; S456-Y460 PolarHBondContact N-O 3.15Å; S456-Y460 WeakPolarHBondContact OG-CA 3.3Å; S456-Y460 WeakPolarHBondContact OG-CB 3.33Å; S456-Y460 PolarHBondContact OG-N 3.34Å; S456-Y460 PolarHBondContact OG-O 2.86Å; S456-Y462 WeakPolarHBondContact OG-CE2 3.32Å; S456-I484 PolarHBondContact O-N 2.93Å
457	E	83.6	Confident	79.5	Confident	99 Å²	99	39.8 Å²	39.8	46%	0.463	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.9	169.3	-166.4	-176.2	161.3	0	0	111.8	A438 T440 G459 P483	A438-E457 HydrophobicContact CB-CB 4.15Å; A438-E457 PolarHBondContact O-N 3.04Å; T440-E457 HydrophobicContact CG2-CB 4.11Å; E457-G459 PolarHBondContact O-N 3.36Å; E457-P483 HydrophobicContact CG-CB 4.08Å; E457-P483 HydrophobicContact CG-CG 4.19Å; E457-P483 VanDerWaalsContact O-CA 3.26Å; E457-P483 WeakPolarHBondContact O-CA 3.3Å; E457-P483 WeakPolarHBondContact O-CB 3.35Å; E457-P483 WeakPolarHBondContact O-CG 3.4Å
458	D	81.9	Confident	79.4	Confident	65 Å²	65	36.9 Å²	36.9	35%	0.348	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-2.5	177.3	-74.2	-23.9	0	0	0	112.9	K435 S456 Y460 R479	K435-D458 IonicContact NZ-OD1 3.94Å; K435-D458 IonicContact NZ-OD2 2.94Å; S456-D458 PolarHBondContact O-N 2.97Å; D458-Y460 HydrophobicContact CB-CD2 4.11Å; D458-R479 PolarHBondContact O-NE 2.67Å; D458-R479 VanDerWaalsContact O-NE 3.08Å
459	G	82	Confident	78.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	89.7	-0.2	177.1	0	0	0	0	0	114.6	S456 E457 H480 G482	S456-G459 PolarHBondContact O-N 3.2Å; E457-G459 PolarHBondContact O-N 3.36Å; G459-H480 WeakPolarHBondContact O-CB 3.45Å; G459-H480 PolarHBondContact O-N 3.37Å; G459-G482 WeakPolarHBondContact CA-O 3.45Å
460	Y	87	Confident	78.2	Confident	82 Å²	82	46.9 Å²	46.9	32%	0.322	23%	0.232	S	C	.	.			trans	-84.5	140.2	174.2	-64.6	-83.1	0	0	0	111.2	S456 D458 V476 R479 I484	S456-Y460 WeakPolarHBondContact CB-O 3.26Å; S456-Y460 PolarHBondContact N-O 3.15Å; S456-Y460 WeakPolarHBondContact OG-CA 3.3Å; S456-Y460 WeakPolarHBondContact OG-CB 3.33Å; S456-Y460 PolarHBondContact OG-N 3.34Å; S456-Y460 PolarHBondContact OG-O 2.86Å; D458-Y460 HydrophobicContact CB-CD2 4.11Å; Y460-V476 HydrophobicContact CD1-CG1 3.68Å; Y460-V476 HydrophobicContact CE1-CG1 4.41Å; Y460-V476 HydrophobicContact CG-CG1 4.18Å; Y460-R479 HydrophobicContact CD1-CB 4.01Å; Y460-R479 HydrophobicContact CE1-CB 3.7Å; Y460-R479 HydrophobicContact CE1-CG 4.37Å; Y460-I484 VanDerWaalsContact C-CD1 3.49Å; Y460-I484 VanDerWaalsContact O-CD1 3.23Å; Y460-I484 WeakPolarHBondContact O-CD1 3.12Å
461	V	86.9	Confident	77.4	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	134.5	164.7	-165.7	0	0	0	0	108.3	V453 M454 Y477 I484 I487 F502 T504 W514	V453-V461 HydrophobicContact CG1-CG1 3.42Å; V453-V461 VanDerWaalsContact CG1-CG1 3.42Å; M454-V461 CarbonylContact O-C 3.45Å; M454-V461 WeakPolarHBondContact O-CA 3.43Å; M454-V461 WeakPolarHBondContact O-CG1 3.23Å; V461-Y477 HydrophobicContact CB-CD2 3.86Å; V461-Y477 HydrophobicContact CB-CG 4.29Å; V461-Y477 HydrophobicContact CG1-CD2 4.01Å; V461-Y477 WeakPolarHBondContact O-CD2 3.34Å; V461-Y477 PolarHBondContact O-N 3.25Å; V461-I484 HydrophobicContact CB-CD1 4.39Å; V461-I484 HydrophobicContact CG2-CD1 3.6Å; V461-I487 HydrophobicContact CG1-CD1 4.15Å; V461-F502 HydrophobicContact CG1-CE2 3.81Å; V461-F502 HydrophobicContact CG1-CZ 4.27Å; V461-T504 HydrophobicContact CG1-CG2 4.33Å; V461-T504 HydrophobicContact CG2-CG2 3.77Å; V461-W514 HydrophobicContact CG2-CZ2 4.49Å
462	Y	84.8	Confident	76.8	Confident	4 Å²	4	46 Å²	46	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.1	179.2	-65.7	-71.3	0	0	0	109.7	Q431 I437 V453 M454 S456 V473 E475 V476	Q431-Y462 PolarHBondContact OE1-OH 3.19Å; I437-Y462 HydrophobicContact CD1-CE1 4.04Å; I437-Y462 HydrophobicContact CD1-CE2 3.81Å; I437-Y462 WeakPolarHBondContact CD1-OH 3.46Å; I437-Y462 HydrophobicContact CG1-CE2 4.36Å; I437-Y462 HydrophobicContact CG2-CD2 4.11Å; I437-Y462 HydrophobicContact CG2-CE2 3.51Å; V453-Y462 CarbonylContact C-O 3.56Å; V453-Y462 WeakPolarHBondContact CA-O 3.41Å; M454-Y462 PolarHBondContact N-O 3.12Å; M454-Y462 PolarHBondContact O-N 2.92Å; S456-Y462 WeakPolarHBondContact OG-CE2 3.32Å; Y462-V473 HydrophobicContact CD1-CG1 3.39Å; Y462-V473 HydrophobicContact CD1-CG2 4.41Å; Y462-V473 HydrophobicContact CE1-CG1 4.09Å; Y462-V473 HydrophobicContact CG-CG1 4.16Å; Y462-E475 WeakPolarHBondContact CA-O 3.38Å; Y462-V476 HydrophobicContact CD1-CB 4.29Å; Y462-V476 HydrophobicContact CD1-CG1 4.09Å; Y462-V476 HydrophobicContact CD1-CG2 3.81Å; Y462-V476 HydrophobicContact CE1-CB 4.17Å; Y462-V476 HydrophobicContact CE1-CG1 3.66Å; Y462-V476 HydrophobicContact CE1-CG2 3.63Å
463	S	83.1	Confident	76.3	Confident	7 Å²	7	48 Å²	48	5%	0.049	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.6	160.1	176.2	0	0	0	0	108	L452 N474 E475	L452-S463 CarbonylContact O-C 3.55Å; L452-S463 WeakPolarHBondContact O-CA 3.26Å; S463-N474 PolarHBondContact O-N 3.3Å; S463-E475 PolarHBondContact N-O 3.32Å; S463-E475 PolarHBondContact O-N 3.09Å
464	A	79.7	Confident	75.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	161.9	173.4	0	0	0	0	0	111.1	L429 S451 L452 M454 G472	L429-A464 HydrophobicContact CD2-CB 4.01Å; S451-A464 CarbonylContact C-O 3.56Å; S451-A464 WeakPolarHBondContact CA-O 3.45Å; L452-A464 HydrophobicContact CD1-CB 3.64Å; L452-A464 HydrophobicContact CD2-CB 4.48Å; L452-A464 HydrophobicContact CG-CB 3.96Å; L452-A464 WeakPolarHBondContact CG-O 3.31Å; L452-A464 PolarHBondContact N-O 3.15Å; L452-A464 PolarHBondContact O-N 2.74Å; M454-A464 HydrophobicContact SD-CB 4.03Å; A464-G472 VanDerWaalsContact CA-O 3.3Å; A464-G472 WeakPolarHBondContact CA-O 3.47Å; A464-G472 WeakPolarHBondContact CB-O 3.38Å
465	S	80.4	Confident	75.2	Confident	22 Å²	22	54.6 Å²	54.6	15%	0.154	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.4	170.7	-70.5	0	0	0	0	111.1	N450 G472 N474	N450-S465 CarbonylContact O-C 3.57Å; N450-S465 WeakPolarHBondContact O-CA 3.26Å; S465-G472 PolarHBondContact N-O 2.58Å; S465-G472 PolarHBondContact O-N 3.36Å; S465-N474 PolarHBondContact OG-ND2 2.99Å
466	R	69.6	Low	75	Confident	43 Å²	43	57.1 Å²	57.1	16%	0.162	29%	0.294	C	S	.	.	S	Bend	trans	-74.5	-29.2	-176.6	69.9	-176	-86	-165.6	-8.3	114.1	N402 I449 N450	N402-R466 PolarHBondContact ND2-NH2 3.48Å; I449-R466 WeakPolarHBondContact O-CD 3.31Å; N450-R466 HydrophobicContact CB-CG 4.36Å; N450-R466 PolarHBondContact O-N 3.14Å
467	H	66.1	Low	74.8	Confident	137 Å²	137	57.2 Å²	57.2	63%	0.634	30%	0.295	S	S	*	.	S	Bend	trans	-145.6	128	-170.3	-164.5	77	0	0	0	110.9
468	G	61.8	Low	74.5	Confident	46 Å²	46	57 Å²	57	47%	0.474	29%	0.293	S	S	.	.	S	Bend	trans	138.8	179.8	175.8	0	0	0	0	0	113.9	R470 S471	G468-R470 PolarHBondContact O-N 2.86Å; G468-S471 WeakPolarHBondContact O-CB 3.31Å; G468-S471 PolarHBondContact O-N 3.19Å
469	L	56.1	Low	74.3	Confident	193 Å²	193	60.8 Å²	60.8	100%	1.01	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.9	175.6	-113.7	84	0	0	0	113.2
470	R	58.8	Low	74.2	Confident	197 Å²	197	60.8 Å²	60.8	74%	0.743	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	41.9	171.6	-60.6	-170.9	-177.8	-163.6	2.1	111.1	G468 G472 N474	G468-R470 PolarHBondContact O-N 2.86Å; R470-G472 PolarHBondContact O-N 3.27Å; R470-N474 PolarHBondContact O-OD1 3.27Å
471	S	61.2	Low	74	Confident	59 Å²	59	64.2 Å²	64.2	41%	0.413	33%	0.326	S	S	.	.			trans	-68.7	118.8	170.5	-166.6	0	0	0	0	108.5	L427 G468	L427-S471 WeakPolarHBondContact CD1-OG 3.47Å; G468-S471 WeakPolarHBondContact O-CB 3.31Å; G468-S471 PolarHBondContact O-N 3.19Å
472	G	67.3	Low	73.8	Confident	13 Å²	13	64.8 Å²	64.8	13%	0.134	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	136	-171.4	-172.3	0	0	0	0	0	112.7	A464 S465 R470 N474	A464-G472 VanDerWaalsContact CA-O 3.3Å; A464-G472 WeakPolarHBondContact CA-O 3.47Å; A464-G472 WeakPolarHBondContact CB-O 3.38Å; S465-G472 PolarHBondContact N-O 2.58Å; S465-G472 PolarHBondContact O-N 3.36Å; R470-G472 PolarHBondContact O-N 3.27Å; G472-N474 PolarHBondContact O-N 3.29Å
473	V	71.6	Confident	73.9	Confident	40 Å²	40	66.6 Å²	66.6	24%	0.242	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	117.4	175.9	178.2	0	0	0	0	109	L429 Y462 V476	L429-V473 HydrophobicContact CB-CG2 4.14Å; L429-V473 HydrophobicContact CD2-CG2 3.78Å; Y462-V473 HydrophobicContact CD1-CG1 3.39Å; Y462-V473 HydrophobicContact CD1-CG2 4.41Å; Y462-V473 HydrophobicContact CE1-CG1 4.09Å; Y462-V473 HydrophobicContact CG-CG1 4.16Å; V473-V476 HydrophobicContact CG1-CG2 4.14Å
474	N	72.3	Confident	74.2	Confident	59 Å²	59	66.2 Å²	66.2	32%	0.316	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-61.1	178.3	-72.8	-36	0	0	0	111	S463 S465 R470 G472	S463-N474 PolarHBondContact O-N 3.3Å; S465-N474 PolarHBondContact OG-ND2 2.99Å; R470-N474 PolarHBondContact O-OD1 3.27Å; G472-N474 PolarHBondContact O-N 3.29Å
475	E	74.6	Confident	74.4	Confident	81 Å²	81	67.6 Å²	67.6	38%	0.379	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	140	-171.9	-62.9	-171.3	171.7	0	0	109.5	Y462 S463	Y462-E475 WeakPolarHBondContact CA-O 3.38Å; S463-E475 PolarHBondContact N-O 3.32Å; S463-E475 PolarHBondContact O-N 3.09Å
476	V	80.9	Confident	74.6	Confident	52 Å²	52	66.6 Å²	66.6	32%	0.315	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	114.4	174.6	-172.1	0	0	0	0	105.7	Y460 Y462 V473	Y460-V476 HydrophobicContact CD1-CG1 3.68Å; Y460-V476 HydrophobicContact CE1-CG1 4.41Å; Y460-V476 HydrophobicContact CG-CG1 4.18Å; Y462-V476 HydrophobicContact CD1-CB 4.29Å; Y462-V476 HydrophobicContact CD1-CG1 4.09Å; Y462-V476 HydrophobicContact CD1-CG2 3.81Å; Y462-V476 HydrophobicContact CE1-CB 4.17Å; Y462-V476 HydrophobicContact CE1-CG1 3.66Å; Y462-V476 HydrophobicContact CE1-CG2 3.63Å; V473-V476 HydrophobicContact CG1-CG2 4.14Å
477	Y	81.1	Confident	75.5	Confident	3 Å²	3	65 Å²	65	1%	0.012	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-78.3	163.8	174.3	-61.3	-84.1	0	0	0	110.1	V461 F502 W514 L516 D518	V461-Y477 HydrophobicContact CB-CD2 3.86Å; V461-Y477 HydrophobicContact CB-CG 4.29Å; V461-Y477 HydrophobicContact CG1-CD2 4.01Å; V461-Y477 WeakPolarHBondContact O-CD2 3.34Å; V461-Y477 PolarHBondContact O-N 3.25Å; Y477-F502 HydrophobicContact CD1-CZ 4.32Å; Y477-F502 HydrophobicContact CD2-CZ 4.03Å; Y477-F502 HydrophobicContact CE1-CE1 4.37Å; Y477-F502 HydrophobicContact CE1-CZ 4.18Å; Y477-F502 HydrophobicContact CE2-CE1 4.28Å; Y477-F502 AromaticContact CE2-CZ 3.83Å; Y477-F502 HydrophobicContact CE2-CZ 3.83Å; Y477-F502 HydrophobicContact CG-CZ 4.29Å; Y477-F502 AromaticContact CZ-CZ 3.96Å; Y477-W514 AromaticContact CD1-CE3 3.99Å; Y477-W514 HydrophobicContact CD1-CE3 3.99Å; Y477-W514 HydrophobicContact CD1-CZ3 4.4Å; Y477-W514 HydrophobicContact CG-CE3 4.29Å; Y477-L516 WeakPolarHBondContact OH-CA 3.37Å; Y477-L516 WeakPolarHBondContact OH-CD2 3.37Å; Y477-L516 PolarHBondContact OH-O 3.41Å; Y477-D518 WeakPolarHBondContact CD1-O 3.42Å; Y477-D518 VanDerWaalsContact CE1-O 3.26Å; Y477-D518 WeakPolarHBondContact CE1-O 3.4Å
478	E	78.1	Confident	76.4	Confident	93 Å²	93	59.5 Å²	59.5	44%	0.435	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-57.1	153.9	176.8	-75.2	-175.6	170.3	0	0	112.7	W514 T519 P521	E478-W514 HydrophobicContact CB-CH2 4.06Å; E478-W514 HydrophobicContact CB-CZ3 4.29Å; E478-W514 WeakPolarHBondContact O-CH2 3.49Å; E478-T519 PolarHBondContact N-O 2.91Å; E478-P521 WeakPolarHBondContact OE2-CD 3.47Å
479	R	76.6	Confident	77.2	Confident	146 Å²	146	57.9 Å²	57.9	55%	0.551	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-78.1	134.1	-171.4	176.7	167.1	-173.9	-141.7	-4.4	111.7	D458 Y460	D458-R479 PolarHBondContact O-NE 2.67Å; D458-R479 VanDerWaalsContact O-NE 3.08Å; Y460-R479 HydrophobicContact CD1-CB 4.01Å; Y460-R479 HydrophobicContact CE1-CB 3.7Å; Y460-R479 HydrophobicContact CE1-CG 4.37Å
480	H	80.9	Confident	78	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-75.2	147.3	156.7	-70.2	-83.7	0	0	0	111.1	G459 G482 I484 T504 D508 K512 W514	G459-H480 WeakPolarHBondContact O-CB 3.45Å; G459-H480 PolarHBondContact O-N 3.37Å; H480-G482 PolarHBondContact O-N 2.88Å; H480-I484 HydrophobicContact CB-CG1 4.46Å; H480-T504 PolarHBondContact CE1-OG1 3.33Å; H480-T504 PolarHBondContact NE2-OG1 3.5Å; H480-D508 IonicContact ND1-OD2 3.65Å; H480-K512 WeakPolarHBondContact CE1-CD 3Å; H480-K512 VanDerWaalsContact CE1-CG 3.47Å; H480-K512 WeakPolarHBondContact CE1-CG 3.39Å; H480-K512 PolarHBondContact ND1-NZ 2.86Å; H480-W514 AromaticContact NE2-CE2 3.95Å; H480-W514 AromaticContact NE2-CZ2 3.56Å; H480-W514 AromaticContact NE2-NE1 3.72Å
481	L	81.5	Confident	78.3	Confident	153 Å²	153	43.5 Å²	43.5	80%	0.801	23%	0.228	S	C	*	.	S	Bend	trans	-66.7	-27.9	-177.4	-78.8	146.4	0	0	0	111.2	D508	L481-D508 HydrophobicContact CB-CB 3.81Å; L481-D508 PolarHBondContact N-OD2 2.79Å
482	G	84	Confident	78	Confident	13 Å²	13	41.2 Å²	41.2	13%	0.134	21%	0.211	C	C	.	.	S	Bend	trans	-119.7	178.3	176.5	0	0	0	0	0	114.1	G459 H480 S506	G459-G482 WeakPolarHBondContact CA-O 3.45Å; H480-G482 PolarHBondContact O-N 2.88Å; G482-S506 PolarHBondContact O-OG 2.98Å
483	P	86.8	Confident	77.4	Confident	41 Å²	41	47.8 Å²	47.8	27%	0.266	24%	0.239	S	C	.	.			trans	-56.6	142.9	169.9	-24.1	34.1	0	0	0	111.8	E457 S506 I507	E457-P483 HydrophobicContact CG-CB 4.08Å; E457-P483 HydrophobicContact CG-CG 4.19Å; E457-P483 VanDerWaalsContact O-CA 3.26Å; E457-P483 WeakPolarHBondContact O-CA 3.3Å; E457-P483 WeakPolarHBondContact O-CB 3.35Å; E457-P483 WeakPolarHBondContact O-CG 3.4Å; P483-S506 WeakPolarHBondContact O-CA 3.28Å; P483-S506 WeakPolarHBondContact O-CB 3.37Å; P483-S506 PolarHBondContact O-OG 3.02Å; P483-I507 HydrophobicContact CB-CD1 3.91Å; P483-I507 HydrophobicContact CB-CG1 4.36Å; P483-I507 HydrophobicContact CG-CD1 3.97Å; P483-I507 PolarHBondContact O-N 2.77Å; P483-I507 VanDerWaalsContact O-N 3.09Å
484	I	88.7	Confident	76.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	134.5	172.7	-63.8	155.1	0	0	0	107.9	T440 S456 Y460 V461 H480 I487 S505	T440-I484 VanDerWaalsContact CB-O 3.31Å; T440-I484 WeakPolarHBondContact CB-O 3.13Å; T440-I484 PolarHBondContact OG1-O 2.86Å; S456-I484 PolarHBondContact O-N 2.93Å; Y460-I484 VanDerWaalsContact C-CD1 3.49Å; Y460-I484 VanDerWaalsContact O-CD1 3.23Å; Y460-I484 WeakPolarHBondContact O-CD1 3.12Å; V461-I484 HydrophobicContact CB-CD1 4.39Å; V461-I484 HydrophobicContact CG2-CD1 3.6Å; H480-I484 HydrophobicContact CB-CG1 4.46Å; I484-I487 HydrophobicContact CG2-CD1 4.11Å; I484-I487 HydrophobicContact CG2-CG1 3.75Å; I484-S505 WeakPolarHBondContact CA-O 3.13Å; I484-S505 WeakPolarHBondContact CG2-O 3.14Å
485	T	84.8	Confident	75.2	Confident	29 Å²	29	51.8 Å²	51.8	18%	0.178	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-45.1	-174.7	48.2	0	0	0	0	111.4	S505 I507 V532 M533	T485-S505 PolarHBondContact N-O 3.04Å; T485-S505 PolarHBondContact OG1-O 2.88Å; T485-S505 PolarHBondContact OG1-OG 2.9Å; T485-I507 HydrophobicContact CG2-CD1 3.94Å; T485-I507 HydrophobicContact CG2-CG1 3.32Å; T485-V532 PolarHBondContact OG1-O 2.85Å; T485-M533 WeakPolarHBondContact CB-O 3.47Å; T485-M533 PolarHBondContact OG1-O 2.93Å
486	G	83.7	Confident	74.3	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145	176.7	0	0	0	0	0	112.9	T504 S505	G486-T504 WeakPolarHBondContact O-CA 3.41Å; G486-S505 VanDerWaalsContact CA-OG 3.23Å; G486-S505 WeakPolarHBondContact CA-OG 3.46Å; G486-S505 PolarHBondContact N-OG 3.32Å; G486-S505 PolarHBondContact O-N 3.26Å; G486-S505 PolarHBondContact O-OG 3.5Å; G486-S505 VanDerWaalsContact O-OG 3.04Å
487	I	87.9	Confident	73.3	Confident	11 Å²	11	54.5 Å²	54.5	6%	0.056	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.6	169.2	-59.3	-171.3	0	0	0	108	S441 A443 V453 M454 G455 V461 I484 L503 T504	S441-I487 PolarHBondContact OG-N 3.03Å; A443-I487 HydrophobicContact CB-CB 4.38Å; A443-I487 HydrophobicContact CB-CG2 3.84Å; V453-I487 HydrophobicContact CG1-CD1 4.2Å; V453-I487 HydrophobicContact CG1-CG2 4.17Å; M454-I487 VanDerWaalsContact C-CD1 3.46Å; G455-I487 VanDerWaalsContact CA-CD1 3.44Å; V461-I487 HydrophobicContact CG1-CD1 4.15Å; I484-I487 HydrophobicContact CG2-CD1 4.11Å; I484-I487 HydrophobicContact CG2-CG1 3.75Å; I487-L503 WeakPolarHBondContact CA-O 3.49Å; I487-T504 HydrophobicContact CD1-CG2 4.16Å; I487-T504 HydrophobicContact CG1-CG2 3.99Å; I487-T504 HydrophobicContact CG2-CG2 4.38Å
488	S	85.1	Confident	72.5	Confident	20 Å²	20	54.5 Å²	54.5	14%	0.14	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	123.7	172.8	-171.3	0	0	0	0	110.3	F502 L503 V535 W537	S488-F502 WeakPolarHBondContact O-CA 3.4Å; S488-L503 PolarHBondContact N-O 3.1Å; S488-L503 PolarHBondContact O-N 3.1Å; S488-V535 VanDerWaalsContact CB-O 3.3Å; S488-V535 WeakPolarHBondContact CB-O 3.35Å; S488-W537 VanDerWaalsContact O-CD1 3.3Å; S488-W537 PolarHBondContact OG-N 2.75Å
489	T	79.7	Confident	71.8	Confident	12 Å²	12	50.7 Å²	50.7	7%	0.074	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	145.3	173.3	51	0	0	0	0	109.6	A443 F444 P445 Y491 F502	A443-T489 HydrophobicContact CB-CG2 3.62Å; F444-T489 PolarHBondContact O-OG1 3.13Å; P445-T489 HydrophobicContact CG-CG2 4.23Å; T489-Y491 PolarHBondContact O-N 3.38Å; T489-F502 HydrophobicContact CG2-CB 3.93Å
490	H	72.9	Confident	71.8	Confident	2 Å²	2	45 Å²	45	1%	0.009	25%	0.246	C	C	.	.			trans	-58.8	111.6	175.3	-174.9	-94.4	0	0	0	110.3	N492 L501 W537 P542	H490-N492 WeakPolarHBondContact CE1-CB 3.3Å; H490-L501 HydrophobicContact CB-CB 4.43Å; H490-L501 PolarHBondContact N-O 3.07Å; H490-L501 VanDerWaalsContact N-O 3.09Å; H490-W537 AromaticContact CD2-CE3 3.7Å; H490-W537 AromaticContact CD2-CZ3 3.78Å; H490-P542 WeakPolarHBondContact NE2-CA 3.46Å; H490-P542 PolarHBondContact NE2-O 3.38Å
491	Y	63.8	Low	72	Confident	86 Å²	86	45.1 Å²	45.1	34%	0.337	25%	0.246	S	C	.	.			trans	-98.1	90.7	-178.8	-172.6	-90.5	0	0	0	107.6	A446 T489 Q493 P539	A446-Y491 HydrophobicContact CB-CD2 4.02Å; A446-Y491 HydrophobicContact CB-CE2 4.42Å; T489-Y491 PolarHBondContact O-N 3.38Å; Y491-Q493 HydrophobicContact CE1-CG 4.11Å; Y491-Q493 PolarHBondContact OH-NE2 3.39Å; Y491-P539 HydrophobicContact CD1-CB 3.73Å; Y491-P539 HydrophobicContact CE1-CB 4.41Å; Y491-P539 WeakPolarHBondContact O-CA 3.44Å
492	N	56.4	Low	72.2	Confident	11 Å²	11	37.9 Å²	37.9	6%	0.059	21%	0.208	C	C	.	.			trans	-131	119.9	172	-149.5	-43.1	0	0	0	112.2	H490 L494 W616	H490-N492 WeakPolarHBondContact CE1-CB 3.3Å; N492-L494 VanDerWaalsContact C-N 3.35Å; N492-L494 PolarHBondContact OD1-N 3.41Å; N492-W616 HydrophobicContact CB-CH2 4.18Å; N492-W616 WeakPolarHBondContact ND2-CH2 3.47Å; N492-W616 VanDerWaalsContact ND2-CZ2 3.35Å; N492-W616 WeakPolarHBondContact ND2-CZ2 3.41Å
493	Q	53.2	Low	72.5	Confident	152 Å²	152	37.2 Å²	37.2	71%	0.71	20%	0.202	S	C	*	.	S	Bend	trans	-78.9	-19.7	178.1	-63.6	-179.6	-8.5	0	0	112	Y491	Y491-Q493 HydrophobicContact CE1-CG 4.11Å; Y491-Q493 PolarHBondContact OH-NE2 3.39Å
494	L	46.6	Very low	72.6	Confident	151 Å²	151	35.3 Å²	35.3	79%	0.791	19%	0.189	S	C	*	.	S	Bend	trans	-92.4	-22.9	-174	-76.3	105.3	0	0	0	114.7	N492	N492-L494 VanDerWaalsContact C-N 3.35Å; N492-L494 PolarHBondContact OD1-N 3.41Å
495	S	51	Low	72.7	Confident	32 Å²	32	35.3 Å²	35.3	22%	0.224	19%	0.189	C	C	.	.			trans	-143.6	111.7	173.4	-174	0	0	0	0	111.3	D497	S495-D497 PolarHBondContact O-N 3.11Å
496	P	57.3	Low	73	Confident	85 Å²	85	33.9 Å²	33.9	55%	0.552	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-76.1	-6.3	-177.6	28	-32	0	0	0	114.1	F498 G499	P496-F498 VanDerWaalsContact C-N 3.32Å; P496-F498 PolarHBondContact O-N 3.13Å; P496-G499 PolarHBondContact O-N 3.42Å
497	D	59.2	Low	73.2	Confident	104 Å²	104	36.9 Å²	36.9	56%	0.556	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-68.4	-31.3	-172.6	-156	18.4	0	0	0	112.6	S495 H500	S495-D497 PolarHBondContact O-N 3.11Å; D497-H500 PolarHBondContact O-CE1 3.09Å; D497-H500 PolarHBondContact O-ND1 3.28Å
498	F	63.6	Low	73.1	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.018	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-90.4	5.2	-180	-60.3	-84.5	0	0	0	114.4	P496 H500 L501 W616 F619 N620	P496-F498 VanDerWaalsContact C-N 3.32Å; P496-F498 PolarHBondContact O-N 3.13Å; F498-H500 PolarHBondContact O-N 3.41Å; F498-L501 HydrophobicContact CB-CD1 4.42Å; F498-L501 HydrophobicContact CD1-CD1 4Å; F498-L501 PolarHBondContact O-N 2.81Å; F498-W616 AromaticContact CD2-CE3 3.85Å; F498-W616 HydrophobicContact CD2-CE3 3.85Å; F498-W616 AromaticContact CD2-CZ3 3.51Å; F498-W616 HydrophobicContact CD2-CZ3 3.51Å; F498-W616 AromaticContact CE2-CE3 3.43Å; F498-W616 HydrophobicContact CE2-CE3 3.43Å; F498-W616 VanDerWaalsContact CE2-CE3 3.43Å; F498-W616 AromaticContact CE2-CZ3 3.62Å; F498-W616 HydrophobicContact CE2-CZ3 3.62Å; F498-W616 HydrophobicContact CG-CZ3 4.5Å; F498-W616 HydrophobicContact CZ-CE3 4.24Å; F498-F619 AromaticContact CD1-CD1 3.88Å; F498-F619 HydrophobicContact CD1-CD1 3.88Å; F498-F619 AromaticContact CD1-CE1 3.7Å; F498-F619 HydrophobicContact CD1-CE1 3.7Å; F498-F619 AromaticContact CE1-CD1 3.45Å; F498-F619 HydrophobicContact CE1-CD1 3.45Å; F498-F619 VanDerWaalsContact CE1-CD1 3.45Å; F498-F619 AromaticContact CE1-CE1 3.74Å; F498-F619 HydrophobicContact CE1-CE1 3.74Å; F498-F619 AromaticContact CZ-CD1 3.95Å; F498-F619 HydrophobicContact CZ-CD1 3.95Å; F498-N620 WeakPolarHBondContact CE1-OD1 3.3Å; F498-N620 HydrophobicContact CZ-CB 4.26Å; F498-N620 VanDerWaalsContact CZ-ND2 3.27Å; F498-N620 WeakPolarHBondContact CZ-ND2 3.44Å; F498-N620 WeakPolarHBondContact CZ-OD1 3.16Å
499	G	64.4	Low	73.2	Confident	13 Å²	13	42.7 Å²	42.7	13%	0.134	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-62.4	-8	178.9	0	0	0	0	0	114.3	P496	P496-G499 PolarHBondContact O-N 3.42Å
500	H	75.9	Confident	73.7	Confident	27 Å²	27	42.7 Å²	42.7	13%	0.125	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-83.3	-8.7	175.6	68.8	-80.8	0	0	0	114	D497 F498 S515 L516	D497-H500 PolarHBondContact O-CE1 3.09Å; D497-H500 PolarHBondContact O-ND1 3.28Å; F498-H500 PolarHBondContact O-N 3.41Å; H500-S515 CarbonylContact O-C 3.59Å; H500-S515 WeakPolarHBondContact O-CA 3.47Å; H500-L516 HydrophobicContact CB-CB 4.27Å; H500-L516 PolarHBondContact O-N 2.79Å
501	L	85.1	Confident	74.5	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	138.5	-178.6	-60.9	172.8	0	0	0	111.7	H490 F498 L513 W514 L522 F619 L623	H490-L501 HydrophobicContact CB-CB 4.43Å; H490-L501 PolarHBondContact N-O 3.07Å; H490-L501 VanDerWaalsContact N-O 3.09Å; F498-L501 HydrophobicContact CB-CD1 4.42Å; F498-L501 HydrophobicContact CD1-CD1 4Å; F498-L501 PolarHBondContact O-N 2.81Å; L501-L513 HydrophobicContact CB-CD1 4.46Å; L501-W514 WeakPolarHBondContact CA-O 3.36Å; L501-L522 HydrophobicContact CD2-CD1 3.68Å; L501-F619 HydrophobicContact CD1-CE1 3.82Å; L501-F619 HydrophobicContact CD1-CZ 3.99Å; L501-L623 HydrophobicContact CD1-CD1 3.4Å; L501-L623 VanDerWaalsContact CD1-CD1 3.4Å; L501-L623 HydrophobicContact CD2-CD1 3.88Å; L501-L623 HydrophobicContact CG-CD1 4.28Å
502	F	87.3	Confident	75.7	Confident	1 Å²	1	39.7 Å²	39.7	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	147.6	172.9	65.8	-88.3	0	0	0	111.1	V453 V461 Y477 S488 T489 T504 W514 L516	V453-F502 HydrophobicContact CG1-CD2 3.98Å; V453-F502 HydrophobicContact CG1-CE2 3.91Å; V453-F502 HydrophobicContact CG1-CG 4.4Å; V453-F502 HydrophobicContact CG1-CZ 4.23Å; V453-F502 HydrophobicContact CG2-CD1 4.42Å; V461-F502 HydrophobicContact CG1-CE2 3.81Å; V461-F502 HydrophobicContact CG1-CZ 4.27Å; Y477-F502 HydrophobicContact CD1-CZ 4.32Å; Y477-F502 HydrophobicContact CD2-CZ 4.03Å; Y477-F502 HydrophobicContact CE1-CE1 4.37Å; Y477-F502 HydrophobicContact CE1-CZ 4.18Å; Y477-F502 HydrophobicContact CE2-CE1 4.28Å; Y477-F502 AromaticContact CE2-CZ 3.83Å; Y477-F502 HydrophobicContact CE2-CZ 3.83Å; Y477-F502 HydrophobicContact CG-CZ 4.29Å; Y477-F502 AromaticContact CZ-CZ 3.96Å; S488-F502 WeakPolarHBondContact O-CA 3.4Å; T489-F502 HydrophobicContact CG2-CB 3.93Å; F502-T504 HydrophobicContact CD2-CG2 3.78Å; F502-T504 HydrophobicContact CE2-CG2 3.79Å; F502-W514 HydrophobicContact CD1-CB 3.87Å; F502-W514 HydrophobicContact CD2-CB 3.76Å; F502-W514 AromaticContact CD2-CD1 3.8Å; F502-W514 HydrophobicContact CD2-CG 4.02Å; F502-W514 HydrophobicContact CE1-CB 3.42Å; F502-W514 VanDerWaalsContact CE1-CB 3.42Å; F502-W514 HydrophobicContact CE1-CG 4.34Å; F502-W514 HydrophobicContact CE2-CB 3.28Å; F502-W514 AromaticContact CE2-CD1 3.39Å; F502-W514 HydrophobicContact CE2-CD2 4.24Å; F502-W514 AromaticContact CE2-CG 3.35Å; F502-W514 HydrophobicContact CE2-CG 3.35Å; F502-W514 HydrophobicContact CG-CB 4.04Å; F502-W514 HydrophobicContact CZ-CB 3.12Å; F502-W514 HydrophobicContact CZ-CD2 4.31Å; F502-W514 AromaticContact CZ-CG 3.56Å; F502-W514 HydrophobicContact CZ-CG 3.56Å; F502-W514 PolarHBondContact N-O 3.1Å; F502-W514 VanDerWaalsContact N-O 3.08Å; F502-W514 PolarHBondContact O-N 3.04Å; F502-L516 HydrophobicContact CD1-CD2 4.04Å; F502-L516 HydrophobicContact CD1-CG 4.09Å; F502-L516 HydrophobicContact CE1-CD2 3.79Å; F502-L516 HydrophobicContact CE1-CG 4.13Å
503	L	88.7	Confident	77.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	145.7	172.6	-74.8	170.3	0	0	0	109.5	I487 S488 I511 K512 L513 F525 V535 W537 F545	I487-L503 WeakPolarHBondContact CA-O 3.49Å; S488-L503 PolarHBondContact N-O 3.1Å; S488-L503 PolarHBondContact O-N 3.1Å; L503-I511 HydrophobicContact CD2-CG2 3.95Å; L503-K512 WeakPolarHBondContact CA-O 3.36Å; L503-L513 HydrophobicContact CD2-CB 3.89Å; L503-L513 HydrophobicContact CD2-CD1 3.79Å; L503-L513 HydrophobicContact CD2-CG 4.46Å; L503-L513 HydrophobicContact CG-CD1 4.19Å; L503-F525 HydrophobicContact CD2-CE2 4.13Å; L503-V535 HydrophobicContact CB-CG1 4.23Å; L503-V535 HydrophobicContact CB-CG2 4.23Å; L503-V535 HydrophobicContact CD1-CG2 3.99Å; L503-W537 HydrophobicContact CD1-CD2 4.09Å; L503-W537 HydrophobicContact CD1-CG 4.21Å; L503-W537 HydrophobicContact CD1-CZ2 3.81Å; L503-W537 HydrophobicContact CG-CZ2 3.97Å; L503-F545 HydrophobicContact CD1-CB 3.53Å; L503-F545 HydrophobicContact CD1-CD1 3.68Å; L503-F545 HydrophobicContact CD1-CD2 3.74Å; L503-F545 HydrophobicContact CD1-CE1 4.25Å; L503-F545 HydrophobicContact CD1-CE2 4.31Å; L503-F545 HydrophobicContact CD1-CG 3.38Å
504	T	90	Very high	78.8	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	135.6	170.1	61.7	0	0	0	0	109.1	V461 H480 G486 I487 F502 I511 K512 W514	V461-T504 HydrophobicContact CG1-CG2 4.33Å; V461-T504 HydrophobicContact CG2-CG2 3.77Å; H480-T504 PolarHBondContact CE1-OG1 3.33Å; H480-T504 PolarHBondContact NE2-OG1 3.5Å; G486-T504 WeakPolarHBondContact O-CA 3.41Å; I487-T504 HydrophobicContact CD1-CG2 4.16Å; I487-T504 HydrophobicContact CG1-CG2 3.99Å; I487-T504 HydrophobicContact CG2-CG2 4.38Å; F502-T504 HydrophobicContact CD2-CG2 3.78Å; F502-T504 HydrophobicContact CE2-CG2 3.79Å; T504-I511 CarbonylContact O-C 3.59Å; T504-I511 WeakPolarHBondContact O-CA 3.19Å; T504-K512 PolarHBondContact N-O 2.8Å; T504-K512 PolarHBondContact O-N 2.87Å; T504-K512 PolarHBondContact OG1-O 3.19Å; T504-W514 PolarHBondContact OG1-NE1 3.09Å
505	S	90.4	Very high	80.7	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	148.3	170.5	47.8	0	0	0	0	110	I484 T485 G486	I484-S505 WeakPolarHBondContact CA-O 3.13Å; I484-S505 WeakPolarHBondContact CG2-O 3.14Å; T485-S505 PolarHBondContact N-O 3.04Å; T485-S505 PolarHBondContact OG1-O 2.88Å; T485-S505 PolarHBondContact OG1-OG 2.9Å; G486-S505 VanDerWaalsContact CA-OG 3.23Å; G486-S505 WeakPolarHBondContact CA-OG 3.46Å; G486-S505 PolarHBondContact N-OG 3.32Å; G486-S505 PolarHBondContact O-N 3.26Å; G486-S505 PolarHBondContact O-OG 3.5Å; G486-S505 VanDerWaalsContact O-OG 3.04Å
506	S	90	Very high	82	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159.6	178.9	-179.3	0	0	0	0	111.6	G482 P483 D508 W509 T510	G482-S506 PolarHBondContact O-OG 2.98Å; P483-S506 WeakPolarHBondContact O-CA 3.28Å; P483-S506 WeakPolarHBondContact O-CB 3.37Å; P483-S506 PolarHBondContact O-OG 3.02Å; S506-D508 VanDerWaalsContact CB-OD1 3.26Å; S506-D508 WeakPolarHBondContact CB-OD1 3.3Å; S506-D508 PolarHBondContact O-N 2.94Å; S506-D508 PolarHBondContact OG-N 3.46Å; S506-W509 PolarHBondContact O-N 3.04Å; S506-T510 PolarHBondContact N-O 3.01Å
507	I	88.5	Confident	83	Confident	63 Å²	63	27.7 Å²	27.7	32%	0.323	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-12	170.2	-52.7	-175.7	0	0	0	111.1	P483 T485 W509 Y531	P483-I507 HydrophobicContact CB-CD1 3.91Å; P483-I507 HydrophobicContact CB-CG1 4.36Å; P483-I507 HydrophobicContact CG-CD1 3.97Å; P483-I507 PolarHBondContact O-N 2.77Å; P483-I507 VanDerWaalsContact O-N 3.09Å; T485-I507 HydrophobicContact CG2-CD1 3.94Å; T485-I507 HydrophobicContact CG2-CG1 3.32Å; I507-W509 PolarHBondContact O-N 2.88Å; I507-W509 VanDerWaalsContact O-N 3.08Å; I507-Y531 HydrophobicContact CB-CD1 4.42Å; I507-Y531 HydrophobicContact CG2-CD1 3.37Å; I507-Y531 HydrophobicContact CG2-CE1 3.68Å; I507-Y531 HydrophobicContact CG2-CG 3.96Å; I507-Y531 WeakPolarHBondContact O-CD1 3.38Å
508	D	86.8	Confident	83.9	Confident	24 Å²	24	25.9 Å²	25.9	13%	0.128	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	14.2	174.2	68.7	10.3	0	0	0	114.6	H480 L481 S506 T510	H480-D508 IonicContact ND1-OD2 3.65Å; L481-D508 HydrophobicContact CB-CB 3.81Å; L481-D508 PolarHBondContact N-OD2 2.79Å; S506-D508 VanDerWaalsContact CB-OD1 3.26Å; S506-D508 WeakPolarHBondContact CB-OD1 3.3Å; S506-D508 PolarHBondContact O-N 2.94Å; S506-D508 PolarHBondContact OG-N 3.46Å; D508-T510 PolarHBondContact O-N 3.17Å; D508-T510 VanDerWaalsContact O-N 3.17Å; D508-T510 VanDerWaalsContact OD1-CB 3.32Å; D508-T510 WeakPolarHBondContact OD1-CB 3.42Å; D508-T510 PolarHBondContact OD1-N 3.42Å; D508-T510 PolarHBondContact OD1-OG1 2.96Å
509	W	87.6	Confident	84.6	Confident	129 Å²	129	29.3 Å²	29.3	49%	0.489	14%	0.143	S	C	.	.	S	Bend	trans	70.2	-3.4	-177.3	-45.1	-34.7	0	0	0	113.8	S506 I507 N528 Y531	S506-W509 PolarHBondContact O-N 3.04Å; I507-W509 PolarHBondContact O-N 2.88Å; I507-W509 VanDerWaalsContact O-N 3.08Å; W509-N528 WeakPolarHBondContact O-CB 3.18Å; W509-N528 PolarHBondContact O-ND2 2.97Å; W509-Y531 AromaticContact CD1-CD1 3.57Å; W509-Y531 VanDerWaalsContact CD1-N 3.33Å; W509-Y531 HydrophobicContact CZ2-CE1 4.44Å; W509-Y531 AromaticContact NE1-CD1 3.12Å; W509-Y531 AromaticContact NE1-CE1 3.27Å; W509-Y531 VanDerWaalsContact NE1-CE1 3.27Å
510	T	88.3	Confident	85.3	Confident	11 Å²	11	33.8 Å²	33.8	7%	0.067	16%	0.159	C	C	.	.			trans	-97.3	147.9	-176.3	78.4	0	0	0	0	112.2	S506 D508 F525 E526	S506-T510 PolarHBondContact N-O 3.01Å; D508-T510 PolarHBondContact O-N 3.17Å; D508-T510 VanDerWaalsContact O-N 3.17Å; D508-T510 VanDerWaalsContact OD1-CB 3.32Å; D508-T510 WeakPolarHBondContact OD1-CB 3.42Å; D508-T510 PolarHBondContact OD1-N 3.42Å; D508-T510 PolarHBondContact OD1-OG1 2.96Å; T510-F525 WeakPolarHBondContact CA-O 3.19Å; T510-E526 HydrophobicContact CG2-CG 3.96Å
511	I	90.1	Very high	85.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	132.2	164.2	-56.7	165.7	0	0	0	106	L503 T504 S524 F525 V532 V535 F545 A547	L503-I511 HydrophobicContact CD2-CG2 3.95Å; T504-I511 CarbonylContact O-C 3.59Å; T504-I511 WeakPolarHBondContact O-CA 3.19Å; I511-S524 CarbonylContact O-C 3.56Å; I511-S524 WeakPolarHBondContact O-CA 3.45Å; I511-F525 HydrophobicContact CB-CB 4.16Å; I511-F525 HydrophobicContact CB-CD2 4.04Å; I511-F525 HydrophobicContact CG2-CD2 4.07Å; I511-F525 PolarHBondContact N-O 2.97Å; I511-F525 WeakPolarHBondContact O-CD2 3.45Å; I511-F525 PolarHBondContact O-N 2.94Å; I511-V532 HydrophobicContact CD1-CG1 4.21Å; I511-V532 HydrophobicContact CG1-CG1 4.06Å; I511-V532 HydrophobicContact CG1-CG2 4.28Å; I511-V535 HydrophobicContact CG2-CG2 4.34Å; I511-F545 HydrophobicContact CD1-CE2 4.16Å; I511-F545 HydrophobicContact CG2-CE2 4.41Å; I511-A547 HydrophobicContact CD1-CB 3.35Å
512	K	89.3	Confident	85.6	Confident	25 Å²	25	33.8 Å²	33.8	11%	0.109	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	136.1	175.8	-62.4	-175.1	-169.5	138.1	0	111	H480 L503 T504 W514 P521 Y523	H480-K512 WeakPolarHBondContact CE1-CD 3Å; H480-K512 VanDerWaalsContact CE1-CG 3.47Å; H480-K512 WeakPolarHBondContact CE1-CG 3.39Å; H480-K512 PolarHBondContact ND1-NZ 2.86Å; L503-K512 WeakPolarHBondContact CA-O 3.36Å; T504-K512 PolarHBondContact N-O 2.8Å; T504-K512 PolarHBondContact O-N 2.87Å; T504-K512 PolarHBondContact OG1-O 3.19Å; K512-W514 HydrophobicContact CB-CZ2 3.98Å; K512-W514 HydrophobicContact CD-CH2 4.47Å; K512-W514 HydrophobicContact CD-CZ2 3.81Å; K512-W514 VanDerWaalsContact O-CD1 3.29Å; K512-P521 HydrophobicContact CB-CB 4.19Å; K512-P521 HydrophobicContact CD-CB 3.96Å; K512-P521 HydrophobicContact CD-CG 4.24Å; K512-P521 HydrophobicContact CG-CB 4.45Å; K512-Y523 CarbonylContact C-O 3.2Å; K512-Y523 VanDerWaalsContact CA-O 3.3Å; K512-Y523 WeakPolarHBondContact CA-O 3.38Å
513	L	88.7	Confident	85.3	Confident	1 Å²	1	36 Å²	36	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	132.4	168.6	-179.3	66.1	0	0	0	109.1	L501 L503 P521 L522 Y523 F525 W537 L559	L501-L513 HydrophobicContact CB-CD1 4.46Å; L503-L513 HydrophobicContact CD2-CB 3.89Å; L503-L513 HydrophobicContact CD2-CD1 3.79Å; L503-L513 HydrophobicContact CD2-CG 4.46Å; L503-L513 HydrophobicContact CG-CD1 4.19Å; L513-P521 CarbonylContact O-C 3.58Å; L513-L522 HydrophobicContact CD2-CB 4.44Å; L513-L522 HydrophobicContact CD2-CD1 4.38Å; L513-L522 HydrophobicContact CG-CB 4.36Å; L513-L522 HydrophobicContact CG-CD1 4.32Å; L513-L522 PolarHBondContact O-N 2.79Å; L513-Y523 PolarHBondContact N-O 3.38Å; L513-Y523 PolarHBondContact O-N 3.21Å; L513-F525 HydrophobicContact CB-CE2 4.32Å; L513-W537 HydrophobicContact CD1-CZ2 4.06Å; L513-L559 HydrophobicContact CD2-CD2 3.93Å
514	W	87.2	Confident	85.2	Confident	1 Å²	1	38.6 Å²	38.6	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	157.9	-178.8	-56.7	88.7	0	0	0	111	V461 Y477 E478 H480 L501 F502 T504 K512 K520 P521	V461-W514 HydrophobicContact CG2-CZ2 4.49Å; Y477-W514 AromaticContact CD1-CE3 3.99Å; Y477-W514 HydrophobicContact CD1-CE3 3.99Å; Y477-W514 HydrophobicContact CD1-CZ3 4.4Å; Y477-W514 HydrophobicContact CG-CE3 4.29Å; E478-W514 HydrophobicContact CB-CH2 4.06Å; E478-W514 HydrophobicContact CB-CZ3 4.29Å; E478-W514 WeakPolarHBondContact O-CH2 3.49Å; H480-W514 AromaticContact NE2-CE2 3.95Å; H480-W514 AromaticContact NE2-CZ2 3.56Å; H480-W514 AromaticContact NE2-NE1 3.72Å; L501-W514 WeakPolarHBondContact CA-O 3.36Å; F502-W514 HydrophobicContact CD1-CB 3.87Å; F502-W514 HydrophobicContact CD2-CB 3.76Å; F502-W514 AromaticContact CD2-CD1 3.8Å; F502-W514 HydrophobicContact CD2-CG 4.02Å; F502-W514 HydrophobicContact CE1-CB 3.42Å; F502-W514 VanDerWaalsContact CE1-CB 3.42Å; F502-W514 HydrophobicContact CE1-CG 4.34Å; F502-W514 HydrophobicContact CE2-CB 3.28Å; F502-W514 AromaticContact CE2-CD1 3.39Å; F502-W514 HydrophobicContact CE2-CD2 4.24Å; F502-W514 AromaticContact CE2-CG 3.35Å; F502-W514 HydrophobicContact CE2-CG 3.35Å; F502-W514 HydrophobicContact CG-CB 4.04Å; F502-W514 HydrophobicContact CZ-CB 3.12Å; F502-W514 HydrophobicContact CZ-CD2 4.31Å; F502-W514 AromaticContact CZ-CG 3.56Å; F502-W514 HydrophobicContact CZ-CG 3.56Å; F502-W514 PolarHBondContact N-O 3.1Å; F502-W514 VanDerWaalsContact N-O 3.08Å; F502-W514 PolarHBondContact O-N 3.04Å; T504-W514 PolarHBondContact OG1-NE1 3.09Å; K512-W514 HydrophobicContact CB-CZ2 3.98Å; K512-W514 HydrophobicContact CD-CH2 4.47Å; K512-W514 HydrophobicContact CD-CZ2 3.81Å; K512-W514 VanDerWaalsContact O-CD1 3.29Å; W514-K520 VanDerWaalsContact CZ3-C 3.46Å; W514-P521 HydrophobicContact CD2-CB 4.08Å; W514-P521 HydrophobicContact CE3-CB 3.87Å; W514-P521 HydrophobicContact CH2-CB 3.66Å; W514-P521 HydrophobicContact CH2-CG 3.88Å; W514-P521 HydrophobicContact CZ2-CB 3.88Å; W514-P521 HydrophobicContact CZ2-CG 4.46Å; W514-P521 VanDerWaalsContact CZ3-CA 3.48Å; W514-P521 HydrophobicContact CZ3-CB 3.67Å; W514-P521 HydrophobicContact CZ3-CG 4Å
515	S	84.8	Confident	84.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.6	170.2	156.6	0	0	0	0	107.8	H500 K517 D518	H500-S515 CarbonylContact O-C 3.59Å; H500-S515 WeakPolarHBondContact O-CA 3.47Å; S515-K517 PolarHBondContact O-N 2.96Å; S515-K517 PolarHBondContact OG-N 2.9Å; S515-D518 WeakPolarHBondContact CB-OD2 3.3Å; S515-D518 PolarHBondContact O-N 3.4Å; S515-D518 PolarHBondContact OG-OD2 2.88Å
516	L	78.6	Confident	84.3	Confident	30 Å²	30	45.8 Å²	45.8	16%	0.157	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-19.2	175.6	-76.3	175.3	0	0	0	112.9	P445 V453 Y477 H500 F502	P445-L516 HydrophobicContact CB-CD1 4.45Å; P445-L516 HydrophobicContact CG-CD1 3.97Å; V453-L516 HydrophobicContact CG2-CD2 3.76Å; Y477-L516 WeakPolarHBondContact OH-CA 3.37Å; Y477-L516 WeakPolarHBondContact OH-CD2 3.37Å; Y477-L516 PolarHBondContact OH-O 3.41Å; H500-L516 HydrophobicContact CB-CB 4.27Å; H500-L516 PolarHBondContact O-N 2.79Å; F502-L516 HydrophobicContact CD1-CD2 4.04Å; F502-L516 HydrophobicContact CD1-CG 4.09Å; F502-L516 HydrophobicContact CE1-CD2 3.79Å; F502-L516 HydrophobicContact CE1-CG 4.13Å
517	K	78.6	Confident	83.5	Confident	148 Å²	148	50 Å²	50	64%	0.643	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-21.8	179.9	-60.4	176.4	-178.6	170.8	0	112.9	S515	S515-K517 PolarHBondContact O-N 2.96Å; S515-K517 PolarHBondContact OG-N 2.9Å
518	D	79	Confident	82.8	Confident	65 Å²	65	47.5 Å²	47.5	35%	0.348	23%	0.231	S	C	.	.			trans	-121.4	128.2	-168.5	-56.4	-59.2	0	0	0	109.7	Y477 S515 K520	Y477-D518 WeakPolarHBondContact CD1-O 3.42Å; Y477-D518 VanDerWaalsContact CE1-O 3.26Å; Y477-D518 WeakPolarHBondContact CE1-O 3.4Å; S515-D518 WeakPolarHBondContact CB-OD2 3.3Å; S515-D518 PolarHBondContact O-N 3.4Å; S515-D518 PolarHBondContact OG-OD2 2.88Å; D518-K520 PolarHBondContact O-N 2.86Å
519	T	77.4	Confident	82.1	Confident	76 Å²	76	50.1 Å²	50.1	47%	0.466	25%	0.252	S	S	.	.	S	Bend	trans	-76.2	-10.8	-177.8	58.9	0	0	0	0	113.6	E478	E478-T519 PolarHBondContact N-O 2.91Å
520	K	80.4	Confident	82	Confident	108 Å²	108	46.3 Å²	46.3	47%	0.47	24%	0.241	S	C	.	.	S	Bend	trans	-98.3	149.9	178.9	-68.9	-172.9	175.6	-174.9	0	110.9	W514 D518 L522	W514-K520 VanDerWaalsContact CZ3-C 3.46Å; D518-K520 PolarHBondContact O-N 2.86Å; K520-L522 PolarHBondContact O-N 2.75Å
521	P	82.4	Confident	82.1	Confident	21 Å²	21	51.4 Å²	51.4	14%	0.136	26%	0.26	C	S	.	.			trans	-66.3	136	174.1	27.4	-30.9	0	0	0	108.7	E478 K512 L513 W514 Q630	E478-P521 WeakPolarHBondContact OE2-CD 3.47Å; K512-P521 HydrophobicContact CB-CB 4.19Å; K512-P521 HydrophobicContact CD-CB 3.96Å; K512-P521 HydrophobicContact CD-CG 4.24Å; K512-P521 HydrophobicContact CG-CB 4.45Å; L513-P521 CarbonylContact O-C 3.58Å; W514-P521 HydrophobicContact CD2-CB 4.08Å; W514-P521 HydrophobicContact CE3-CB 3.87Å; W514-P521 HydrophobicContact CH2-CB 3.66Å; W514-P521 HydrophobicContact CH2-CG 3.88Å; W514-P521 HydrophobicContact CZ2-CB 3.88Å; W514-P521 HydrophobicContact CZ2-CG 4.46Å; W514-P521 VanDerWaalsContact CZ3-CA 3.48Å; W514-P521 HydrophobicContact CZ3-CB 3.67Å; W514-P521 HydrophobicContact CZ3-CG 4Å; P521-Q630 PolarHBondContact O-NE2 3.43Å; P521-Q630 PolarHBondContact O-OE1 3.3Å
522	L	83.3	Confident	82	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.031	26%	0.26	C	S	.	.	S	Bend	trans	-71.8	-38.1	175	-67	179.1	0	0	0	111.6	L501 L513 K520 I626 K627 Q630	L501-L522 HydrophobicContact CD2-CD1 3.68Å; L513-L522 HydrophobicContact CD2-CB 4.44Å; L513-L522 HydrophobicContact CD2-CD1 4.38Å; L513-L522 HydrophobicContact CG-CB 4.36Å; L513-L522 HydrophobicContact CG-CD1 4.32Å; L513-L522 PolarHBondContact O-N 2.79Å; K520-L522 PolarHBondContact O-N 2.75Å; L522-I626 VanDerWaalsContact O-CG2 3.25Å; L522-I626 WeakPolarHBondContact O-CG2 3.35Å; L522-K627 HydrophobicContact CD2-CD 4.38Å; L522-K627 HydrophobicContact CD2-CG 3.83Å; L522-Q630 VanDerWaalsContact O-CD 3.31Å; L522-Q630 PolarHBondContact O-NE2 3.08Å; L522-Q630 VanDerWaalsContact O-NE2 3.1Å
523	Y	82.4	Confident	82	Confident	49 Å²	49	53 Å²	53	19%	0.192	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	145.7	-177.8	-164.3	-98.7	0	0	0	110.5	K512 L513 F525 T563 I626	K512-Y523 CarbonylContact C-O 3.2Å; K512-Y523 VanDerWaalsContact CA-O 3.3Å; K512-Y523 WeakPolarHBondContact CA-O 3.38Å; L513-Y523 PolarHBondContact N-O 3.38Å; L513-Y523 PolarHBondContact O-N 3.21Å; Y523-F525 AromaticContact CD1-CD1 3.72Å; Y523-F525 HydrophobicContact CD1-CD1 3.72Å; Y523-F525 AromaticContact CD1-CD2 3.96Å; Y523-F525 HydrophobicContact CD1-CD2 3.96Å; Y523-F525 AromaticContact CD1-CE1 3.46Å; Y523-F525 HydrophobicContact CD1-CE1 3.46Å; Y523-F525 VanDerWaalsContact CD1-CE1 3.46Å; Y523-F525 AromaticContact CD1-CE2 3.74Å; Y523-F525 HydrophobicContact CD1-CE2 3.74Å; Y523-F525 AromaticContact CD1-CG 3.94Å; Y523-F525 HydrophobicContact CD1-CG 3.94Å; Y523-F525 AromaticContact CD1-CZ 3.46Å; Y523-F525 HydrophobicContact CD1-CZ 3.46Å; Y523-F525 VanDerWaalsContact CD1-CZ 3.46Å; Y523-F525 AromaticContact CE1-CD1 3.41Å; Y523-F525 HydrophobicContact CE1-CD1 3.41Å; Y523-F525 VanDerWaalsContact CE1-CD1 3.41Å; Y523-F525 HydrophobicContact CE1-CD2 4.45Å; Y523-F525 AromaticContact CE1-CE1 3.36Å; Y523-F525 HydrophobicContact CE1-CE1 3.36Å; Y523-F525 HydrophobicContact CE1-CE2 4.42Å; Y523-F525 AromaticContact CE1-CG 3.96Å; Y523-F525 HydrophobicContact CE1-CG 3.96Å; Y523-F525 AromaticContact CE1-CZ 3.9Å; Y523-F525 HydrophobicContact CE1-CZ 3.9Å; Y523-F525 HydrophobicContact CG-CZ 4.48Å; Y523-T563 WeakPolarHBondContact CE1-O 3.36Å; Y523-T563 WeakPolarHBondContact OH-CB 3.34Å; Y523-T563 PolarHBondContact OH-O 2.88Å; Y523-T563 VanDerWaalsContact OH-O 3.04Å; Y523-T563 PolarHBondContact OH-OG1 3.25Å; Y523-I626 HydrophobicContact CD2-CG2 4.18Å
524	S	84.9	Confident	82	Confident	54 Å²	54	53.7 Å²	53.7	38%	0.378	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.6	174.5	51.2	0	0	0	0	109.9	I511	I511-S524 CarbonylContact O-C 3.56Å; I511-S524 WeakPolarHBondContact O-CA 3.45Å
525	F	82.9	Confident	82.2	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	120.2	172.9	-54.4	-86.5	0	0	0	108.6	L503 T510 I511 L513 Y523 F545 W557 L559 T563	L503-F525 HydrophobicContact CD2-CE2 4.13Å; T510-F525 WeakPolarHBondContact CA-O 3.19Å; I511-F525 HydrophobicContact CB-CB 4.16Å; I511-F525 HydrophobicContact CB-CD2 4.04Å; I511-F525 HydrophobicContact CG2-CD2 4.07Å; I511-F525 PolarHBondContact N-O 2.97Å; I511-F525 WeakPolarHBondContact O-CD2 3.45Å; I511-F525 PolarHBondContact O-N 2.94Å; L513-F525 HydrophobicContact CB-CE2 4.32Å; Y523-F525 AromaticContact CD1-CD1 3.72Å; Y523-F525 HydrophobicContact CD1-CD1 3.72Å; Y523-F525 AromaticContact CD1-CD2 3.96Å; Y523-F525 HydrophobicContact CD1-CD2 3.96Å; Y523-F525 AromaticContact CD1-CE1 3.46Å; Y523-F525 HydrophobicContact CD1-CE1 3.46Å; Y523-F525 VanDerWaalsContact CD1-CE1 3.46Å; Y523-F525 AromaticContact CD1-CE2 3.74Å; Y523-F525 HydrophobicContact CD1-CE2 3.74Å; Y523-F525 AromaticContact CD1-CG 3.94Å; Y523-F525 HydrophobicContact CD1-CG 3.94Å; Y523-F525 AromaticContact CD1-CZ 3.46Å; Y523-F525 HydrophobicContact CD1-CZ 3.46Å; Y523-F525 VanDerWaalsContact CD1-CZ 3.46Å; Y523-F525 AromaticContact CE1-CD1 3.41Å; Y523-F525 HydrophobicContact CE1-CD1 3.41Å; Y523-F525 VanDerWaalsContact CE1-CD1 3.41Å; Y523-F525 HydrophobicContact CE1-CD2 4.45Å; Y523-F525 AromaticContact CE1-CE1 3.36Å; Y523-F525 HydrophobicContact CE1-CE1 3.36Å; Y523-F525 HydrophobicContact CE1-CE2 4.42Å; Y523-F525 AromaticContact CE1-CG 3.96Å; Y523-F525 HydrophobicContact CE1-CG 3.96Å; Y523-F525 AromaticContact CE1-CZ 3.9Å; Y523-F525 HydrophobicContact CE1-CZ 3.9Å; Y523-F525 HydrophobicContact CG-CZ 4.48Å; F525-F545 HydrophobicContact CD1-CZ 4.3Å; F525-F545 HydrophobicContact CD2-CZ 4.03Å; F525-F545 HydrophobicContact CE1-CE1 4.3Å; F525-F545 HydrophobicContact CE1-CZ 4.04Å; F525-F545 HydrophobicContact CE2-CE1 4.07Å; F525-F545 AromaticContact CE2-CZ 3.75Å; F525-F545 HydrophobicContact CE2-CZ 3.75Å; F525-F545 HydrophobicContact CG-CZ 4.32Å; F525-F545 AromaticContact CZ-CE1 3.82Å; F525-F545 HydrophobicContact CZ-CE1 3.82Å; F525-F545 AromaticContact CZ-CZ 3.76Å; F525-F545 HydrophobicContact CZ-CZ 3.76Å; F525-W557 AromaticContact CD1-CE3 3.92Å; F525-W557 HydrophobicContact CD1-CE3 3.92Å; F525-W557 HydrophobicContact CD1-CH2 4.36Å; F525-W557 AromaticContact CD1-CZ3 3.83Å; F525-W557 HydrophobicContact CD1-CZ3 3.83Å; F525-W557 HydrophobicContact CE1-CE3 4.2Å; F525-W557 HydrophobicContact CE1-CZ3 4.44Å; F525-L559 HydrophobicContact CZ-CD2 3.88Å; F525-L559 HydrophobicContact CZ-CG 4.26Å; F525-T563 VanDerWaalsContact CD1-O 3.3Å; F525-T563 WeakPolarHBondContact CD1-O 3.44Å; F525-T563 WeakPolarHBondContact CE1-O 3.27Å
526	E	79.7	Confident	82.4	Confident	147 Å²	147	54.3 Å²	54.3	69%	0.687	28%	0.277	S	S	*	.			trans	-120	19.3	-176.7	-59	-168	160.2	0	0	113.5	T510	T510-E526 HydrophobicContact CG2-CG 3.96Å
527	D	72.4	Confident	82.9	Confident	87 Å²	87	53.3 Å²	53.3	47%	0.465	27%	0.271	S	S	.	.			trans	-84.4	-8.1	-175.7	-161	42.4	0	0	0	114.1	W557 P566	D527-W557 HydrophobicContact CB-CH2 3.7Å; D527-W557 HydrophobicContact CB-CZ2 4.12Å; D527-P566 WeakPolarHBondContact OD2-CD 3.23Å
528	N	74.2	Confident	83.3	Confident	11 Å²	11	46.2 Å²	46.2	6%	0.059	24%	0.24	C	C	.	.			trans	-72.8	143.7	-175	-52.7	-48.1	0	0	0	111.3	W509 V532	W509-N528 WeakPolarHBondContact O-CB 3.18Å; W509-N528 PolarHBondContact O-ND2 2.97Å; N528-V532 HydrophobicContact CB-CG2 3.91Å; N528-V532 WeakPolarHBondContact ND2-CG2 3.3Å
529	S	73.2	Confident	83.3	Confident	80 Å²	80	44.1 Å²	44.1	56%	0.559	23%	0.23	S	C	*	.	S	Bend	trans	-91.5	-13	-173.2	62.9	0	0	0	0	114
530	D	85.2	Confident	83.5	Confident	49 Å²	49	42.4 Å²	42.4	26%	0.262	22%	0.219	S	C	.	.	S	Bend	trans	-152.1	-175.4	-176.8	-153.3	-10.4	0	0	0	111.6	V532	D530-V532 PolarHBondContact O-N 3.47Å
531	Y	88.8	Confident	83.5	Confident	118 Å²	118	37.3 Å²	37.3	46%	0.463	20%	0.197	S	C	.	.			trans	-55	121.2	178.6	-56.3	-47.2	0	0	0	112.2	I507 W509 M533 D549 G550	I507-Y531 HydrophobicContact CB-CD1 4.42Å; I507-Y531 HydrophobicContact CG2-CD1 3.37Å; I507-Y531 HydrophobicContact CG2-CE1 3.68Å; I507-Y531 HydrophobicContact CG2-CG 3.96Å; I507-Y531 WeakPolarHBondContact O-CD1 3.38Å; W509-Y531 AromaticContact CD1-CD1 3.57Å; W509-Y531 VanDerWaalsContact CD1-N 3.33Å; W509-Y531 HydrophobicContact CZ2-CE1 4.44Å; W509-Y531 AromaticContact NE1-CD1 3.12Å; W509-Y531 AromaticContact NE1-CE1 3.27Å; W509-Y531 VanDerWaalsContact NE1-CE1 3.27Å; Y531-M533 PolarHBondContact O-N 3.4Å; Y531-D549 CarbonylContact O-C 3.57Å; Y531-D549 WeakPolarHBondContact O-CA 3.48Å; Y531-G550 PolarHBondContact O-N 3.36Å
532	V	89.3	Confident	83.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	117.4	173.5	-170.8	0	0	0	0	108.2	T485 I511 N528 D530 V548	T485-V532 PolarHBondContact OG1-O 2.85Å; I511-V532 HydrophobicContact CD1-CG1 4.21Å; I511-V532 HydrophobicContact CG1-CG1 4.06Å; I511-V532 HydrophobicContact CG1-CG2 4.28Å; N528-V532 HydrophobicContact CB-CG2 3.91Å; N528-V532 WeakPolarHBondContact ND2-CG2 3.3Å; D530-V532 PolarHBondContact O-N 3.47Å; V532-V548 WeakPolarHBondContact CA-O 3.25Å
533	M	88.6	Confident	83.2	Confident	58 Å²	58	36 Å²	36	29%	0.286	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-34.9	-173.4	-64.3	-67.4	-93	0	0	112	T485 Y531 V548 L578 N579	T485-M533 WeakPolarHBondContact CB-O 3.47Å; T485-M533 PolarHBondContact OG1-O 2.93Å; Y531-M533 PolarHBondContact O-N 3.4Å; M533-V548 PolarHBondContact N-O 3.18Å; M533-L578 WeakPolarHBondContact CB-O 3.45Å; M533-L578 WeakPolarHBondContact CG-O 3.43Å; M533-N579 WeakPolarHBondContact CE-OD1 3.49Å
534	D	88.8	Confident	83.4	Confident	16 Å²	16	33.7 Å²	33.7	9%	0.086	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	157.7	178.8	-159.3	10	0	0	0	111.8	V548 R580 V581	D534-V548 PolarHBondContact O-N 3.16Å; D534-V548 VanDerWaalsContact O-N 3.11Å; D534-R580 WeakPolarHBondContact OD2-CA 3.38Å; D534-R580 WeakPolarHBondContact OD2-CD 3.44Å; D534-V581 HydrophobicContact CB-CG1 3.95Å; D534-V581 PolarHBondContact OD2-N 2.91Å
535	V	90.7	Very high	83.5	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.012	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	137	177.5	66.9	0	0	0	0	109.2	S488 L503 I511 F545 A546	S488-V535 VanDerWaalsContact CB-O 3.3Å; S488-V535 WeakPolarHBondContact CB-O 3.35Å; L503-V535 HydrophobicContact CB-CG1 4.23Å; L503-V535 HydrophobicContact CB-CG2 4.23Å; L503-V535 HydrophobicContact CD1-CG2 3.99Å; I511-V535 HydrophobicContact CG2-CG2 4.34Å; V535-F545 HydrophobicContact CG2-CD2 3.97Å; V535-A546 WeakPolarHBondContact CA-O 3.49Å; V535-A546 WeakPolarHBondContact CG2-O 3.47Å
536	A	89.5	Confident	83.8	Confident	11 Å²	11	30.9 Å²	30.9	9%	0.091	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	128.7	174.6	0	0	0	0	0	111.7	F545 A546 V581 W583	A536-F545 WeakPolarHBondContact O-CA 3.47Å; A536-A546 PolarHBondContact N-O 3.35Å; A536-A546 PolarHBondContact O-N 3.39Å; A536-V581 HydrophobicContact CB-CG1 3.75Å; A536-W583 PolarHBondContact O-NE1 2.92Å
537	W	89.1	Confident	84.3	Confident	9 Å²	9	23.9 Å²	23.9	3%	0.034	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	144.7	168.8	-87.3	94.9	0	0	0	111.6	S488 H490 L503 L513 P542 L544 F545 L559 F619	S488-W537 VanDerWaalsContact O-CD1 3.3Å; S488-W537 PolarHBondContact OG-N 2.75Å; H490-W537 AromaticContact CD2-CE3 3.7Å; H490-W537 AromaticContact CD2-CZ3 3.78Å; L503-W537 HydrophobicContact CD1-CD2 4.09Å; L503-W537 HydrophobicContact CD1-CG 4.21Å; L503-W537 HydrophobicContact CD1-CZ2 3.81Å; L503-W537 HydrophobicContact CG-CZ2 3.97Å; L513-W537 HydrophobicContact CD1-CZ2 4.06Å; W537-P542 WeakPolarHBondContact CZ3-O 3.39Å; W537-L544 VanDerWaalsContact CE3-O 3.3Å; W537-F545 HydrophobicContact CD2-CB 4.3Å; W537-F545 HydrophobicContact CE3-CB 4.45Å; W537-L559 HydrophobicContact CH2-CD1 3.6Å; W537-L559 HydrophobicContact CZ2-CD1 4.32Å; W537-L559 HydrophobicContact CZ3-CD1 4.19Å; W537-F619 HydrophobicContact CH2-CZ 4.31Å
538	S	86.6	Confident	85.1	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.106	C	C	.	.			trans	-66.8	135.9	166.1	-178.9	0	0	0	0	110	V540 H541 L544	S538-V540 VanDerWaalsContact C-N 3.27Å; S538-V540 PolarHBondContact O-N 3.38Å; S538-V540 PolarHBondContact OG-N 2.83Å; S538-H541 PolarHBondContact OG-N 2.98Å; S538-L544 WeakPolarHBondContact CB-O 3.45Å; S538-L544 PolarHBondContact N-O 3.47Å
539	P	80.4	Confident	85.8	Confident	20 Å²	20	19.2 Å²	19.2	13%	0.13	10%	0.103	C	C	.	.	S	Bend	trans	-78.2	-12.4	176.3	29.1	-31.7	0	0	0	113.4	Y491 W583 T584	Y491-P539 HydrophobicContact CD1-CB 3.73Å; Y491-P539 HydrophobicContact CE1-CB 4.41Å; Y491-P539 WeakPolarHBondContact O-CA 3.44Å; P539-W583 HydrophobicContact CG-CB 4.36Å; P539-T584 WeakPolarHBondContact CG-O 3.3Å
540	V	81.4	Confident	86.3	Confident	40 Å²	40	16.2 Å²	16.2	24%	0.242	9%	0.085	C	C	.	.	S	Bend	trans	-108.5	-45.8	-173.7	178.4	0	0	0	0	111.3	S538 S586 A609 P611	S538-V540 VanDerWaalsContact C-N 3.27Å; S538-V540 PolarHBondContact O-N 3.38Å; S538-V540 PolarHBondContact OG-N 2.83Å; V540-S586 WeakPolarHBondContact CG2-O 3.49Å; V540-A609 WeakPolarHBondContact CG1-O 3.38Å; V540-P611 HydrophobicContact CG1-CG 4.47Å
541	H	79.8	Confident	86.3	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.005	8%	0.083	C	C	.	.			trans	-96.5	128.2	-177.9	-175.5	-75.8	0	0	0	111.8	S538 A543 L544 L608 E615	S538-H541 PolarHBondContact OG-N 2.98Å; H541-A543 VanDerWaalsContact C-N 3.32Å; H541-A543 PolarHBondContact ND1-N 2.78Å; H541-A543 VanDerWaalsContact ND1-N 3.1Å; H541-A543 PolarHBondContact O-N 3.48Å; H541-L544 HydrophobicContact CB-CB 3.77Å; H541-L544 HydrophobicContact CB-CD2 4.27Å; H541-L544 VanDerWaalsContact ND1-CB 3.28Å; H541-L544 WeakPolarHBondContact ND1-CB 3.36Å; H541-L544 PolarHBondContact ND1-N 3.41Å; H541-L608 PolarHBondContact CD2-O 3.09Å; H541-E615 IonicContact CD2-OE2 3.18Å; H541-E615 PolarHBondContact CD2-OE2 2.94Å; H541-E615 IonicContact NE2-OE1 2.76Å; H541-E615 IonicContact NE2-OE2 3.94Å; H541-E615 PolarHBondContact NE2-OE2 3.29Å; H541-E615 VanDerWaalsContact NE2-OE2 3.13Å
542	P	77.8	Confident	86.1	Confident	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-15.2	-168.9	31.1	-37.8	0	0	0	115.5	H490 W537 W616	H490-P542 WeakPolarHBondContact NE2-CA 3.46Å; H490-P542 PolarHBondContact NE2-O 3.38Å; W537-P542 WeakPolarHBondContact CZ3-O 3.39Å; P542-W616 HydrophobicContact CB-CD2 4.08Å; P542-W616 HydrophobicContact CB-CE3 3.71Å; P542-W616 HydrophobicContact CB-CH2 3.8Å; P542-W616 HydrophobicContact CB-CZ2 4.07Å; P542-W616 HydrophobicContact CB-CZ3 3.56Å; P542-W616 HydrophobicContact CG-CD2 3.87Å; P542-W616 HydrophobicContact CG-CE3 4Å; P542-W616 HydrophobicContact CG-CG 4.42Å; P542-W616 HydrophobicContact CG-CH2 4.41Å; P542-W616 HydrophobicContact CG-CZ2 4.2Å; P542-W616 HydrophobicContact CG-CZ3 4.27Å
543	A	81.1	Confident	86	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	12.4	-177.6	0	0	0	0	0	112.7	H541 N558 L559 N560 F619	H541-A543 VanDerWaalsContact C-N 3.32Å; H541-A543 PolarHBondContact ND1-N 2.78Å; H541-A543 VanDerWaalsContact ND1-N 3.1Å; H541-A543 PolarHBondContact O-N 3.48Å; A543-N558 CarbonylContact O-C 3.34Å; A543-N558 WeakPolarHBondContact O-CA 2.87Å; A543-L559 HydrophobicContact CB-CB 4.11Å; A543-L559 WeakPolarHBondContact O-CD1 3.18Å; A543-L559 PolarHBondContact O-N 3Å; A543-N560 HydrophobicContact CB-CB 4.34Å; A543-F619 HydrophobicContact CB-CD2 3.55Å; A543-F619 HydrophobicContact CB-CE2 3.91Å; A543-F619 HydrophobicContact CB-CG 4.13Å
544	L	86.5	Confident	86	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.7	-176	-171.4	70.1	0	0	0	110.1	W537 S538 H541 L556 W557 N558 W583 L608	W537-L544 VanDerWaalsContact CE3-O 3.3Å; S538-L544 WeakPolarHBondContact CB-O 3.45Å; S538-L544 PolarHBondContact N-O 3.47Å; H541-L544 HydrophobicContact CB-CB 3.77Å; H541-L544 HydrophobicContact CB-CD2 4.27Å; H541-L544 VanDerWaalsContact ND1-CB 3.28Å; H541-L544 WeakPolarHBondContact ND1-CB 3.36Å; H541-L544 PolarHBondContact ND1-N 3.41Å; L544-L556 HydrophobicContact CD1-CD1 3.81Å; L544-L556 HydrophobicContact CD1-CD2 4.02Å; L544-L556 HydrophobicContact CD1-CG 3.69Å; L544-L556 HydrophobicContact CD2-CD1 4.32Å; L544-L556 HydrophobicContact CG-CD1 4Å; L544-L556 HydrophobicContact CG-CG 4.43Å; L544-W557 WeakPolarHBondContact CA-O 3.41Å; L544-W557 WeakPolarHBondContact CD1-O 3.34Å; L544-N558 HydrophobicContact CD1-CB 4.3Å; L544-W583 HydrophobicContact CD2-CH2 3.58Å; L544-W583 HydrophobicContact CD2-CZ2 4.21Å; L544-W583 HydrophobicContact CD2-CZ3 4.26Å; L544-W583 HydrophobicContact CG-CH2 4.14Å; L544-W583 HydrophobicContact CG-CZ2 4.29Å; L544-L608 HydrophobicContact CD1-CD1 3.97Å; L544-L608 HydrophobicContact CD1-CD2 4.23Å; L544-L608 HydrophobicContact CD1-CG 3.93Å; L544-L608 HydrophobicContact CD2-CG 4.22Å
545	F	88.2	Confident	86	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	153.8	169.4	67.5	-90	0	0	0	111.3	L503 I511 F525 V535 A536 W537 W557 L559	L503-F545 HydrophobicContact CD1-CB 3.53Å; L503-F545 HydrophobicContact CD1-CD1 3.68Å; L503-F545 HydrophobicContact CD1-CD2 3.74Å; L503-F545 HydrophobicContact CD1-CE1 4.25Å; L503-F545 HydrophobicContact CD1-CE2 4.31Å; L503-F545 HydrophobicContact CD1-CG 3.38Å; I511-F545 HydrophobicContact CD1-CE2 4.16Å; I511-F545 HydrophobicContact CG2-CE2 4.41Å; F525-F545 HydrophobicContact CD1-CZ 4.3Å; F525-F545 HydrophobicContact CD2-CZ 4.03Å; F525-F545 HydrophobicContact CE1-CE1 4.3Å; F525-F545 HydrophobicContact CE1-CZ 4.04Å; F525-F545 HydrophobicContact CE2-CE1 4.07Å; F525-F545 AromaticContact CE2-CZ 3.75Å; F525-F545 HydrophobicContact CE2-CZ 3.75Å; F525-F545 HydrophobicContact CG-CZ 4.32Å; F525-F545 AromaticContact CZ-CE1 3.82Å; F525-F545 HydrophobicContact CZ-CE1 3.82Å; F525-F545 AromaticContact CZ-CZ 3.76Å; F525-F545 HydrophobicContact CZ-CZ 3.76Å; V535-F545 HydrophobicContact CG2-CD2 3.97Å; A536-F545 WeakPolarHBondContact O-CA 3.47Å; W537-F545 HydrophobicContact CD2-CB 4.3Å; W537-F545 HydrophobicContact CE3-CB 4.45Å; F545-W557 HydrophobicContact CD1-CB 3.68Å; F545-W557 HydrophobicContact CD2-CB 3.83Å; F545-W557 AromaticContact CD2-CD1 3.87Å; F545-W557 HydrophobicContact CD2-CG 4.04Å; F545-W557 HydrophobicContact CE1-CB 3.27Å; F545-W557 AromaticContact CE1-CG 3.96Å; F545-W557 HydrophobicContact CE1-CG 3.96Å; F545-W557 HydrophobicContact CE2-CB 3.44Å; F545-W557 VanDerWaalsContact CE2-CB 3.44Å; F545-W557 AromaticContact CE2-CD1 3.27Å; F545-W557 HydrophobicContact CE2-CD2 4.12Å; F545-W557 AromaticContact CE2-CG 3.31Å; F545-W557 HydrophobicContact CE2-CG 3.31Å; F545-W557 HydrophobicContact CG-CB 3.96Å; F545-W557 HydrophobicContact CZ-CB 3.15Å; F545-W557 AromaticContact CZ-CD1 3.76Å; F545-W557 AromaticContact CZ-CD2 3.83Å; F545-W557 HydrophobicContact CZ-CD2 3.83Å; F545-W557 HydrophobicContact CZ-CE3 4.4Å; F545-W557 AromaticContact CZ-CG 3.27Å; F545-W557 HydrophobicContact CZ-CG 3.27Å; F545-W557 PolarHBondContact N-O 3.39Å; F545-W557 PolarHBondContact O-N 3.19Å; F545-L559 HydrophobicContact CD1-CD1 3.52Å; F545-L559 HydrophobicContact CD1-CG 4.49Å; F545-L559 HydrophobicContact CE1-CD1 3.54Å; F545-L559 HydrophobicContact CE1-CG 4.03Å
546	A	89.6	Confident	85.9	Confident	0 Å²	0	11 Å²	11	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	138.3	172.6	0	0	0	0	0	109.2	V535 A536 L554 D555 L556 V581 W583 V590	V535-A546 WeakPolarHBondContact CA-O 3.49Å; V535-A546 WeakPolarHBondContact CG2-O 3.47Å; A536-A546 PolarHBondContact N-O 3.35Å; A536-A546 PolarHBondContact O-N 3.39Å; A546-L554 HydrophobicContact CB-CD1 4.19Å; A546-D555 CarbonylContact C-O 3.59Å; A546-D555 WeakPolarHBondContact CA-O 3.34Å; A546-L556 HydrophobicContact CB-CD1 4.33Å; A546-V581 HydrophobicContact CB-CG2 3.99Å; A546-W583 HydrophobicContact CB-CZ2 3.76Å; A546-V590 HydrophobicContact CB-CG1 4.45Å
547	A	89.9	Confident	85.8	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.8	175.9	0	0	0	0	0	109.6	I511 D555	I511-A547 HydrophobicContact CD1-CB 3.35Å; A547-D555 PolarHBondContact N-O 3.14Å; A547-D555 PolarHBondContact O-N 2.84Å
548	V	88.8	Confident	85.6	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.9	-175.2	167.9	0	0	0	0	110.8	V532 M533 D534 L554 L578 V581 I592	V532-V548 WeakPolarHBondContact CA-O 3.25Å; M533-V548 PolarHBondContact N-O 3.18Å; D534-V548 PolarHBondContact O-N 3.16Å; D534-V548 VanDerWaalsContact O-N 3.11Å; V548-L554 HydrophobicContact CG2-CD1 3.59Å; V548-L578 HydrophobicContact CG1-CB 3.09Å; V548-L578 HydrophobicContact CG1-CD1 3.79Å; V548-L578 HydrophobicContact CG1-CG 4.07Å; V548-V581 HydrophobicContact CB-CB 4.41Å; V548-V581 HydrophobicContact CG2-CB 3.6Å; V548-V581 HydrophobicContact CG2-CG1 4.21Å; V548-V581 HydrophobicContact CG2-CG2 3.87Å; V548-I592 HydrophobicContact CG1-CG2 4.41Å; V548-I592 HydrophobicContact CG2-CG2 4.33Å
549	D	89	Confident	85.3	Confident	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	151.2	-179.6	-80.4	4.1	0	0	0	112.4	Y531 S551 G552 R553	Y531-D549 CarbonylContact O-C 3.57Å; Y531-D549 WeakPolarHBondContact O-CA 3.48Å; D549-S551 PolarHBondContact O-N 3.25Å; D549-S551 VanDerWaalsContact O-N 3.16Å; D549-G552 PolarHBondContact O-N 3.41Å; D549-R553 HydrophobicContact CB-CB 4.04Å; D549-R553 PolarHBondContact N-O 3.45Å
550	G	84	Confident	85.4	Confident	16 Å²	16	10.7 Å²	10.7	17%	0.165	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.1	172.1	0	0	0	0	0	114.8	Y531 A577	Y531-G550 PolarHBondContact O-N 3.36Å; G550-A577 VanDerWaalsContact O-CA 3.25Å; G550-A577 WeakPolarHBondContact O-CA 3.26Å; G550-A577 WeakPolarHBondContact O-CB 3.48Å
551	S	84.3	Confident	85.1	Confident	32 Å²	32	13.9 Å²	13.9	22%	0.224	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	5.2	175.9	69.1	0	0	0	0	114.2	D549	D549-S551 PolarHBondContact O-N 3.25Å; D549-S551 VanDerWaalsContact O-N 3.16Å
552	G	84.4	Confident	84.8	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.093	C	C	.	.	S	Bend	trans	89.6	15.2	-178.4	0	0	0	0	0	114.6	D549 V572 P576 L578	D549-G552 PolarHBondContact O-N 3.41Å; G552-V572 PolarHBondContact O-N 2.92Å; G552-P576 WeakPolarHBondContact CA-O 3.1Å; G552-P576 PolarHBondContact N-O 2.86Å; G552-L578 VanDerWaalsContact C-CD1 3.43Å
553	R	87.4	Confident	84.5	Confident	95 Å²	95	20.1 Å²	20.1	36%	0.358	11%	0.105	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133.5	178.5	-61.5	-178	174.5	-107.9	-1.3	111.2	D549 I570 V571	D549-R553 HydrophobicContact CB-CB 4.04Å; D549-R553 PolarHBondContact N-O 3.45Å; R553-I570 CarbonylContact C-O 3.59Å; R553-I570 WeakPolarHBondContact CA-O 3.02Å; R553-V571 HydrophobicContact CG-CG2 4.17Å
554	L	88.1	Confident	84.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.6	164.9	175.6	70	0	0	0	107.7	L270 A546 V548 S569 I570 V581 V590 I592 Y602	L270-L554 HydrophobicContact CD1-CD2 4.26Å; L270-L554 HydrophobicContact CD2-CD2 4.4Å; A546-L554 HydrophobicContact CB-CD1 4.19Å; V548-L554 HydrophobicContact CG2-CD1 3.59Å; L554-S569 WeakPolarHBondContact O-CA 3.48Å; L554-I570 PolarHBondContact N-O 3.09Å; L554-I570 PolarHBondContact O-N 3.08Å; L554-V581 HydrophobicContact CD1-CG2 4.3Å; L554-V590 HydrophobicContact CD1-CG1 4.27Å; L554-V590 HydrophobicContact CD2-CG1 4.22Å; L554-I592 HydrophobicContact CB-CD1 3.65Å; L554-I592 HydrophobicContact CD1-CD1 3.86Å; L554-I592 HydrophobicContact CD1-CG1 4.32Å; L554-I592 HydrophobicContact CD2-CD1 3.69Å; L554-I592 HydrophobicContact CD2-CG1 4.41Å; L554-I592 HydrophobicContact CG-CD1 3.9Å; L554-Y602 HydrophobicContact CD2-CD2 4.1Å; L554-Y602 HydrophobicContact CD2-CG 4.26Å
555	D	88.9	Confident	83.7	Confident	8 Å²	8	31 Å²	31	4%	0.043	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.6	177.7	-66.6	-37.2	0	0	0	110.4	A546 A547 P566 S569	A546-D555 CarbonylContact C-O 3.59Å; A546-D555 WeakPolarHBondContact CA-O 3.34Å; A547-D555 PolarHBondContact N-O 3.14Å; A547-D555 PolarHBondContact O-N 2.84Å; D555-P566 HydrophobicContact CB-CB 4.03Å; D555-S569 WeakPolarHBondContact OD1-CA 3.35Å; D555-S569 WeakPolarHBondContact OD1-CB 3.31Å
556	L	88.8	Confident	83.3	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.9	179.6	-171.5	78	0	0	0	108.9	L270 L544 A546 T567 A568 W583 V604 L608	L270-L556 HydrophobicContact CD1-CB 4.11Å; L270-L556 HydrophobicContact CD1-CD2 4.34Å; L270-L556 HydrophobicContact CD2-CD2 4.43Å; L270-L556 HydrophobicContact CG-CD2 4.3Å; L544-L556 HydrophobicContact CD1-CD1 3.81Å; L544-L556 HydrophobicContact CD1-CD2 4.02Å; L544-L556 HydrophobicContact CD1-CG 3.69Å; L544-L556 HydrophobicContact CD2-CD1 4.32Å; L544-L556 HydrophobicContact CG-CD1 4Å; L544-L556 HydrophobicContact CG-CG 4.43Å; A546-L556 HydrophobicContact CB-CD1 4.33Å; L556-T567 PolarHBondContact O-N 2.94Å; L556-A568 HydrophobicContact CB-CB 4.14Å; L556-A568 WeakPolarHBondContact CB-O 3.17Å; L556-A568 HydrophobicContact CD2-CB 4.32Å; L556-A568 PolarHBondContact N-O 2.85Å; L556-A568 PolarHBondContact O-N 3.39Å; L556-W583 HydrophobicContact CD1-CH2 3.6Å; L556-W583 HydrophobicContact CD1-CZ2 3.52Å; L556-V604 HydrophobicContact CD2-CG1 4.27Å; L556-L608 HydrophobicContact CD2-CD2 3.22Å; L556-L608 HydrophobicContact CD2-CG 4.23Å; L556-L608 HydrophobicContact CG-CD2 4.35Å
557	W	87.1	Confident	82.6	Confident	3 Å²	3	32.5 Å²	32.5	1%	0.011	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.2	-171.5	-68.5	86.7	0	0	0	110.5	F525 D527 L544 F545 P566	F525-W557 AromaticContact CD1-CE3 3.92Å; F525-W557 HydrophobicContact CD1-CE3 3.92Å; F525-W557 HydrophobicContact CD1-CH2 4.36Å; F525-W557 AromaticContact CD1-CZ3 3.83Å; F525-W557 HydrophobicContact CD1-CZ3 3.83Å; F525-W557 HydrophobicContact CE1-CE3 4.2Å; F525-W557 HydrophobicContact CE1-CZ3 4.44Å; D527-W557 HydrophobicContact CB-CH2 3.7Å; D527-W557 HydrophobicContact CB-CZ2 4.12Å; L544-W557 WeakPolarHBondContact CA-O 3.41Å; L544-W557 WeakPolarHBondContact CD1-O 3.34Å; F545-W557 HydrophobicContact CD1-CB 3.68Å; F545-W557 HydrophobicContact CD2-CB 3.83Å; F545-W557 AromaticContact CD2-CD1 3.87Å; F545-W557 HydrophobicContact CD2-CG 4.04Å; F545-W557 HydrophobicContact CE1-CB 3.27Å; F545-W557 AromaticContact CE1-CG 3.96Å; F545-W557 HydrophobicContact CE1-CG 3.96Å; F545-W557 HydrophobicContact CE2-CB 3.44Å; F545-W557 VanDerWaalsContact CE2-CB 3.44Å; F545-W557 AromaticContact CE2-CD1 3.27Å; F545-W557 HydrophobicContact CE2-CD2 4.12Å; F545-W557 AromaticContact CE2-CG 3.31Å; F545-W557 HydrophobicContact CE2-CG 3.31Å; F545-W557 HydrophobicContact CG-CB 3.96Å; F545-W557 HydrophobicContact CZ-CB 3.15Å; F545-W557 AromaticContact CZ-CD1 3.76Å; F545-W557 AromaticContact CZ-CD2 3.83Å; F545-W557 HydrophobicContact CZ-CD2 3.83Å; F545-W557 HydrophobicContact CZ-CE3 4.4Å; F545-W557 AromaticContact CZ-CG 3.27Å; F545-W557 HydrophobicContact CZ-CG 3.27Å; F545-W557 PolarHBondContact N-O 3.39Å; F545-W557 PolarHBondContact O-N 3.19Å; W557-P566 HydrophobicContact CD2-CB 4.23Å; W557-P566 HydrophobicContact CH2-CB 4.46Å; W557-P566 HydrophobicContact CZ2-CB 4.06Å; W557-P566 HydrophobicContact CZ2-CG 4.31Å
558	N	85.6	Confident	82	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	105.4	171.1	-171.8	-9.4	0	0	0	110	A543 L544 N560 Q561 D562 T567 L608	A543-N558 CarbonylContact O-C 3.34Å; A543-N558 WeakPolarHBondContact O-CA 2.87Å; L544-N558 HydrophobicContact CD1-CB 4.3Å; N558-N560 PolarHBondContact O-N 2.76Å; N558-N560 VanDerWaalsContact O-N 3.07Å; N558-N560 WeakPolarHBondContact OD1-CB 3.47Å; N558-N560 PolarHBondContact OD1-N 3.04Å; N558-N560 VanDerWaalsContact OD1-N 3.1Å; N558-Q561 HydrophobicContact CB-CB 4.42Å; N558-Q561 PolarHBondContact O-N 3.36Å; N558-Q561 VanDerWaalsContact O-N 3.09Å; N558-D562 PolarHBondContact O-N 3.24Å; N558-D562 VanDerWaalsContact O-O 3.13Å; N558-T567 WeakPolarHBondContact CB-OG1 3.18Å; N558-T567 PolarHBondContact N-OG1 2.85Å; N558-L608 HydrophobicContact CB-CD1 4.34Å; N558-L608 WeakPolarHBondContact ND2-CD1 3.38Å
559	L	81.1	Confident	81.7	Confident	6 Å²	6	36.4 Å²	36.4	3%	0.031	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.6	-179	-67.4	103.9	0	0	0	113.6	L513 F525 W537 A543 F545 F619	L513-L559 HydrophobicContact CD2-CD2 3.93Å; F525-L559 HydrophobicContact CZ-CD2 3.88Å; F525-L559 HydrophobicContact CZ-CG 4.26Å; W537-L559 HydrophobicContact CH2-CD1 3.6Å; W537-L559 HydrophobicContact CZ2-CD1 4.32Å; W537-L559 HydrophobicContact CZ3-CD1 4.19Å; A543-L559 HydrophobicContact CB-CB 4.11Å; A543-L559 WeakPolarHBondContact O-CD1 3.18Å; A543-L559 PolarHBondContact O-N 3Å; F545-L559 HydrophobicContact CD1-CD1 3.52Å; F545-L559 HydrophobicContact CD1-CG 4.49Å; F545-L559 HydrophobicContact CE1-CD1 3.54Å; F545-L559 HydrophobicContact CE1-CG 4.03Å; L559-F619 HydrophobicContact CB-CD2 4.3Å; L559-F619 HydrophobicContact CB-CE2 3.86Å; L559-F619 HydrophobicContact CD1-CE2 4.36Å; L559-F619 HydrophobicContact CD2-CE2 4.19Å; L559-F619 HydrophobicContact CG-CE2 4.37Å
560	N	80.9	Confident	81.4	Confident	22 Å²	22	38.4 Å²	38.4	12%	0.118	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-18.3	178	-75.6	-20.5	0	0	0	113.9	A543 N558 E615 F619	A543-N560 HydrophobicContact CB-CB 4.34Å; N558-N560 PolarHBondContact O-N 2.76Å; N558-N560 VanDerWaalsContact O-N 3.07Å; N558-N560 WeakPolarHBondContact OD1-CB 3.47Å; N558-N560 PolarHBondContact OD1-N 3.04Å; N558-N560 VanDerWaalsContact OD1-N 3.1Å; N560-E615 PolarHBondContact ND2-O 2.94Å; N560-F619 WeakPolarHBondContact OD1-CA 3.31Å; N560-F619 VanDerWaalsContact OD1-CB 3.27Å; N560-F619 WeakPolarHBondContact OD1-CB 3.41Å; N560-F619 WeakPolarHBondContact OD1-CD2 3.31Å; N560-F619 PolarHBondContact OD1-N 3.42Å
561	Q	76.1	Confident	81.3	Confident	107 Å²	107	41.3 Å²	41.3	50%	0.5	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-62.5	-177.9	-71	-176.9	2	0	0	110.3	N558 T567	N558-Q561 HydrophobicContact CB-CB 4.42Å; N558-Q561 PolarHBondContact O-N 3.36Å; N558-Q561 VanDerWaalsContact O-N 3.09Å; Q561-T567 VanDerWaalsContact OE1-CG2 3.31Å
562	D	73.3	Confident	81.1	Confident	92 Å²	92	39.9 Å²	39.9	49%	0.492	21%	0.213	S	C	.	.			trans	-141.3	128.7	-176.8	-69.5	-53.1	0	0	0	109.2	N558	N558-D562 PolarHBondContact O-N 3.24Å; N558-D562 VanDerWaalsContact O-O 3.13Å
563	T	71.4	Confident	80.2	Confident	41 Å²	41	43.9 Å²	43.9	25%	0.252	25%	0.246	S	C	.	.	S	Bend	trans	-93.5	-14.4	177.9	55.8	0	0	0	0	113	Y523 F525	Y523-T563 WeakPolarHBondContact CE1-O 3.36Å; Y523-T563 WeakPolarHBondContact OH-CB 3.34Å; Y523-T563 PolarHBondContact OH-O 2.88Å; Y523-T563 VanDerWaalsContact OH-O 3.04Å; Y523-T563 PolarHBondContact OH-OG1 3.25Å; F525-T563 VanDerWaalsContact CD1-O 3.3Å; F525-T563 WeakPolarHBondContact CD1-O 3.44Å; F525-T563 WeakPolarHBondContact CE1-O 3.27Å
564	E	72.1	Confident	79.2	Confident	146 Å²	146	43 Å²	43	68%	0.682	27%	0.267	S	S	*	.	S	Bend	trans	-104.2	-25.7	-174.6	-64.8	-176.9	177.7	0	0	113.2
565	V	79.8	Confident	78.4	Confident	83 Å²	83	45.7 Å²	45.7	50%	0.503	29%	0.289	S	S	.	.	S	Bend	trans	-124	137	-175.8	-178.6	0	0	0	0	109.6	T567	V565-T567 PolarHBondContact O-N 2.99Å
566	P	77.9	Confident	78	Confident	19 Å²	19	46.5 Å²	46.5	12%	0.123	30%	0.295	C	S	.	.			trans	-64.6	131.4	173.5	26.3	-33.8	0	0	0	110.4	D527 D555 W557 A568	D527-P566 WeakPolarHBondContact OD2-CD 3.23Å; D555-P566 HydrophobicContact CB-CB 4.03Å; W557-P566 HydrophobicContact CD2-CB 4.23Å; W557-P566 HydrophobicContact CH2-CB 4.46Å; W557-P566 HydrophobicContact CZ2-CB 4.06Å; W557-P566 HydrophobicContact CZ2-CG 4.31Å; P566-A568 VanDerWaalsContact C-N 3.27Å; P566-A568 PolarHBondContact O-N 2.76Å
567	T	76.3	Confident	77.7	Confident	12 Å²	12	47.6 Å²	47.6	7%	0.074	30%	0.303	C	S	.	.	S	Bend	trans	-66.6	-30.8	-179.3	-50.4	0	0	0	0	112.2	R269 L556 N558 Q561 V565	R269-T567 PolarHBondContact NH1-O 2.92Å; L556-T567 PolarHBondContact O-N 2.94Å; N558-T567 WeakPolarHBondContact CB-OG1 3.18Å; N558-T567 PolarHBondContact N-OG1 2.85Å; Q561-T567 VanDerWaalsContact OE1-CG2 3.31Å; V565-T567 PolarHBondContact O-N 2.99Å
568	A	77.7	Confident	77.8	Confident	13 Å²	13	47.4 Å²	47.4	11%	0.107	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	129.4	170.5	0	0	0	0	0	110.2	R269 L270 L556 P566	R269-A568 HydrophobicContact CB-CB 4Å; L270-A568 HydrophobicContact CD1-CB 3.69Å; L270-A568 HydrophobicContact CG-CB 4.27Å; L556-A568 HydrophobicContact CB-CB 4.14Å; L556-A568 WeakPolarHBondContact CB-O 3.17Å; L556-A568 HydrophobicContact CD2-CB 4.32Å; L556-A568 PolarHBondContact N-O 2.85Å; L556-A568 PolarHBondContact O-N 3.39Å; P566-A568 VanDerWaalsContact C-N 3.27Å; P566-A568 PolarHBondContact O-N 2.76Å
569	S	81.4	Confident	77.8	Confident	68 Å²	68	48.8 Å²	48.8	48%	0.476	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132.4	172.5	55.7	0	0	0	0	109.4	L554 D555	L554-S569 WeakPolarHBondContact O-CA 3.48Å; D555-S569 WeakPolarHBondContact OD1-CA 3.35Å; D555-S569 WeakPolarHBondContact OD1-CB 3.31Å
570	I	82.4	Confident	78.1	Confident	42 Å²	42	51.1 Å²	51.1	22%	0.215	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.3	174.4	-68.5	-166.9	0	0	0	109.3	L270 R553 L554 Y602	L270-I570 HydrophobicContact CB-CD1 3.23Å; L270-I570 HydrophobicContact CB-CG1 4.07Å; L270-I570 HydrophobicContact CD1-CD1 4.07Å; L270-I570 HydrophobicContact CD1-CG1 4.06Å; L270-I570 HydrophobicContact CG-CD1 4.28Å; L270-I570 WeakPolarHBondContact O-CD1 3.38Å; R553-I570 CarbonylContact C-O 3.59Å; R553-I570 WeakPolarHBondContact CA-O 3.02Å; L554-I570 PolarHBondContact N-O 3.09Å; L554-I570 PolarHBondContact O-N 3.08Å; I570-Y602 HydrophobicContact CD1-CD1 4.29Å; I570-Y602 HydrophobicContact CD1-CE1 4.19Å; I570-Y602 HydrophobicContact CG2-CE1 3.94Å
571	V	82.5	Confident	78.6	Confident	77 Å²	77	50.5 Å²	50.5	47%	0.467	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	122.1	167.6	-168.6	0	0	0	0	108.5	R553	R553-V571 HydrophobicContact CG-CG2 4.17Å
572	V	79.8	Confident	79.1	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-66.3	139	174.8	-176.5	0	0	0	0	109.6	G552 G574 A575 L578 I592 Y600 Y602	G552-V572 PolarHBondContact O-N 2.92Å; V572-G574 PolarHBondContact O-N 3.01Å; V572-A575 PolarHBondContact O-N 3.32Å; V572-L578 HydrophobicContact CG2-CD1 3.89Å; V572-L578 HydrophobicContact CG2-CD2 4.13Å; V572-I592 HydrophobicContact CG2-CD1 4.29Å; V572-Y600 HydrophobicContact CG1-CD1 3.88Å; V572-Y600 HydrophobicContact CG1-CD2 3.87Å; V572-Y600 HydrophobicContact CG1-CE1 3.55Å; V572-Y600 HydrophobicContact CG1-CE2 3.49Å; V572-Y600 VanDerWaalsContact CG1-CE2 3.49Å; V572-Y600 HydrophobicContact CG1-CG 4.05Å; V572-Y602 HydrophobicContact CG2-CE2 4.32Å; V572-Y602 WeakPolarHBondContact CG2-OH 3.25Å
573	A	66.3	Low	79.8	Confident	84 Å²	84	42.8 Å²	42.8	69%	0.694	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	119.9	-178.7	0	0	0	0	0	111.4
574	G	65.1	Low	80.6	Confident	77 Å²	77	40.9 Å²	40.9	79%	0.794	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.5	-7.1	-176.4	0	0	0	0	0	114.5	V572 P576	V572-G574 PolarHBondContact O-N 3.01Å; G574-P576 VanDerWaalsContact C-N 3.27Å
575	A	72.7	Confident	80.9	Confident	56 Å²	56	36.6 Å²	36.6	46%	0.463	25%	0.251	S	S	.	.			trans	42	45.5	-178.1	0	0	0	0	0	114.7	V572	V572-A575 PolarHBondContact O-N 3.32Å
576	P	79.3	Confident	80.9	Confident	26 Å²	26	35 Å²	35	17%	0.169	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-79.5	159.7	176.1	39	-36.2	0	0	0	110.3	G552 G574 L578 D594	G552-P576 WeakPolarHBondContact CA-O 3.1Å; G552-P576 PolarHBondContact N-O 2.86Å; G574-P576 VanDerWaalsContact C-N 3.27Å; P576-L578 PolarHBondContact O-N 3.32Å; P576-D594 WeakPolarHBondContact CB-OD1 3.36Å; P576-D594 WeakPolarHBondContact CG-OD1 3.34Å; P576-D594 WeakPolarHBondContact CG-OD2 3.24Å
577	A	83.2	Confident	81	Confident	22 Å²	22	34.1 Å²	34.1	18%	0.182	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-67.5	128.8	179.7	0	0	0	0	0	110.6	G550 E595	G550-A577 VanDerWaalsContact O-CA 3.25Å; G550-A577 WeakPolarHBondContact O-CA 3.26Å; G550-A577 WeakPolarHBondContact O-CB 3.48Å; A577-E595 HydrophobicContact CB-CB 4.37Å; A577-E595 WeakPolarHBondContact O-CB 3.42Å; A577-E595 PolarHBondContact O-N 3.12Å
578	L	87.9	Confident	81.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.5	-179.3	-56.8	170.4	0	0	0	108.5	M533 V548 G552 V572 P576 I592 G593	M533-L578 WeakPolarHBondContact CB-O 3.45Å; M533-L578 WeakPolarHBondContact CG-O 3.43Å; V548-L578 HydrophobicContact CG1-CB 3.09Å; V548-L578 HydrophobicContact CG1-CD1 3.79Å; V548-L578 HydrophobicContact CG1-CG 4.07Å; G552-L578 VanDerWaalsContact C-CD1 3.43Å; V572-L578 HydrophobicContact CG2-CD1 3.89Å; V572-L578 HydrophobicContact CG2-CD2 4.13Å; P576-L578 PolarHBondContact O-N 3.32Å; L578-I592 HydrophobicContact CB-CG2 3.92Å; L578-I592 HydrophobicContact CD1-CD1 4.48Å; L578-I592 HydrophobicContact CD1-CG2 3.86Å; L578-I592 HydrophobicContact CD2-CG2 3.67Å; L578-I592 HydrophobicContact CG-CG2 3.97Å; L578-G593 WeakPolarHBondContact CA-O 3.24Å
579	N	87.3	Confident	81.6	Confident	29 Å²	29	37.3 Å²	37.3	16%	0.155	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-33.4	-170.5	-71.9	-25.8	0	0	0	113.6	I287 M533 G593	I287-N579 WeakPolarHBondContact O-CB 3.43Å; I287-N579 PolarHBondContact O-ND2 3.09Å; M533-N579 WeakPolarHBondContact CE-OD1 3.49Å; N579-G593 PolarHBondContact N-O 2.79Å
580	R	87.1	Confident	82	Confident	56 Å²	56	34 Å²	34	21%	0.211	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	149.5	-169.1	-69.9	-64.7	-173.3	107.7	5.9	112	T288 M290 D534 G593	T288-R580 WeakPolarHBondContact O-CG 3.38Å; T288-R580 PolarHBondContact O-NE 3.07Å; T288-R580 PolarHBondContact O-NH2 2.79Å; M290-R580 HydrophobicContact CE-CB 3.75Å; M290-R580 WeakPolarHBondContact CE-O 3.4Å; D534-R580 WeakPolarHBondContact OD2-CA 3.38Å; D534-R580 WeakPolarHBondContact OD2-CD 3.44Å; R580-G593 PolarHBondContact O-N 2.98Å
581	V	90.1	Very high	82.2	Confident	8 Å²	8	32 Å²	32	5%	0.048	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.9	175.8	66.9	0	0	0	0	110.6	D534 A536 A546 V548 L554 V590 C591	D534-V581 HydrophobicContact CB-CG1 3.95Å; D534-V581 PolarHBondContact OD2-N 2.91Å; A536-V581 HydrophobicContact CB-CG1 3.75Å; A546-V581 HydrophobicContact CB-CG2 3.99Å; V548-V581 HydrophobicContact CB-CB 4.41Å; V548-V581 HydrophobicContact CG2-CB 3.6Å; V548-V581 HydrophobicContact CG2-CG1 4.21Å; V548-V581 HydrophobicContact CG2-CG2 3.87Å; L554-V581 HydrophobicContact CD1-CG2 4.3Å; V581-V590 HydrophobicContact CG2-CG1 3.77Å; V581-C591 WeakPolarHBondContact CA-O 3.21Å
582	S	88.1	Confident	82.5	Confident	21 Å²	21	28.4 Å²	28.4	15%	0.147	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	132.4	177	-165.9	0	0	0	0	111.9	W292 C591	W292-S582 VanDerWaalsContact CD1-OG 3.25Å; W292-S582 PolarHBondContact NE1-O 2.68Å; S582-C591 PolarHBondContact N-O 2.83Å; S582-C591 PolarHBondContact O-N 2.88Å
583	W	88.3	Confident	82.8	Confident	16 Å²	16	28.3 Å²	28.3	6%	0.061	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	144.1	177.1	-74.6	88.4	0	0	0	111.5	W292 A536 P539 L544 A546 L556 G587 V590 V604	W292-W583 PolarHBondContact NE1-O 2.75Å; A536-W583 PolarHBondContact O-NE1 2.92Å; P539-W583 HydrophobicContact CG-CB 4.36Å; L544-W583 HydrophobicContact CD2-CH2 3.58Å; L544-W583 HydrophobicContact CD2-CZ2 4.21Å; L544-W583 HydrophobicContact CD2-CZ3 4.26Å; L544-W583 HydrophobicContact CG-CH2 4.14Å; L544-W583 HydrophobicContact CG-CZ2 4.29Å; A546-W583 HydrophobicContact CB-CZ2 3.76Å; L556-W583 HydrophobicContact CD1-CH2 3.6Å; L556-W583 HydrophobicContact CD1-CZ2 3.52Å; W583-G587 VanDerWaalsContact CZ3-O 3.31Å; W583-G587 WeakPolarHBondContact CZ3-O 3.48Å; W583-V590 HydrophobicContact CD2-CG2 3.68Å; W583-V590 HydrophobicContact CE3-CG2 3.5Å; W583-V590 HydrophobicContact CH2-CG2 3.43Å; W583-V590 VanDerWaalsContact CH2-CG2 3.43Å; W583-V590 HydrophobicContact CZ2-CG2 3.62Å; W583-V590 HydrophobicContact CZ3-CG2 3.39Å; W583-V604 HydrophobicContact CH2-CG2 3.81Å; W583-V604 HydrophobicContact CZ3-CB 4.44Å; W583-V604 HydrophobicContact CZ3-CG2 3.71Å
584	T	86.4	Confident	83.8	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.006	16%	0.162	C	C	.	.			trans	-62.5	148.8	165.5	56.3	0	0	0	0	110.3	W292 P539 S586 G587 L588 H589	W292-T584 HydrophobicContact CD2-CG2 4.12Å; W292-T584 HydrophobicContact CE3-CG2 4.17Å; W292-T584 HydrophobicContact CH2-CG2 3.4Å; W292-T584 HydrophobicContact CZ2-CG2 3.23Å; W292-T584 HydrophobicContact CZ3-CG2 3.87Å; P539-T584 WeakPolarHBondContact CG-O 3.3Å; T584-S586 WeakPolarHBondContact CB-OG 3.44Å; T584-S586 PolarHBondContact O-N 3.11Å; T584-S586 PolarHBondContact OG1-OG 2.78Å; T584-G587 PolarHBondContact O-N 3.31Å; T584-G587 PolarHBondContact OG1-N 2.83Å; T584-L588 PolarHBondContact OG1-N 3.01Å; T584-H589 HydrophobicContact CG2-CB 3.7Å; T584-H589 PolarHBondContact N-O 3.35Å; T584-H589 PolarHBondContact OG1-N 2.83Å; T584-H589 PolarHBondContact OG1-O 3.48Å
585	P	79.7	Confident	84.7	Confident	56 Å²	56	26 Å²	26	36%	0.364	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.2	170.4	-25.5	34.5	0	0	0	113.7	W292	W292-P585 HydrophobicContact CB-CG 4.23Å
586	S	80.3	Confident	85.2	Confident	51 Å²	51	24.9 Å²	24.9	36%	0.357	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-11.9	174.4	60.9	0	0	0	0	114.5	V540 T584 L588	V540-S586 WeakPolarHBondContact CG2-O 3.49Å; T584-S586 WeakPolarHBondContact CB-OG 3.44Å; T584-S586 PolarHBondContact O-N 3.11Å; T584-S586 PolarHBondContact OG1-OG 2.78Å; S586-L588 PolarHBondContact O-N 2.86Å; S586-L588 VanDerWaalsContact O-N 3.14Å
587	G	78.3	Confident	85.1	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	70.4	-1	-179.6	0	0	0	0	0	115.9	W583 T584 A609	W583-G587 VanDerWaalsContact CZ3-O 3.31Å; W583-G587 WeakPolarHBondContact CZ3-O 3.48Å; T584-G587 PolarHBondContact O-N 3.31Å; T584-G587 PolarHBondContact OG1-N 2.83Å; G587-A609 WeakPolarHBondContact O-CB 3.43Å
588	L	82.3	Confident	85.2	Confident	47 Å²	47	26.1 Å²	26.1	25%	0.246	14%	0.139	C	C	.	.	S	Bend	trans	-86.3	-27.7	-178	-68	170.2	0	0	0	113.3	T584 S586 D603 V604 E606 A609	T584-L588 PolarHBondContact OG1-N 3.01Å; S586-L588 PolarHBondContact O-N 2.86Å; S586-L588 VanDerWaalsContact O-N 3.14Å; L588-D603 VanDerWaalsContact O-OD1 3.07Å; L588-V604 PolarHBondContact O-N 3.09Å; L588-E606 HydrophobicContact CD2-CG 4.12Å; L588-A609 HydrophobicContact CD2-CB 3.87Å
589	H	85.7	Confident	85.2	Confident	44 Å²	44	26.1 Å²	26.1	20%	0.204	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	143.8	-177.8	-44.2	-53	0	0	0	111.6	T584 V601 Y602 D603	T584-H589 HydrophobicContact CG2-CB 3.7Å; T584-H589 PolarHBondContact N-O 3.35Å; T584-H589 PolarHBondContact OG1-N 2.83Å; T584-H589 PolarHBondContact OG1-O 3.48Å; H589-V601 HydrophobicContact CB-CG1 4.04Å; H589-Y602 CarbonylContact C-O 3.45Å; H589-Y602 WeakPolarHBondContact CA-O 3.03Å; H589-Y602 WeakPolarHBondContact CB-O 2.97Å; H589-D603 IonicContact CE1-OD1 3.88Å; H589-D603 PolarHBondContact CE1-OD1 3.42Å; H589-D603 IonicContact ND1-OD1 3.41Å; H589-D603 PolarHBondContact ND1-OD1 3.42Å
590	V	88.4	Confident	85.2	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.4	175.2	177.5	0	0	0	0	108.4	A546 L554 V581 W583 I592 Y602 V604	A546-V590 HydrophobicContact CB-CG1 4.45Å; L554-V590 HydrophobicContact CD1-CG1 4.27Å; L554-V590 HydrophobicContact CD2-CG1 4.22Å; V581-V590 HydrophobicContact CG2-CG1 3.77Å; W583-V590 HydrophobicContact CD2-CG2 3.68Å; W583-V590 HydrophobicContact CE3-CG2 3.5Å; W583-V590 HydrophobicContact CH2-CG2 3.43Å; W583-V590 VanDerWaalsContact CH2-CG2 3.43Å; W583-V590 HydrophobicContact CZ2-CG2 3.62Å; W583-V590 HydrophobicContact CZ3-CG2 3.39Å; V590-I592 HydrophobicContact CG1-CG1 4.5Å; V590-Y602 PolarHBondContact N-O 3.04Å; V590-Y602 PolarHBondContact O-N 3.11Å; V590-V604 HydrophobicContact CG2-CG2 3.58Å
591	C	87.7	Confident	85.3	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	139	173.2	-84.1	0	0	0	0	111.2	M290 W292 V581 S582 L599 Y600	M290-C591 HydrophobicContact SD-CB 4.44Å; W292-C591 HydrophobicContact CZ2-CB 3.99Å; W292-C591 WeakPolarHBondContact CZ2-SG 3.46Å; V581-C591 WeakPolarHBondContact CA-O 3.21Å; S582-C591 PolarHBondContact N-O 2.83Å; S582-C591 PolarHBondContact O-N 2.88Å; C591-L599 HydrophobicContact CB-CD2 4.12Å; C591-Y600 CarbonylContact C-O 3.45Å; C591-Y600 VanDerWaalsContact CA-O 3.29Å; C591-Y600 WeakPolarHBondContact CA-O 3.36Å
592	I	88.6	Confident	85.2	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	136.9	175.8	-43.4	-178	0	0	0	109.7	V548 L554 V572 L578 V590 L599 Y600 Y602	V548-I592 HydrophobicContact CG1-CG2 4.41Å; V548-I592 HydrophobicContact CG2-CG2 4.33Å; L554-I592 HydrophobicContact CB-CD1 3.65Å; L554-I592 HydrophobicContact CD1-CD1 3.86Å; L554-I592 HydrophobicContact CD1-CG1 4.32Å; L554-I592 HydrophobicContact CD2-CD1 3.69Å; L554-I592 HydrophobicContact CD2-CG1 4.41Å; L554-I592 HydrophobicContact CG-CD1 3.9Å; V572-I592 HydrophobicContact CG2-CD1 4.29Å; L578-I592 HydrophobicContact CB-CG2 3.92Å; L578-I592 HydrophobicContact CD1-CD1 4.48Å; L578-I592 HydrophobicContact CD1-CG2 3.86Å; L578-I592 HydrophobicContact CD2-CG2 3.67Å; L578-I592 HydrophobicContact CG-CG2 3.97Å; V590-I592 HydrophobicContact CG1-CG1 4.5Å; I592-L599 CarbonylContact O-C 3.49Å; I592-L599 WeakPolarHBondContact O-CA 3.44Å; I592-Y600 PolarHBondContact N-O 3.43Å; I592-Y600 PolarHBondContact O-N 3.3Å; I592-Y602 HydrophobicContact CD1-CD2 3.57Å; I592-Y602 HydrophobicContact CD1-CE2 3.39Å; I592-Y602 HydrophobicContact CG1-CD2 3.92Å; I592-Y602 HydrophobicContact CG1-CE2 4.09Å
593	G	87.1	Confident	85.1	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	130	173.1	0	0	0	0	0	111.7	L578 N579 R580	L578-G593 WeakPolarHBondContact CA-O 3.24Å; N579-G593 PolarHBondContact N-O 2.79Å; R580-G593 PolarHBondContact O-N 2.98Å
594	D	87.2	Confident	84.8	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	153.7	177.3	-167.2	-12.6	0	0	0	111.8	I287 P576 A596 G597 K598 Y600	I287-D594 PolarHBondContact N-O 2.95Å; I287-D594 VanDerWaalsContact N-O 3.14Å; P576-D594 WeakPolarHBondContact CB-OD1 3.36Å; P576-D594 WeakPolarHBondContact CG-OD1 3.34Å; P576-D594 WeakPolarHBondContact CG-OD2 3.24Å; D594-A596 VanDerWaalsContact C-N 3.28Å; D594-A596 PolarHBondContact OD1-N 2.82Å; D594-G597 PolarHBondContact O-N 2.75Å; D594-K598 HydrophobicContact CB-CB 4.07Å; D594-K598 WeakPolarHBondContact CB-O 3.4Å; D594-K598 PolarHBondContact N-O 2.71Å; D594-Y600 HydrophobicContact CB-CD2 4.44Å; D594-Y600 HydrophobicContact CB-CE2 3.88Å; D594-Y600 PolarHBondContact OD2-OH 2.85Å
595	E	84.1	Confident	84.4	Confident	111 Å²	111	24.5 Å²	24.5	52%	0.519	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-33.1	165.2	-172.2	-176.8	-179.7	0	0	112	R285 C286 A577 G597	R285-E595 CarbonylContact C-O 3.54Å; C286-E595 WeakPolarHBondContact CA-O 3.34Å; C286-E595 HydrophobicContact CB-CB 4.5Å; C286-E595 HydrophobicContact CB-CG 4.07Å; C286-E595 PolarHBondContact N-O 2.72Å; A577-E595 HydrophobicContact CB-CB 4.37Å; A577-E595 WeakPolarHBondContact O-CB 3.42Å; A577-E595 PolarHBondContact O-N 3.12Å; E595-G597 PolarHBondContact O-N 2.88Å
596	A	81.4	Confident	83.9	Confident	34 Å²	34	28 Å²	28	28%	0.281	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	2.3	177.6	0	0	0	0	0	114	D594	D594-A596 VanDerWaalsContact C-N 3.28Å; D594-A596 PolarHBondContact OD1-N 2.82Å
597	G	78.8	Confident	83.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	82.8	11.4	177.8	0	0	0	0	0	115.7	S282 R285 Y304 D594 E595	S282-G597 WeakPolarHBondContact CB-O 3.04Å; R285-G597 WeakPolarHBondContact O-CA 3.46Å; R285-G597 PolarHBondContact O-N 3.11Å; Y304-G597 WeakPolarHBondContact CE1-O 3.38Å; D594-G597 PolarHBondContact O-N 2.75Å; E595-G597 PolarHBondContact O-N 2.88Å
598	K	85.5	Confident	83	Confident	73 Å²	73	33 Å²	33	32%	0.317	17%	0.171	S	C	.	.			trans	-85.4	136.5	172.6	-65.7	171.6	-177	172.3	0	110	V275 F276 Y277 I287 D594 Y600	V275-K598 HydrophobicContact CG1-CB 3.95Å; V275-K598 HydrophobicContact CG1-CD 4.33Å; V275-K598 HydrophobicContact CG1-CG 4.26Å; F276-K598 WeakPolarHBondContact O-CA 3.45Å; Y277-K598 HydrophobicContact CD2-CD 4.47Å; Y277-K598 HydrophobicContact CD2-CG 3.54Å; Y277-K598 HydrophobicContact CE2-CG 4.32Å; Y277-K598 HydrophobicContact CG-CG 4.16Å; I287-K598 WeakPolarHBondContact CD1-O 3.44Å; D594-K598 HydrophobicContact CB-CB 4.07Å; D594-K598 WeakPolarHBondContact CB-O 3.4Å; D594-K598 PolarHBondContact N-O 2.71Å; K598-Y600 HydrophobicContact CB-CD2 4.41Å; K598-Y600 HydrophobicContact CB-CE2 3.69Å; K598-Y600 VanDerWaalsContact CD-OH 3.23Å; K598-Y600 WeakPolarHBondContact CD-OH 3.48Å
599	L	87.3	Confident	82.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	118	170.9	-166.5	155.2	0	0	0	108.7	V275 F276 I287 M290 V300 C591 I592 V601	V275-L599 CarbonylContact C-O 3.52Å; V275-L599 WeakPolarHBondContact CA-O 3.42Å; F276-L599 HydrophobicContact CB-CB 4.16Å; F276-L599 HydrophobicContact CD2-CB 4.18Å; F276-L599 HydrophobicContact CD2-CD2 3.59Å; F276-L599 HydrophobicContact CD2-CG 4.4Å; F276-L599 HydrophobicContact CE2-CD2 4.01Å; F276-L599 PolarHBondContact N-O 3.34Å; F276-L599 PolarHBondContact O-N 2.89Å; I287-L599 HydrophobicContact CD1-CB 4.01Å; M290-L599 HydrophobicContact CG-CD1 4.3Å; M290-L599 HydrophobicContact SD-CD1 3.52Å; M290-L599 VanDerWaalsContact SD-CD1 3.52Å; M290-L599 HydrophobicContact SD-CG 3.85Å; V300-L599 HydrophobicContact CG1-CD1 4.4Å; V300-L599 HydrophobicContact CG1-CD2 4.49Å; V300-L599 HydrophobicContact CG2-CD1 4.4Å; C591-L599 HydrophobicContact CB-CD2 4.12Å; I592-L599 CarbonylContact O-C 3.49Å; I592-L599 WeakPolarHBondContact O-CA 3.44Å; L599-V601 HydrophobicContact CD2-CG2 3.98Å
600	Y	87.8	Confident	81.6	Confident	11 Å²	11	34.4 Å²	34.4	4%	0.043	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131	179.4	-61	-90.9	0	0	0	109.7	L272 V275 V572 C591 I592 D594 K598 Y602	L272-Y600 HydrophobicContact CD1-CD1 4.04Å; V275-Y600 HydrophobicContact CB-CD1 4.26Å; V275-Y600 HydrophobicContact CB-CE1 4.28Å; V275-Y600 HydrophobicContact CG1-CD1 3.97Å; V275-Y600 HydrophobicContact CG1-CE1 3.7Å; V275-Y600 HydrophobicContact CG2-CD1 3.49Å; V275-Y600 VanDerWaalsContact CG2-CD1 3.49Å; V275-Y600 HydrophobicContact CG2-CE1 3.56Å; V572-Y600 HydrophobicContact CG1-CD1 3.88Å; V572-Y600 HydrophobicContact CG1-CD2 3.87Å; V572-Y600 HydrophobicContact CG1-CE1 3.55Å; V572-Y600 HydrophobicContact CG1-CE2 3.49Å; V572-Y600 VanDerWaalsContact CG1-CE2 3.49Å; V572-Y600 HydrophobicContact CG1-CG 4.05Å; C591-Y600 CarbonylContact C-O 3.45Å; C591-Y600 VanDerWaalsContact CA-O 3.29Å; C591-Y600 WeakPolarHBondContact CA-O 3.36Å; I592-Y600 PolarHBondContact N-O 3.43Å; I592-Y600 PolarHBondContact O-N 3.3Å; D594-Y600 HydrophobicContact CB-CD2 4.44Å; D594-Y600 HydrophobicContact CB-CE2 3.88Å; D594-Y600 PolarHBondContact OD2-OH 2.85Å; K598-Y600 HydrophobicContact CB-CD2 4.41Å; K598-Y600 HydrophobicContact CB-CE2 3.69Å; K598-Y600 VanDerWaalsContact CD-OH 3.23Å; K598-Y600 WeakPolarHBondContact CD-OH 3.48Å; Y600-Y602 HydrophobicContact CG-CE2 4.4Å
601	V	88.6	Confident	80.6	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.024	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	115.2	171.2	-170.9	0	0	0	0	108.1	N273 R274 F276 H589 L599	N273-V601 WeakPolarHBondContact CA-O 3.5Å; N273-V601 HydrophobicContact CB-CG1 4.44Å; N273-V601 WeakPolarHBondContact CB-O 3.33Å; N273-V601 PolarHBondContact N-O 3.08Å; R274-V601 PolarHBondContact N-O 3.4Å; R274-V601 PolarHBondContact O-N 2.9Å; F276-V601 HydrophobicContact CD2-CG2 3.92Å; F276-V601 HydrophobicContact CE2-CG2 3.31Å; F276-V601 HydrophobicContact CZ-CG2 4.17Å; H589-V601 HydrophobicContact CB-CG1 4.04Å; L599-V601 HydrophobicContact CD2-CG2 3.98Å
602	Y	88.1	Confident	79.7	Confident	7 Å²	7	39.8 Å²	39.8	3%	0.027	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136.9	173.2	-72.9	-81.6	0	0	0	110	S271 L272 L554 I570 V572 H589 V590 I592 Y600	S271-Y602 CarbonylContact O-C 3.59Å; S271-Y602 WeakPolarHBondContact O-CA 3.2Å; L272-Y602 HydrophobicContact CB-CD1 4.21Å; L272-Y602 HydrophobicContact CB-CE1 3.85Å; L272-Y602 HydrophobicContact CD1-CD1 4.18Å; L272-Y602 HydrophobicContact CD1-CE1 3.73Å; L272-Y602 HydrophobicContact CD1-CE2 4.18Å; L272-Y602 HydrophobicContact CG-CE1 4.38Å; L554-Y602 HydrophobicContact CD2-CD2 4.1Å; L554-Y602 HydrophobicContact CD2-CG 4.26Å; I570-Y602 HydrophobicContact CD1-CD1 4.29Å; I570-Y602 HydrophobicContact CD1-CE1 4.19Å; I570-Y602 HydrophobicContact CG2-CE1 3.94Å; V572-Y602 HydrophobicContact CG2-CE2 4.32Å; V572-Y602 WeakPolarHBondContact CG2-OH 3.25Å; H589-Y602 CarbonylContact C-O 3.45Å; H589-Y602 WeakPolarHBondContact CA-O 3.03Å; H589-Y602 WeakPolarHBondContact CB-O 2.97Å; V590-Y602 PolarHBondContact N-O 3.04Å; V590-Y602 PolarHBondContact O-N 3.11Å; I592-Y602 HydrophobicContact CD1-CD2 3.57Å; I592-Y602 HydrophobicContact CD1-CE2 3.39Å; I592-Y602 HydrophobicContact CG1-CD2 3.92Å; I592-Y602 HydrophobicContact CG1-CE2 4.09Å; Y600-Y602 HydrophobicContact CG-CE2 4.4Å
603	D	85.8	Confident	78.8	Confident	49 Å²	49	51.2 Å²	51.2	26%	0.262	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.1	170.5	-157.7	9.3	0	0	0	109	L270 S271 N273 L588 H589	L270-D603 CarbonylContact C-O 3.59Å; L270-D603 WeakPolarHBondContact CA-O 3.2Å; S271-D603 PolarHBondContact N-O 3.06Å; S271-D603 PolarHBondContact O-N 3.4Å; N273-D603 HydrophobicContact CB-CB 4.41Å; L588-D603 VanDerWaalsContact O-OD1 3.07Å; H589-D603 IonicContact CE1-OD1 3.88Å; H589-D603 PolarHBondContact CE1-OD1 3.42Å; H589-D603 IonicContact ND1-OD1 3.41Å; H589-D603 PolarHBondContact ND1-OD1 3.42Å
604	V	82.8	Confident	78.4	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	131.2	177.3	-178.1	0	0	0	0	107.4	L270 L556 W583 L588 V590 E606 L608 A609	L270-V604 HydrophobicContact CD2-CB 4.43Å; L270-V604 HydrophobicContact CD2-CG2 3.64Å; L556-V604 HydrophobicContact CD2-CG1 4.27Å; W583-V604 HydrophobicContact CH2-CG2 3.81Å; W583-V604 HydrophobicContact CZ3-CB 4.44Å; W583-V604 HydrophobicContact CZ3-CG2 3.71Å; L588-V604 PolarHBondContact O-N 3.09Å; V590-V604 HydrophobicContact CG2-CG2 3.58Å; V604-E606 PolarHBondContact O-N 2.87Å; V604-L608 HydrophobicContact CG1-CB 4.24Å; V604-L608 HydrophobicContact CG1-CD2 4.42Å; V604-L608 HydrophobicContact CG1-CG 4.42Å; V604-A609 HydrophobicContact CG1-CB 4.26Å
605	A	76.4	Confident	77.8	Confident	25 Å²	25	56 Å²	56	21%	0.207	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-53.9	135.5	178.9	0	0	0	0	0	111.3	R269 N607 L608 A609	R269-A605 PolarHBondContact O-N 2.82Å; A605-N607 PolarHBondContact O-N 3.17Å; A605-N607 VanDerWaalsContact O-N 3.1Å; A605-L608 PolarHBondContact O-N 3.37Å; A605-A609 PolarHBondContact O-N 2.86Å; A605-A609 VanDerWaalsContact O-N 3.07Å
606	E	70.3	Confident	77.4	Confident	129 Å²	129	53.2 Å²	53.2	60%	0.603	27%	0.265	S	S	*	.	H	α-helix	trans	-55.3	-33.7	-176.8	-65	-174.2	173.3	0	0	112.5	L588 V604 L608 A609 Q610	L588-E606 HydrophobicContact CD2-CG 4.12Å; V604-E606 PolarHBondContact O-N 2.87Å; E606-L608 PolarHBondContact O-N 3.05Å; E606-A609 PolarHBondContact O-N 3.15Å; E606-Q610 PolarHBondContact O-N 3.39Å
607	N	68.3	Low	77.4	Confident	144 Å²	144	54.2 Å²	54.2	77%	0.77	27%	0.27	S	S	*	.	H	α-helix	trans	-61	-22.6	176.8	-68.4	-18.6	0	0	0	114.1	A605	A605-N607 PolarHBondContact O-N 3.17Å; A605-N607 VanDerWaalsContact O-N 3.1Å
608	L	70.3	Confident	77.5	Confident	13 Å²	13	60.6 Å²	60.6	7%	0.068	29%	0.294	C	S	.	.	H	α-helix	trans	-105.9	-28.4	179.1	-173.3	57.1	0	0	0	111.9	H541 L544 L556 N558 V604 A605 E606	H541-L608 PolarHBondContact CD2-O 3.09Å; L544-L608 HydrophobicContact CD1-CD1 3.97Å; L544-L608 HydrophobicContact CD1-CD2 4.23Å; L544-L608 HydrophobicContact CD1-CG 3.93Å; L544-L608 HydrophobicContact CD2-CG 4.22Å; L556-L608 HydrophobicContact CD2-CD2 3.22Å; L556-L608 HydrophobicContact CD2-CG 4.23Å; L556-L608 HydrophobicContact CG-CD2 4.35Å; N558-L608 HydrophobicContact CB-CD1 4.34Å; N558-L608 WeakPolarHBondContact ND2-CD1 3.38Å; V604-L608 HydrophobicContact CG1-CB 4.24Å; V604-L608 HydrophobicContact CG1-CD2 4.42Å; V604-L608 HydrophobicContact CG1-CG 4.42Å; A605-L608 PolarHBondContact O-N 3.37Å; E606-L608 PolarHBondContact O-N 3.05Å
609	A	68.2	Low	77.2	Confident	2 Å²	2	57.3 Å²	57.3	2%	0.017	28%	0.28	C	S	.	.	H	α-helix	trans	-77.6	-33.9	-179.6	0	0	0	0	0	113.2	V540 G587 L588 V604 A605 E606	V540-A609 WeakPolarHBondContact CG1-O 3.38Å; G587-A609 WeakPolarHBondContact O-CB 3.43Å; L588-A609 HydrophobicContact CD2-CB 3.87Å; V604-A609 HydrophobicContact CG1-CB 4.26Å; A605-A609 PolarHBondContact O-N 2.86Å; A605-A609 VanDerWaalsContact O-N 3.07Å; E606-A609 PolarHBondContact O-N 3.15Å
610	Q	70.3	Confident	77	Confident	119 Å²	119	60.3 Å²	60.3	56%	0.556	30%	0.296	S	S	*	.	S	Bend	trans	-93.4	125.1	-179.3	-65.2	-169.4	8.7	0	0	111.5	E606 S612	E606-Q610 PolarHBondContact O-N 3.39Å; Q610-S612 PolarHBondContact O-N 2.82Å
611	P	67.4	Low	76.7	Confident	44 Å²	44	63.5 Å²	63.5	29%	0.286	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-70.6	130.1	178.4	28.3	-35.9	0	0	0	111	V540 E615	V540-P611 HydrophobicContact CG1-CG 4.47Å; P611-E615 WeakPolarHBondContact CA-OE2 3.26Å
612	S	70.7	Confident	76.4	Confident	68 Å²	68	66.7 Å²	66.7	48%	0.476	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-68.7	147.7	162.4	-178.4	0	0	0	0	109.8	Q610 D614 E615	Q610-S612 PolarHBondContact O-N 2.82Å; S612-D614 PolarHBondContact O-N 3.34Å; S612-E615 PolarHBondContact N-OE2 3.38Å; S612-E615 WeakPolarHBondContact O-CB 3.44Å; S612-E615 PolarHBondContact O-N 3.1Å
613	R	69.1	Low	76.1	Confident	241 Å²	241	66.8 Å²	66.8	91%	0.909	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.2	-175.4	-154.7	175.9	-178.8	171.2	0.9	113.3
614	D	77.4	Confident	75.9	Confident	69 Å²	69	67.3 Å²	67.3	37%	0.369	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-10.9	178.7	-168.9	31	0	0	0	113.7	S612 W616 S617 R618	S612-D614 PolarHBondContact O-N 3.34Å; D614-W616 PolarHBondContact O-N 3.41Å; D614-S617 PolarHBondContact O-N 3.37Å; D614-S617 PolarHBondContact O-OG 2.73Å; D614-S617 PolarHBondContact OD1-OG 3.49Å; D614-R618 WeakPolarHBondContact O-CG 3.44Å; D614-R618 PolarHBondContact O-N 2.78Å; D614-R618 VanDerWaalsContact O-N 3.11Å; D614-R618 IonicContact OD2-CZ 3.7Å; D614-R618 IonicContact OD2-NE 2.82Å; D614-R618 PolarHBondContact OD2-NE 3.19Å; D614-R618 IonicContact OD2-NH2 3.42Å; D614-R618 PolarHBondContact OD2-NH2 3.06Å
615	E	75.7	Confident	75.9	Confident	32 Å²	32	71.6 Å²	71.6	15%	0.15	36%	0.36	C	S	.	.	H	α-helix	trans	-69	-25	-178.3	-78	171.6	169.7	0	0	112.9	H541 N560 P611 S612 F619	H541-E615 IonicContact CD2-OE2 3.18Å; H541-E615 PolarHBondContact CD2-OE2 2.94Å; H541-E615 IonicContact NE2-OE1 2.76Å; H541-E615 IonicContact NE2-OE2 3.94Å; H541-E615 PolarHBondContact NE2-OE2 3.29Å; H541-E615 VanDerWaalsContact NE2-OE2 3.13Å; N560-E615 PolarHBondContact ND2-O 2.94Å; P611-E615 WeakPolarHBondContact CA-OE2 3.26Å; S612-E615 PolarHBondContact N-OE2 3.38Å; S612-E615 WeakPolarHBondContact O-CB 3.44Å; S612-E615 PolarHBondContact O-N 3.1Å; E615-F619 WeakPolarHBondContact O-CB 2.95Å; E615-F619 PolarHBondContact O-N 3.05Å
616	W	76.4	Confident	76.1	Confident	52 Å²	52	71.6 Å²	71.6	20%	0.197	36%	0.356	C	S	.	.	H	α-helix	trans	-67.5	-44.3	174.8	-69.9	96	0	0	0	112.9	N492 F498 P542 D614 N620	N492-W616 HydrophobicContact CB-CH2 4.18Å; N492-W616 WeakPolarHBondContact ND2-CH2 3.47Å; N492-W616 VanDerWaalsContact ND2-CZ2 3.35Å; N492-W616 WeakPolarHBondContact ND2-CZ2 3.41Å; F498-W616 AromaticContact CD2-CE3 3.85Å; F498-W616 HydrophobicContact CD2-CE3 3.85Å; F498-W616 AromaticContact CD2-CZ3 3.51Å; F498-W616 HydrophobicContact CD2-CZ3 3.51Å; F498-W616 AromaticContact CE2-CE3 3.43Å; F498-W616 HydrophobicContact CE2-CE3 3.43Å; F498-W616 VanDerWaalsContact CE2-CE3 3.43Å; F498-W616 AromaticContact CE2-CZ3 3.62Å; F498-W616 HydrophobicContact CE2-CZ3 3.62Å; F498-W616 HydrophobicContact CG-CZ3 4.5Å; F498-W616 HydrophobicContact CZ-CE3 4.24Å; P542-W616 HydrophobicContact CB-CD2 4.08Å; P542-W616 HydrophobicContact CB-CE3 3.71Å; P542-W616 HydrophobicContact CB-CH2 3.8Å; P542-W616 HydrophobicContact CB-CZ2 4.07Å; P542-W616 HydrophobicContact CB-CZ3 3.56Å; P542-W616 HydrophobicContact CG-CD2 3.87Å; P542-W616 HydrophobicContact CG-CE3 4Å; P542-W616 HydrophobicContact CG-CG 4.42Å; P542-W616 HydrophobicContact CG-CH2 4.41Å; P542-W616 HydrophobicContact CG-CZ2 4.2Å; P542-W616 HydrophobicContact CG-CZ3 4.27Å; D614-W616 PolarHBondContact O-N 3.41Å; W616-N620 PolarHBondContact O-N 3.04Å; W616-N620 VanDerWaalsContact O-N 3.09Å
617	S	80.3	Confident	76.5	Confident	55 Å²	55	68.6 Å²	68.6	39%	0.385	34%	0.341	S	S	.	.	H	α-helix	trans	-66.3	-43.4	175.8	19.7	0	0	0	0	110.9	D614 N620 T621	D614-S617 PolarHBondContact O-N 3.37Å; D614-S617 PolarHBondContact O-OG 2.73Å; D614-S617 PolarHBondContact OD1-OG 3.49Å; S617-N620 PolarHBondContact O-N 3.03Å; S617-T621 PolarHBondContact O-N 3.31Å; S617-T621 PolarHBondContact O-OG1 3.24Å
618	R	80.4	Confident	76.9	Confident	135 Å²	135	67.7 Å²	67.7	51%	0.509	33%	0.333	S	S	.	.	H	α-helix	trans	-62.5	-46	176.9	-68.8	178.4	-168	-171.7	3.3	111.5	D614 N620 T621 H622	D614-R618 WeakPolarHBondContact O-CG 3.44Å; D614-R618 PolarHBondContact O-N 2.78Å; D614-R618 VanDerWaalsContact O-N 3.11Å; D614-R618 IonicContact OD2-CZ 3.7Å; D614-R618 IonicContact OD2-NE 2.82Å; D614-R618 PolarHBondContact OD2-NE 3.19Å; D614-R618 IonicContact OD2-NH2 3.42Å; D614-R618 PolarHBondContact OD2-NH2 3.06Å; R618-N620 VanDerWaalsContact C-N 3.35Å; R618-N620 PolarHBondContact O-N 3.02Å; R618-T621 WeakPolarHBondContact O-CB 3.3Å; R618-T621 PolarHBondContact O-N 3.22Å; R618-T621 VanDerWaalsContact O-N 3.11Å; R618-H622 PolarHBondContact O-CD2 2.85Å; R618-H622 PolarHBondContact O-N 3.42Å
619	F	80.6	Confident	77.2	Confident	3 Å²	3	72.1 Å²	72.1	1%	0.013	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-42.9	178.5	-175.1	-117.2	0	0	0	112.2	F498 L501 W537 A543 L559 N560 E615 T621 H622 L623	F498-F619 AromaticContact CD1-CD1 3.88Å; F498-F619 HydrophobicContact CD1-CD1 3.88Å; F498-F619 AromaticContact CD1-CE1 3.7Å; F498-F619 HydrophobicContact CD1-CE1 3.7Å; F498-F619 AromaticContact CE1-CD1 3.45Å; F498-F619 HydrophobicContact CE1-CD1 3.45Å; F498-F619 VanDerWaalsContact CE1-CD1 3.45Å; F498-F619 AromaticContact CE1-CE1 3.74Å; F498-F619 HydrophobicContact CE1-CE1 3.74Å; F498-F619 AromaticContact CZ-CD1 3.95Å; F498-F619 HydrophobicContact CZ-CD1 3.95Å; L501-F619 HydrophobicContact CD1-CE1 3.82Å; L501-F619 HydrophobicContact CD1-CZ 3.99Å; W537-F619 HydrophobicContact CH2-CZ 4.31Å; A543-F619 HydrophobicContact CB-CD2 3.55Å; A543-F619 HydrophobicContact CB-CE2 3.91Å; A543-F619 HydrophobicContact CB-CG 4.13Å; L559-F619 HydrophobicContact CB-CD2 4.3Å; L559-F619 HydrophobicContact CB-CE2 3.86Å; L559-F619 HydrophobicContact CD1-CE2 4.36Å; L559-F619 HydrophobicContact CD2-CE2 4.19Å; L559-F619 HydrophobicContact CG-CE2 4.37Å; N560-F619 WeakPolarHBondContact OD1-CA 3.31Å; N560-F619 VanDerWaalsContact OD1-CB 3.27Å; N560-F619 WeakPolarHBondContact OD1-CB 3.41Å; N560-F619 WeakPolarHBondContact OD1-CD2 3.31Å; N560-F619 PolarHBondContact OD1-N 3.42Å; E615-F619 WeakPolarHBondContact O-CB 2.95Å; E615-F619 PolarHBondContact O-N 3.05Å; F619-T621 VanDerWaalsContact C-N 3.29Å; F619-T621 PolarHBondContact O-N 3.26Å; F619-H622 PolarHBondContact O-N 3.2Å; F619-L623 HydrophobicContact CE1-CD1 4.16Å; F619-L623 HydrophobicContact CZ-CD1 3.97Å; F619-L623 WeakPolarHBondContact O-CB 3.1Å; F619-L623 PolarHBondContact O-N 3.04Å
620	N	82.1	Confident	77.1	Confident	64 Å²	64	75.3 Å²	75.3	34%	0.342	37%	0.372	S	S	.	.	H	α-helix	trans	-59.6	-40.9	173.9	-101.2	-29.4	0	0	0	112.8	F498 W616 S617 R618 S624	F498-N620 WeakPolarHBondContact CE1-OD1 3.3Å; F498-N620 HydrophobicContact CZ-CB 4.26Å; F498-N620 VanDerWaalsContact CZ-ND2 3.27Å; F498-N620 WeakPolarHBondContact CZ-ND2 3.44Å; F498-N620 WeakPolarHBondContact CZ-OD1 3.16Å; W616-N620 PolarHBondContact O-N 3.04Å; W616-N620 VanDerWaalsContact O-N 3.09Å; S617-N620 PolarHBondContact O-N 3.03Å; R618-N620 VanDerWaalsContact C-N 3.35Å; R618-N620 PolarHBondContact O-N 3.02Å; N620-S624 WeakPolarHBondContact O-CB 3.27Å; N620-S624 PolarHBondContact O-N 3.46Å; N620-S624 PolarHBondContact O-OG 3.45Å
621	T	81.9	Confident	76.7	Confident	78 Å²	78	73.1 Å²	73.1	48%	0.479	37%	0.37	S	S	.	.	H	α-helix	trans	-67.5	-49.8	179.9	-52.3	0	0	0	0	109.9	S617 R618 F619 L623 S624 E625	S617-T621 PolarHBondContact O-N 3.31Å; S617-T621 PolarHBondContact O-OG1 3.24Å; R618-T621 WeakPolarHBondContact O-CB 3.3Å; R618-T621 PolarHBondContact O-N 3.22Å; R618-T621 VanDerWaalsContact O-N 3.11Å; F619-T621 VanDerWaalsContact C-N 3.29Å; F619-T621 PolarHBondContact O-N 3.26Å; T621-L623 VanDerWaalsContact C-N 3.35Å; T621-L623 PolarHBondContact O-N 2.95Å; T621-S624 WeakPolarHBondContact O-CA 3.37Å; T621-S624 WeakPolarHBondContact O-CB 3.21Å; T621-S624 PolarHBondContact O-N 2.83Å; T621-S624 VanDerWaalsContact O-N 3.08Å; T621-E625 WeakPolarHBondContact O-CG 3.46Å; T621-E625 PolarHBondContact O-N 2.78Å
622	H	81.6	Confident	76.1	Confident	71 Å²	71	77.3 Å²	77.3	33%	0.329	39%	0.39	S	S	.	.	H	α-helix	trans	-61	-40.5	176.4	-81	-52.7	0	0	0	112.9	R618 F619 S624 E625 I626	R618-H622 PolarHBondContact O-CD2 2.85Å; R618-H622 PolarHBondContact O-N 3.42Å; F619-H622 PolarHBondContact O-N 3.2Å; H622-S624 VanDerWaalsContact C-N 3.26Å; H622-S624 PolarHBondContact O-N 3.14Å; H622-E625 IonicContact CE1-OE2 2.65Å; H622-E625 IonicContact CG-OE2 3.33Å; H622-E625 IonicContact ND1-OE2 3.54Å; H622-E625 PolarHBondContact ND1-OE2 2.93Å; H622-E625 WeakPolarHBondContact O-CB 3.34Å; H622-E625 PolarHBondContact O-N 2.74Å; H622-E625 VanDerWaalsContact O-N 3.17Å; H622-I626 VanDerWaalsContact O-CG1 3.31Å; H622-I626 WeakPolarHBondContact O-CG1 3.47Å; H622-I626 PolarHBondContact O-N 2.89Å
623	L	81.7	Confident	75.1	Confident	9 Å²	9	82.3 Å²	82.3	5%	0.047	41%	0.406	C	S	.	.	H	α-helix	trans	-64.8	-34	176.1	-170.4	131.4	0	0	0	112.1	L501 F619 T621 K627	L501-L623 HydrophobicContact CD1-CD1 3.4Å; L501-L623 VanDerWaalsContact CD1-CD1 3.4Å; L501-L623 HydrophobicContact CD2-CD1 3.88Å; L501-L623 HydrophobicContact CG-CD1 4.28Å; F619-L623 HydrophobicContact CE1-CD1 4.16Å; F619-L623 HydrophobicContact CZ-CD1 3.97Å; F619-L623 WeakPolarHBondContact O-CB 3.1Å; F619-L623 PolarHBondContact O-N 3.04Å; T621-L623 VanDerWaalsContact C-N 3.35Å; T621-L623 PolarHBondContact O-N 2.95Å; L623-K627 HydrophobicContact CD2-CD 4.02Å; L623-K627 WeakPolarHBondContact O-CG 3.46Å; L623-K627 PolarHBondContact O-N 3.36Å; L623-K627 VanDerWaalsContact O-N 3.09Å
624	S	81.2	Confident	73.8	Confident	60 Å²	60	78.7 Å²	78.7	42%	0.42	41%	0.41	S	S	.	.	H	α-helix	trans	-69.7	-39.3	172.8	-56.9	0	0	0	0	111.6	N620 T621 H622 K627 M628	N620-S624 WeakPolarHBondContact O-CB 3.27Å; N620-S624 PolarHBondContact O-N 3.46Å; N620-S624 PolarHBondContact O-OG 3.45Å; T621-S624 WeakPolarHBondContact O-CA 3.37Å; T621-S624 WeakPolarHBondContact O-CB 3.21Å; T621-S624 PolarHBondContact O-N 2.83Å; T621-S624 VanDerWaalsContact O-N 3.08Å; H622-S624 VanDerWaalsContact C-N 3.26Å; H622-S624 PolarHBondContact O-N 3.14Å; S624-K627 PolarHBondContact O-N 2.7Å; S624-M628 WeakPolarHBondContact O-CG 3.34Å; S624-M628 PolarHBondContact O-N 2.81Å
625	E	82.7	Confident	73.7	Confident	90 Å²	90	79.2 Å²	79.2	42%	0.421	41%	0.412	S	S	.	.	H	α-helix	trans	-61.8	-45.5	173.8	-70.1	171.3	173.5	0	0	111.6	T621 H622 K627 M628 N629	T621-E625 WeakPolarHBondContact O-CG 3.46Å; T621-E625 PolarHBondContact O-N 2.78Å; H622-E625 IonicContact CE1-OE2 2.65Å; H622-E625 IonicContact CG-OE2 3.33Å; H622-E625 IonicContact ND1-OE2 3.54Å; H622-E625 PolarHBondContact ND1-OE2 2.93Å; H622-E625 WeakPolarHBondContact O-CB 3.34Å; H622-E625 PolarHBondContact O-N 2.74Å; H622-E625 VanDerWaalsContact O-N 3.17Å; E625-K627 VanDerWaalsContact C-N 3.3Å; E625-K627 PolarHBondContact O-N 3.05Å; E625-M628 PolarHBondContact O-N 3.31Å; E625-M628 VanDerWaalsContact O-N 3.15Å; E625-N629 VanDerWaalsContact O-CG 3.27Å; E625-N629 PolarHBondContact O-N 3.12Å
626	I	81.2	Confident	73.5	Confident	25 Å²	25	81.7 Å²	81.7	13%	0.128	43%	0.426	C	S	.	.	H	α-helix	trans	-59.5	-43.7	176.2	-68.3	166.2	0	0	0	110.5	L522 Y523 H622 N629 Q630	L522-I626 VanDerWaalsContact O-CG2 3.25Å; L522-I626 WeakPolarHBondContact O-CG2 3.35Å; Y523-I626 HydrophobicContact CD2-CG2 4.18Å; H622-I626 VanDerWaalsContact O-CG1 3.31Å; H622-I626 WeakPolarHBondContact O-CG1 3.47Å; H622-I626 PolarHBondContact O-N 2.89Å; I626-N629 PolarHBondContact O-N 2.82Å; I626-Q630 PolarHBondContact O-N 2.87Å
627	K	78.8	Confident	73.4	Confident	67 Å²	67	83.3 Å²	83.3	29%	0.291	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-40.5	175.6	-77.8	178.3	177.1	-175.9	0	112.6	L522 L623 S624 E625 S631	L522-K627 HydrophobicContact CD2-CD 4.38Å; L522-K627 HydrophobicContact CD2-CG 3.83Å; L623-K627 HydrophobicContact CD2-CD 4.02Å; L623-K627 WeakPolarHBondContact O-CG 3.46Å; L623-K627 PolarHBondContact O-N 3.36Å; L623-K627 VanDerWaalsContact O-N 3.09Å; S624-K627 PolarHBondContact O-N 2.7Å; E625-K627 VanDerWaalsContact C-N 3.3Å; E625-K627 PolarHBondContact O-N 3.05Å; K627-S631 PolarHBondContact O-N 3.07Å
628	M	76.9	Confident	73	Confident	124 Å²	124	85 Å²	85	61%	0.611	44%	0.442	S	S	*	.	H	α-helix	trans	-66.4	-43.9	177.6	-77	-179.5	160.4	0	0	111.8	S624 E625 Q630 S631 D632	S624-M628 WeakPolarHBondContact O-CG 3.34Å; S624-M628 PolarHBondContact O-N 2.81Å; E625-M628 PolarHBondContact O-N 3.31Å; E625-M628 VanDerWaalsContact O-N 3.15Å; M628-Q630 VanDerWaalsContact C-N 3.27Å; M628-Q630 PolarHBondContact O-N 3.33Å; M628-S631 WeakPolarHBondContact CA-OG 3.4Å; M628-S631 PolarHBondContact O-N 3.46Å; M628-S631 PolarHBondContact O-OG 3.21Å; M628-D632 PolarHBondContact O-N 3.33Å; M628-D632 VanDerWaalsContact O-N 3.12Å
629	N	76.4	Confident	72.5	Confident	107 Å²	107	81.9 Å²	81.9	57%	0.572	44%	0.437	S	S	*	.	H	α-helix	trans	-59.9	-38.6	178.1	-70	-11.5	0	0	0	111.7	E625 I626 D632 E633	E625-N629 VanDerWaalsContact O-CG 3.27Å; E625-N629 PolarHBondContact O-N 3.12Å; I626-N629 PolarHBondContact O-N 2.82Å; N629-D632 PolarHBondContact O-N 2.87Å; N629-E633 PolarHBondContact O-N 3.28Å
630	Q	66.1	Low	72	Confident	69 Å²	69	87.1 Å²	87.1	32%	0.322	47%	0.466	S	S	.	.	H	α-helix	trans	-68.5	-34	174.2	-79.8	-159.4	-26.6	0	0	114	P521 L522 I626 M628 D632	P521-Q630 PolarHBondContact O-NE2 3.43Å; P521-Q630 PolarHBondContact O-OE1 3.3Å; L522-Q630 VanDerWaalsContact O-CD 3.31Å; L522-Q630 PolarHBondContact O-NE2 3.08Å; L522-Q630 VanDerWaalsContact O-NE2 3.1Å; I626-Q630 PolarHBondContact O-N 2.87Å; M628-Q630 VanDerWaalsContact C-N 3.27Å; M628-Q630 PolarHBondContact O-N 3.33Å; Q630-D632 PolarHBondContact O-N 3.21Å
631	S	61.8	Low	71.3	Confident	73 Å²	73	88.8 Å²	88.8	51%	0.51	48%	0.475	S	S	.	.	H	α-helix	trans	-70	-25.1	176.8	57.1	0	0	0	0	112.9	K627 M628	K627-S631 PolarHBondContact O-N 3.07Å; M628-S631 WeakPolarHBondContact CA-OG 3.4Å; M628-S631 PolarHBondContact O-N 3.46Å; M628-S631 PolarHBondContact O-OG 3.21Å
632	D	55.8	Low	70.4	Confident	131 Å²	131	89.6 Å²	89.6	70%	0.701	47%	0.474	S	S	*	.	H	α-helix	trans	-84.7	-14.6	-179.8	-72.9	-12.1	0	0	0	113.4	M628 N629 Q630 V634	M628-D632 PolarHBondContact O-N 3.33Å; M628-D632 VanDerWaalsContact O-N 3.12Å; N629-D632 PolarHBondContact O-N 2.87Å; Q630-D632 PolarHBondContact O-N 3.21Å; D632-V634 VanDerWaalsContact C-N 3.34Å
633	E	49.8	Very low	69.5	Low	174 Å²	174	91.2 Å²	91.2	81%	0.813	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	0.3	175.6	-74.7	-169.8	160	0	0	114.4	N629	N629-E633 PolarHBondContact O-N 3.28Å
634	V	41.8	Very low	68.4	Low	165 Å²	165	98.6 Å²	98.6	100%	1	53%	0.526	S	S	*	.			trans	-105.5	0	176.8	-175.2	0	0	0	0	110.7	D632	D632-V634 VanDerWaalsContact C-N 3.34Å

Retrieved 634 of 634 residues in 97.3 ms (Link to these results)

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