A0A077ZD77_TRITR Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A077ZD77, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 827 aa.

						>A0A077ZD77_TRITR|A0A077ZD77
MAEKFGFDSGGFDDDGYENRSRDTGGGGRRFGGYSGNQRSRGGGGYERNYGRFGGESDGDGRDSGFSGSHSRGGGSGFRNADSGDGFRKNDRNGDFSYGFDSNTRDDYRDSDRSGGFSGRGYRGRGSGRNFRGESNRDNDRYGGGDRFNGNEDSYGRRERSRPFSSYENDDGSNFRRSGTDDTFSRNQDGMRRGRGRNFQYDNRSNDGRNRGFSDRSNDGDRYGGRGGGGGGFRSNDDFGGGFQSHDDFGGGFGSGERDNNDDYSKDSFGNDRRRNDGRGFRDNNRNYDDDYSFSGRDRAYRGRGSFEDGGGFRGRGRSRGREDNSAGSFERREATQGQPKPPVNYVPSKMTEEEMRMHIRAGVNFENQLRAKVETIGQDCPEPMESFREANFHELIMEHLKKSDINVPTVIQRYGIPVVTAGRDYMACAQTGSGKTAVYLLPILDSIVKNNDGLSSRRCTALVLVPTRELAIQINTVGMNFLRETQYRTVAVYGGVSVMYQSQSIRKGCDIVVGTPGRLCDFIKRGYIQLSGCRYFVVDEADRLLDMGFENDFRFIAQQLESIEHQTMMFSATFPPAIQSIAKEFLKSDFIFQIVGNLGGANKDITQEVLPVTMAEKQAKLEKILGERFDNNPNAKILVFVGRKRVADFVAASLAHTGWRTTSIHGDREQMQRETALRGFKSGANNVLIATEVAARGLDIAGVDLVVNYDLPSSIDDYVHRIGRTGRVGNPGKATSFYDEVTDAALASELVETLRLCEQEVPDFLTSRNDGFATRSQQHQQDNYSQESGFVNSFDDRRSDDFDRTTVTTKEKEEVTDEIELEDNGW
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	36.2	Very low	37.5	Very low	139 Å²	139	100.4 Å²	100.4	69%	0.685	61%	0.606	S	S	*	*				0	-41.2	0	-88.8	-168	-170.5	0	0	113.2	E3 K4 F5	M1-E3 VanDerWaalsContact C-N 3.32Å; M1-E3 PolarHBondContact O-N 2.96Å; M1-K4 WeakPolarHBondContact O-CA 3.36Å; M1-K4 WeakPolarHBondContact O-CB 3.43Å; M1-K4 PolarHBondContact O-N 3.12Å; M1-F5 HydrophobicContact CB-CD2 4.16Å; M1-F5 HydrophobicContact CB-CE2 4.07Å; M1-F5 HydrophobicContact CG-CE2 4.3Å; M1-F5 WeakPolarHBondContact O-CD2 3.47Å; M1-F5 PolarHBondContact O-N 3.46Å; M1-F5 HydrophobicContact SD-CE2 4.04Å
2	A	34.1	Very low	37.1	Very low	31 Å²	31	109.3 Å²	109.3	26%	0.256	63%	0.631	S	S	.	*	H	α-helix	trans	-45	-47.8	-179	0	0	0	0	0	114.7	K4 F5 G6 F7	A2-K4 VanDerWaalsContact C-N 3.35Å; A2-K4 PolarHBondContact O-N 3.12Å; A2-F5 CarbonylContact O-C 3.54Å; A2-F5 WeakPolarHBondContact O-CA 3.41Å; A2-F5 PolarHBondContact O-N 3.45Å; A2-G6 PolarHBondContact O-N 3.25Å; A2-G6 VanDerWaalsContact O-N 3.09Å; A2-F7 HydrophobicContact CB-CB 4.4Å; A2-F7 PolarHBondContact O-N 3.27Å
3	E	37	Very low	36.9	Very low	171 Å²	171	112.5 Å²	112.5	80%	0.799	65%	0.645	S	S	*	*	H	α-helix	trans	-57.5	-41.1	175	-63.2	177.8	126.5	0	0	113.5	M1 F5 G6	M1-E3 VanDerWaalsContact C-N 3.32Å; M1-E3 PolarHBondContact O-N 2.96Å; E3-F5 PolarHBondContact O-N 3.1Å; E3-G6 PolarHBondContact O-N 3.5Å
4	K	45.9	Very low	36.8	Very low	197 Å²	197	116.1 Å²	116.1	86%	0.857	66%	0.661	S	S	*	*	H	α-helix	trans	-65.9	-18.8	174.4	-95.2	-173.9	175.9	179.9	0	113	M1 A2	M1-K4 WeakPolarHBondContact O-CA 3.36Å; M1-K4 WeakPolarHBondContact O-CB 3.43Å; M1-K4 PolarHBondContact O-N 3.12Å; A2-K4 VanDerWaalsContact C-N 3.35Å; A2-K4 PolarHBondContact O-N 3.12Å
5	F	45.2	Very low	36.8	Very low	36 Å²	36	118.9 Å²	118.9	16%	0.158	67%	0.673	C	S	.	*	H	α-helix	trans	-98.9	-9.1	178.5	-75.8	-68.8	0	0	0	113.9	M1 A2 E3 F7 F575 Q580	M1-F5 HydrophobicContact CB-CD2 4.16Å; M1-F5 HydrophobicContact CB-CE2 4.07Å; M1-F5 HydrophobicContact CG-CE2 4.3Å; M1-F5 WeakPolarHBondContact O-CD2 3.47Å; M1-F5 PolarHBondContact O-N 3.46Å; M1-F5 HydrophobicContact SD-CE2 4.04Å; A2-F5 CarbonylContact O-C 3.54Å; A2-F5 WeakPolarHBondContact O-CA 3.41Å; A2-F5 PolarHBondContact O-N 3.45Å; E3-F5 PolarHBondContact O-N 3.1Å; F5-F7 HydrophobicContact CB-CD2 3.57Å; F5-F7 HydrophobicContact CB-CE2 3.83Å; F5-F575 HydrophobicContact CE1-CE1 4.2Å; F5-F575 HydrophobicContact CZ-CD1 4.42Å; F5-F575 HydrophobicContact CZ-CE1 4.02Å; F5-Q580 HydrophobicContact CE1-CG 4.21Å
6	G	34.2	Very low	36.6	Very low	70 Å²	70	114.9 Å²	114.9	72%	0.722	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.5	22.6	-177.6	0	0	0	0	0	114	A2 E3	A2-G6 PolarHBondContact O-N 3.25Å; A2-G6 VanDerWaalsContact O-N 3.09Å; E3-G6 PolarHBondContact O-N 3.5Å
7	F	41.2	Very low	36.6	Very low	78 Å²	78	122.3 Å²	122.3	34%	0.342	68%	0.683	S	S	.	*			trans	-91.4	126.6	170.8	-67.7	-72	0	0	0	109.6	A2 F5 S9 I377 F591	A2-F7 HydrophobicContact CB-CB 4.4Å; A2-F7 PolarHBondContact O-N 3.27Å; F5-F7 HydrophobicContact CB-CD2 3.57Å; F5-F7 HydrophobicContact CB-CE2 3.83Å; F7-S9 PolarHBondContact O-N 3.09Å; F7-S9 VanDerWaalsContact O-N 3.12Å; F7-I377 HydrophobicContact CD2-CG2 4.1Å; F7-I377 HydrophobicContact CE2-CG2 4.1Å; F7-F591 HydrophobicContact CZ-CE1 4.3Å
8	D	36.3	Very low	36.5	Very low	163 Å²	163	124.8 Å²	124.8	87%	0.872	69%	0.689	S	S	*	*			trans	-59.2	113.6	165.5	-89.5	-33.5	0	0	0	108.9	G10	D8-G10 PolarHBondContact O-N 3.21Å; D8-G10 VanDerWaalsContact O-N 3.12Å
9	S	39.2	Very low	36.4	Very low	85 Å²	85	125.1 Å²	125.1	59%	0.594	69%	0.689	S	S	*	*			trans	-71.5	101	164.7	50.4	0	0	0	0	108.1	F7 G11	F7-S9 PolarHBondContact O-N 3.09Å; F7-S9 VanDerWaalsContact O-N 3.12Å; S9-G11 PolarHBondContact O-N 2.72Å
10	G	34.1	Very low	36.3	Very low	72 Å²	72	131.3 Å²	131.3	74%	0.742	70%	0.702	S	S	*	*			trans	-58.4	104.8	165.8	0	0	0	0	0	108.9	D8 F12	D8-G10 PolarHBondContact O-N 3.21Å; D8-G10 VanDerWaalsContact O-N 3.12Å; G10-F12 PolarHBondContact O-N 3.19Å
11	G	28.7	Very low	36.1	Very low	62 Å²	62	130.3 Å²	130.3	64%	0.639	71%	0.705	S	S	*	*			trans	-67	128.8	-177.6	0	0	0	0	0	111.3	S9	S9-G11 PolarHBondContact O-N 2.72Å
12	F	33.5	Very low	36.1	Very low	208 Å²	208	135.1 Å²	135.1	91%	0.912	72%	0.716	S	S	*	*			trans	-112.9	99.2	153.3	-91.6	-89.1	0	0	0	106.8	G10 D14	G10-F12 PolarHBondContact O-N 3.19Å; F12-D14 PolarHBondContact O-N 2.78Å
13	D	34.1	Very low	36.2	Very low	150 Å²	150	140.5 Å²	140.5	80%	0.802	74%	0.74	S	S	*	*			trans	-69.7	119.6	165.8	-65.2	-56.6	0	0	0	108	D15	D13-D15 VanDerWaalsContact C-N 3.28Å; D13-D15 PolarHBondContact O-N 3.29Å; D13-D15 VanDerWaalsContact O-N 3.1Å
14	D	35	Very low	36.3	Very low	164 Å²	164	139.4 Å²	139.4	88%	0.877	75%	0.745	S	S	*	*			trans	-87.4	65.1	-177.8	-162	13.6	0	0	0	110.5	F12 G16	F12-D14 PolarHBondContact O-N 2.78Å; D14-G16 PolarHBondContact O-N 2.81Å
15	D	37.9	Very low	35.9	Very low	157 Å²	157	134 Å²	134	84%	0.84	75%	0.746	S	S	*	*			trans	-88.5	102.2	173.7	-95.5	-21.7	0	0	0	110	D13	D13-D15 VanDerWaalsContact C-N 3.28Å; D13-D15 PolarHBondContact O-N 3.29Å; D13-D15 VanDerWaalsContact O-N 3.1Å
16	G	33.3	Very low	35.5	Very low	56 Å²	56	136.3 Å²	136.3	58%	0.577	78%	0.779	S	S	*	*			trans	-66	177.3	-164.3	0	0	0	0	0	118.1	D14	D14-G16 PolarHBondContact O-N 2.81Å
17	Y	35.7	Very low	35.6	Very low	240 Å²	240	137 Å²	137	94%	0.941	79%	0.787	S	S	*	*			trans	-157.3	117	149.5	-104.2	-67.9	0	0	0	111.7
18	E	35.5	Very low	35.4	Very low	168 Å²	168	136.8 Å²	136.8	79%	0.785	81%	0.806	S	S	*	*			trans	-70.3	148.7	164.5	-72.9	-168.3	124.7	0	0	112
19	N	34.6	Very low	35.5	Very low	130 Å²	130	141.3 Å²	141.3	70%	0.695	81%	0.811	S	S	*	*			trans	53.9	109.6	148	-73.7	-50.2	0	0	0	119.3
20	R	34.1	Very low	35.3	Very low	248 Å²	248	148.4 Å²	148.4	94%	0.936	83%	0.825	S	S	*	*				-175.9	129.3	104	-97.4	163.5	-147.2	-166.2	6.6	113.8
21	S	32.7	Very low	35.5	Very low	111 Å²	111	155.5 Å²	155.5	78%	0.776	84%	0.836	S	S	*	*			trans	-74.4	138.7	165	-26.7	0	0	0	0	111.4
22	R	36.9	Very low	35.9	Very low	241 Å²	241	156 Å²	156	91%	0.909	84%	0.841	S	S	*	*				-178.8	152.5	128.1	-102.6	168.4	-175.4	175.6	3.3	113.5
23	D	35.7	Very low	36	Very low	144 Å²	144	149.6 Å²	149.6	77%	0.77	83%	0.833	S	S	*	*			trans	-55.2	151.2	179.4	-50.7	-92.2	0	0	0	114.9
24	T	39.6	Very low	36.1	Very low	147 Å²	147	153.8 Å²	153.8	90%	0.902	84%	0.84	S	S	*	*				-176.4	142.5	102	26.6	0	0	0	0	112.6
25	G	36.1	Very low	36.1	Very low	85 Å²	85	151.7 Å²	151.7	88%	0.876	84%	0.837	S	S	*	*			trans	-78.9	-179.6	-167.8	0	0	0	0	0	117.6
26	G	36.3	Very low	36.1	Very low	83 Å²	83	148 Å²	148	86%	0.856	84%	0.837	S	S	*	*			trans	156.5	92.7	160.2	0	0	0	0	0	117.6
27	G	36.9	Very low	36.2	Very low	86 Å²	86	152.9 Å²	152.9	89%	0.887	85%	0.85	S	S	*	*			trans	77.4	139.7	158.9	0	0	0	0	0	116.7
28	G	36.6	Very low	36.5	Very low	72 Å²	72	150.7 Å²	150.7	74%	0.742	85%	0.848	S	S	*	*			cis	128.7	105.2	-3.1	0	0	0	0	0	113.1
29	R	38.6	Very low	36.4	Very low	259 Å²	259	154 Å²	154	98%	0.977	85%	0.853	S	S	*	*			trans	-163.6	151.1	148.6	-105.6	163.6	-138.5	-137.4	6.4	110.4
30	R	35.6	Very low	36.4	Very low	234 Å²	234	153 Å²	153	88%	0.883	86%	0.856	S	S	*	*			trans	-107.1	157.9	-166.7	-62	168.7	168.9	171.6	-5.5	111.8
31	F	39	Very low	36.6	Very low	221 Å²	221	152.7 Å²	152.7	97%	0.969	86%	0.855	S	S	*	*			trans	166.5	135.5	134.8	-88.4	-66.2	0	0	0	107.8
32	G	36.8	Very low	36.7	Very low	73 Å²	73	151.3 Å²	151.3	75%	0.753	86%	0.859	S	S	*	*			cis	161.5	116.7	-13.4	0	0	0	0	0	113.4
33	G	34.3	Very low	36.6	Very low	72 Å²	72	143.9 Å²	143.9	74%	0.742	86%	0.857	S	S	*	*			trans	76.8	154.8	169.1	0	0	0	0	0	116.1
34	Y	37.4	Very low	36.6	Very low	239 Å²	239	141.1 Å²	141.1	94%	0.937	86%	0.862	S	S	*	*			cis	-146.6	147.6	11.5	-99.6	-96.5	0	0	0	112.2
35	S	35.1	Very low	36.4	Very low	119 Å²	119	137.1 Å²	137.1	83%	0.832	85%	0.85	S	S	*	*			trans	-96.9	144.4	161.7	59.5	0	0	0	0	110.7
36	G	37.7	Very low	36.5	Very low	80 Å²	80	144.5 Å²	144.5	83%	0.825	85%	0.854	S	S	*	*			trans	-141.3	95.5	-178.5	0	0	0	0	0	112.1
37	N	34.5	Very low	36.4	Very low	159 Å²	159	148.5 Å²	148.5	85%	0.85	85%	0.85	S	S	*	*			trans	-101.7	117.6	176.8	-169	3.7	0	0	0	109
38	Q	41.8	Very low	36.5	Very low	194 Å²	194	156.1 Å²	156.1	91%	0.907	85%	0.852	S	S	*	*			trans	-137	138.2	171.5	-76.6	-160.8	-0.4	0	0	112.8
39	R	34.1	Very low	36.5	Very low	236 Å²	236	158.7 Å²	158.7	89%	0.891	85%	0.849	S	S	*	*			trans	-99.6	143.3	-177.9	-73.1	175.2	164	-176.3	-5.2	111.6
40	S	34.9	Very low	36.6	Very low	109 Å²	109	157.3 Å²	157.3	76%	0.762	85%	0.845	S	S	*	*			trans	67.6	118.2	140.6	-161.8	0	0	0	0	119.8
41	R	37.3	Very low	36.7	Very low	242 Å²	242	149.9 Å²	149.9	91%	0.913	84%	0.842	S	S	*	*				175.7	123.7	104.6	-94.5	175.6	175.5	-175.5	-1.1	114.3
42	G	35.2	Very low	36.5	Very low	82 Å²	82	150.5 Å²	150.5	85%	0.845	84%	0.838	S	S	*	*				93.6	121.6	123.6	0	0	0	0	0	121.8
43	G	35	Very low	36.5	Very low	86 Å²	86	157.7 Å²	157.7	89%	0.887	85%	0.848	S	S	*	*			trans	91	126.2	162.5	0	0	0	0	0	114.4
44	G	35.7	Very low	36.6	Very low	85 Å²	85	158 Å²	158	88%	0.876	85%	0.852	S	S	*	*			cis	128.7	135.6	14.9	0	0	0	0	0	108.3
45	G	34.9	Very low	36.7	Very low	63 Å²	63	150.5 Å²	150.5	65%	0.649	85%	0.848	S	S	*	*			cis	-169	-146.8	-0	0	0	0	0	0	110.1
46	Y	39.1	Very low	36.7	Very low	241 Å²	241	153.8 Å²	153.8	95%	0.945	85%	0.85	S	S	*	*			trans	92.7	80.1	178.3	-53.3	-65.2	0	0	0	118.2
47	E	33.2	Very low	36.8	Very low	167 Å²	167	155.7 Å²	155.7	78%	0.78	85%	0.85	S	S	*	*			trans	-88.8	161.9	150.2	-68.9	-176.7	135.8	0	0	111.3
48	R	40.5	Very low	36.9	Very low	245 Å²	245	156.4 Å²	156.4	93%	0.925	85%	0.854	S	S	*	*			trans	-134.8	131	145.7	-72.9	-166.9	-168.4	-177.9	6.5	110
49	N	35.5	Very low	36.9	Very low	126 Å²	126	150.9 Å²	150.9	67%	0.674	85%	0.85	S	S	*	*			trans	-113.6	140.6	178.2	-107.1	-49.7	0	0	0	110.8
50	Y	40	Very low	37	Very low	230 Å²	230	147.8 Å²	147.8	90%	0.902	85%	0.851	S	S	*	*			trans	-156.6	139.9	154.8	-71.8	-78.2	0	0	0	105.7
51	G	39.1	Very low	37.3	Very low	79 Å²	79	146.3 Å²	146.3	81%	0.814	85%	0.852	S	S	*	*			cis	-171.6	155.5	-3.4	0	0	0	0	0	108.6
52	R	33.9	Very low	37.2	Very low	234 Å²	234	145.5 Å²	145.5	88%	0.883	85%	0.849	S	S	*	*			trans	-113.6	134.9	-161	-179.5	-157.1	-152.1	-160.9	8.9	112.8
53	F	38.2	Very low	37.5	Very low	223 Å²	223	148.4 Å²	148.4	98%	0.978	85%	0.846	S	S	*	*			trans	-169.7	143.1	151.8	-80.1	-69.4	0	0	0	107.5
54	G	35.2	Very low	37.6	Very low	79 Å²	79	149.9 Å²	149.9	81%	0.814	84%	0.842	S	S	*	*			cis	134.5	111.8	-3.3	0	0	0	0	0	111.9
55	G	40	Very low	37.6	Very low	82 Å²	82	149 Å²	149	85%	0.845	83%	0.832	S	S	*	*			trans	157.2	118.9	171.7	0	0	0	0	0	115.3
56	E	35	Very low	37.8	Very low	188 Å²	188	156.3 Å²	156.3	88%	0.879	85%	0.847	S	S	*	*			trans	-96.7	160	177.8	-61.1	137.8	118.3	0	0	112.4
57	S	40.3	Very low	37.6	Very low	119 Å²	119	150.2 Å²	150.2	83%	0.832	84%	0.839	S	S	*	*			trans	179.8	139.1	130.5	32.1	0	0	0	0	113.1
58	D	35.8	Very low	37.8	Very low	174 Å²	174	146.1 Å²	146.1	93%	0.93	84%	0.842	S	S	*	*			trans	-86.5	166.5	179.3	-57.4	-70.3	0	0	0	113.5
59	G	42.5	Very low	37.6	Very low	79 Å²	79	139.3 Å²	139.3	81%	0.814	83%	0.832	S	S	*	*			trans	-170.9	91.6	171.9	0	0	0	0	0	114.8
60	D	36.1	Very low	37.8	Very low	171 Å²	171	141.6 Å²	141.6	91%	0.914	84%	0.838	S	S	*	*			trans	-68.1	149.2	171.1	-104.3	-32.4	0	0	0	112.8
61	G	41	Very low	37.7	Very low	77 Å²	77	135 Å²	135	79%	0.794	83%	0.826	S	S	*	*			trans	-164.3	115.9	171.7	0	0	0	0	0	113.1
62	R	35.4	Very low	37.6	Very low	225 Å²	225	143.3 Å²	143.3	85%	0.849	83%	0.833	S	S	*	*			trans	-98.7	154.9	-177.1	-59.8	174.6	-178.1	170.1	0.3	111.8
63	D	40.7	Very low	37.7	Very low	144 Å²	144	135.8 Å²	135.8	77%	0.77	83%	0.828	S	S	*	*				167.2	122.3	121.2	-82.7	-16	0	0	0	110
64	S	38.5	Very low	37.5	Very low	117 Å²	117	129.4 Å²	129.4	82%	0.818	83%	0.825	S	S	*	*				42.2	129.8	105.4	85	0	0	0	0	115.5
65	G	35.5	Very low	37.6	Very low	65 Å²	65	129 Å²	129	67%	0.67	82%	0.821	S	S	*	*			cis	138	142	4.5	0	0	0	0	0	109.1
66	F	38.2	Very low	37.4	Very low	217 Å²	217	131 Å²	131	95%	0.952	82%	0.822	S	S	*	*			trans	-179.5	152.2	150.1	-117.3	-85.2	0	0	0	112.5
67	S	35.5	Very low	37.5	Very low	113 Å²	113	125.4 Å²	125.4	79%	0.79	82%	0.815	S	S	*	*			trans	-104.3	159.5	-177.4	52.4	0	0	0	0	113
68	G	37.8	Very low	37.3	Very low	81 Å²	81	128.2 Å²	128.2	84%	0.835	81%	0.813	S	S	*	*			trans	-166.9	106.7	172.2	0	0	0	0	0	113
69	S	36.3	Very low	37.3	Very low	103 Å²	103	130 Å²	130	72%	0.72	81%	0.806	S	S	*	*			trans	-97.6	-174.9	-178.9	54.6	0	0	0	0	112.9
70	H	39.4	Very low	37	Very low	173 Å²	173	133 Å²	133	80%	0.801	80%	0.803	S	S	*	*			trans	113.3	138.9	167.7	-65.1	77.6	0	0	0	114
71	S	37.1	Very low	37	Very low	93 Å²	93	129.2 Å²	129.2	65%	0.65	80%	0.796	S	S	*	*			cis	164	130.3	-25.3	-106	0	0	0	0	108.4
72	R	36.8	Very low	36.9	Very low	253 Å²	253	132.2 Å²	132.2	96%	0.955	79%	0.794	S	S	*	*			trans	68.3	148.5	161.3	-53.6	169.1	179.3	-171.1	-2.6	117.1
73	G	36.3	Very low	36.9	Very low	76 Å²	76	126.9 Å²	126.9	78%	0.784	79%	0.791	S	S	*	*			cis	162.5	152.9	-8.8	0	0	0	0	0	113.4
74	G	34.6	Very low	36.7	Very low	88 Å²	88	123.8 Å²	123.8	91%	0.907	79%	0.793	S	S	*	*			trans	75.7	152.1	171.2	0	0	0	0	0	116.6
75	G	36.2	Very low	36.6	Very low	71 Å²	71	126.6 Å²	126.6	73%	0.732	80%	0.799	S	S	*	*			cis	172.7	140.9	-8.1	0	0	0	0	0	112.8
76	S	37	Very low	36.6	Very low	125 Å²	125	127 Å²	127	87%	0.874	80%	0.804	S	S	*	*			trans	37.8	134.4	155.6	62	0	0	0	0	122.9
77	G	37.1	Very low	36.5	Very low	70 Å²	70	126.2 Å²	126.2	72%	0.722	80%	0.8	S	S	*	*			trans	169.4	61.3	156.2	0	0	0	0	0	122.1
78	F	35.1	Very low	36.4	Very low	178 Å²	178	131.6 Å²	131.6	78%	0.781	80%	0.803	S	S	*	*			trans	34.9	135.5	142.7	-69.7	-71.5	0	0	0	125.3
79	R	36.9	Very low	36.3	Very low	210 Å²	210	136.2 Å²	136.2	79%	0.792	80%	0.8	S	S	*	*			trans	70.3	154.4	137.9	-70.2	172.3	-175	-168.6	1	118.8
80	N	35.1	Very low	36.2	Very low	142 Å²	142	137.7 Å²	137.7	76%	0.759	80%	0.8	S	S	*	*			cis	-169.7	150.9	-23.6	-111	12.3	0	0	0	107.3
81	A	36.3	Very low	36	Very low	93 Å²	93	136.8 Å²	136.8	77%	0.769	80%	0.801	S	S	*	*			trans	63.4	160.9	159.9	0	0	0	0	0	116.5
82	D	38.2	Very low	36.1	Very low	139 Å²	139	142.6 Å²	142.6	74%	0.743	81%	0.809	S	S	*	*			cis	-153.4	160.3	1	-143.8	-39.4	0	0	0	110.9
83	S	36.5	Very low	35.8	Very low	113 Å²	113	138.9 Å²	138.9	79%	0.79	81%	0.808	S	S	*	*			trans	35.5	132.7	149.9	-63.9	0	0	0	0	122.8
84	G	36.9	Very low	35.7	Very low	79 Å²	79	138.1 Å²	138.1	81%	0.814	80%	0.8	S	S	*	*			trans	163.8	99.4	155.5	0	0	0	0	0	116.4
85	D	35.5	Very low	35.4	Very low	176 Å²	176	141.6 Å²	141.6	94%	0.941	80%	0.798	S	S	*	*			trans	-61.4	149.5	173.5	-73.8	-60.8	0	0	0	114.1
86	G	36.7	Very low	35.3	Very low	74 Å²	74	147.1 Å²	147.1	76%	0.763	80%	0.802	S	S	*	*			trans	-174.5	79.6	176.9	0	0	0	0	0	116.1	R88	G86-R88 PolarHBondContact O-N 3.13Å
87	F	34.3	Very low	34.8	Very low	201 Å²	201	146.5 Å²	146.5	88%	0.882	80%	0.798	S	S	*	*			trans	-49.5	125.4	167.7	-84.6	-103.6	0	0	0	113.1
88	R	34.8	Very low	34.9	Very low	225 Å²	225	153.4 Å²	153.4	85%	0.849	80%	0.804	S	S	*	*				169	139.8	115.3	-94.8	163	179.5	-179.4	0.9	115.6	G86	G86-R88 PolarHBondContact O-N 3.13Å
89	K	35.8	Very low	34.5	Very low	178 Å²	178	148 Å²	148	77%	0.774	80%	0.799	S	S	*	*			trans	61.5	103.4	148.6	-65.9	-176.8	173.6	-167.9	0	118.8	D91	K89-D91 PolarHBondContact O-N 2.91Å
90	N	34.1	Very low	34.4	Very low	135 Å²	135	147.9 Å²	147.9	72%	0.722	80%	0.804	S	S	*	*			trans	-72.8	103	153.5	-85.9	-39.6	0	0	0	109.9
91	D	34.3	Very low	34.4	Very low	153 Å²	153	148.3 Å²	148.3	82%	0.818	81%	0.807	S	S	*	*			trans	-91.5	101.9	151	-72.1	-44.8	0	0	0	107.3	K89	K89-D91 PolarHBondContact O-N 2.91Å
92	R	38.7	Very low	34.1	Very low	215 Å²	215	148.6 Å²	148.6	81%	0.811	80%	0.803	S	S	*	*			trans	-108.2	78	173.5	-73.1	-165.3	-171.4	179.9	4.9	111
93	N	30.9	Very low	33.7	Very low	175 Å²	175	149.2 Å²	149.2	94%	0.936	81%	0.806	S	S	*	*			trans	-83.3	118.5	146.6	-77.4	-26.8	0	0	0	106.9
94	G	34	Very low	33.7	Very low	61 Å²	61	150.5 Å²	150.5	63%	0.629	81%	0.809	S	S	*	*			trans	-164.3	93.2	-177	0	0	0	0	0	110.5	F96	G94-F96 PolarHBondContact O-N 3.45Å
95	D	29.7	Very low	33.3	Very low	161 Å²	161	158 Å²	158	86%	0.861	81%	0.813	S	S	*	*			trans	-56.2	126.4	173.7	-67.1	-62.4	0	0	0	110.9
96	F	34.4	Very low	33.4	Very low	187 Å²	187	157 Å²	157	82%	0.82	81%	0.808	S	S	*	*			trans	-134.3	98.1	158.9	-88.2	-78.4	0	0	0	109.6	G94	G94-F96 PolarHBondContact O-N 3.45Å
97	S	26.4	Very low	33.3	Very low	111 Å²	111	160 Å²	160	78%	0.776	81%	0.807	S	S	*	*			trans	-76.6	137.2	163.5	52.7	0	0	0	0	109.7
98	Y	37.7	Very low	33.5	Very low	215 Å²	215	161.8 Å²	161.8	84%	0.843	81%	0.809	S	S	*	*			trans	-127.7	113	153.9	-96.2	-83.4	0	0	0	107.3
99	G	27.1	Very low	33.3	Very low	66 Å²	66	161.1 Å²	161.1	68%	0.68	81%	0.806	S	S	*	*			trans	-76.4	152.4	168.4	0	0	0	0	0	110.3
100	F	35.9	Very low	33.4	Very low	207 Å²	207	159.9 Å²	159.9	91%	0.908	81%	0.808	S	S	*	*			trans	-132.9	142.4	156.5	-121	-87.3	0	0	0	108.8
101	D	34.3	Very low	33.5	Very low	151 Å²	151	158.4 Å²	158.4	81%	0.807	81%	0.809	S	S	*	*			trans	-72.4	150.8	-156.4	-70	-72.8	0	0	0	115.8
102	S	28.9	Very low	33.6	Very low	98 Å²	98	159.4 Å²	159.4	69%	0.685	81%	0.814	S	S	*	*			trans	-68.7	122.8	159.9	54.2	0	0	0	0	110.7
103	N	31.5	Very low	33.3	Very low	153 Å²	153	160.7 Å²	160.7	82%	0.818	82%	0.819	S	S	*	*				170.3	93.6	128.6	-87.1	-32.7	0	0	0	112.8
104	T	36.1	Very low	33.8	Very low	140 Å²	140	158.5 Å²	158.5	86%	0.859	82%	0.817	S	S	*	*			trans	-149.5	101.2	142.5	3.7	0	0	0	0	109.2
105	R	28.2	Very low	33.8	Very low	235 Å²	235	159.3 Å²	159.3	89%	0.887	83%	0.826	S	S	*	*			trans	-76.2	132.2	151.8	-81.6	175.3	159.7	134.4	-5.9	106.4
106	D	38.5	Very low	34	Very low	155 Å²	155	155.3 Å²	155.3	83%	0.829	82%	0.822	S	S	*	*			trans	-150.5	137.6	143.7	-95.6	-40.2	0	0	0	109.7
107	D	32.6	Very low	34.1	Very low	139 Å²	139	156.7 Å²	156.7	74%	0.743	83%	0.828	S	S	*	*			trans	-85.7	134.6	-171.1	-72.2	-67.5	0	0	0	111.9
108	Y	39.7	Very low	34.7	Very low	237 Å²	237	156.8 Å²	156.8	93%	0.929	83%	0.829	S	S	*	*			trans	-132.3	102.2	149.9	-87.2	-76.9	0	0	0	110.9
109	R	30.3	Very low	34.5	Very low	211 Å²	211	150.1 Å²	150.1	80%	0.796	83%	0.825	S	S	*	*			trans	-89.2	164.6	163.3	-85.6	-176	172.1	171.6	-0.5	110.4
110	D	37.5	Very low	35	Very low	152 Å²	152	157.9 Å²	157.9	81%	0.813	83%	0.834	S	S	*	*			trans	73.6	133.5	163.6	-57.7	-29.8	0	0	0	116.1
111	S	36.3	Very low	34.8	Very low	105 Å²	105	151.4 Å²	151.4	73%	0.734	83%	0.826	S	S	*	*			cis	-159.3	131.7	-2.3	44.1	0	0	0	0	112.2
112	D	36.1	Very low	35.1	Very low	174 Å²	174	154.9 Å²	154.9	93%	0.93	83%	0.829	S	S	*	*			trans	-116.1	109.9	162.9	-96.6	-38.9	0	0	0	109.7
113	R	33.2	Very low	35.5	Very low	242 Å²	242	162 Å²	162	91%	0.913	84%	0.841	S	S	*	*			trans	-132.3	105	165.7	-87.4	-169	178.4	-176.2	2.6	109.8
114	S	40.8	Very low	35.5	Very low	129 Å²	129	158.2 Å²	158.2	90%	0.902	84%	0.838	S	S	*	*				171.8	153.4	123.3	47.2	0	0	0	0	112.2
115	G	35.4	Very low	35.6	Very low	78 Å²	78	163.7 Å²	163.7	80%	0.804	84%	0.843	S	S	*	*			trans	102.3	38	153.8	0	0	0	0	0	118.5
116	G	32.1	Very low	35.7	Very low	76 Å²	76	156.2 Å²	156.2	78%	0.784	84%	0.839	S	S	*	*			trans	-71.9	134.8	161.9	0	0	0	0	0	111.7
117	F	38.2	Very low	35.7	Very low	216 Å²	216	154.7 Å²	154.7	95%	0.947	84%	0.841	S	S	*	*			trans	-128.8	131.6	158.3	-110.5	-85.8	0	0	0	109.9
118	S	38.7	Very low	35.7	Very low	114 Å²	114	151.3 Å²	151.3	80%	0.797	84%	0.839	S	S	*	*			trans	-89.3	146.6	-166.5	45.6	0	0	0	0	112.9
119	G	32.7	Very low	35.6	Very low	74 Å²	74	152 Å²	152	76%	0.763	84%	0.84	S	S	*	*			trans	-75.2	147.9	170.7	0	0	0	0	0	112.7
120	R	38.7	Very low	35.7	Very low	229 Å²	229	149.3 Å²	149.3	86%	0.864	84%	0.841	S	S	*	*			trans	-134.3	116.9	151.2	-79.2	-169.2	176.8	-172.3	0.3	108.3
121	G	31	Very low	35.8	Very low	72 Å²	72	152.3 Å²	152.3	74%	0.742	85%	0.848	S	S	*	*			trans	-78.8	152.3	167.8	0	0	0	0	0	111
122	Y	40.9	Very low	35.7	Very low	223 Å²	223	159 Å²	159	88%	0.875	86%	0.857	S	S	*	*			trans	-134	147.2	157.5	-99.9	-84.3	0	0	0	110.6
123	R	37.1	Very low	35.6	Very low	247 Å²	247	154.1 Å²	154.1	93%	0.932	85%	0.848	S	S	*	*			trans	-68.1	147.1	-172.4	-65.3	170.6	172.4	170.6	-4.8	111.6
124	G	31.6	Very low	35.7	Very low	74 Å²	74	152.2 Å²	152.2	76%	0.763	85%	0.849	S	S	*	*			trans	-81.6	169.6	175.2	0	0	0	0	0	114.5
125	R	37.1	Very low	35.5	Very low	255 Å²	255	150.8 Å²	150.8	96%	0.962	84%	0.839	S	S	*	*			trans	-155.8	134.6	146.4	-103.1	-173.7	-179.2	-157.9	-0.1	107.3
126	G	31.5	Very low	35.6	Very low	78 Å²	78	153.1 Å²	153.1	80%	0.804	83%	0.833	S	S	*	*			trans	-86	155.4	178.2	0	0	0	0	0	112.8
127	S	37.9	Very low	35.9	Very low	124 Å²	124	159.3 Å²	159.3	87%	0.867	83%	0.833	S	S	*	*			trans	-163.9	133.9	137.1	55	0	0	0	0	107.9
128	G	32.3	Very low	36	Very low	68 Å²	68	154.8 Å²	154.8	70%	0.701	82%	0.819	S	S	*	*			trans	-85.3	163.2	178.7	0	0	0	0	0	112.3
129	R	37.8	Very low	36	Very low	251 Å²	251	157.1 Å²	157.1	95%	0.947	82%	0.822	S	S	*	*			trans	-164.6	134.3	145.8	-105.4	165.2	-147.7	-153.8	5.3	109.8
130	N	33.2	Very low	36.4	Very low	154 Å²	154	160.6 Å²	160.6	82%	0.824	82%	0.823	S	S	*	*			trans	-68.3	150.3	174.5	-55	-34.9	0	0	0	110.8
131	F	39	Very low	36.4	Very low	216 Å²	216	159.9 Å²	159.9	95%	0.947	82%	0.821	S	S	*	*			trans	-147.4	144.6	141.4	-104.6	-76.2	0	0	0	111.2
132	R	34.1	Very low	36.8	Very low	244 Å²	244	166.5 Å²	166.5	92%	0.921	83%	0.825	S	S	*	*			trans	-92.2	162.1	178.3	-84.1	176.7	164.7	177.5	-4.8	111
133	G	33.4	Very low	36.7	Very low	72 Å²	72	159.7 Å²	159.7	74%	0.742	82%	0.823	S	S	*	*			trans	98.1	146.6	159.7	0	0	0	0	0	114.1
134	E	36.6	Very low	36.7	Very low	202 Å²	202	151.9 Å²	151.9	94%	0.944	82%	0.819	S	S	*	*			cis	-149.8	168	3.2	-96.1	165.9	137.5	0	0	111
135	S	35.9	Very low	36.9	Very low	99 Å²	99	151.8 Å²	151.8	69%	0.692	82%	0.818	S	S	*	*			trans	-82.7	150.3	-176.4	53.6	0	0	0	0	115
136	N	38.2	Very low	37	Very low	127 Å²	127	145.5 Å²	145.5	68%	0.679	80%	0.803	S	S	*	*			trans	-177.2	126.7	137.4	-93.3	-32.3	0	0	0	109.4
137	R	38	Very low	37.1	Very low	206 Å²	206	151.7 Å²	151.7	78%	0.777	80%	0.802	S	S	*	*				67.2	135.8	95.6	-69.7	-164.7	-142.8	-163.7	-0.4	114.7
138	D	40	Very low	37.1	Very low	122 Å²	122	156.1 Å²	156.1	65%	0.652	81%	0.807	S	S	*	*			cis	-156	156.4	-1	-76.8	-40.9	0	0	0	108.8
139	N	39.8	Very low	37.3	Very low	163 Å²	163	160.4 Å²	160.4	87%	0.872	81%	0.813	S	S	*	*				167	144.6	126	-90.9	-60	0	0	0	114.7
140	D	40	Very low	37.3	Very low	146 Å²	146	151.9 Å²	151.9	78%	0.781	80%	0.803	S	S	*	*			trans	-104.7	-177.3	-162.8	-58.7	-70.1	0	0	0	116.8
141	R	38.8	Very low	37.4	Very low	214 Å²	214	151.9 Å²	151.9	81%	0.808	80%	0.803	S	S	*	*			trans	97.8	131.1	158.7	-53.5	176.4	-175.4	-174	1.1	115.1
142	Y	40.4	Very low	37.3	Very low	211 Å²	211	150.9 Å²	150.9	83%	0.827	80%	0.801	S	S	*	*			cis	-128.4	157	5.1	-70.7	-105.9	0	0	0	108.2
143	G	37.5	Very low	37.4	Very low	81 Å²	81	146.2 Å²	146.2	84%	0.835	80%	0.795	S	S	*	*			cis	105.3	126.2	28.2	0	0	0	0	0	110.2
144	G	37.2	Very low	37.6	Very low	83 Å²	83	147.3 Å²	147.3	86%	0.856	79%	0.791	S	S	*	*			cis	168.3	161.8	-5.9	0	0	0	0	0	112.4
145	G	35.9	Very low	37.6	Very low	71 Å²	71	148.4 Å²	148.4	73%	0.732	79%	0.788	S	S	*	*			trans	95	108.5	170.8	0	0	0	0	0	115.4
146	D	38.8	Very low	37.6	Very low	124 Å²	124	147.2 Å²	147.2	66%	0.663	79%	0.792	S	S	*	*				76.1	101.8	57.8	-69.9	-51.8	0	0	0	113.6
147	R	35.1	Very low	37.5	Very low	207 Å²	207	152.2 Å²	152.2	78%	0.781	80%	0.801	S	S	*	*				100.8	126.9	90.8	-85.1	-177.2	-134	-176.5	11.4	112.9
148	F	37.9	Very low	37.3	Very low	218 Å²	218	152.7 Å²	152.7	96%	0.956	80%	0.803	S	S	*	*				-165.4	148.8	117.4	-109.6	-75.3	0	0	0	109.9
149	N	36.6	Very low	37.2	Very low	158 Å²	158	155.5 Å²	155.5	85%	0.845	81%	0.812	S	S	*	*			trans	-128.8	138.5	-179.1	-163.1	21	0	0	0	107.7
150	G	36.9	Very low	37	Very low	71 Å²	71	158.9 Å²	158.9	73%	0.732	81%	0.813	S	S	*	*			trans	-171.8	110.3	-176.5	0	0	0	0	0	112.2
151	N	34.3	Very low	36.9	Very low	155 Å²	155	157.2 Å²	157.2	83%	0.829	81%	0.813	S	S	*	*			trans	-77.2	148.8	164.6	-62.6	-26.2	0	0	0	109
152	E	38.3	Very low	36.8	Very low	194 Å²	194	158.2 Å²	158.2	91%	0.907	82%	0.816	S	S	*	*			trans	-169.2	154	133.4	-109.7	165	-159.6	0	0	112.7
153	D	36.8	Very low	36.6	Very low	147 Å²	147	153.9 Å²	153.9	79%	0.786	81%	0.814	S	S	*	*			trans	-86	158.8	-162.3	-61.9	-74.6	0	0	0	116.3
154	S	36.4	Very low	36.7	Very low	94 Å²	94	160.2 Å²	160.2	66%	0.657	82%	0.819	S	S	*	*			trans	71.5	125.7	130.1	-78.2	0	0	0	0	124.4
155	Y	37.8	Very low	36.6	Very low	225 Å²	225	160.9 Å²	160.9	88%	0.882	81%	0.811	S	S	*	*			trans	54.5	108.1	143.7	-56.6	-64.5	0	0	0	122.8
156	G	35.1	Very low	36.6	Very low	75 Å²	75	161.6 Å²	161.6	77%	0.773	80%	0.804	S	S	*	*				115.6	144.9	114.1	0	0	0	0	0	121.4
157	R	36.5	Very low	36.6	Very low	232 Å²	232	165.7 Å²	165.7	88%	0.875	81%	0.812	S	S	*	*			trans	79.1	109.3	163.7	-71.8	-168.8	176	-156.2	3.2	121.8
158	R	33.6	Very low	36.8	Very low	216 Å²	216	163 Å²	163	82%	0.815	81%	0.808	S	S	*	*				44.5	120.8	118.9	-61.7	-177.9	175.9	-173.1	-1.2	120.7
159	E	38	Very low	36.8	Very low	181 Å²	181	158.5 Å²	158.5	85%	0.846	79%	0.794	S	S	*	*				170.5	115.7	112.1	-92.2	171.8	-160.1	0	0	109.4
160	R	34.4	Very low	37	Very low	234 Å²	234	158.2 Å²	158.2	88%	0.883	79%	0.792	S	S	*	*				77.8	126.7	84.6	-86.9	-164.6	176.1	-158	0	116.8
161	S	38.3	Very low	37.2	Very low	111 Å²	111	162 Å²	162	78%	0.776	80%	0.796	S	S	*	*			trans	88.9	145.5	162.5	-37.7	0	0	0	0	116.9
162	R	36.6	Very low	37.4	Very low	234 Å²	234	158.3 Å²	158.3	88%	0.883	80%	0.795	S	S	*	*			cis	-163.6	164.5	-22.3	-113.5	179.7	-177.1	-173.5	-0.1	107.5
163	P	37.4	Very low	37.5	Very low	121 Å²	121	154 Å²	154	79%	0.786	79%	0.787	S	S	*	*			trans	-91.3	173.7	-168.8	38	-36.9	0	0	0	114.4
164	F	38.8	Very low	37.7	Very low	214 Å²	214	153.4 Å²	153.4	94%	0.939	78%	0.783	S	S	*	*			trans	-131.9	136.3	172	-107.1	-87.1	0	0	0	112.5
165	S	35.9	Very low	37.8	Very low	97 Å²	97	159.2 Å²	159.2	68%	0.678	80%	0.797	S	S	*	*			trans	-135.8	157.4	166	70.5	0	0	0	0	110.1
166	S	34.9	Very low	37.8	Very low	85 Å²	85	159.3 Å²	159.3	59%	0.594	80%	0.796	S	S	*	*			trans	41.7	111.9	147.3	60.9	0	0	0	0	120.5
167	Y	39	Very low	38	Very low	211 Å²	211	167 Å²	167	83%	0.827	80%	0.801	S	S	*	*			trans	-168.6	114.8	132.2	-77.2	-61.4	0	0	0	105.5
168	E	38.5	Very low	38	Very low	151 Å²	151	161.7 Å²	161.7	71%	0.706	80%	0.8	S	S	*	*				82.2	111.4	73.9	-81.4	-159.9	120.2	0	0	115.8
169	N	38.8	Very low	38.2	Very low	122 Å²	122	154.3 Å²	154.3	65%	0.652	79%	0.791	S	S	*	*			trans	79.7	139.3	138.2	-53.1	-25.6	0	0	0	122.5
170	D	41.4	Very low	38.2	Very low	152 Å²	152	151.8 Å²	151.8	81%	0.813	79%	0.788	S	S	*	*			trans	66.9	146.9	153.8	-63.4	-31.2	0	0	0	119.1
171	D	40.4	Very low	38.4	Very low	150 Å²	150	147.2 Å²	147.2	80%	0.802	78%	0.781	S	S	*	*			cis	-160.7	152.7	-6.8	53.7	-17.8	0	0	0	113.1
172	G	38.5	Very low	38.4	Very low	79 Å²	79	149.4 Å²	149.4	81%	0.814	78%	0.784	S	S	*	*			trans	66.8	160.2	158.2	0	0	0	0	0	119.7
173	S	41.4	Very low	38.4	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	78%	0.776	S	S	*	*			cis	-161.1	149.9	-18.5	66.6	0	0	0	0	110.7
174	N	40	Very low	38.4	Very low	134 Å²	134	148.1 Å²	148.1	72%	0.717	78%	0.783	S	S	*	*			trans	46.6	123.3	154.1	-60.8	-46.5	0	0	0	121.3
175	F	39.4	Very low	38.3	Very low	216 Å²	216	142.5 Å²	142.5	95%	0.947	77%	0.77	S	S	*	*				-161.6	142.1	99.7	-112.5	-79.7	0	0	0	112
176	R	37.1	Very low	38.3	Very low	226 Å²	226	148 Å²	148	85%	0.853	78%	0.776	S	S	*	*			trans	-110.4	150.6	-176.2	-67.1	177.6	172.3	-179.3	-3.2	112.4
177	R	38.1	Very low	38.4	Very low	237 Å²	237	150 Å²	150	89%	0.894	78%	0.78	S	S	*	*			trans	155	122.8	137.7	-86.3	163.1	-177.1	-158.7	1.2	108.6
178	S	37.3	Very low	38.4	Very low	120 Å²	120	147.5 Å²	147.5	84%	0.839	78%	0.776	S	S	*	*			cis	82.8	115.6	32.3	84.1	0	0	0	0	115.9
179	G	37	Very low	38.2	Very low	61 Å²	61	147.4 Å²	147.4	63%	0.629	78%	0.78	S	S	*	*			trans	141.7	104.2	168.5	0	0	0	0	0	110.7
180	T	38.9	Very low	38.1	Very low	128 Å²	128	145.3 Å²	145.3	79%	0.785	79%	0.787	S	S	*	*				53	131.1	81.5	66	0	0	0	0	112.2
181	D	38.5	Very low	37.9	Very low	139 Å²	139	146.4 Å²	146.4	74%	0.743	79%	0.79	S	S	*	*			cis	-178.3	-173.8	-3	-111.6	-45	0	0	0	105.2
182	D	39.2	Very low	37.9	Very low	157 Å²	157	148.4 Å²	148.4	84%	0.84	79%	0.786	S	S	*	*			trans	98.7	131.6	156.3	-67.6	-36.8	0	0	0	120.7
183	T	35.1	Very low	38	Very low	116 Å²	116	154.9 Å²	154.9	71%	0.712	79%	0.786	S	S	*	*			trans	-87.8	160.8	178.8	60.3	0	0	0	0	110.9
184	F	38.2	Very low	37.8	Very low	212 Å²	212	153.3 Å²	153.3	93%	0.93	79%	0.786	S	S	*	*				-172.2	170.8	127.4	-109	-72.9	0	0	0	112
185	S	36.4	Very low	37.8	Very low	95 Å²	95	159.2 Å²	159.2	66%	0.664	80%	0.798	S	S	*	*			trans	-102.1	158.6	-158.3	-128.7	0	0	0	0	114.9
186	R	37.3	Very low	37.8	Very low	213 Å²	213	152.5 Å²	152.5	80%	0.804	79%	0.79	S	S	*	*			trans	71.6	126.9	143.6	-76.4	-179.2	-176.3	-169.3	0.6	122
187	N	35.6	Very low	38	Very low	126 Å²	126	153.8 Å²	153.8	67%	0.674	80%	0.795	S	S	*	*				91.1	127.5	128.5	-70.6	7.7	0	0	0	121.9
188	Q	39.9	Very low	38	Very low	160 Å²	160	149.2 Å²	149.2	75%	0.748	79%	0.788	S	S	*	*			trans	75.2	119.7	140.2	-74.9	178.7	-19.1	0	0	121.3
189	D	33.8	Very low	38.2	Very low	149 Å²	149	153.4 Å²	153.4	80%	0.797	79%	0.791	S	S	*	*			trans	57.8	103.7	132.1	-54.3	-33.9	0	0	0	119.5
190	G	35.7	Very low	38.1	Very low	78 Å²	78	158 Å²	158	80%	0.804	80%	0.797	S	S	*	*			trans	-163	46	-176.7	0	0	0	0	0	117.3
191	M	38.7	Very low	38.2	Very low	175 Å²	175	162.4 Å²	162.4	86%	0.862	80%	0.8	S	S	*	*			trans	-3.7	119	157.4	-58	-175.5	-177.1	0	0	119.1
192	R	40.2	Very low	38.2	Very low	192 Å²	192	162.2 Å²	162.2	73%	0.725	80%	0.799	S	S	*	*				159.1	130	112.1	-90.5	167.2	178.5	-161.1	0.6	117.5
193	R	39.6	Very low	38	Very low	215 Å²	215	161.6 Å²	161.6	81%	0.811	80%	0.796	S	S	*	*			trans	69.8	122	133.8	-66.9	170.2	177.5	-168.6	-3.7	121.2
194	G	38.5	Very low	38	Very low	71 Å²	71	166.3 Å²	166.3	73%	0.732	80%	0.801	S	S	*	*			trans	170.1	85.4	144.5	0	0	0	0	0	118
195	R	39.8	Very low	37.9	Very low	258 Å²	258	161.6 Å²	161.6	97%	0.974	79%	0.794	S	S	*	*			trans	42.8	129.3	154	-54.5	177.4	179.5	-179.1	-0.6	119
196	G	39.1	Very low	38.1	Very low	74 Å²	74	164.6 Å²	164.6	76%	0.763	80%	0.802	S	S	*	*			cis	123.9	117.9	7	0	0	0	0	0	112.6
197	R	41.6	Very low	38.2	Very low	254 Å²	254	161.9 Å²	161.9	96%	0.958	80%	0.804	S	S	*	*			trans	-162	136.9	153.3	-107.8	-179.4	-125.8	-151.5	4.6	109.9
198	N	38.4	Very low	38.3	Very low	140 Å²	140	159.1 Å²	159.1	75%	0.749	81%	0.805	S	S	*	*			trans	-87.7	156.8	-168.7	-70.1	-9.7	0	0	0	113.3
199	F	41.8	Very low	38.3	Very low	208 Å²	208	163.1 Å²	163.1	91%	0.912	81%	0.813	S	S	*	*				-155.7	128.5	100.7	-97.8	-73.8	0	0	0	110.2
200	Q	33.7	Very low	38.4	Very low	159 Å²	159	163.3 Å²	163.3	74%	0.743	82%	0.815	S	S	*	*			trans	-123.8	154.1	173.7	-83.9	176.8	-39.1	0	0	108.2
201	Y	41.3	Very low	38.5	Very low	220 Å²	220	170.5 Å²	170.5	86%	0.863	82%	0.817	S	S	*	*			trans	-131.2	95.9	148.1	-108.7	-72.2	0	0	0	109.2
202	D	39.5	Very low	38.3	Very low	135 Å²	135	165.4 Å²	165.4	72%	0.722	81%	0.809	S	S	*	*			trans	31.1	148.4	143.8	-57.4	-33.9	0	0	0	123.3
203	N	34.2	Very low	38.3	Very low	143 Å²	143	166.5 Å²	166.5	77%	0.765	82%	0.82	S	S	*	*			trans	-142.6	161.1	-172.9	-159.6	-18.7	0	0	0	107.4
204	R	34.3	Very low	38.2	Very low	216 Å²	216	160.6 Å²	160.6	82%	0.815	81%	0.811	S	S	*	*			trans	88.3	127	161.5	-61	-179.2	177.9	-168.7	-1.1	122
205	S	36.8	Very low	38.2	Very low	113 Å²	113	164.1 Å²	164.1	79%	0.79	81%	0.814	S	S	*	*			trans	75.3	119.9	131	-61.8	0	0	0	0	121.4
206	N	39.6	Very low	38.1	Very low	157 Å²	157	163.7 Å²	163.7	84%	0.84	81%	0.812	S	S	*	*				-153.8	157	118.1	-141.4	-3.8	0	0	0	114.5
207	D	39.7	Very low	37.9	Very low	156 Å²	156	165.2 Å²	165.2	83%	0.834	81%	0.811	S	S	*	*			trans	-67	155	-170.7	-64.2	-52.1	0	0	0	117.8
208	G	38.8	Very low	37.8	Very low	68 Å²	68	159.4 Å²	159.4	70%	0.701	80%	0.799	S	S	*	*				125.3	128.8	112.5	0	0	0	0	0	121.6
209	R	38.7	Very low	37.7	Very low	244 Å²	244	159.6 Å²	159.6	92%	0.921	80%	0.8	S	S	*	*			trans	84.3	84.1	144.2	-52.8	-178.2	-172.5	-169.4	2.7	121
210	N	37	Very low	37.5	Very low	154 Å²	154	153.3 Å²	153.3	82%	0.824	79%	0.794	S	S	*	*				47.2	150.9	106.1	-154.7	10.4	0	0	0	122.2
211	R	38.3	Very low	37.9	Very low	229 Å²	229	151.4 Å²	151.4	86%	0.864	79%	0.789	S	S	*	*			trans	81.5	118.9	-178.4	-50.6	174.8	-171.6	179.3	2.1	113.6
212	G	33.5	Very low	37.7	Very low	67 Å²	67	149.3 Å²	149.3	69%	0.691	78%	0.78	S	S	*	*			cis	98.6	102.6	4.7	0	0	0	0	0	112.7
213	F	40.1	Very low	37.9	Very low	215 Å²	215	152.2 Å²	152.2	94%	0.943	78%	0.782	S	S	*	*			trans	-155.1	154.9	158.4	-100.3	-69	0	0	0	110.4
214	S	37.7	Very low	38.1	Very low	91 Å²	91	149.4 Å²	149.4	64%	0.636	79%	0.786	S	S	*	*			trans	-116.2	163.9	-154.9	54.5	0	0	0	0	114.4
215	D	38	Very low	38.1	Very low	146 Å²	146	142.4 Å²	142.4	78%	0.781	78%	0.781	S	S	*	*			trans	34.7	129	147.5	-53	-39.2	0	0	0	120.8
216	R	38.2	Very low	38.2	Very low	248 Å²	248	149.4 Å²	149.4	94%	0.936	79%	0.791	S	S	*	*				-166.5	132.6	117.5	-103.4	157.5	-157.1	-155.6	4.3	113.8
217	S	35.3	Very low	37.9	Very low	107 Å²	107	145.7 Å²	145.7	75%	0.748	79%	0.789	S	S	*	*			trans	-56.8	155.8	157.2	-28	0	0	0	0	111.1
218	N	38	Very low	37.5	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	79%	0.791	S	S	*	*				172.5	152.8	94.5	-142.8	31.6	0	0	0	113.1
219	D	37.9	Very low	37.2	Very low	143 Å²	143	143 Å²	143	77%	0.765	80%	0.798	S	S	*	*			trans	34.3	141.5	150.7	-60.4	-21.2	0	0	0	123.3
220	G	37.6	Very low	36.8	Very low	77 Å²	77	135.5 Å²	135.5	79%	0.794	80%	0.797	S	S	*	*			trans	178.8	27.3	173	0	0	0	0	0	121.5
221	D	40.7	Very low	36.6	Very low	119 Å²	119	131.7 Å²	131.7	64%	0.636	79%	0.794	S	S	*	*			trans	41.7	123	144.9	-94.3	4.4	0	0	0	124.8
222	R	38.6	Very low	36.3	Very low	176 Å²	176	124.1 Å²	124.1	66%	0.664	79%	0.788	S	S	*	*			trans	66.6	148.2	139.8	-47.5	169.4	-154.5	-178.1	9.2	119
223	Y	43	Very low	36.6	Very low	196 Å²	196	131 Å²	131	77%	0.769	80%	0.798	S	S	*	*			cis	-148.7	140.4	30.8	-86.7	-91.4	0	0	0	108
224	G	37.8	Very low	36.2	Very low	83 Å²	83	132 Å²	132	86%	0.856	80%	0.796	S	S	*	*				82.5	130.2	81.1	0	0	0	0	0	112
225	G	34.5	Very low	36.3	Very low	69 Å²	69	133.4 Å²	133.4	71%	0.711	81%	0.806	S	S	*	*			cis	161.4	165.4	-1	0	0	0	0	0	110.9
226	R	38.1	Very low	36.1	Very low	261 Å²	261	132.6 Å²	132.6	99%	0.985	80%	0.802	S	S	*	*			trans	69.6	144.8	179.1	-52.5	178.5	173.6	-163.6	-2.9	116.3
227	G	33.4	Very low	36.3	Very low	78 Å²	78	128.7 Å²	128.7	80%	0.804	80%	0.8	S	S	*	*			cis	141.3	135.2	-12.3	0	0	0	0	0	114.7
228	G	32.6	Very low	36.2	Very low	86 Å²	86	130.2 Å²	130.2	89%	0.887	80%	0.799	S	S	*	*			trans	95.5	134.7	150.2	0	0	0	0	0	118.8
229	G	31.5	Very low	36.1	Very low	81 Å²	81	134 Å²	134	84%	0.835	81%	0.81	S	S	*	*			trans	116.9	83.6	130.9	0	0	0	0	0	118.5
230	G	31.1	Very low	35.7	Very low	88 Å²	88	131.2 Å²	131.2	91%	0.907	82%	0.815	S	S	*	*			trans	8.9	152.7	133.5	0	0	0	0	0	122.8
231	G	33.7	Very low	35.5	Very low	73 Å²	73	130.8 Å²	130.8	75%	0.753	81%	0.811	S	S	*	*			trans	150.5	87.3	166	0	0	0	0	0	112.3
232	G	31	Very low	35	Very low	71 Å²	71	128.8 Å²	128.8	73%	0.732	82%	0.818	S	S	*	*			trans	-85.3	146.4	169.7	0	0	0	0	0	111
233	F	39.5	Very low	34.8	Very low	210 Å²	210	130.6 Å²	130.6	92%	0.921	83%	0.831	S	S	*	*			trans	-133.2	135	157.6	-83.8	-77.4	0	0	0	110.2
234	R	31.7	Very low	34.5	Very low	236 Å²	236	129.7 Å²	129.7	89%	0.891	83%	0.834	S	S	*	*			trans	-78.5	142.2	169.9	-59.3	168.3	175.8	170.6	-4.4	108.3
235	S	40.5	Very low	34.2	Very low	122 Å²	122	130.9 Å²	130.9	85%	0.853	83%	0.829	S	S	*	*			trans	-144.2	137.3	139	-83.2	0	0	0	0	107.9
236	N	34.4	Very low	34.2	Very low	128 Å²	128	136 Å²	136	68%	0.684	83%	0.834	S	S	*	*			trans	-67	156.4	169.5	-56.7	-12	0	0	0	109.1
237	D	40.7	Very low	34	Very low	167 Å²	167	130 Å²	130	89%	0.893	82%	0.822	S	S	*	*				-154.9	115.9	121.3	-90.8	-33.8	0	0	0	108.1
238	D	33.5	Very low	34.1	Very low	139 Å²	139	134.1 Å²	134.1	74%	0.743	83%	0.825	S	S	*	*			trans	-70.4	126.1	173.8	-71.1	-75.5	0	0	0	110.2
239	F	36	Very low	34.2	Very low	211 Å²	211	139.8 Å²	139.8	93%	0.925	83%	0.826	S	S	*	*			trans	-149.8	110.1	145	-98.4	-70.6	0	0	0	110.2
240	G	30.5	Very low	34.3	Very low	85 Å²	85	139.2 Å²	139.2	88%	0.876	82%	0.82	S	S	*	*			trans	-74.7	144.6	174.5	0	0	0	0	0	112.2
241	G	33	Very low	34.4	Very low	68 Å²	68	138.4 Å²	138.4	70%	0.701	81%	0.811	S	S	*	*			trans	-149.5	111.3	170.7	0	0	0	0	0	108.8
242	G	30.3	Very low	34.4	Very low	77 Å²	77	138.8 Å²	138.8	79%	0.794	82%	0.816	S	S	*	*			trans	-74.6	142.2	-174.1	0	0	0	0	0	112.8	Q244	G242-Q244 PolarHBondContact O-N 3.35Å
243	F	34.9	Very low	34.6	Very low	214 Å²	214	145.2 Å²	145.2	94%	0.939	82%	0.824	S	S	*	*			trans	-84.2	97.2	167	-77.5	-87.5	0	0	0	109.4
244	Q	35.8	Very low	34.3	Very low	176 Å²	176	139 Å²	139	82%	0.822	82%	0.819	S	S	*	*			trans	-80.7	142.3	163.3	-76.2	178.4	-29.1	0	0	109.9	G242	G242-Q244 PolarHBondContact O-N 3.35Å
245	S	32.5	Very low	34.6	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	81%	0.813	S	S	*	*			trans	-56.3	143.2	165.6	47.2	0	0	0	0	111.2
246	H	34.5	Very low	34.3	Very low	175 Å²	175	130.6 Å²	130.6	81%	0.81	81%	0.808	S	S	*	*			trans	-136.7	139.7	161.9	-107.9	49.7	0	0	0	110.7
247	D	32.2	Very low	34.4	Very low	136 Å²	136	133.3 Å²	133.3	73%	0.727	82%	0.817	S	S	*	*			trans	-81.7	129.3	-175.9	-50.1	-90.3	0	0	0	111.4
248	D	36.9	Very low	34.2	Very low	164 Å²	164	136 Å²	136	88%	0.877	81%	0.814	S	S	*	*			trans	-101.8	68.8	169.2	-93	-42.1	0	0	0	111.1	G250	D248-G250 VanDerWaalsContact C-N 3.29Å; D248-G250 PolarHBondContact O-N 2.93Å
249	F	34	Very low	34.5	Very low	206 Å²	206	137.2 Å²	137.2	90%	0.904	82%	0.821	S	S	*	*			trans	-84.3	74	158.6	-96.7	-85.9	0	0	0	109.7
250	G	34.8	Very low	34.6	Very low	69 Å²	69	133.9 Å²	133.9	71%	0.711	81%	0.813	S	S	*	*			trans	-97.6	102.3	-179.3	0	0	0	0	0	113.6	D248	D248-G250 VanDerWaalsContact C-N 3.29Å; D248-G250 PolarHBondContact O-N 2.93Å
251	G	31.9	Very low	35	Very low	70 Å²	70	136.7 Å²	136.7	72%	0.722	81%	0.807	S	S	*	*			trans	-73.6	123	175.9	0	0	0	0	0	113.5
252	G	33.5	Very low	35.3	Very low	82 Å²	82	140.5 Å²	140.5	85%	0.845	81%	0.812	S	S	*	*			trans	-94.6	95.1	176.2	0	0	0	0	0	113.3	G254	G252-G254 PolarHBondContact O-N 3.25Å
253	F	35	Very low	35.7	Very low	206 Å²	206	142.5 Å²	142.5	90%	0.904	80%	0.804	S	S	*	*			trans	-77.8	104.8	168	-74.7	-89.1	0	0	0	110.5	S255	F253-S255 PolarHBondContact O-N 2.92Å
254	G	34.7	Very low	35.9	Very low	80 Å²	80	141.5 Å²	141.5	83%	0.825	80%	0.796	S	S	*	*			trans	-75.9	103.1	171.5	0	0	0	0	0	111.6	G252 G256	G252-G254 PolarHBondContact O-N 3.25Å; G254-G256 PolarHBondContact O-N 2.89Å
255	S	36.3	Very low	36.1	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	79%	0.793	S	S	*	*			trans	-69.1	111.3	171.8	52.1	0	0	0	0	110.8	F253 E257	F253-S255 PolarHBondContact O-N 2.92Å; S255-E257 PolarHBondContact O-N 3.36Å
256	G	34.8	Very low	36.5	Very low	73 Å²	73	140.9 Å²	140.9	75%	0.753	79%	0.79	S	S	*	*			trans	-71	112.9	172.3	0	0	0	0	0	111.5	G254	G254-G256 PolarHBondContact O-N 2.89Å
257	E	37.6	Very low	36.7	Very low	186 Å²	186	138.6 Å²	138.6	87%	0.869	78%	0.784	S	S	*	*			trans	-62.3	137.1	170.4	-72.2	160.4	117.8	0	0	110.3	S255	S255-E257 PolarHBondContact O-N 3.36Å
258	R	36.8	Very low	37.1	Very low	223 Å²	223	135.6 Å²	135.6	84%	0.842	77%	0.774	S	S	*	*			trans	-97	99.6	177.1	-74.8	-176.8	177	176.7	-1.6	109.8	N260	R258-N260 PolarHBondContact O-N 3.03Å
259	D	39.4	Very low	37.3	Very low	164 Å²	164	137.8 Å²	137.8	88%	0.877	78%	0.776	S	S	*	*			trans	-71.6	103.6	160	-73.8	-41.3	0	0	0	109
260	N	37.2	Very low	37.6	Very low	142 Å²	142	131.5 Å²	131.5	76%	0.759	77%	0.769	S	S	*	*			trans	-91.5	124.6	162.9	-74.2	-38.7	0	0	0	108	R258	R258-N260 PolarHBondContact O-N 3.03Å
261	N	39.1	Very low	37.8	Very low	143 Å²	143	135 Å²	135	77%	0.765	77%	0.771	S	S	*	*			trans	-137.1	146.8	161.1	-98.4	-17.1	0	0	0	109.3
262	D	39.3	Very low	38.2	Very low	149 Å²	149	138.3 Å²	138.3	80%	0.797	77%	0.772	S	S	*	*			trans	68.3	139.1	159.6	-46.7	-26.4	0	0	0	118.5
263	D	39.4	Very low	38.4	Very low	118 Å²	118	144.4 Å²	144.4	63%	0.631	77%	0.77	S	S	*	*			cis	-165.4	176.7	-24	-166	2.3	0	0	0	107.2
264	Y	39.4	Very low	38.6	Very low	194 Å²	194	145.6 Å²	145.6	76%	0.761	77%	0.769	S	S	*	*			trans	78.3	110	166.8	-63.9	-78.7	0	0	0	120.5
265	S	39.6	Very low	38.8	Very low	109 Å²	109	153.2 Å²	153.2	76%	0.762	77%	0.772	S	S	*	*				69.7	135.9	118.1	-179	0	0	0	0	119.8
266	K	39.8	Very low	39	Very low	162 Å²	162	155.7 Å²	155.7	70%	0.704	78%	0.777	S	S	*	*			cis	-176.3	157.7	-15.9	-161.4	-174.1	175.4	-173.5	0	105.8
267	D	39	Very low	39.2	Very low	127 Å²	127	159.6 Å²	159.6	68%	0.679	78%	0.781	S	S	*	*			trans	66.7	147.6	167.4	-49.6	-48.5	0	0	0	116.4
268	S	40.5	Very low	39.3	Very low	74 Å²	74	154.3 Å²	154.3	52%	0.517	78%	0.776	S	S	.	*			cis	-165.6	164.3	-23.2	-101.9	0	0	0	0	108.1
269	F	41.9	Very low	39.5	Very low	210 Å²	210	155.8 Å²	155.8	92%	0.921	78%	0.781	S	S	*	*			trans	68.7	137.5	172.4	-35.1	-72	0	0	0	116.1
270	G	39.1	Very low	39.5	Very low	73 Å²	73	150.8 Å²	150.8	75%	0.753	77%	0.769	S	S	*	*			cis	179.7	150.1	-5.4	0	0	0	0	0	110.8
271	N	38.9	Very low	39.7	Very low	143 Å²	143	153.4 Å²	153.4	77%	0.765	77%	0.774	S	S	*	*			trans	-39	151.3	169.3	-85.7	-17.8	0	0	0	113.2
272	D	41.2	Very low	39.8	Very low	139 Å²	139	156.1 Å²	156.1	74%	0.743	77%	0.773	S	S	*	*				-165.9	173.6	58.1	-129.9	-44.5	0	0	0	116.4
273	R	37.3	Very low	39.9	Very low	210 Å²	210	154.2 Å²	154.2	79%	0.792	76%	0.763	S	S	*	*			trans	-96	150.1	-173.5	-55.4	157.9	176.3	161.3	-2.6	112.9
274	R	39	Very low	39.9	Very low	232 Å²	232	155.7 Å²	155.7	88%	0.875	77%	0.771	S	S	*	*			trans	168.4	118.9	136.5	-88.3	146.5	-156.8	-129.9	6.8	109.6
275	R	39.9	Very low	39.9	Very low	239 Å²	239	152.7 Å²	152.7	90%	0.902	77%	0.768	S	S	*	*				55.3	112.8	88.4	-70.8	-171.4	-179.5	-175.7	-0.1	114.7
276	N	40.7	Very low	39.8	Very low	159 Å²	159	158 Å²	158	85%	0.85	77%	0.772	S	S	*	*				-166	154.4	108	-140.8	7.3	0	0	0	113.9
277	D	38.7	Very low	39.7	Very low	156 Å²	156	156.9 Å²	156.9	83%	0.834	77%	0.773	S	S	*	*			trans	-83.5	159.3	177	-59.3	-75.9	0	0	0	113.4
278	G	39.3	Very low	39.7	Very low	74 Å²	74	160.2 Å²	160.2	76%	0.763	78%	0.777	S	S	*	*			trans	-170.6	47.1	-175.3	0	0	0	0	0	120.3
279	R	40.8	Very low	39.6	Very low	254 Å²	254	162.4 Å²	162.4	96%	0.958	78%	0.783	S	S	*	*			trans	17.1	135.2	152.3	-52.9	177.8	-175.7	-169.1	0.1	121
280	G	39.4	Very low	39.4	Very low	59 Å²	59	159 Å²	159	61%	0.608	78%	0.775	S	S	*	*				141.8	123.7	120.4	0	0	0	0	0	120.7
281	F	42.2	Very low	39.2	Very low	197 Å²	197	162.3 Å²	162.3	86%	0.864	78%	0.775	S	S	*	*			trans	66.4	153.9	143.9	-56.6	-76.1	0	0	0	120.4
282	R	39.6	Very low	39.2	Very low	201 Å²	201	167 Å²	167	76%	0.758	78%	0.784	S	S	*	*			cis	-170.8	142.2	-38.8	-129.8	-166.8	162.7	168.2	0.7	109.4
283	D	42.3	Very low	38.9	Very low	108 Å²	108	165.8 Å²	165.8	58%	0.578	79%	0.786	S	S	*	*			trans	59.1	142.8	146.7	-53.6	-20.4	0	0	0	124.8
284	N	38.9	Very low	38.8	Very low	150 Å²	150	165.1 Å²	165.1	80%	0.802	79%	0.789	S	S	*	*			trans	87.9	124.2	155.5	-57	-51.1	0	0	0	119
285	N	38.8	Very low	38.7	Very low	130 Å²	130	158.7 Å²	158.7	70%	0.695	78%	0.78	S	S	*	*			cis	120.6	146	12.4	-176.9	19.6	0	0	0	110.9
286	R	38.6	Very low	38.5	Very low	222 Å²	222	150.9 Å²	150.9	84%	0.838	77%	0.774	S	S	*	*			trans	86	118.4	-174.2	-52.8	167.7	-170.5	178	2.9	113.2
287	N	37	Very low	38.3	Very low	137 Å²	137	154.6 Å²	154.6	73%	0.733	78%	0.776	S	S	*	*				87.6	144.6	50.1	-77.3	15.8	0	0	0	113.8
288	Y	38.9	Very low	38.1	Very low	197 Å²	197	154.3 Å²	154.3	77%	0.773	77%	0.774	S	S	*	*			trans	91.7	98	170.8	-73.8	-83.1	0	0	0	119
289	D	38.4	Very low	38.1	Very low	120 Å²	120	162.1 Å²	162.1	64%	0.642	78%	0.781	S	S	*	*				59.8	119.5	118.1	-53.9	6.1	0	0	0	122
290	D	38.1	Very low	38	Very low	140 Å²	140	154 Å²	154	75%	0.749	77%	0.768	S	S	*	*				61.8	128.6	126.1	-55.4	-16.9	0	0	0	124.2
291	D	36.1	Very low	38	Very low	142 Å²	142	160.8 Å²	160.8	76%	0.759	78%	0.777	S	S	*	*			trans	39.6	113.4	142.2	-68.4	-19.9	0	0	0	121.2
292	Y	38.5	Very low	37.8	Very low	242 Å²	242	162.4 Å²	162.4	95%	0.949	78%	0.777	S	S	*	*				-151.7	133	128.1	-84.3	-67	0	0	0	111.8
293	S	33.6	Very low	37.8	Very low	112 Å²	112	156.2 Å²	156.2	78%	0.783	78%	0.776	S	S	*	*			trans	-96.2	120.9	170.6	49.6	0	0	0	0	111
294	F	36.8	Very low	37.6	Very low	197 Å²	197	162.5 Å²	162.5	86%	0.864	79%	0.791	S	S	*	*			trans	-165.2	135.1	148.9	-137.6	-119.7	0	0	0	114.5
295	S	36.3	Very low	37.3	Very low	96 Å²	96	158.7 Å²	158.7	67%	0.671	79%	0.788	S	S	*	*			trans	38	118.9	150.5	72	0	0	0	0	121.8
296	G	35.7	Very low	37.4	Very low	76 Å²	76	157 Å²	157	78%	0.784	79%	0.787	S	S	*	*				106.9	154.8	105.1	0	0	0	0	0	120.4
297	R	37.2	Very low	37.3	Very low	236 Å²	236	154.7 Å²	154.7	89%	0.891	78%	0.783	S	S	*	*			trans	88.4	101.5	167.4	-64.3	-173.1	174.7	170.6	0.9	119.3
298	D	34.1	Very low	37.4	Very low	150 Å²	150	156 Å²	156	80%	0.802	78%	0.784	S	S	*	*			trans	-40.9	153.2	148.7	-48.3	-94.3	0	0	0	115.9
299	R	39.6	Very low	37.4	Very low	238 Å²	238	154.5 Å²	154.5	90%	0.898	79%	0.79	S	S	*	*			trans	-165.9	85.9	144.6	-98.6	161.9	-165.8	179.5	4.4	106.9
300	A	37.7	Very low	37.5	Very low	83 Å²	83	151.8 Å²	151.8	69%	0.686	79%	0.79	S	S	*	*				58.8	120.2	80.1	0	0	0	0	0	114.5
301	Y	39.7	Very low	37.4	Very low	203 Å²	203	149.1 Å²	149.1	80%	0.796	80%	0.795	S	S	*	*			trans	-163.4	109.6	142.5	-109.4	-68.1	0	0	0	114.4
302	R	38.3	Very low	37.3	Very low	231 Å²	231	145.7 Å²	145.7	87%	0.872	79%	0.794	S	S	*	*			trans	62.1	143.5	156.4	-71.6	165.7	-173.6	-177.6	1.9	119.6
303	G	38.4	Very low	37.4	Very low	71 Å²	71	144.6 Å²	144.6	73%	0.732	80%	0.795	S	S	*	*			cis	-161.9	140.1	7.4	0	0	0	0	0	116.7
304	R	39.4	Very low	37.5	Very low	239 Å²	239	151 Å²	151	90%	0.902	80%	0.801	S	S	*	*			trans	10.2	120.5	149.8	-135	-178.4	-165	-144.4	3.5	118.3
305	G	32.4	Very low	37.6	Very low	71 Å²	71	144.9 Å²	144.9	73%	0.732	80%	0.795	S	S	*	*			trans	-89.5	160.4	155.5	0	0	0	0	0	112.2
306	S	39.6	Very low	37.7	Very low	95 Å²	95	151.4 Å²	151.4	66%	0.664	81%	0.805	S	S	*	*			trans	-160.7	120	160.4	-95.9	0	0	0	0	110.5
307	F	38.5	Very low	37.9	Very low	172 Å²	172	151.3 Å²	151.3	75%	0.754	80%	0.803	S	S	*	*			trans	56.9	124.3	139.3	-71.8	-91	0	0	0	122.6
308	E	39	Very low	37.9	Very low	164 Å²	164	150.6 Å²	150.6	77%	0.766	80%	0.8	S	S	*	*			trans	72.1	110.5	131.5	-75.5	167.9	163.2	0	0	122
309	D	38.8	Very low	38.4	Very low	167 Å²	167	149 Å²	149	89%	0.893	80%	0.801	S	S	*	*				84.1	152	118.5	-157.5	22.7	0	0	0	119.8
310	G	38.6	Very low	38.5	Very low	62 Å²	62	149.5 Å²	149.5	64%	0.639	80%	0.803	S	S	*	*			trans	94.2	93.4	156.1	0	0	0	0	0	118.2
311	G	36.5	Very low	38.4	Very low	84 Å²	84	149.2 Å²	149.2	87%	0.866	81%	0.809	S	S	*	*			trans	75.7	115.3	134.7	0	0	0	0	0	118.9
312	G	35.1	Very low	38.1	Very low	71 Å²	71	150.4 Å²	150.4	73%	0.732	81%	0.812	S	S	*	*			trans	-77.5	157.3	167	0	0	0	0	0	113
313	F	39.1	Very low	38	Very low	219 Å²	219	147.5 Å²	147.5	96%	0.961	81%	0.808	S	S	*	*			trans	-154.3	154.7	152.1	-119.6	-81.5	0	0	0	112.4
314	R	37	Very low	37.9	Very low	245 Å²	245	150.8 Å²	150.8	93%	0.925	81%	0.809	S	S	*	*			trans	-80.7	142.4	-179.7	-59.8	167.3	173.3	174	-3.8	111.6
315	G	39.1	Very low	37.8	Very low	70 Å²	70	147 Å²	147	72%	0.722	81%	0.806	S	S	*	*			trans	164.4	100.2	162.5	0	0	0	0	0	113.9
316	R	37.6	Very low	38.1	Very low	233 Å²	233	148.7 Å²	148.7	88%	0.879	81%	0.807	S	S	*	*				61.5	104.7	95.2	-91	-167.8	172.7	-173.3	1.8	116.2
317	G	39.4	Very low	38	Very low	73 Å²	73	148.7 Å²	148.7	75%	0.753	81%	0.813	S	S	*	*			trans	-175.2	69.2	161.2	0	0	0	0	0	110.5
318	R	38.7	Very low	37.7	Very low	221 Å²	221	143.7 Å²	143.7	83%	0.834	81%	0.81	S	S	*	*				40.9	94.1	91.1	-81.6	-166.4	172.5	-169.5	-3	114.2
319	S	43	Very low	37.5	Very low	118 Å²	118	140.1 Å²	140.1	83%	0.825	80%	0.803	S	S	*	*			trans	-142.2	116.2	144.2	-93.6	0	0	0	0	110.9
320	R	42.4	Very low	37.4	Very low	247 Å²	247	141.9 Å²	141.9	93%	0.932	80%	0.803	S	S	*	*			trans	0.4	124.8	156.5	-57.2	163.2	-177.9	166.1	-1.2	114.9
321	G	34.9	Very low	37.1	Very low	78 Å²	78	146.5 Å²	146.5	80%	0.804	81%	0.808	S	S	*	*			cis	103.8	81.2	28.2	0	0	0	0	0	109.8
322	R	35.3	Very low	36.9	Very low	227 Å²	227	153.4 Å²	153.4	86%	0.857	81%	0.808	S	S	*	*			trans	-140.8	113.6	161.7	-159.2	178.4	-164.8	177.1	2.5	106.7	D324	R322-D324 PolarHBondContact O-N 3.06Å
323	E	35.7	Very low	36.8	Very low	171 Å²	171	161.1 Å²	161.1	80%	0.799	82%	0.815	S	S	*	*			trans	-86.5	97.4	-176.8	-66.5	165.8	133.7	0	0	108.9
324	D	36.7	Very low	36.5	Very low	139 Å²	139	159.3 Å²	159.3	74%	0.743	81%	0.809	S	S	*	*			trans	-103.1	84.4	160.8	-75.9	-52.6	0	0	0	107.9	R322 S326	R322-D324 PolarHBondContact O-N 3.06Å; D324-S326 PolarHBondContact O-N 2.91Å
325	N	36.1	Very low	36.4	Very low	159 Å²	159	152 Å²	152	85%	0.85	80%	0.802	S	S	*	*			trans	-69.7	72.9	169.9	-80.6	-35.5	0	0	0	109.9
326	S	39	Very low	36.4	Very low	107 Å²	107	155 Å²	155	75%	0.748	81%	0.806	S	S	*	*			trans	-104.4	94	155	-167.7	0	0	0	0	107.2	D324 G328	D324-S326 PolarHBondContact O-N 2.91Å; S326-G328 PolarHBondContact O-N 3.24Å
327	A	38	Very low	36.5	Very low	96 Å²	96	153.2 Å²	153.2	79%	0.793	81%	0.807	S	S	*	*			trans	-64	89.5	162.3	0	0	0	0	0	106.6	S329	A327-S329 PolarHBondContact O-N 2.81Å
328	G	32.9	Very low	36.6	Very low	66 Å²	66	152.8 Å²	152.8	68%	0.68	80%	0.803	S	S	*	*			trans	-62.4	87.5	170.5	0	0	0	0	0	107.8	S326 F330	S326-G328 PolarHBondContact O-N 3.24Å; G328-F330 PolarHBondContact O-N 2.8Å
329	S	34.7	Very low	36.8	Very low	89 Å²	89	150.9 Å²	150.9	62%	0.622	80%	0.804	S	S	*	*			trans	-47.6	113	160.4	40.1	0	0	0	0	105.6	A327 E331	A327-S329 PolarHBondContact O-N 2.81Å; S329-E331 PolarHBondContact O-N 3.01Å
330	F	34.9	Very low	37.3	Very low	205 Å²	205	151.1 Å²	151.1	90%	0.899	80%	0.802	S	S	*	*			trans	-71	73.3	160.8	-146.4	-90	0	0	0	104.9	G328 R332	G328-F330 PolarHBondContact O-N 2.8Å; F330-R332 VanDerWaalsContact C-N 3.26Å; F330-R332 PolarHBondContact O-N 2.74Å
331	E	32.8	Very low	38.3	Very low	158 Å²	158	148.8 Å²	148.8	74%	0.738	80%	0.799	S	S	*	*			trans	-52.3	105.3	166	-79	-171.4	157.8	0	0	104.4	S329 R333	S329-E331 PolarHBondContact O-N 3.01Å; E331-R333 PolarHBondContact O-N 2.8Å
332	R	32.9	Very low	40	Very low	229 Å²	229	150.2 Å²	150.2	86%	0.864	79%	0.794	S	S	*	*			trans	-52.1	94.7	166.3	177.8	-170.2	-144.8	-141.1	6.1	104.5	F330 E334	F330-R332 VanDerWaalsContact C-N 3.26Å; F330-R332 PolarHBondContact O-N 2.74Å; R332-E334 PolarHBondContact O-N 2.81Å
333	R	33.2	Very low	41.9	Very low	234 Å²	234	144.1 Å²	144.1	88%	0.883	78%	0.784	S	S	*	*			trans	-41.8	111.4	179.9	-84.5	-178.5	169.6	178	-4.4	105.6	E331 A335	E331-R333 PolarHBondContact O-N 2.8Å; R333-A335 PolarHBondContact O-N 2.93Å
334	E	31.5	Very low	44	Very low	181 Å²	181	139.6 Å²	139.6	85%	0.846	77%	0.768	S	S	*	*			trans	-49.3	125	170.2	-70	-167.7	131.3	0	0	104.6	R332 T336	R332-E334 PolarHBondContact O-N 2.81Å; E334-T336 VanDerWaalsContact C-N 3.28Å; E334-T336 PolarHBondContact O-N 3.32Å
335	A	36.4	Very low	46.5	Very low	92 Å²	92	138.9 Å²	138.9	76%	0.76	76%	0.764	S	S	*	*			trans	-58.7	103.5	-176.8	0	0	0	0	0	105.7	R333 Q337	R333-A335 PolarHBondContact O-N 2.93Å; A335-Q337 PolarHBondContact O-N 2.76Å
336	T	39.1	Very low	49.1	Very low	132 Å²	132	132.7 Å²	132.7	81%	0.81	73%	0.729	S	S	*	*			trans	-42.5	115.9	-177.8	38.4	0	0	0	0	105.8	E334 G338	E334-T336 VanDerWaalsContact C-N 3.28Å; E334-T336 PolarHBondContact O-N 3.32Å; T336-G338 VanDerWaalsContact C-N 3.27Å; T336-G338 WeakPolarHBondContact O-CA 3.32Å; T336-G338 PolarHBondContact O-N 3.17Å
337	Q	40.1	Very low	51.5	Low	195 Å²	195	131 Å²	131	91%	0.911	71%	0.714	S	S	*	*			trans	-53.3	97.9	-168	-70.2	-176.3	12.3	0	0	107.9	A335 Q339	A335-Q337 PolarHBondContact O-N 2.76Å; Q337-Q339 PolarHBondContact O-N 3.05Å
338	G	41.4	Very low	53.7	Low	64 Å²	64	127.3 Å²	127.3	66%	0.66	68%	0.682	S	S	*	*			trans	-60.1	132.4	-175	0	0	0	0	0	105.9	T336 P340	T336-G338 VanDerWaalsContact C-N 3.27Å; T336-G338 WeakPolarHBondContact O-CA 3.32Å; T336-G338 PolarHBondContact O-N 3.17Å; G338-P340 VanDerWaalsContact O-N 3.12Å
339	Q	41.2	Very low	56.1	Low	182 Å²	182	127.8 Å²	127.8	85%	0.85	68%	0.675	S	S	*	*			trans	-40.5	126	-177.6	-71.1	-173.7	-4	0	0	108.8	Q337 K341	Q337-Q339 PolarHBondContact O-N 3.05Å; Q339-K341 PolarHBondContact O-N 3.27Å
340	P	54.9	Low	58.3	Low	123 Å²	123	133 Å²	133	80%	0.799	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-53.3	118.6	-167.5	19.7	-32.5	0	0	0	108.4	G338	G338-P340 VanDerWaalsContact O-N 3.12Å
341	K	63.6	Low	60.3	Low	197 Å²	197	126.5 Å²	126.5	86%	0.857	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-49	131.3	-174.4	-72.9	-175.9	177.5	-178.5	0	108.3	Q339	Q339-K341 PolarHBondContact O-N 3.27Å
342	P	69.7	Low	62.4	Low	109 Å²	109	122.1 Å²	122.1	71%	0.708	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-54	142.3	-172.3	20.5	-32.6	0	0	0	110.4	V344	P342-V344 PolarHBondContact O-N 3.49Å
343	P	74.4	Confident	64.3	Low	99 Å²	99	114.4 Å²	114.4	64%	0.643	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-59.2	132.3	-174.3	24.3	-34	0	0	0	110.4	N345	P343-N345 PolarHBondContact O-N 3.47Å; P343-N345 PolarHBondContact O-OD1 2.93Å
344	V	81.5	Confident	66	Low	76 Å²	76	110.5 Å²	110.5	46%	0.461	61%	0.609	S	S	.	*			trans	-70.4	104.1	179.5	-179.4	0	0	0	0	108.9	P342 G496 S498	P342-V344 PolarHBondContact O-N 3.49Å; V344-G496 VanDerWaalsContact CG1-C 3.49Å; V344-G496 WeakPolarHBondContact CG1-O 3.49Å; V344-S498 WeakPolarHBondContact O-CA 3.25Å
345	N	87.4	Confident	67.7	Low	124 Å²	124	104 Å²	104	66%	0.663	58%	0.579	S	S	*	*			trans	-93.2	1.1	-176.3	-67.8	-27	0	0	0	113.7	P343 V347	P343-N345 PolarHBondContact O-N 3.47Å; P343-N345 PolarHBondContact O-OD1 2.93Å; N345-V347 PolarHBondContact O-N 3.29Å
346	Y	90.7	Very high	69.2	Low	28 Å²	28	101.1 Å²	101.1	11%	0.11	55%	0.55	C	S	.	*			trans	-60.7	132.3	-178.3	179.4	-128.7	0	0	0	112.2	P348 V497 S498 Q671 M672 E675	Y346-P348 HydrophobicContact CE1-CG 4.11Å; Y346-V497 HydrophobicContact CD1-CG2 3.88Å; Y346-V497 HydrophobicContact CE1-CG2 4.22Å; Y346-S498 WeakPolarHBondContact O-CB 3.36Å; Y346-S498 PolarHBondContact O-N 3.05Å; Y346-Q671 HydrophobicContact CD1-CB 4.03Å; Y346-Q671 HydrophobicContact CD1-CG 4.16Å; Y346-Q671 HydrophobicContact CE1-CB 4.26Å; Y346-Q671 HydrophobicContact CE1-CG 4.04Å; Y346-M672 HydrophobicContact CD1-CB 4.47Å; Y346-M672 HydrophobicContact CD2-CB 3.77Å; Y346-M672 HydrophobicContact CD2-CE 3.48Å; Y346-M672 VanDerWaalsContact CD2-CE 3.48Å; Y346-M672 HydrophobicContact CD2-CG 4.11Å; Y346-M672 HydrophobicContact CE1-CB 4.27Å; Y346-M672 HydrophobicContact CE2-CB 3.54Å; Y346-M672 HydrophobicContact CE2-CE 3.71Å; Y346-M672 HydrophobicContact CE2-CG 3.58Å; Y346-M672 HydrophobicContact CE2-SD 4.47Å; Y346-M672 HydrophobicContact CG-CB 4.24Å; Y346-E675 PolarHBondContact OH-OE2 3.37Å
347	V	89.6	Confident	70.6	Confident	72 Å²	72	102.4 Å²	102.4	44%	0.436	54%	0.54	S	S	.	.			trans	-121.6	119.9	172	176.3	0	0	0	0	107.4	N345 Y501	N345-V347 PolarHBondContact O-N 3.29Å; V347-Y501 HydrophobicContact CG1-CD1 4.4Å; V347-Y501 HydrophobicContact CG1-CD2 3.55Å; V347-Y501 HydrophobicContact CG1-CE1 4.48Å; V347-Y501 HydrophobicContact CG1-CE2 3.61Å; V347-Y501 HydrophobicContact CG1-CG 3.96Å; V347-Y501 HydrophobicContact CG2-CD2 4.32Å; V347-Y501 HydrophobicContact CG2-CG 4.22Å
348	P	85.4	Confident	71.5	Confident	19 Å²	19	98.4 Å²	98.4	12%	0.123	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-58.2	144	176.5	-26.7	34.7	0	0	0	112.7	Y346 Y494 V497	Y346-P348 HydrophobicContact CE1-CG 4.11Å; P348-Y494 VanDerWaalsContact CG-OH 3.25Å; P348-Y494 WeakPolarHBondContact CG-OH 3.48Å; P348-V497 HydrophobicContact CG-CG1 4.13Å; P348-V497 HydrophobicContact CG-CG2 3.63Å
349	S	82.7	Confident	72.8	Confident	76 Å²	76	98.8 Å²	98.8	53%	0.531	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-61.6	146	168.9	-55.7	0	0	0	0	110.1
350	K	80.6	Confident	73.8	Confident	199 Å²	199	91.8 Å²	91.8	87%	0.865	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-62.6	139.2	165.8	-66.4	-177.1	-179.3	179	0	108.8
351	M	76.6	Confident	74.5	Confident	67 Å²	67	93.9 Å²	93.9	33%	0.33	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-73.6	148.9	174.1	-70.1	174.7	175.3	0	0	111.4	E355 M356 I473 T477	M351-E355 WeakPolarHBondContact CA-OE2 3.4Å; M351-E355 HydrophobicContact CB-CB 4.25Å; M351-M356 HydrophobicContact CB-CG 4.18Å; M351-I473 HydrophobicContact CE-CG2 3.36Å; M351-T477 VanDerWaalsContact CE-OG1 3.27Å; M351-T477 WeakPolarHBondContact CE-OG1 3.44Å; M351-T477 HydrophobicContact SD-CG2 3.71Å; M351-T477 PolarHBondContact SD-OG1 3.2Å
352	T	76.7	Confident	74.7	Confident	67 Å²	67	87.5 Å²	87.5	41%	0.411	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-79.5	162	169.3	72.4	0	0	0	0	111.2	E354 E355 M356	T352-E354 PolarHBondContact O-N 3.41Å; T352-E354 PolarHBondContact OG1-N 2.93Å; T352-E355 PolarHBondContact N-OE2 2.57Å; T352-E355 PolarHBondContact O-N 3.14Å; T352-E355 WeakPolarHBondContact OG1-CG 3.32Å; T352-E355 PolarHBondContact OG1-N 3.5Å; T352-E355 VanDerWaalsContact OG1-N 3.09Å; T352-M356 WeakPolarHBondContact O-CG 3.24Å; T352-M356 PolarHBondContact O-N 2.95Å
353	E	73.1	Confident	74.7	Confident	66 Å²	66	82.9 Å²	82.9	31%	0.308	42%	0.424	S	S	.	.	H	α-helix	trans	-58.9	-33.4	172.2	-67.4	-66.4	148.7	0	0	112.5	M356 R357 R484	E353-M356 VanDerWaalsContact CD-CE 3.48Å; E353-M356 HydrophobicContact CG-CE 4.34Å; E353-M356 PolarHBondContact O-N 2.86Å; E353-M356 VanDerWaalsContact OE1-CE 3.27Å; E353-M356 WeakPolarHBondContact OE1-CE 3.42Å; E353-R357 VanDerWaalsContact O-CG 3.27Å; E353-R357 WeakPolarHBondContact O-CG 3.34Å; E353-R357 PolarHBondContact O-N 3.03Å; E353-R357 VanDerWaalsContact O-N 3.14Å; E353-R484 IonicContact OE1-CZ 2.77Å; E353-R484 IonicContact OE1-NE 3.03Å; E353-R484 PolarHBondContact OE1-NE 2.76Å; E353-R484 IonicContact OE1-NH1 3.66Å; E353-R484 IonicContact OE1-NH2 2.87Å; E353-R484 PolarHBondContact OE1-NH2 2.77Å; E353-R484 IonicContact OE2-CZ 2.69Å; E353-R484 IonicContact OE2-NE 3.28Å; E353-R484 IonicContact OE2-NH1 3.38Å; E353-R484 PolarHBondContact OE2-NH1 3.43Å; E353-R484 IonicContact OE2-NH2 3.99Å; E353-R484 PolarHBondContact OE2-NH2 3.14Å
354	E	70.2	Confident	74.8	Confident	152 Å²	152	84 Å²	84	71%	0.71	43%	0.428	S	S	*	.	H	α-helix	trans	-68.9	-44.4	176.1	-60.3	173.8	159.2	0	0	111	T352 M356 R357 M358	T352-E354 PolarHBondContact O-N 3.41Å; T352-E354 PolarHBondContact OG1-N 2.93Å; E354-M356 PolarHBondContact O-N 3.34Å; E354-R357 PolarHBondContact O-N 3.33Å; E354-R357 VanDerWaalsContact O-N 3.15Å; E354-M358 PolarHBondContact O-N 3.44Å
355	E	66.4	Low	74.5	Confident	44 Å²	44	82.6 Å²	82.6	21%	0.206	42%	0.418	C	S	.	.	H	α-helix	trans	-59.9	-34.4	173.8	-75	178.9	132.7	0	0	112.3	M351 T352 M358 R679	M351-E355 WeakPolarHBondContact CA-OE2 3.4Å; M351-E355 HydrophobicContact CB-CB 4.25Å; T352-E355 PolarHBondContact N-OE2 2.57Å; T352-E355 PolarHBondContact O-N 3.14Å; T352-E355 WeakPolarHBondContact OG1-CG 3.32Å; T352-E355 PolarHBondContact OG1-N 3.5Å; T352-E355 VanDerWaalsContact OG1-N 3.09Å; E355-M358 HydrophobicContact CB-CE 4.42Å; E355-M358 HydrophobicContact CG-CE 4.15Å; E355-R679 WeakPolarHBondContact OE1-CD 3.43Å; E355-R679 IonicContact OE1-CZ 2.75Å; E355-R679 IonicContact OE1-NE 3.61Å; E355-R679 PolarHBondContact OE1-NE 2.71Å; E355-R679 IonicContact OE1-NH2 2.71Å
356	M	67.9	Low	74	Confident	33 Å²	33	78 Å²	78	16%	0.163	39%	0.393	C	S	.	.	H	α-helix	trans	-75.3	-25.2	176.8	-68.1	-170.9	-68.5	0	0	113.9	M351 T352 E353 E354 T477 N481	M351-M356 HydrophobicContact CB-CG 4.18Å; T352-M356 WeakPolarHBondContact O-CG 3.24Å; T352-M356 PolarHBondContact O-N 2.95Å; E353-M356 VanDerWaalsContact CD-CE 3.48Å; E353-M356 HydrophobicContact CG-CE 4.34Å; E353-M356 PolarHBondContact O-N 2.86Å; E353-M356 VanDerWaalsContact OE1-CE 3.27Å; E353-M356 WeakPolarHBondContact OE1-CE 3.42Å; E354-M356 PolarHBondContact O-N 3.34Å; M356-T477 HydrophobicContact CB-CG2 4.33Å; M356-T477 HydrophobicContact CG-CG2 4.01Å; M356-N481 HydrophobicContact CB-CB 4.49Å
357	R	67.6	Low	73.3	Confident	158 Å²	158	83.2 Å²	83.2	60%	0.596	42%	0.418	S	S	*	.	H	α-helix	trans	-88.9	-16.2	-178.9	-73.8	172.9	-179.1	-167.7	-1.2	114.4	E353 E354 H359	E353-R357 VanDerWaalsContact O-CG 3.27Å; E353-R357 WeakPolarHBondContact O-CG 3.34Å; E353-R357 PolarHBondContact O-N 3.03Å; E353-R357 VanDerWaalsContact O-N 3.14Å; E354-R357 PolarHBondContact O-N 3.33Å; E354-R357 VanDerWaalsContact O-N 3.15Å; R357-H359 PolarHBondContact O-N 2.95Å; R357-H359 VanDerWaalsContact O-N 3.09Å; R357-H359 PolarHBondContact O-ND1 3.01Å
358	M	60.6	Low	72.5	Confident	111 Å²	111	84.1 Å²	84.1	55%	0.547	42%	0.42	S	S	.	.			trans	-64.7	107.6	-179.6	-80.2	-165.4	-82.2	0	0	112.4	E354 E355	E354-M358 PolarHBondContact O-N 3.44Å; E355-M358 HydrophobicContact CB-CE 4.42Å; E355-M358 HydrophobicContact CG-CE 4.15Å
359	H	68.2	Low	71.8	Confident	73 Å²	73	84.7 Å²	84.7	34%	0.338	42%	0.421	S	S	.	.			trans	-129.7	161.3	171.8	61.6	-86	0	0	0	110.2	R357 S404	R357-H359 PolarHBondContact O-N 2.95Å; R357-H359 VanDerWaalsContact O-N 3.09Å; R357-H359 PolarHBondContact O-ND1 3.01Å; H359-S404 PolarHBondContact CE1-O 3.49Å; H359-S404 PolarHBondContact NE2-O 3.1Å; H359-S404 VanDerWaalsContact NE2-O 3.1Å
360	I	61.7	Low	71.6	Confident	35 Å²	35	83.2 Å²	83.2	18%	0.179	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-79.7	120	173.8	-59.9	179.9	0	0	0	108.5	D700 A702 R728 V729	I360-D700 VanDerWaalsContact CD1-OD1 3.31Å; I360-D700 WeakPolarHBondContact CD1-OD1 3.43Å; I360-A702 HydrophobicContact CD1-CB 4.4Å; I360-A702 HydrophobicContact CG1-CB 3.63Å; I360-R728 HydrophobicContact CD1-CB 3.95Å; I360-V729 HydrophobicContact CB-CG2 4.04Å; I360-V729 HydrophobicContact CG2-CB 4.07Å; I360-V729 HydrophobicContact CG2-CG2 3.69Å
361	R	69.2	Low	71.5	Confident	166 Å²	166	83.3 Å²	83.3	63%	0.626	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-70.6	149.1	171.6	-73	-178.2	162	173.4	-9.8	110.8	G363 D405 N731	R361-G363 PolarHBondContact O-N 3.06Å; R361-D405 IonicContact CZ-OD2 2.63Å; R361-D405 IonicContact NE-OD2 3.65Å; R361-D405 IonicContact NH2-OD2 3.47Å; R361-D405 PolarHBondContact NH2-OD2 2.88Å; R361-N731 PolarHBondContact O-ND2 1.82Å
362	A	69	Low	71.7	Confident	64 Å²	64	81.8 Å²	81.8	53%	0.529	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-57.7	130.2	172.4	0	0	0	0	0	110.7	F366 V729	A362-F366 HydrophobicContact CB-CB 4.14Å; A362-F366 HydrophobicContact CB-CD1 4.4Å; A362-F366 HydrophobicContact CB-CD2 3.91Å; A362-F366 HydrophobicContact CB-CE2 4.39Å; A362-F366 HydrophobicContact CB-CG 3.9Å; A362-V729 HydrophobicContact CB-CG1 4.34Å
363	G	68.5	Low	72.1	Confident	12 Å²	12	85.2 Å²	85.2	12%	0.124	41%	0.41	C	S	.	.			trans	-95.2	178.2	177.7	0	0	0	0	0	112.8	R361 N365 F366 V729 G730 N731	R361-G363 PolarHBondContact O-N 3.06Å; G363-N365 VanDerWaalsContact C-N 3.26Å; G363-N365 PolarHBondContact O-N 2.98Å; G363-N365 VanDerWaalsContact O-N 3.17Å; G363-F366 VanDerWaalsContact O-CB 3.26Å; G363-F366 WeakPolarHBondContact O-CB 3.29Å; G363-F366 PolarHBondContact O-N 3.16Å; G363-V729 PolarHBondContact N-O 3.06Å; G363-G730 CarbonylContact C-O 3.6Å; G363-G730 VanDerWaalsContact C-O 3.27Å; G363-N731 VanDerWaalsContact CA-OD1 3.29Å; G363-N731 WeakPolarHBondContact CA-OD1 3.49Å
364	V	77.5	Confident	72.9	Confident	121 Å²	121	83.2 Å²	83.2	73%	0.733	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-31.7	-172.8	-68.4	0	0	0	0	114.8	G730	V364-G730 PolarHBondContact N-O 2.86Å
365	N	74.9	Confident	73.9	Confident	48 Å²	48	80 Å²	80	26%	0.257	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	10.6	-178.9	-62.7	-6.2	0	0	0	113.4	G363 E367 N368 Q369 D605 G730	G363-N365 VanDerWaalsContact C-N 3.26Å; G363-N365 PolarHBondContact O-N 2.98Å; G363-N365 VanDerWaalsContact O-N 3.17Å; N365-E367 PolarHBondContact O-N 3.26Å; N365-N368 WeakPolarHBondContact O-CB 3.42Å; N365-N368 PolarHBondContact O-N 3.27Å; N365-Q369 PolarHBondContact O-N 3.06Å; N365-D605 WeakPolarHBondContact CB-OD1 3.26Å; N365-D605 PolarHBondContact ND2-OD1 2.97Å; N365-G730 WeakPolarHBondContact CB-O 3.46Å; N365-G730 PolarHBondContact N-O 2.88Å
366	F	76.4	Confident	75.1	Confident	28 Å²	28	80.7 Å²	80.7	12%	0.123	39%	0.394	C	S	.	.	H	α-helix	trans	-57.3	-37.4	-176.6	-175.6	-101.2	0	0	0	112.6	A362 G363 N368 Q369 L370 V408 T410 V729	A362-F366 HydrophobicContact CB-CB 4.14Å; A362-F366 HydrophobicContact CB-CD1 4.4Å; A362-F366 HydrophobicContact CB-CD2 3.91Å; A362-F366 HydrophobicContact CB-CE2 4.39Å; A362-F366 HydrophobicContact CB-CG 3.9Å; G363-F366 VanDerWaalsContact O-CB 3.26Å; G363-F366 WeakPolarHBondContact O-CB 3.29Å; G363-F366 PolarHBondContact O-N 3.16Å; F366-N368 VanDerWaalsContact C-N 3.33Å; F366-N368 PolarHBondContact O-N 3.39Å; F366-Q369 WeakPolarHBondContact O-CB 3.31Å; F366-Q369 PolarHBondContact O-N 2.86Å; F366-L370 HydrophobicContact CD1-CD1 4.35Å; F366-L370 HydrophobicContact CE1-CD1 4.18Å; F366-L370 HydrophobicContact CE1-CD2 4.26Å; F366-L370 HydrophobicContact CE1-CG 4.33Å; F366-L370 PolarHBondContact O-N 3.22Å; F366-V408 HydrophobicContact CE1-CB 4.18Å; F366-V408 HydrophobicContact CE1-CG1 4.17Å; F366-T410 HydrophobicContact CE2-CG2 3.88Å; F366-T410 HydrophobicContact CZ-CG2 4.03Å; F366-V729 HydrophobicContact CD2-CG1 3.75Å; F366-V729 HydrophobicContact CE2-CG1 3.8Å
367	E	77.1	Confident	76.3	Confident	136 Å²	136	80.6 Å²	80.6	64%	0.636	39%	0.394	S	S	*	.	H	α-helix	trans	-65.5	-32.5	176.9	-63.2	-172	172.6	0	0	113.3	N365 Q369 L370	N365-E367 PolarHBondContact O-N 3.26Å; E367-Q369 VanDerWaalsContact C-N 3.3Å; E367-Q369 PolarHBondContact O-N 3.21Å; E367-L370 WeakPolarHBondContact O-CB 3.49Å; E367-L370 PolarHBondContact O-N 2.85Å; E367-L370 VanDerWaalsContact O-N 3.16Å
368	N	73.1	Confident	77.3	Confident	92 Å²	92	75 Å²	75	49%	0.492	39%	0.385	S	S	.	.	H	α-helix	trans	-66.2	-36.7	174.5	-67	-25.4	0	0	0	110.8	N365 F366 L370 R371	N365-N368 WeakPolarHBondContact O-CB 3.42Å; N365-N368 PolarHBondContact O-N 3.27Å; F366-N368 VanDerWaalsContact C-N 3.33Å; F366-N368 PolarHBondContact O-N 3.39Å; N368-L370 PolarHBondContact O-N 3.06Å; N368-R371 PolarHBondContact O-N 2.92Å; N368-R371 VanDerWaalsContact O-N 3.15Å
369	Q	70.7	Confident	78.6	Confident	30 Å²	30	76.6 Å²	76.6	14%	0.14	39%	0.391	C	S	.	.	H	α-helix	trans	-65.8	-26.1	175.1	-56.4	-163.2	-7	0	0	112.5	N365 F366 E367 R371 A372 V411 D605 G730	N365-Q369 PolarHBondContact O-N 3.06Å; F366-Q369 WeakPolarHBondContact O-CB 3.31Å; F366-Q369 PolarHBondContact O-N 2.86Å; E367-Q369 VanDerWaalsContact C-N 3.3Å; E367-Q369 PolarHBondContact O-N 3.21Å; Q369-R371 PolarHBondContact O-N 2.82Å; Q369-A372 PolarHBondContact O-N 2.83Å; Q369-V411 WeakPolarHBondContact O-CG2 3.25Å; Q369-D605 PolarHBondContact NE2-OD2 3.22Å; Q369-G730 VanDerWaalsContact NE2-N 3.13Å
370	L	77.4	Confident	79.7	Confident	46 Å²	46	80 Å²	80	24%	0.241	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-17.1	174.9	-63.6	177.3	0	0	0	113.6	F366 E367 N368 V408 V411	F366-L370 HydrophobicContact CD1-CD1 4.35Å; F366-L370 HydrophobicContact CE1-CD1 4.18Å; F366-L370 HydrophobicContact CE1-CD2 4.26Å; F366-L370 HydrophobicContact CE1-CG 4.33Å; F366-L370 PolarHBondContact O-N 3.22Å; E367-L370 WeakPolarHBondContact O-CB 3.49Å; E367-L370 PolarHBondContact O-N 2.85Å; E367-L370 VanDerWaalsContact O-N 3.16Å; N368-L370 PolarHBondContact O-N 3.06Å; L370-V408 HydrophobicContact CD1-CG1 4.18Å; L370-V411 HydrophobicContact CD2-CG2 4.43Å
371	R	79.3	Confident	81	Confident	201 Å²	201	80.3 Å²	80.3	76%	0.758	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	5.1	178.5	-57.5	-178.7	-174.5	-178.4	1.7	113.8	N368 Q369 K373	N368-R371 PolarHBondContact O-N 2.92Å; N368-R371 VanDerWaalsContact O-N 3.15Å; Q369-R371 PolarHBondContact O-N 2.82Å; R371-K373 PolarHBondContact O-N 3.03Å
372	A	79.9	Confident	82.2	Confident	35 Å²	35	74.3 Å²	74.3	29%	0.289	40%	0.399	S	S	.	.			trans	-63.9	128.4	-179.1	0	0	0	0	0	111.5	Q369 V374 V411 V596	Q369-A372 PolarHBondContact O-N 2.83Å; A372-V374 PolarHBondContact O-N 2.91Å; A372-V411 HydrophobicContact CB-CG2 4.4Å; A372-V596 HydrophobicContact CB-CG1 4.09Å
373	K	85.6	Confident	83.3	Confident	139 Å²	139	78.9 Å²	78.9	60%	0.604	41%	0.41	S	S	*	.			trans	-58.3	136.8	172.9	-171	-169.6	179.7	-162.1	0	109.8	R371 E375 G597	R371-K373 PolarHBondContact O-N 3.03Å; K373-E375 HydrophobicContact CD-CG 4.44Å; K373-E375 IonicContact NZ-OE1 3.3Å; K373-E375 PolarHBondContact NZ-OE1 2.82Å; K373-G597 PolarHBondContact O-N 3.46Å
374	V	89.5	Confident	84.5	Confident	23 Å²	23	80.4 Å²	80.4	14%	0.139	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.7	170.9	-172	0	0	0	0	108.9	A372 V411 Y415 Q594 I595 V596	A372-V374 PolarHBondContact O-N 2.91Å; V374-V411 HydrophobicContact CG2-CG1 3.23Å; V374-Y415 HydrophobicContact CB-CD1 4.2Å; V374-Y415 HydrophobicContact CB-CE1 3.93Å; V374-Y415 HydrophobicContact CB-CE2 4.3Å; V374-Y415 HydrophobicContact CB-CG 4.49Å; V374-Y415 HydrophobicContact CG1-CD1 3.84Å; V374-Y415 HydrophobicContact CG1-CE1 4.05Å; V374-Y415 HydrophobicContact CG1-CG 4.1Å; V374-Y415 HydrophobicContact CG2-CD1 4.38Å; V374-Y415 HydrophobicContact CG2-CD2 3.86Å; V374-Y415 HydrophobicContact CG2-CE1 4.17Å; V374-Y415 HydrophobicContact CG2-CE2 3.63Å; V374-Y415 HydrophobicContact CG2-CG 4.23Å; V374-Q594 HydrophobicContact CG1-CB 4.45Å; V374-Q594 HydrophobicContact CG1-CG 4.49Å; V374-I595 CarbonylContact C-O 3.5Å; V374-I595 VanDerWaalsContact CA-O 3.32Å; V374-I595 WeakPolarHBondContact CA-O 3.44Å; V374-V596 HydrophobicContact CG1-CG2 4.22Å; V374-V596 HydrophobicContact CG2-CG2 4.11Å
375	E	91.4	Very high	85.3	Confident	84 Å²	84	75 Å²	75	39%	0.393	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.7	167.9	-56.1	-167.5	163.9	0	0	108.3	K373 Q594 I595	K373-E375 HydrophobicContact CD-CG 4.44Å; K373-E375 IonicContact NZ-OE1 3.3Å; K373-E375 PolarHBondContact NZ-OE1 2.82Å; E375-Q594 WeakPolarHBondContact O-CA 3.29Å; E375-I595 HydrophobicContact CB-CB 4.32Å; E375-I595 PolarHBondContact N-O 2.94Å; E375-I595 PolarHBondContact O-N 3.13Å
376	T	92.7	Very high	86	Confident	59 Å²	59	77.9 Å²	77.9	36%	0.362	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130.4	-180	-57.9	0	0	0	0	109.4	C381 I592 F593 Q594	T376-C381 HydrophobicContact CG2-CB 4.08Å; T376-I592 HydrophobicContact CG2-CG2 4.11Å; T376-F593 WeakPolarHBondContact CA-O 3.39Å; T376-Q594 HydrophobicContact CG2-CG 4.04Å
377	I	91.8	Very high	86.8	Confident	31 Å²	31	78.4 Å²	78.4	16%	0.159	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.5	177.5	-64.9	163.7	0	0	0	107.3	F7 F593	F7-I377 HydrophobicContact CD2-CG2 4.1Å; F7-I377 HydrophobicContact CE2-CG2 4.1Å; I377-F593 HydrophobicContact CB-CB 4.24Å; I377-F593 HydrophobicContact CB-CD1 4.31Å; I377-F593 HydrophobicContact CD1-CD1 3.82Å; I377-F593 HydrophobicContact CD1-CE1 4.18Å; I377-F593 PolarHBondContact N-O 2.75Å; I377-F593 PolarHBondContact O-N 3.13Å
378	G	89	Confident	87.5	Confident	40 Å²	40	72.3 Å²	72.3	41%	0.412	37%	0.374	S	S	.	.	S	Bend	trans	148	163.6	-178.6	0	0	0	0	0	111.7
379	Q	88.7	Confident	88.4	Confident	146 Å²	146	77.9 Å²	77.9	68%	0.682	39%	0.389	S	S	*	.	S	Bend	trans	-96.3	145.3	177.1	-67.2	177.9	-8	0	0	110.7	C381 R424 I592	Q379-C381 VanDerWaalsContact C-N 3.32Å; Q379-C381 PolarHBondContact O-N 3.25Å; Q379-R424 PolarHBondContact O-NH1 2.82Å; Q379-R424 VanDerWaalsContact O-NH1 3.13Å; Q379-R424 PolarHBondContact O-NH2 3.45Å; Q379-I592 WeakPolarHBondContact O-CD1 3.5Å
380	D	89.9	Confident	89.4	Confident	145 Å²	145	81.5 Å²	81.5	78%	0.775	41%	0.405	S	S	*	.	S	Bend	trans	49	48.9	178	-54.8	-34.5	0	0	0	113.2	R424	D380-R424 PolarHBondContact O-NH1 3.09Å
381	C	90.5	Very high	90	Very high	40 Å²	40	80 Å²	80	27%	0.27	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-68.8	129.5	174.6	-174	0	0	0	0	109.7	T376 Q379 I592	T376-C381 HydrophobicContact CG2-CB 4.08Å; Q379-C381 VanDerWaalsContact C-N 3.32Å; Q379-C381 PolarHBondContact O-N 3.25Å; C381-I592 HydrophobicContact CB-CD1 4.01Å
382	P	92.9	Very high	90.5	Very high	40 Å²	40	76.4 Å²	76.4	26%	0.26	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-57.8	145.9	169.4	-25.1	35.3	0	0	0	112.2	P418 A422	P382-P418 HydrophobicContact CB-CB 3.88Å; P382-A422 HydrophobicContact CG-CB 3.78Å
383	E	93	Very high	91.1	Very high	161 Å²	161	75.2 Å²	75.2	75%	0.752	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-59.4	146.1	173.1	-65.7	-61	154.7	0	0	111.6	P418	E383-P418 WeakPolarHBondContact O-CB 3.33Å; E383-P418 WeakPolarHBondContact O-CG 3.38Å
384	P	93.2	Very high	91.4	Very high	43 Å²	43	71.8 Å²	71.8	28%	0.279	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-67	144.5	176.5	29.4	-34.3	0	0	0	111.1	R414 Y415	P384-R414 WeakPolarHBondContact CA-O 3.27Å; P384-Y415 HydrophobicContact CB-CD1 4.03Å; P384-Y415 HydrophobicContact CB-CD2 4.01Å; P384-Y415 HydrophobicContact CB-CE1 4.14Å; P384-Y415 HydrophobicContact CB-CE2 4.11Å; P384-Y415 HydrophobicContact CB-CG 3.98Å; P384-Y415 HydrophobicContact CG-CD1 4.46Å; P384-Y415 HydrophobicContact CG-CE1 4.15Å
385	M	93.9	Very high	91.5	Very high	7 Å²	7	76.9 Å²	76.9	3%	0.034	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-86.2	143.2	171.5	66.9	176.9	-154.8	0	0	110.9	F388 E390 A391 P409 R414 I417 P418	M385-F388 HydrophobicContact CE-CD1 3.83Å; M385-F388 HydrophobicContact CE-CE1 4.08Å; M385-E390 WeakPolarHBondContact CA-OE2 3.49Å; M385-E390 HydrophobicContact CB-CB 4.12Å; M385-A391 HydrophobicContact SD-CB 3.8Å; M385-P409 HydrophobicContact CE-CB 3.71Å; M385-P409 HydrophobicContact CE-CG 4.11Å; M385-R414 PolarHBondContact N-O 3.1Å; M385-R414 WeakPolarHBondContact O-CA 3.41Å; M385-R414 WeakPolarHBondContact O-CB 3.39Å; M385-R414 WeakPolarHBondContact O-CG 3.42Å; M385-I417 HydrophobicContact CE-CB 3.98Å; M385-I417 HydrophobicContact CE-CD1 3.67Å; M385-I417 HydrophobicContact CE-CG1 4.36Å; M385-I417 HydrophobicContact CE-CG2 4.1Å; M385-I417 HydrophobicContact SD-CB 4.02Å; M385-I417 HydrophobicContact SD-CG2 3.74Å; M385-P418 HydrophobicContact CB-CG 4.03Å; M385-P418 HydrophobicContact CG-CG 4.01Å
386	E	90	Very high	91.4	Very high	110 Å²	110	75 Å²	75	51%	0.514	39%	0.385	S	S	.	.	S	Bend	trans	-88.8	-30.5	174.1	-76.4	-61.7	116.7	0	0	112.2	E390 P409 R414	E386-E390 PolarHBondContact N-OE2 3.41Å; E386-P409 WeakPolarHBondContact O-CG 3.33Å; E386-R414 IonicContact OE1-CZ 2.8Å; E386-R414 IonicContact OE1-NH1 3.92Å; E386-R414 PolarHBondContact OE1-NH1 2.75Å; E386-R414 IonicContact OE2-CZ 3.79Å; E386-R414 IonicContact OE2-NH1 3.53Å; E386-R414 PolarHBondContact OE2-NH1 2.66Å; E386-R414 IonicContact OE2-NH2 3.89Å
387	S	92.7	Very high	91.3	Very high	38 Å²	38	72.4 Å²	72.4	27%	0.266	37%	0.368	S	S	.	.	S	Bend	trans	-136.5	153.5	-179.3	79.1	0	0	0	0	113.7	R389 E390	S387-R389 PolarHBondContact O-N 3.35Å; S387-R389 PolarHBondContact OG-N 2.93Å; S387-E390 VanDerWaalsContact CB-OE1 3.25Å; S387-E390 WeakPolarHBondContact CB-OE1 3.36Å; S387-E390 PolarHBondContact N-OE1 3.06Å; S387-E390 PolarHBondContact O-N 2.89Å; S387-E390 VanDerWaalsContact O-N 3.08Å; S387-E390 PolarHBondContact OG-OE1 2.79Å
388	F	92.1	Very high	91.3	Very high	9 Å²	9	72.9 Å²	72.9	4%	0.039	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-14.8	173	-69	-66.2	0	0	0	114.1	M385 F393 M398 L401 I406 P409 I417 L442	M385-F388 HydrophobicContact CE-CD1 3.83Å; M385-F388 HydrophobicContact CE-CE1 4.08Å; F388-F393 HydrophobicContact CD1-CE2 4.21Å; F388-M398 HydrophobicContact CB-CE 4.21Å; F388-M398 HydrophobicContact CB-SD 4.33Å; F388-L401 HydrophobicContact CB-CD1 4.25Å; F388-L401 HydrophobicContact CD1-CD1 4.08Å; F388-L401 HydrophobicContact CD2-CD1 4.45Å; F388-L401 HydrophobicContact CG-CD1 4.03Å; F388-I406 HydrophobicContact CE2-CG2 3.74Å; F388-I406 HydrophobicContact CZ-CG2 3.94Å; F388-P409 HydrophobicContact CD1-CB 4.4Å; F388-P409 HydrophobicContact CD2-CB 4.45Å; F388-P409 HydrophobicContact CE1-CB 3.94Å; F388-P409 HydrophobicContact CE2-CB 3.99Å; F388-P409 HydrophobicContact CZ-CB 3.72Å; F388-I417 HydrophobicContact CE1-CD1 4.07Å; F388-L442 HydrophobicContact CD1-CD1 4.47Å; F388-L442 HydrophobicContact CE1-CD1 3.95Å
389	R	91.6	Very high	91.4	Very high	209 Å²	209	74.5 Å²	74.5	79%	0.789	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-31.9	176.1	-65.8	-178.5	177.7	173.9	1.4	112.1	S387 A391 N392 M398	S387-R389 PolarHBondContact O-N 3.35Å; S387-R389 PolarHBondContact OG-N 2.93Å; R389-A391 VanDerWaalsContact C-N 3.31Å; R389-A391 PolarHBondContact O-N 2.89Å; R389-N392 PolarHBondContact O-N 2.84Å; R389-N392 VanDerWaalsContact O-N 3.14Å; R389-M398 HydrophobicContact CG-CE 3.91Å
390	E	91.6	Very high	91.3	Very high	106 Å²	106	68.2 Å²	68.2	50%	0.495	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-29.9	177.5	-70.1	139.2	-115.3	0	0	112.2	M385 E386 S387 N392	M385-E390 WeakPolarHBondContact CA-OE2 3.49Å; M385-E390 HydrophobicContact CB-CB 4.12Å; E386-E390 PolarHBondContact N-OE2 3.41Å; S387-E390 VanDerWaalsContact CB-OE1 3.25Å; S387-E390 WeakPolarHBondContact CB-OE1 3.36Å; S387-E390 PolarHBondContact N-OE1 3.06Å; S387-E390 PolarHBondContact O-N 2.89Å; S387-E390 VanDerWaalsContact O-N 3.08Å; S387-E390 PolarHBondContact OG-OE1 2.79Å; E390-N392 PolarHBondContact O-N 2.95Å; E390-N392 VanDerWaalsContact O-N 3.14Å
391	A	89.7	Confident	91.2	Very high	15 Å²	15	61.6 Å²	61.6	12%	0.124	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.9	171.5	0	0	0	0	0	113.7	M385 R389 F393 I417	M385-A391 HydrophobicContact SD-CB 3.8Å; R389-A391 VanDerWaalsContact C-N 3.31Å; R389-A391 PolarHBondContact O-N 2.89Å; A391-F393 HydrophobicContact CB-CD1 4.11Å; A391-F393 HydrophobicContact CB-CD2 3.88Å; A391-F393 HydrophobicContact CB-CE1 3.93Å; A391-F393 HydrophobicContact CB-CE2 3.68Å; A391-F393 HydrophobicContact CB-CG 4.11Å; A391-F393 HydrophobicContact CB-CZ 3.72Å; A391-F393 PolarHBondContact O-N 3.18Å; A391-F393 VanDerWaalsContact O-N 3.16Å; A391-I417 HydrophobicContact CB-CG2 3.96Å
392	N	90.1	Very high	91.1	Very high	125 Å²	125	67.3 Å²	67.3	67%	0.668	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	39.8	177.6	-171	28.8	0	0	0	112.8	R389 E390 K450	R389-N392 PolarHBondContact O-N 2.84Å; R389-N392 VanDerWaalsContact O-N 3.14Å; E390-N392 PolarHBondContact O-N 2.95Å; E390-N392 VanDerWaalsContact O-N 3.14Å; N392-K450 WeakPolarHBondContact O-CE 3.32Å; N392-K450 PolarHBondContact O-NZ 3.38Å
393	F	92.5	Very high	90.7	Very high	10 Å²	10	71 Å²	71	4%	0.044	33%	0.334	C	S	.	.			trans	-64.9	153.5	178.4	-65.6	-43.1	0	0	0	111.8	F388 A391 I397 M398 L401 I417 L442 P443 D446	F388-F393 HydrophobicContact CD1-CE2 4.21Å; A391-F393 HydrophobicContact CB-CD1 4.11Å; A391-F393 HydrophobicContact CB-CD2 3.88Å; A391-F393 HydrophobicContact CB-CE1 3.93Å; A391-F393 HydrophobicContact CB-CE2 3.68Å; A391-F393 HydrophobicContact CB-CG 4.11Å; A391-F393 HydrophobicContact CB-CZ 3.72Å; A391-F393 PolarHBondContact O-N 3.18Å; A391-F393 VanDerWaalsContact O-N 3.16Å; F393-I397 HydrophobicContact CB-CB 4.28Å; F393-I397 HydrophobicContact CB-CG2 4.2Å; F393-I397 HydrophobicContact CD2-CG2 4.29Å; F393-I397 HydrophobicContact CG-CG2 4.37Å; F393-M398 HydrophobicContact CB-CG 4.17Å; F393-M398 HydrophobicContact CB-SD 4.04Å; F393-M398 HydrophobicContact CD2-SD 4.25Å; F393-L401 HydrophobicContact CD2-CD1 4.42Å; F393-I417 HydrophobicContact CE1-CG2 4.24Å; F393-I417 HydrophobicContact CE2-CD1 4.47Å; F393-I417 HydrophobicContact CE2-CG2 4.41Å; F393-I417 HydrophobicContact CZ-CD1 4.24Å; F393-I417 HydrophobicContact CZ-CG2 3.59Å; F393-L442 HydrophobicContact CE1-CB 4.32Å; F393-L442 HydrophobicContact CE2-CB 3.85Å; F393-L442 HydrophobicContact CE2-CD1 4.05Å; F393-L442 HydrophobicContact CZ-CB 3.63Å; F393-P443 HydrophobicContact CE1-CG 4.26Å; F393-P443 HydrophobicContact CZ-CG 4.34Å; F393-D446 WeakPolarHBondContact CA-OD1 3.38Å; F393-D446 HydrophobicContact CD1-CB 3.69Å; F393-D446 HydrophobicContact CE1-CB 4.21Å
394	H	92.3	Very high	90	Very high	67 Å²	67	64 Å²	64	31%	0.31	30%	0.304	S	S	.	.			trans	-56.1	143	175.3	-172.1	-86.3	0	0	0	111.8	L396 I397 M398 D446 V449 K450	H394-L396 VanDerWaalsContact C-N 3.28Å; H394-L396 PolarHBondContact ND1-N 2.67Å; H394-L396 PolarHBondContact O-N 2.75Å; H394-L396 VanDerWaalsContact O-N 3.11Å; H394-I397 WeakPolarHBondContact O-CB 3.36Å; H394-I397 PolarHBondContact O-N 2.89Å; H394-M398 PolarHBondContact O-N 2.96Å; H394-D446 PolarHBondContact N-OD1 3.44Å; H394-V449 HydrophobicContact CB-CG1 4.15Å; H394-V449 WeakPolarHBondContact ND1-CG1 3.45Å; H394-K450 HydrophobicContact CB-CG 4.29Å
395	E	91.7	Very high	89.5	Confident	129 Å²	129	66.2 Å²	66.2	60%	0.603	31%	0.313	S	S	*	.	H	α-helix	trans	-50.7	-43.8	-172.5	-167	64.3	-143.2	0	0	113	I397 M398 E399	E395-I397 PolarHBondContact O-N 2.69Å; E395-I397 VanDerWaalsContact O-N 3.16Å; E395-M398 CarbonylContact O-C 3.15Å; E395-M398 PolarHBondContact O-N 3.44Å; E395-M398 VanDerWaalsContact O-N 3.08Å; E395-E399 WeakPolarHBondContact O-CB 3.45Å; E395-E399 PolarHBondContact O-N 3.05Å
396	L	89.6	Confident	89	Confident	46 Å²	46	69 Å²	69	24%	0.241	33%	0.327	C	S	.	.	H	α-helix	trans	-54.2	-33.8	175.8	-65.5	173.7	0	0	0	114.2	H394 H400 V449 T486	H394-L396 VanDerWaalsContact C-N 3.28Å; H394-L396 PolarHBondContact ND1-N 2.67Å; H394-L396 PolarHBondContact O-N 2.75Å; H394-L396 VanDerWaalsContact O-N 3.11Å; L396-H400 PolarHBondContact O-N 2.7Å; L396-H400 PolarHBondContact O-ND1 3.47Å; L396-H400 VanDerWaalsContact O-ND1 3.09Å; L396-V449 HydrophobicContact CD1-CG1 4.36Å; L396-T486 HydrophobicContact CD1-CG2 4.14Å
397	I	91.3	Very high	88.7	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.015	33%	0.332	C	S	.	.	H	α-helix	trans	-78.5	-42.7	178.1	-63	174.5	0	0	0	109.7	F393 H394 E395 E399 H400 L401 L442 L445 D446 F482	F393-I397 HydrophobicContact CB-CB 4.28Å; F393-I397 HydrophobicContact CB-CG2 4.2Å; F393-I397 HydrophobicContact CD2-CG2 4.29Å; F393-I397 HydrophobicContact CG-CG2 4.37Å; H394-I397 WeakPolarHBondContact O-CB 3.36Å; H394-I397 PolarHBondContact O-N 2.89Å; E395-I397 PolarHBondContact O-N 2.69Å; E395-I397 VanDerWaalsContact O-N 3.16Å; I397-E399 VanDerWaalsContact C-N 3.34Å; I397-E399 PolarHBondContact O-N 3.47Å; I397-H400 PolarHBondContact O-N 3.02Å; I397-H400 VanDerWaalsContact O-N 3.15Å; I397-L401 HydrophobicContact CG2-CD1 4.31Å; I397-L401 WeakPolarHBondContact O-CG 3.42Å; I397-L401 PolarHBondContact O-N 3.47Å; I397-L442 HydrophobicContact CG2-CD2 3.89Å; I397-L445 HydrophobicContact CD1-CB 3.86Å; I397-D446 HydrophobicContact CD1-CB 3.66Å; I397-D446 VanDerWaalsContact CD1-N 3.25Å; I397-F482 HydrophobicContact CG2-CD1 4.37Å; I397-F482 HydrophobicContact CG2-CE1 4.12Å
398	M	91.6	Very high	88.4	Confident	42 Å²	42	70.4 Å²	70.4	21%	0.207	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-40.9	175.5	-65.7	-59.6	-68.3	0	0	112	F388 R389 F393 H394 E395 L401 K402	F388-M398 HydrophobicContact CB-CE 4.21Å; F388-M398 HydrophobicContact CB-SD 4.33Å; R389-M398 HydrophobicContact CG-CE 3.91Å; F393-M398 HydrophobicContact CB-CG 4.17Å; F393-M398 HydrophobicContact CB-SD 4.04Å; F393-M398 HydrophobicContact CD2-SD 4.25Å; H394-M398 PolarHBondContact O-N 2.96Å; E395-M398 CarbonylContact O-C 3.15Å; E395-M398 PolarHBondContact O-N 3.44Å; E395-M398 VanDerWaalsContact O-N 3.08Å; M398-L401 PolarHBondContact O-N 2.77Å; M398-L401 HydrophobicContact SD-CD1 4.23Å; M398-K402 WeakPolarHBondContact O-CB 3.45Å; M398-K402 PolarHBondContact O-N 2.96Å
399	E	89.8	Confident	88.3	Confident	74 Å²	74	70 Å²	70	35%	0.346	34%	0.336	S	S	.	.	H	α-helix	trans	-59.7	-45.1	170.6	-81.6	-164.4	-152.7	0	0	112	E395 I397 K402 K403	E395-E399 WeakPolarHBondContact O-CB 3.45Å; E395-E399 PolarHBondContact O-N 3.05Å; I397-E399 VanDerWaalsContact C-N 3.34Å; I397-E399 PolarHBondContact O-N 3.47Å; E399-K402 PolarHBondContact O-N 3.29Å; E399-K403 WeakPolarHBondContact O-CB 3.25Å; E399-K403 WeakPolarHBondContact O-CD 3.45Å; E399-K403 WeakPolarHBondContact O-CG 3.21Å; E399-K403 PolarHBondContact O-N 2.83Å; E399-K403 WeakPolarHBondContact OE2-CE 3.42Å; E399-K403 IonicContact OE2-NZ 3.52Å; E399-K403 PolarHBondContact OE2-NZ 2.78Å
400	H	87	Confident	88.2	Confident	13 Å²	13	60.9 Å²	60.9	6%	0.06	30%	0.304	C	S	.	.	H	α-helix	trans	-68.5	-37.4	179.4	-79.1	140.9	0	0	0	113.3	L396 I397 K402 K403 S404 F482	L396-H400 PolarHBondContact O-N 2.7Å; L396-H400 PolarHBondContact O-ND1 3.47Å; L396-H400 VanDerWaalsContact O-ND1 3.09Å; I397-H400 PolarHBondContact O-N 3.02Å; I397-H400 VanDerWaalsContact O-N 3.15Å; H400-K402 VanDerWaalsContact C-N 3.35Å; H400-K403 PolarHBondContact O-N 2.99Å; H400-S404 WeakPolarHBondContact O-CB 3.37Å; H400-S404 PolarHBondContact O-N 2.9Å; H400-S404 PolarHBondContact O-OG 3.42Å; H400-F482 HydrophobicContact CB-CD1 3.52Å; H400-F482 HydrophobicContact CB-CE1 3.45Å; H400-F482 VanDerWaalsContact CB-CE1 3.45Å; H400-F482 HydrophobicContact CB-CG 4.46Å; H400-F482 HydrophobicContact CB-CZ 4.34Å; H400-F482 PolarHBondContact CE1-O 3.27Å; H400-F482 VanDerWaalsContact CE1-O 3.32Å; H400-F482 PolarHBondContact ND1-O 2.89Å
401	L	88.3	Confident	88.2	Confident	6 Å²	6	56.4 Å²	56.4	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-59.4	-47.3	171.5	-70.5	171.5	0	0	0	110.6	F388 F393 I397 M398 S404 D405 I406 L442 F482	F388-L401 HydrophobicContact CB-CD1 4.25Å; F388-L401 HydrophobicContact CD1-CD1 4.08Å; F388-L401 HydrophobicContact CD2-CD1 4.45Å; F388-L401 HydrophobicContact CG-CD1 4.03Å; F393-L401 HydrophobicContact CD2-CD1 4.42Å; I397-L401 HydrophobicContact CG2-CD1 4.31Å; I397-L401 WeakPolarHBondContact O-CG 3.42Å; I397-L401 PolarHBondContact O-N 3.47Å; M398-L401 PolarHBondContact O-N 2.77Å; M398-L401 HydrophobicContact SD-CD1 4.23Å; L401-S404 CarbonylContact O-C 3.58Å; L401-S404 PolarHBondContact O-N 3.09Å; L401-S404 VanDerWaalsContact O-N 3.14Å; L401-D405 PolarHBondContact O-N 3.46Å; L401-I406 HydrophobicContact CD2-CB 4.11Å; L401-I406 HydrophobicContact CD2-CD1 4.39Å; L401-I406 HydrophobicContact CD2-CG2 3.93Å; L401-I406 PolarHBondContact O-N 3.48Å; L401-L442 HydrophobicContact CD1-CD1 4.39Å; L401-L442 HydrophobicContact CD2-CD1 4.06Å; L401-L442 HydrophobicContact CD2-CD2 4.12Å; L401-F482 HydrophobicContact CD2-CE1 4.42Å; L401-F482 HydrophobicContact CD2-CZ 4.09Å; L401-F482 HydrophobicContact CG-CE1 4.38Å
402	K	87.7	Confident	88.3	Confident	161 Å²	161	55.7 Å²	55.7	70%	0.7	28%	0.278	S	S	*	.	H	α-helix	trans	-63.7	-42.7	176.3	-173.6	-178.1	178.6	-174.3	0	113.2	M398 E399 H400 S404 D405	M398-K402 WeakPolarHBondContact O-CB 3.45Å; M398-K402 PolarHBondContact O-N 2.96Å; E399-K402 PolarHBondContact O-N 3.29Å; H400-K402 VanDerWaalsContact C-N 3.35Å; K402-S404 PolarHBondContact O-N 3Å; K402-D405 PolarHBondContact O-N 3.26Å
403	K	85.2	Confident	88.5	Confident	116 Å²	116	50.3 Å²	50.3	50%	0.504	25%	0.249	S	C	.	.	H	α-helix	trans	-65.2	-16.8	175.1	-72.5	164.1	-172.5	165.8	0	112.6	E399 H400	E399-K403 WeakPolarHBondContact O-CB 3.25Å; E399-K403 WeakPolarHBondContact O-CD 3.45Å; E399-K403 WeakPolarHBondContact O-CG 3.21Å; E399-K403 PolarHBondContact O-N 2.83Å; E399-K403 WeakPolarHBondContact OE2-CE 3.42Å; E399-K403 IonicContact OE2-NZ 3.52Å; E399-K403 PolarHBondContact OE2-NZ 2.78Å; H400-K403 PolarHBondContact O-N 2.99Å
404	S	78.7	Confident	88.6	Confident	16 Å²	16	51.7 Å²	51.7	11%	0.112	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	12.2	-179.7	-49.4	0	0	0	0	113.2	H359 H400 L401 K402 I406	H359-S404 PolarHBondContact CE1-O 3.49Å; H359-S404 PolarHBondContact NE2-O 3.1Å; H359-S404 VanDerWaalsContact NE2-O 3.1Å; H400-S404 WeakPolarHBondContact O-CB 3.37Å; H400-S404 PolarHBondContact O-N 2.9Å; H400-S404 PolarHBondContact O-OG 3.42Å; L401-S404 CarbonylContact O-C 3.58Å; L401-S404 PolarHBondContact O-N 3.09Å; L401-S404 VanDerWaalsContact O-N 3.14Å; K402-S404 PolarHBondContact O-N 3Å; S404-I406 PolarHBondContact O-N 3.39Å
405	D	82.2	Confident	88.7	Confident	89 Å²	89	52.1 Å²	52.1	48%	0.476	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	14.1	-175.7	-57.6	-38.1	0	0	0	114.9	R361 L401 K402 N407	R361-D405 IonicContact CZ-OD2 2.63Å; R361-D405 IonicContact NE-OD2 3.65Å; R361-D405 IonicContact NH2-OD2 3.47Å; R361-D405 PolarHBondContact NH2-OD2 2.88Å; L401-D405 PolarHBondContact O-N 3.46Å; K402-D405 PolarHBondContact O-N 3.26Å; D405-N407 PolarHBondContact O-N 3.17Å; D405-N407 VanDerWaalsContact O-N 3.1Å; D405-N407 PolarHBondContact O-ND2 3.44Å; D405-N407 VanDerWaalsContact O-ND2 3.15Å
406	I	82.9	Confident	88.9	Confident	64 Å²	64	46 Å²	46	33%	0.328	22%	0.224	S	C	.	.			trans	-85.8	83.4	-179.9	-59.1	168	0	0	0	109	F388 L401 S404	F388-I406 HydrophobicContact CE2-CG2 3.74Å; F388-I406 HydrophobicContact CZ-CG2 3.94Å; L401-I406 HydrophobicContact CD2-CB 4.11Å; L401-I406 HydrophobicContact CD2-CD1 4.39Å; L401-I406 HydrophobicContact CD2-CG2 3.93Å; L401-I406 PolarHBondContact O-N 3.48Å; S404-I406 PolarHBondContact O-N 3.39Å
407	N	83.8	Confident	89.2	Confident	113 Å²	113	43.8 Å²	43.8	60%	0.604	21%	0.213	S	C	*	.			trans	-95.1	-30.7	-173.4	-65.8	-64.3	0	0	0	114.4	D405	D405-N407 PolarHBondContact O-N 3.17Å; D405-N407 VanDerWaalsContact O-N 3.1Å; D405-N407 PolarHBondContact O-ND2 3.44Å; D405-N407 VanDerWaalsContact O-ND2 3.15Å
408	V	87.2	Confident	89.4	Confident	66 Å²	66	44.8 Å²	44.8	40%	0.4	22%	0.219	S	C	.	.	S	Bend	trans	-120.6	127.8	-173.8	-179.6	0	0	0	0	109.9	F366 L370	F366-V408 HydrophobicContact CE1-CB 4.18Å; F366-V408 HydrophobicContact CE1-CG1 4.17Å; L370-V408 HydrophobicContact CD1-CG1 4.18Å
409	P	90.4	Very high	89.7	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.006	21%	0.209	C	C	.	.			trans	-70.4	137.3	176.1	28.1	-34.2	0	0	0	111.6	M385 E386 F388 Q413 R414	M385-P409 HydrophobicContact CE-CB 3.71Å; M385-P409 HydrophobicContact CE-CG 4.11Å; E386-P409 WeakPolarHBondContact O-CG 3.33Å; F388-P409 HydrophobicContact CD1-CB 4.4Å; F388-P409 HydrophobicContact CD2-CB 4.45Å; F388-P409 HydrophobicContact CE1-CB 3.94Å; F388-P409 HydrophobicContact CE2-CB 3.99Å; F388-P409 HydrophobicContact CZ-CB 3.72Å; P409-Q413 HydrophobicContact CB-CB 3.97Å; P409-R414 HydrophobicContact CB-CG 3.92Å; P409-R414 HydrophobicContact CG-CG 3.74Å; P409-R414 PolarHBondContact O-NE 2.73Å
410	T	89	Confident	90	Very high	17 Å²	17	39.4 Å²	39.4	10%	0.104	19%	0.194	C	C	.	.			trans	-68	162.6	170.6	71.5	0	0	0	0	111	F366 I412 Q413 R414 S434	F366-T410 HydrophobicContact CE2-CG2 3.88Å; F366-T410 HydrophobicContact CZ-CG2 4.03Å; T410-I412 PolarHBondContact O-N 2.89Å; T410-Q413 CarbonylContact O-C 3.49Å; T410-Q413 WeakPolarHBondContact O-CA 3.4Å; T410-Q413 WeakPolarHBondContact O-CB 3.47Å; T410-Q413 PolarHBondContact O-N 3.23Å; T410-Q413 VanDerWaalsContact OG1-CG 3.32Å; T410-Q413 WeakPolarHBondContact OG1-CG 3.21Å; T410-R414 WeakPolarHBondContact O-CG 3.38Å; T410-R414 PolarHBondContact O-N 3.16Å; T410-S434 VanDerWaalsContact CB-O 3.3Å; T410-S434 WeakPolarHBondContact CB-O 3.25Å; T410-S434 PolarHBondContact OG1-O 2.95Å
411	V	91.2	Very high	90.4	Very high	11 Å²	11	42.1 Å²	42.1	7%	0.067	21%	0.212	C	C	.	.	H	α-helix	trans	-52.1	-49.4	-178.4	-178.3	0	0	0	0	112.5	Q369 L370 A372 V374 Q413 R414 Y415 V596	Q369-V411 WeakPolarHBondContact O-CG2 3.25Å; L370-V411 HydrophobicContact CD2-CG2 4.43Å; A372-V411 HydrophobicContact CB-CG2 4.4Å; V374-V411 HydrophobicContact CG2-CG1 3.23Å; V411-Q413 PolarHBondContact O-N 3.17Å; V411-R414 WeakPolarHBondContact O-CB 3.41Å; V411-R414 PolarHBondContact O-N 2.69Å; V411-Y415 HydrophobicContact CG1-CD2 4.06Å; V411-Y415 HydrophobicContact CG1-CE2 4.09Å; V411-Y415 WeakPolarHBondContact O-CD2 3.16Å; V411-Y415 PolarHBondContact O-N 2.86Å; V411-Y415 VanDerWaalsContact O-N 3.17Å; V411-V596 HydrophobicContact CB-CG1 4.1Å; V411-V596 HydrophobicContact CG1-CG1 3.85Å; V411-V596 HydrophobicContact CG1-CG2 4.38Å
412	I	91.3	Very high	90.6	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-26.2	178.3	-166.8	68	0	0	0	112.8	T410 G416 Y426 A428 A430 S434 K436 V439 V596	T410-I412 PolarHBondContact O-N 2.89Å; I412-G416 WeakPolarHBondContact O-CA 3.33Å; I412-G416 PolarHBondContact O-N 3.01Å; I412-Y426 WeakPolarHBondContact CD1-OH 3.45Å; I412-A428 HydrophobicContact CD1-CB 3.99Å; I412-A430 HydrophobicContact CB-CB 4.5Å; I412-A430 HydrophobicContact CD1-CB 4.24Å; I412-A430 HydrophobicContact CG1-CB 4.31Å; I412-S434 VanDerWaalsContact CG2-O 3.25Å; I412-S434 WeakPolarHBondContact CG2-O 3.39Å; I412-K436 HydrophobicContact CG1-CG 4.46Å; I412-K436 HydrophobicContact CG2-CG 4.45Å; I412-V439 HydrophobicContact CG1-CG2 4.11Å; I412-V439 HydrophobicContact CG2-CG2 4.05Å; I412-V596 HydrophobicContact CB-CG2 4.14Å; I412-V596 HydrophobicContact CD1-CG2 3.5Å; I412-V596 HydrophobicContact CG1-CG2 4.4Å
413	Q	94.4	Very high	90.9	Very high	12 Å²	12	39 Å²	39	6%	0.056	22%	0.22	C	C	.	.	H	α-helix	trans	-75.3	-42.4	173.7	-66.5	163.3	3.8	0	0	111.6	P409 T410 V411 Y415 I417 G435 A438 V439	P409-Q413 HydrophobicContact CB-CB 3.97Å; T410-Q413 CarbonylContact O-C 3.49Å; T410-Q413 WeakPolarHBondContact O-CA 3.4Å; T410-Q413 WeakPolarHBondContact O-CB 3.47Å; T410-Q413 PolarHBondContact O-N 3.23Å; T410-Q413 VanDerWaalsContact OG1-CG 3.32Å; T410-Q413 WeakPolarHBondContact OG1-CG 3.21Å; V411-Q413 PolarHBondContact O-N 3.17Å; Q413-Y415 PolarHBondContact O-N 3.28Å; Q413-I417 HydrophobicContact CB-CD1 3.95Å; Q413-I417 HydrophobicContact CG-CD1 4.39Å; Q413-I417 VanDerWaalsContact O-CB 3.25Å; Q413-I417 WeakPolarHBondContact O-CB 3.32Å; Q413-I417 WeakPolarHBondContact O-CG1 3.33Å; Q413-I417 PolarHBondContact O-N 3.08Å; Q413-G435 PolarHBondContact NE2-O 2.99Å; Q413-A438 HydrophobicContact CG-CB 4.35Å; Q413-V439 HydrophobicContact CG-CG2 3.86Å
414	R	94.4	Very high	91.4	Very high	39 Å²	39	35.4 Å²	35.4	15%	0.147	20%	0.204	C	C	.	.	H	α-helix	trans	-56.4	-46.8	176.6	-67.6	-174.4	-177.4	-146.6	-6.5	112.6	P384 M385 E386 P409 T410 V411 P418	P384-R414 WeakPolarHBondContact CA-O 3.27Å; M385-R414 PolarHBondContact N-O 3.1Å; M385-R414 WeakPolarHBondContact O-CA 3.41Å; M385-R414 WeakPolarHBondContact O-CB 3.39Å; M385-R414 WeakPolarHBondContact O-CG 3.42Å; E386-R414 IonicContact OE1-CZ 2.8Å; E386-R414 IonicContact OE1-NH1 3.92Å; E386-R414 PolarHBondContact OE1-NH1 2.75Å; E386-R414 IonicContact OE2-CZ 3.79Å; E386-R414 IonicContact OE2-NH1 3.53Å; E386-R414 PolarHBondContact OE2-NH1 2.66Å; E386-R414 IonicContact OE2-NH2 3.89Å; P409-R414 HydrophobicContact CB-CG 3.92Å; P409-R414 HydrophobicContact CG-CG 3.74Å; P409-R414 PolarHBondContact O-NE 2.73Å; T410-R414 WeakPolarHBondContact O-CG 3.38Å; T410-R414 PolarHBondContact O-N 3.16Å; V411-R414 WeakPolarHBondContact O-CB 3.41Å; V411-R414 PolarHBondContact O-N 2.69Å; R414-P418 WeakPolarHBondContact O-CD 3.39Å; R414-P418 WeakPolarHBondContact O-CG 3.36Å
415	Y	94.7	Very high	92.2	Very high	75 Å²	75	34.8 Å²	34.8	29%	0.294	20%	0.199	S	C	.	.	H	α-helix	trans	-86.2	-33.2	-177.1	-74.4	-104.9	0	0	0	113.1	V374 P384 V411 Q413 V419 Q594	V374-Y415 HydrophobicContact CB-CD1 4.2Å; V374-Y415 HydrophobicContact CB-CE1 3.93Å; V374-Y415 HydrophobicContact CB-CE2 4.3Å; V374-Y415 HydrophobicContact CB-CG 4.49Å; V374-Y415 HydrophobicContact CG1-CD1 3.84Å; V374-Y415 HydrophobicContact CG1-CE1 4.05Å; V374-Y415 HydrophobicContact CG1-CG 4.1Å; V374-Y415 HydrophobicContact CG2-CD1 4.38Å; V374-Y415 HydrophobicContact CG2-CD2 3.86Å; V374-Y415 HydrophobicContact CG2-CE1 4.17Å; V374-Y415 HydrophobicContact CG2-CE2 3.63Å; V374-Y415 HydrophobicContact CG2-CG 4.23Å; P384-Y415 HydrophobicContact CB-CD1 4.03Å; P384-Y415 HydrophobicContact CB-CD2 4.01Å; P384-Y415 HydrophobicContact CB-CE1 4.14Å; P384-Y415 HydrophobicContact CB-CE2 4.11Å; P384-Y415 HydrophobicContact CB-CG 3.98Å; P384-Y415 HydrophobicContact CG-CD1 4.46Å; P384-Y415 HydrophobicContact CG-CE1 4.15Å; V411-Y415 HydrophobicContact CG1-CD2 4.06Å; V411-Y415 HydrophobicContact CG1-CE2 4.09Å; V411-Y415 WeakPolarHBondContact O-CD2 3.16Å; V411-Y415 PolarHBondContact O-N 2.86Å; V411-Y415 VanDerWaalsContact O-N 3.17Å; Q413-Y415 PolarHBondContact O-N 3.28Å; Y415-V419 WeakPolarHBondContact O-CG2 3.4Å; Y415-Q594 VanDerWaalsContact CB-OE1 3.3Å; Y415-Q594 PolarHBondContact O-NE2 2.92Å; Y415-Q594 VanDerWaalsContact O-NE2 3.17Å; Y415-Q594 PolarHBondContact O-OE1 2.95Å
416	G	95.8	Very high	92.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-87.4	-34.5	-174.5	0	0	0	0	0	115.3	I412 V419 V420 Y426	I412-G416 WeakPolarHBondContact O-CA 3.33Å; I412-G416 PolarHBondContact O-N 3.01Å; G416-V419 PolarHBondContact O-N 3.14Å; G416-V420 WeakPolarHBondContact O-CG2 3.38Å; G416-V420 PolarHBondContact O-N 2.93Å; G416-Y426 WeakPolarHBondContact CA-OH 3.35Å
417	I	96.8	Very high	93.5	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-43.3	-178.9	-74.2	172.6	0	0	0	112.2	M385 F388 A391 F393 Q413 V419 V420 T421 V439 L442 P443	M385-I417 HydrophobicContact CE-CB 3.98Å; M385-I417 HydrophobicContact CE-CD1 3.67Å; M385-I417 HydrophobicContact CE-CG1 4.36Å; M385-I417 HydrophobicContact CE-CG2 4.1Å; M385-I417 HydrophobicContact SD-CB 4.02Å; M385-I417 HydrophobicContact SD-CG2 3.74Å; F388-I417 HydrophobicContact CE1-CD1 4.07Å; A391-I417 HydrophobicContact CB-CG2 3.96Å; F393-I417 HydrophobicContact CE1-CG2 4.24Å; F393-I417 HydrophobicContact CE2-CD1 4.47Å; F393-I417 HydrophobicContact CE2-CG2 4.41Å; F393-I417 HydrophobicContact CZ-CD1 4.24Å; F393-I417 HydrophobicContact CZ-CG2 3.59Å; Q413-I417 HydrophobicContact CB-CD1 3.95Å; Q413-I417 HydrophobicContact CG-CD1 4.39Å; Q413-I417 VanDerWaalsContact O-CB 3.25Å; Q413-I417 WeakPolarHBondContact O-CB 3.32Å; Q413-I417 WeakPolarHBondContact O-CG1 3.33Å; Q413-I417 PolarHBondContact O-N 3.08Å; I417-V419 PolarHBondContact O-N 2.67Å; I417-V420 PolarHBondContact O-N 3.36Å; I417-T421 VanDerWaalsContact O-CB 3.27Å; I417-T421 WeakPolarHBondContact O-CB 3.34Å; I417-T421 PolarHBondContact O-N 3.39Å; I417-T421 PolarHBondContact O-OG1 3.41Å; I417-V439 HydrophobicContact CG1-CG1 4.47Å; I417-L442 HydrophobicContact CD1-CD1 4.21Å; I417-P443 HydrophobicContact CG1-CG 4.42Å; I417-P443 HydrophobicContact CG2-CG 4.28Å
418	P	96.1	Very high	94	Very high	23 Å²	23	22.1 Å²	22.1	15%	0.149	13%	0.132	C	C	.	.	H	α-helix	trans	-58.7	-44.5	173.5	-27.5	37.4	0	0	0	113.1	P382 E383 M385 R414 T421 A422	P382-P418 HydrophobicContact CB-CB 3.88Å; E383-P418 WeakPolarHBondContact O-CB 3.33Å; E383-P418 WeakPolarHBondContact O-CG 3.38Å; M385-P418 HydrophobicContact CB-CG 4.03Å; M385-P418 HydrophobicContact CG-CG 4.01Å; R414-P418 WeakPolarHBondContact O-CD 3.39Å; R414-P418 WeakPolarHBondContact O-CG 3.36Å; P418-T421 PolarHBondContact O-N 3.18Å; P418-A422 WeakPolarHBondContact O-CB 3.32Å; P418-A422 PolarHBondContact O-N 2.87Å
419	V	96.4	Very high	94.2	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.5	-50.5	177.4	175.8	0	0	0	0	111.5	Y415 G416 I417 T421 A422 R424 Y426 I592	Y415-V419 WeakPolarHBondContact O-CG2 3.4Å; G416-V419 PolarHBondContact O-N 3.14Å; I417-V419 PolarHBondContact O-N 2.67Å; V419-T421 VanDerWaalsContact C-N 3.34Å; V419-T421 PolarHBondContact O-N 3.21Å; V419-A422 PolarHBondContact O-N 3.42Å; V419-R424 HydrophobicContact CG1-CB 4.15Å; V419-Y426 HydrophobicContact CB-CD2 4.26Å; V419-Y426 HydrophobicContact CB-CE2 4.49Å; V419-Y426 HydrophobicContact CG1-CD2 3.64Å; V419-Y426 HydrophobicContact CG1-CE2 4.3Å; V419-Y426 HydrophobicContact CG1-CG 4.08Å; V419-I592 HydrophobicContact CG1-CB 3.77Å; V419-I592 HydrophobicContact CG1-CG1 3.85Å; V419-I592 HydrophobicContact CG1-CG2 4.24Å; V419-I592 HydrophobicContact CG2-CB 4.42Å; V419-I592 HydrophobicContact CG2-CG1 4.45Å; V419-I592 HydrophobicContact CG2-CG2 4.04Å
420	V	96.2	Very high	94	Very high	3 Å²	3	19 Å²	19	2%	0.018	11%	0.113	C	C	.	.	H	α-helix	trans	-64.5	-41.3	-179.5	175.6	0	0	0	0	110.7	G416 I417 A422 G423 Y426 V439 P443 Q567 M569	G416-V420 WeakPolarHBondContact O-CG2 3.38Å; G416-V420 PolarHBondContact O-N 2.93Å; I417-V420 PolarHBondContact O-N 3.36Å; V420-A422 VanDerWaalsContact C-N 3.29Å; V420-A422 PolarHBondContact O-N 3.05Å; V420-G423 PolarHBondContact O-N 3.1Å; V420-Y426 HydrophobicContact CG2-CD1 3.89Å; V420-Y426 HydrophobicContact CG2-CG 4.34Å; V420-V439 HydrophobicContact CG2-CG1 4.4Å; V420-P443 HydrophobicContact CB-CB 4.4Å; V420-P443 HydrophobicContact CB-CG 4.16Å; V420-P443 HydrophobicContact CG1-CB 3.68Å; V420-P443 HydrophobicContact CG1-CG 3.86Å; V420-Q567 PolarHBondContact O-NE2 3.33Å; V420-M569 HydrophobicContact CB-SD 4.28Å; V420-M569 HydrophobicContact CG1-CE 3.94Å; V420-M569 HydrophobicContact CG1-SD 3.56Å; V420-M569 VanDerWaalsContact CG1-SD 3.56Å; V420-M569 HydrophobicContact CG2-CG 4.45Å; V420-M569 HydrophobicContact CG2-SD 3.65Å
421	T	94.8	Very high	93.3	Very high	71 Å²	71	21.2 Å²	21.2	44%	0.436	12%	0.122	S	C	.	.	H	α-helix	trans	-66.6	-30.1	178.8	-53.8	0	0	0	0	112.3	I417 P418 V419 G423	I417-T421 VanDerWaalsContact O-CB 3.27Å; I417-T421 WeakPolarHBondContact O-CB 3.34Å; I417-T421 PolarHBondContact O-N 3.39Å; I417-T421 PolarHBondContact O-OG1 3.41Å; P418-T421 PolarHBondContact O-N 3.18Å; V419-T421 VanDerWaalsContact C-N 3.34Å; V419-T421 PolarHBondContact O-N 3.21Å; T421-G423 PolarHBondContact O-N 3.3Å
422	A	93.8	Very high	92.3	Very high	60 Å²	60	22 Å²	22	50%	0.496	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-3.2	172.5	0	0	0	0	0	114.2	P382 P418 V419 V420 R424	P382-A422 HydrophobicContact CG-CB 3.78Å; P418-A422 WeakPolarHBondContact O-CB 3.32Å; P418-A422 PolarHBondContact O-N 2.87Å; V419-A422 PolarHBondContact O-N 3.42Å; V420-A422 VanDerWaalsContact C-N 3.29Å; V420-A422 PolarHBondContact O-N 3.05Å; A422-R424 VanDerWaalsContact C-N 3.32Å; A422-R424 HydrophobicContact CB-CG 4.36Å; A422-R424 PolarHBondContact O-N 3.36Å
423	G	93.7	Very high	91.3	Very high	40 Å²	40	23.1 Å²	23.1	41%	0.412	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	10	176.9	0	0	0	0	0	115.2	V420 T421 Q567	V420-G423 PolarHBondContact O-N 3.1Å; T421-G423 PolarHBondContact O-N 3.3Å; G423-Q567 VanDerWaalsContact C-NE2 3.34Å
424	R	95	Very high	90.4	Very high	42 Å²	42	23.1 Å²	23.1	16%	0.158	14%	0.141	C	C	.	.			trans	-78.9	142.9	178.6	-58.7	-68.6	-69.9	-70.8	-2.6	110.9	Q379 D380 V419 A422 Q567 D590 I592	Q379-R424 PolarHBondContact O-NH1 2.82Å; Q379-R424 VanDerWaalsContact O-NH1 3.13Å; Q379-R424 PolarHBondContact O-NH2 3.45Å; D380-R424 PolarHBondContact O-NH1 3.09Å; V419-R424 HydrophobicContact CG1-CB 4.15Å; A422-R424 VanDerWaalsContact C-N 3.32Å; A422-R424 HydrophobicContact CB-CG 4.36Å; A422-R424 PolarHBondContact O-N 3.36Å; R424-Q567 PolarHBondContact O-NE2 3.21Å; R424-D590 IonicContact CZ-OD2 2.99Å; R424-D590 IonicContact NE-OD2 2.69Å; R424-D590 PolarHBondContact NE-OD2 3.13Å; R424-D590 PolarHBondContact NH2-O 3.22Å; R424-D590 IonicContact NH2-OD2 3.27Å; R424-I592 HydrophobicContact CB-CG1 4.42Å
425	D	96.8	Very high	89.8	Confident	2 Å²	2	22.4 Å²	22.4	1%	0.011	15%	0.146	C	C	.	.			trans	-62.6	145.4	170.1	-79.5	17	0	0	0	109.8	Q567 T568 L587 K588 F591 I592	D425-Q567 WeakPolarHBondContact OD1-CA 3.4Å; D425-T568 VanDerWaalsContact CA-O 3.31Å; D425-T568 WeakPolarHBondContact CA-O 3.24Å; D425-T568 PolarHBondContact OD1-N 2.86Å; D425-L587 HydrophobicContact CB-CD2 4.37Å; D425-K588 HydrophobicContact CB-CB 4.47Å; D425-K588 IonicContact OD1-NZ 2.71Å; D425-K588 PolarHBondContact OD1-NZ 2.9Å; D425-K588 VanDerWaalsContact OD2-CG 3.32Å; D425-K588 WeakPolarHBondContact OD2-CG 3.29Å; D425-K588 PolarHBondContact OD2-N 3.02Å; D425-K588 IonicContact OD2-NZ 3.88Å; D425-F591 HydrophobicContact CB-CB 3.76Å; D425-F591 CarbonylContact O-C 3.27Å; D425-F591 VanDerWaalsContact O-CA 3.29Å; D425-F591 WeakPolarHBondContact O-CA 3.49Å; D425-F591 WeakPolarHBondContact O-CB 3.32Å; D425-I592 PolarHBondContact O-N 3.29Å
426	Y	97	Very high	89.5	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	130	-165.8	-176.9	-126.6	0	0	0	113.3	I412 G416 V419 V420 A428 V439 T568 M569 M570 F571 I592 Q594	I412-Y426 WeakPolarHBondContact CD1-OH 3.45Å; G416-Y426 WeakPolarHBondContact CA-OH 3.35Å; V419-Y426 HydrophobicContact CB-CD2 4.26Å; V419-Y426 HydrophobicContact CB-CE2 4.49Å; V419-Y426 HydrophobicContact CG1-CD2 3.64Å; V419-Y426 HydrophobicContact CG1-CE2 4.3Å; V419-Y426 HydrophobicContact CG1-CG 4.08Å; V420-Y426 HydrophobicContact CG2-CD1 3.89Å; V420-Y426 HydrophobicContact CG2-CG 4.34Å; Y426-A428 HydrophobicContact CD1-CB 4.41Å; Y426-A428 HydrophobicContact CE1-CB 3.67Å; Y426-V439 HydrophobicContact CE1-CG1 3.84Å; Y426-T568 PolarHBondContact N-O 3.08Å; Y426-M569 CarbonylContact O-C 3.53Å; Y426-M569 VanDerWaalsContact O-CA 3.25Å; Y426-M569 WeakPolarHBondContact O-CA 3.33Å; Y426-M570 PolarHBondContact O-N 2.85Å; Y426-F571 HydrophobicContact CD1-CE1 4.19Å; Y426-F571 AromaticContact CD1-CZ 3.81Å; Y426-F571 HydrophobicContact CD1-CZ 3.81Å; Y426-F571 AromaticContact CE1-CE1 3.78Å; Y426-F571 HydrophobicContact CE1-CE1 3.78Å; Y426-F571 AromaticContact CE1-CZ 3.84Å; Y426-F571 HydrophobicContact CE1-CZ 3.84Å; Y426-I592 CarbonylContact C-O 3.6Å; Y426-I592 WeakPolarHBondContact CA-O 3.49Å; Y426-I592 HydrophobicContact CD2-CB 4.34Å; Y426-I592 HydrophobicContact CD2-CG2 4.44Å; Y426-I592 WeakPolarHBondContact CD2-O 3.46Å; Y426-Q594 HydrophobicContact CE2-CB 4.07Å; Y426-Q594 HydrophobicContact CE2-CG 4.06Å; Y426-Q594 PolarHBondContact OH-OE1 3.45Å
427	M	95.6	Very high	89.3	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.1	170.1	-179.8	70.2	-148.2	0	0	109.5	M570 F575 I579 L587 F591 I592 F593 Q594	M427-M570 CarbonylContact C-O 3.57Å; M427-M570 WeakPolarHBondContact CA-O 3.16Å; M427-M570 HydrophobicContact CE-CB 4.45Å; M427-M570 HydrophobicContact SD-CB 3.38Å; M427-M570 WeakPolarHBondContact SD-CB 3.32Å; M427-M570 HydrophobicContact SD-CE 4.48Å; M427-M570 HydrophobicContact SD-CG 4.48Å; M427-M570 HydrophobicContact SD-SD 4.43Å; M427-F575 HydrophobicContact CE-CD2 3.84Å; M427-F575 HydrophobicContact CE-CE2 3.75Å; M427-F575 HydrophobicContact CG-CE2 4Å; M427-F575 HydrophobicContact CG-CZ 4.49Å; M427-F575 HydrophobicContact SD-CE2 4.07Å; M427-I579 HydrophobicContact CE-CG2 4.1Å; M427-L587 HydrophobicContact CB-CD1 3.95Å; M427-F591 HydrophobicContact CB-CD2 3.88Å; M427-F591 HydrophobicContact CB-CE2 3.8Å; M427-I592 PolarHBondContact N-O 2.78Å; M427-F593 HydrophobicContact CB-CB 4.28Å; M427-F593 HydrophobicContact CB-CD2 3.71Å; M427-F593 HydrophobicContact CB-CE2 4.5Å; M427-F593 HydrophobicContact CB-CG 4.33Å; M427-F593 HydrophobicContact CG-CD2 3.38Å; M427-F593 HydrophobicContact CG-CE2 3.69Å; M427-F593 HydrophobicContact CG-CG 4.27Å; M427-F593 WeakPolarHBondContact O-CA 3.15Å; M427-Q594 PolarHBondContact O-N 2.71Å
428	A	94.1	Very high	89	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	119.3	-179.9	0	0	0	0	0	112.1	I412 Y426 M570 F571 S572 Q594	I412-A428 HydrophobicContact CD1-CB 3.99Å; Y426-A428 HydrophobicContact CD1-CB 4.41Å; Y426-A428 HydrophobicContact CE1-CB 3.67Å; A428-M570 PolarHBondContact N-O 2.81Å; A428-F571 HydrophobicContact CB-CD1 3.51Å; A428-F571 HydrophobicContact CB-CE1 3.69Å; A428-F571 HydrophobicContact CB-CG 4.33Å; A428-S572 PolarHBondContact O-N 3.11Å; A428-Q594 WeakPolarHBondContact CA-O 3.15Å
429	C	91.3	Very high	89	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.007	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	109.7	167.9	-74.1	0	0	0	0	109.5	T574 F593 Q594 I595 V596 L599	C429-T574 PolarHBondContact SG-O 2.86Å; C429-F593 HydrophobicContact CB-CE2 4.19Å; C429-Q594 PolarHBondContact N-O 3.32Å; C429-I595 HydrophobicContact CB-CG1 4.33Å; C429-I595 WeakPolarHBondContact O-CA 3.49Å; C429-V596 PolarHBondContact O-N 2.93Å; C429-L599 HydrophobicContact CB-CD2 3.59Å
430	A	85.4	Confident	89	Confident	2 Å²	2	21.2 Å²	21.2	2%	0.017	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	151.1	176.4	0	0	0	0	0	111.4	I412 K436 S572 V596	I412-A430 HydrophobicContact CB-CB 4.5Å; I412-A430 HydrophobicContact CD1-CB 4.24Å; I412-A430 HydrophobicContact CG1-CB 4.31Å; A430-K436 HydrophobicContact CB-CD 4.13Å; A430-K436 HydrophobicContact CB-CG 4.34Å; A430-K436 WeakPolarHBondContact O-CE 3.48Å; A430-K436 PolarHBondContact O-NZ 3.28Å; A430-S572 PolarHBondContact N-O 2.81Å; A430-V596 HydrophobicContact CB-CB 3.93Å; A430-V596 HydrophobicContact CB-CG2 4.46Å
431	Q	75.5	Confident	88.9	Confident	62 Å²	62	21.3 Å²	21.3	29%	0.29	15%	0.147	S	C	.	.			trans	-56	155.6	-179.1	66.7	174.4	4.1	0	0	113.5	S434	Q431-S434 WeakPolarHBondContact O-CB 3.42Å; Q431-S434 PolarHBondContact O-N 2.85Å; Q431-S434 PolarHBondContact O-OG 3.32Å
432	T	69.5	Low	88.9	Confident	27 Å²	27	18.1 Å²	18.1	17%	0.166	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	142.1	175	56	0	0	0	0	111.3	S434 G724	T432-S434 VanDerWaalsContact C-N 3.31Å; T432-S434 PolarHBondContact O-N 2.84Å; T432-G724 PolarHBondContact OG1-O 2.84Å
433	G	69.3	Low	89	Confident	26 Å²	26	15.6 Å²	15.6	27%	0.268	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	1.5	-179	0	0	0	0	0	115.4	G435	G433-G435 PolarHBondContact O-N 2.87Å
434	S	75.5	Confident	89.1	Confident	11 Å²	11	13.7 Å²	13.7	8%	0.077	9%	0.086	C	C	.	.	S	Bend	trans	-74.6	-1.7	174.6	56.6	0	0	0	0	115.1	T410 I412 Q431 T432	T410-S434 VanDerWaalsContact CB-O 3.3Å; T410-S434 WeakPolarHBondContact CB-O 3.25Å; T410-S434 PolarHBondContact OG1-O 2.95Å; I412-S434 VanDerWaalsContact CG2-O 3.25Å; I412-S434 WeakPolarHBondContact CG2-O 3.39Å; Q431-S434 WeakPolarHBondContact O-CB 3.42Å; Q431-S434 PolarHBondContact O-N 2.85Å; Q431-S434 PolarHBondContact O-OG 3.32Å; T432-S434 VanDerWaalsContact C-N 3.31Å; T432-S434 PolarHBondContact O-N 2.84Å
435	G	81.8	Confident	89	Confident	25 Å²	25	11.7 Å²	11.7	26%	0.258	8%	0.079	S	C	.	.			trans	90.1	15.7	178.5	0	0	0	0	0	116.2	Q413 G433 T437 A438	Q413-G435 PolarHBondContact NE2-O 2.99Å; G433-G435 PolarHBondContact O-N 2.87Å; G435-T437 VanDerWaalsContact C-N 3.25Å; G435-T437 PolarHBondContact O-N 2.85Å; G435-T437 VanDerWaalsContact O-N 3.14Å; G435-A438 PolarHBondContact O-N 3.41Å; G435-A438 VanDerWaalsContact O-N 3.09Å
436	K	88.8	Confident	88.8	Confident	16 Å²	16	12 Å²	12	7%	0.07	8%	0.081	C	C	.	.	H	α-helix	trans	-44.1	-42.6	178.4	-68.9	-171	-67.8	-164.7	0	114.6	I412 A430 A438 V439 F571 S572	I412-K436 HydrophobicContact CG1-CG 4.46Å; I412-K436 HydrophobicContact CG2-CG 4.45Å; A430-K436 HydrophobicContact CB-CD 4.13Å; A430-K436 HydrophobicContact CB-CG 4.34Å; A430-K436 WeakPolarHBondContact O-CE 3.48Å; A430-K436 PolarHBondContact O-NZ 3.28Å; K436-A438 VanDerWaalsContact C-N 3.26Å; K436-A438 PolarHBondContact O-N 2.79Å; K436-V439 VanDerWaalsContact O-CB 3.25Å; K436-V439 WeakPolarHBondContact O-CB 3.37Å; K436-V439 VanDerWaalsContact O-CG2 3.3Å; K436-V439 WeakPolarHBondContact O-CG2 3.16Å; K436-V439 PolarHBondContact O-N 2.92Å; K436-F571 HydrophobicContact CB-CD1 3.96Å; K436-F571 HydrophobicContact CD-CB 4.39Å; K436-F571 HydrophobicContact CD-CD1 4.2Å; K436-F571 HydrophobicContact CG-CD1 4.22Å; K436-S572 PolarHBondContact NZ-O 3.01Å
437	T	91.2	Very high	88.6	Confident	34 Å²	34	13.1 Å²	13.1	21%	0.209	9%	0.088	C	C	.	.	H	α-helix	trans	-53.9	-38.7	-179.3	-53.5	0	0	0	0	113.6	G435 V439 Y440 L441 I475	G435-T437 VanDerWaalsContact C-N 3.25Å; G435-T437 PolarHBondContact O-N 2.85Å; G435-T437 VanDerWaalsContact O-N 3.14Å; T437-V439 VanDerWaalsContact C-N 3.29Å; T437-V439 PolarHBondContact O-N 2.92Å; T437-Y440 HydrophobicContact CG2-CE2 4.47Å; T437-L441 HydrophobicContact CG2-CD2 4.29Å; T437-L441 WeakPolarHBondContact O-CB 3.29Å; T437-L441 PolarHBondContact O-N 3.42Å; T437-L441 VanDerWaalsContact O-N 3.1Å; T437-I475 HydrophobicContact CG2-CG1 4Å; T437-I475 HydrophobicContact CG2-CG2 4.35Å
438	A	92.2	Very high	88.4	Confident	24 Å²	24	13.5 Å²	13.5	20%	0.198	9%	0.09	C	C	.	.	H	α-helix	trans	-72.1	-23.8	-178.9	0	0	0	0	0	113	Q413 G435 K436 L442	Q413-A438 HydrophobicContact CG-CB 4.35Å; G435-A438 PolarHBondContact O-N 3.41Å; G435-A438 VanDerWaalsContact O-N 3.09Å; K436-A438 VanDerWaalsContact C-N 3.26Å; K436-A438 PolarHBondContact O-N 2.79Å; A438-L442 HydrophobicContact CB-CD1 3.94Å; A438-L442 HydrophobicContact CB-CG 4.17Å; A438-L442 WeakPolarHBondContact O-CB 3Å; A438-L442 WeakPolarHBondContact O-CG 3.49Å; A438-L442 PolarHBondContact O-N 3.18Å
439	V	95.2	Very high	88.1	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.8	-43.7	-175.7	-173	0	0	0	0	111.2	I412 Q413 I417 V420 Y426 K436 T437 P443 F571	I412-V439 HydrophobicContact CG1-CG2 4.11Å; I412-V439 HydrophobicContact CG2-CG2 4.05Å; Q413-V439 HydrophobicContact CG-CG2 3.86Å; I417-V439 HydrophobicContact CG1-CG1 4.47Å; V420-V439 HydrophobicContact CG2-CG1 4.4Å; Y426-V439 HydrophobicContact CE1-CG1 3.84Å; K436-V439 VanDerWaalsContact O-CB 3.25Å; K436-V439 WeakPolarHBondContact O-CB 3.37Å; K436-V439 VanDerWaalsContact O-CG2 3.3Å; K436-V439 WeakPolarHBondContact O-CG2 3.16Å; K436-V439 PolarHBondContact O-N 2.92Å; T437-V439 VanDerWaalsContact C-N 3.29Å; T437-V439 PolarHBondContact O-N 2.92Å; V439-P443 WeakPolarHBondContact O-CD 3.33Å; V439-P443 WeakPolarHBondContact O-CG 3.48Å; V439-F571 HydrophobicContact CB-CE1 3.88Å; V439-F571 HydrophobicContact CB-CZ 4.06Å; V439-F571 HydrophobicContact CG1-CE1 4.05Å; V439-F571 HydrophobicContact CG1-CZ 4.11Å; V439-F571 HydrophobicContact CG2-CE1 4.42Å
440	Y	95.6	Very high	88	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-87.8	-39	173	60.1	-97.8	0	0	0	112.4	T437 P443 I444 V464 I475 V538 D540 F571	T437-Y440 HydrophobicContact CG2-CE2 4.47Å; Y440-P443 WeakPolarHBondContact O-CD 3.48Å; Y440-I444 HydrophobicContact CD2-CD1 4.39Å; Y440-I444 WeakPolarHBondContact O-CB 3.5Å; Y440-I444 VanDerWaalsContact O-CD1 3.32Å; Y440-I444 WeakPolarHBondContact O-CD1 3.46Å; Y440-I444 WeakPolarHBondContact O-CG1 3.4Å; Y440-I444 PolarHBondContact O-N 2.89Å; Y440-V464 HydrophobicContact CE2-CG1 4.08Å; Y440-V464 HydrophobicContact CE2-CG2 4.35Å; Y440-I475 HydrophobicContact CE2-CG2 4.32Å; Y440-I475 VanDerWaalsContact OH-CD1 3.31Å; Y440-I475 WeakPolarHBondContact OH-CD1 3.16Å; Y440-V538 HydrophobicContact CD1-CG1 3.79Å; Y440-V538 HydrophobicContact CD2-CB 4.42Å; Y440-V538 HydrophobicContact CD2-CG1 3.85Å; Y440-V538 HydrophobicContact CD2-CG2 4.02Å; Y440-V538 HydrophobicContact CE1-CG1 3.94Å; Y440-V538 HydrophobicContact CE2-CG1 4.07Å; Y440-V538 HydrophobicContact CG-CG1 3.71Å; Y440-V538 HydrophobicContact CG-CG2 4.1Å; Y440-D540 HydrophobicContact CE1-CB 4.33Å; Y440-D540 PolarHBondContact OH-OD2 3.03Å; Y440-F571 AromaticContact CD1-CD2 3.72Å; Y440-F571 HydrophobicContact CD1-CD2 3.72Å; Y440-F571 HydrophobicContact CD1-CE1 4.27Å; Y440-F571 AromaticContact CD1-CE2 3.35Å; Y440-F571 HydrophobicContact CD1-CE2 3.35Å; Y440-F571 HydrophobicContact CD1-CG 4.34Å; Y440-F571 AromaticContact CD1-CZ 3.67Å; Y440-F571 HydrophobicContact CD1-CZ 3.67Å; Y440-F571 HydrophobicContact CE1-CD2 4.13Å; Y440-F571 HydrophobicContact CE1-CE2 4.21Å; Y440-F571 HydrophobicContact CG-CE2 4Å; Y440-F571 HydrophobicContact CG-CZ 4.35Å
441	L	95.2	Very high	87.8	Confident	5 Å²	5	21.6 Å²	21.6	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-71.1	-39.3	-169.4	-170.9	61.5	0	0	0	112.5	T437 I444 L445 V478 I512	T437-L441 HydrophobicContact CG2-CD2 4.29Å; T437-L441 WeakPolarHBondContact O-CB 3.29Å; T437-L441 PolarHBondContact O-N 3.42Å; T437-L441 VanDerWaalsContact O-N 3.1Å; L441-I444 PolarHBondContact O-N 3Å; L441-L445 HydrophobicContact CD1-CD1 4.24Å; L441-L445 HydrophobicContact CD1-CG 4.19Å; L441-L445 HydrophobicContact CG-CD1 3.8Å; L441-L445 HydrophobicContact CG-CG 4.24Å; L441-L445 WeakPolarHBondContact O-CB 3.5Å; L441-L445 WeakPolarHBondContact O-CD1 3.37Å; L441-L445 WeakPolarHBondContact O-CG 3.25Å; L441-L445 PolarHBondContact O-N 3.03Å; L441-V478 HydrophobicContact CD2-CB 4.02Å; L441-V478 HydrophobicContact CD2-CG1 3.6Å; L441-I512 HydrophobicContact CD1-CD1 4.41Å
442	L	95	Very high	87.3	Confident	4 Å²	4	23.5 Å²	23.5	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-66.2	-48.7	-179.6	-62	173.2	0	0	0	112.4	F388 F393 I397 L401 I417 A438 I444 L445 D446 F482	F388-L442 HydrophobicContact CD1-CD1 4.47Å; F388-L442 HydrophobicContact CE1-CD1 3.95Å; F393-L442 HydrophobicContact CE1-CB 4.32Å; F393-L442 HydrophobicContact CE2-CB 3.85Å; F393-L442 HydrophobicContact CE2-CD1 4.05Å; F393-L442 HydrophobicContact CZ-CB 3.63Å; I397-L442 HydrophobicContact CG2-CD2 3.89Å; L401-L442 HydrophobicContact CD1-CD1 4.39Å; L401-L442 HydrophobicContact CD2-CD1 4.06Å; L401-L442 HydrophobicContact CD2-CD2 4.12Å; I417-L442 HydrophobicContact CD1-CD1 4.21Å; A438-L442 HydrophobicContact CB-CD1 3.94Å; A438-L442 HydrophobicContact CB-CG 4.17Å; A438-L442 WeakPolarHBondContact O-CB 3Å; A438-L442 WeakPolarHBondContact O-CG 3.49Å; A438-L442 PolarHBondContact O-N 3.18Å; L442-I444 PolarHBondContact O-N 3.48Å; L442-L445 PolarHBondContact O-N 3.1Å; L442-D446 VanDerWaalsContact O-CB 3.3Å; L442-D446 WeakPolarHBondContact O-CB 3.42Å; L442-D446 PolarHBondContact O-N 3.17Å; L442-F482 HydrophobicContact CD2-CE1 3.85Å; L442-F482 HydrophobicContact CD2-CE2 4.31Å; L442-F482 HydrophobicContact CD2-CZ 3.73Å
443	P	95.1	Very high	86.7	Confident	6 Å²	6	27.7 Å²	27.7	4%	0.039	16%	0.163	C	C	.	.	H	α-helix	trans	-63.7	-35.6	175	-25	37.1	0	0	0	113.8	F393 I417 V420 V439 Y440 D446 S447	F393-P443 HydrophobicContact CE1-CG 4.26Å; F393-P443 HydrophobicContact CZ-CG 4.34Å; I417-P443 HydrophobicContact CG1-CG 4.42Å; I417-P443 HydrophobicContact CG2-CG 4.28Å; V420-P443 HydrophobicContact CB-CB 4.4Å; V420-P443 HydrophobicContact CB-CG 4.16Å; V420-P443 HydrophobicContact CG1-CB 3.68Å; V420-P443 HydrophobicContact CG1-CG 3.86Å; V439-P443 WeakPolarHBondContact O-CD 3.33Å; V439-P443 WeakPolarHBondContact O-CG 3.48Å; Y440-P443 WeakPolarHBondContact O-CD 3.48Å; P443-D446 PolarHBondContact O-N 2.94Å; P443-S447 WeakPolarHBondContact O-CB 3.39Å; P443-S447 PolarHBondContact O-N 2.92Å
444	I	95	Very high	85.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.2	-49.2	175.2	-72.3	169.9	0	0	0	110.6	Y440 L441 L442 D446 S447 I448 A462 I512 Y536 V538 M569	Y440-I444 HydrophobicContact CD2-CD1 4.39Å; Y440-I444 WeakPolarHBondContact O-CB 3.5Å; Y440-I444 VanDerWaalsContact O-CD1 3.32Å; Y440-I444 WeakPolarHBondContact O-CD1 3.46Å; Y440-I444 WeakPolarHBondContact O-CG1 3.4Å; Y440-I444 PolarHBondContact O-N 2.89Å; L441-I444 PolarHBondContact O-N 3Å; L442-I444 PolarHBondContact O-N 3.48Å; I444-D446 VanDerWaalsContact C-N 3.35Å; I444-S447 PolarHBondContact O-N 2.99Å; I444-I448 HydrophobicContact CG2-CD1 3.83Å; I444-I448 VanDerWaalsContact O-CG1 3.3Å; I444-I448 WeakPolarHBondContact O-CG1 3.19Å; I444-I448 PolarHBondContact O-N 2.89Å; I444-A462 HydrophobicContact CD1-CB 4.25Å; I444-A462 HydrophobicContact CG2-CB 3.52Å; I444-I512 HydrophobicContact CG2-CD1 4Å; I444-I512 HydrophobicContact CG2-CG1 4.34Å; I444-Y536 HydrophobicContact CD1-CG 4.18Å; I444-Y536 HydrophobicContact CG1-CD1 3.98Å; I444-Y536 HydrophobicContact CG1-CD2 3.93Å; I444-Y536 HydrophobicContact CG1-CE1 4.43Å; I444-Y536 HydrophobicContact CG1-CE2 4.4Å; I444-Y536 HydrophobicContact CG1-CG 3.7Å; I444-Y536 HydrophobicContact CG2-CD2 4.34Å; I444-V538 HydrophobicContact CD1-CG2 3.74Å; I444-M569 HydrophobicContact CD1-CE 4Å; I444-M569 HydrophobicContact CG1-CE 4.27Å
445	L	93.9	Very high	84.5	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-46.7	176.7	-72.9	167.7	0	0	0	111.1	I397 L441 L442 S447 I448 V449 F482 L483 I512	I397-L445 HydrophobicContact CD1-CB 3.86Å; L441-L445 HydrophobicContact CD1-CD1 4.24Å; L441-L445 HydrophobicContact CD1-CG 4.19Å; L441-L445 HydrophobicContact CG-CD1 3.8Å; L441-L445 HydrophobicContact CG-CG 4.24Å; L441-L445 WeakPolarHBondContact O-CB 3.5Å; L441-L445 WeakPolarHBondContact O-CD1 3.37Å; L441-L445 WeakPolarHBondContact O-CG 3.25Å; L441-L445 PolarHBondContact O-N 3.03Å; L442-L445 PolarHBondContact O-N 3.1Å; L445-S447 PolarHBondContact O-N 3.4Å; L445-I448 PolarHBondContact O-N 3.27Å; L445-V449 VanDerWaalsContact O-CG2 3.31Å; L445-V449 WeakPolarHBondContact O-CG2 3.14Å; L445-V449 PolarHBondContact O-N 3.15Å; L445-F482 HydrophobicContact CD1-CB 3.57Å; L445-F482 HydrophobicContact CD1-CD1 4.23Å; L445-F482 HydrophobicContact CD1-CD2 4Å; L445-F482 HydrophobicContact CD1-CG 3.69Å; L445-F482 HydrophobicContact CD2-CB 4.24Å; L445-L483 HydrophobicContact CD2-CD1 3.79Å; L445-L483 HydrophobicContact CD2-CD2 3.52Å; L445-L483 HydrophobicContact CD2-CG 3.47Å; L445-L483 VanDerWaalsContact CD2-CG 3.47Å; L445-I512 HydrophobicContact CD2-CD1 3.87Å
446	D	93.7	Very high	82.9	Confident	9 Å²	9	38.3 Å²	38.3	5%	0.048	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-46.5	179.4	-179.6	65.1	0	0	0	111.8	F393 H394 I397 L442 P443 I444 I448 V449 K450	F393-D446 WeakPolarHBondContact CA-OD1 3.38Å; F393-D446 HydrophobicContact CD1-CB 3.69Å; F393-D446 HydrophobicContact CE1-CB 4.21Å; H394-D446 PolarHBondContact N-OD1 3.44Å; I397-D446 HydrophobicContact CD1-CB 3.66Å; I397-D446 VanDerWaalsContact CD1-N 3.25Å; L442-D446 VanDerWaalsContact O-CB 3.3Å; L442-D446 WeakPolarHBondContact O-CB 3.42Å; L442-D446 PolarHBondContact O-N 3.17Å; P443-D446 PolarHBondContact O-N 2.94Å; I444-D446 VanDerWaalsContact C-N 3.35Å; D446-I448 VanDerWaalsContact C-N 3.35Å; D446-I448 PolarHBondContact O-N 2.71Å; D446-V449 PolarHBondContact O-N 2.89Å; D446-K450 VanDerWaalsContact CG-NZ 3.28Å; D446-K450 WeakPolarHBondContact O-CB 3.38Å; D446-K450 WeakPolarHBondContact O-CG 3.35Å; D446-K450 PolarHBondContact O-N 3.36Å; D446-K450 WeakPolarHBondContact OD1-CE 3.14Å; D446-K450 IonicContact OD1-NZ 2.78Å; D446-K450 PolarHBondContact OD1-NZ 3.3Å; D446-K450 VanDerWaalsContact OD1-NZ 3.1Å; D446-K450 WeakPolarHBondContact OD2-CD 3.11Å; D446-K450 VanDerWaalsContact OD2-CE 3.29Å; D446-K450 WeakPolarHBondContact OD2-CE 3.36Å; D446-K450 IonicContact OD2-NZ 3.54Å; D446-K450 PolarHBondContact OD2-NZ 3.35Å
447	S	92.1	Very high	81.1	Confident	22 Å²	22	41.4 Å²	41.4	15%	0.154	25%	0.248	C	C	.	.	H	α-helix	trans	-69.1	-32.6	179.9	-148.7	0	0	0	0	112.7	P443 I444 L445 N451 R535 Y536	P443-S447 WeakPolarHBondContact O-CB 3.39Å; P443-S447 PolarHBondContact O-N 2.92Å; I444-S447 PolarHBondContact O-N 2.99Å; L445-S447 PolarHBondContact O-N 3.4Å; S447-N451 VanDerWaalsContact O-CB 3.24Å; S447-N451 WeakPolarHBondContact O-CB 3.3Å; S447-N451 VanDerWaalsContact O-CG 3.29Å; S447-N451 PolarHBondContact O-N 3.16Å; S447-N451 VanDerWaalsContact O-N 3.09Å; S447-N451 PolarHBondContact O-ND2 3.26Å; S447-N451 PolarHBondContact OG-ND2 3.16Å; S447-R535 PolarHBondContact OG-NH2 3.1Å; S447-Y536 WeakPolarHBondContact CB-OH 3.42Å; S447-Y536 PolarHBondContact OG-OH 2.95Å; S447-Y536 VanDerWaalsContact OG-OH 3.06Å
448	I	90.2	Very high	79.6	Confident	8 Å²	8	49.2 Å²	49.2	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-68.2	-42.1	172.4	-71.2	167.9	0	0	0	110.8	I444 L445 D446 T461 Y488 I512	I444-I448 HydrophobicContact CG2-CD1 3.83Å; I444-I448 VanDerWaalsContact O-CG1 3.3Å; I444-I448 WeakPolarHBondContact O-CG1 3.19Å; I444-I448 PolarHBondContact O-N 2.89Å; L445-I448 PolarHBondContact O-N 3.27Å; D446-I448 VanDerWaalsContact C-N 3.35Å; D446-I448 PolarHBondContact O-N 2.71Å; I448-T461 HydrophobicContact CD1-CG2 4.33Å; I448-T461 HydrophobicContact CG1-CG2 3.97Å; I448-Y488 HydrophobicContact CG2-CD1 3.59Å; I448-Y488 HydrophobicContact CG2-CD2 3.65Å; I448-Y488 HydrophobicContact CG2-CE1 3.83Å; I448-Y488 HydrophobicContact CG2-CE2 3.87Å; I448-Y488 HydrophobicContact CG2-CG 3.48Å; I448-Y488 VanDerWaalsContact CG2-CG 3.48Å; I448-Y488 WeakPolarHBondContact O-CE2 3.43Å; I448-Y488 PolarHBondContact O-OH 3.43Å; I448-I512 HydrophobicContact CD1-CD1 3.94Å; I448-I512 HydrophobicContact CD1-CG1 3.6Å
449	V	89.2	Confident	78.9	Confident	17 Å²	17	54.1 Å²	54.1	10%	0.103	29%	0.287	C	S	.	.	H	α-helix	trans	-72.1	-41.5	-178.9	175.7	0	0	0	0	112.1	H394 L396 L445 D446 L483 T486 Y488	H394-V449 HydrophobicContact CB-CG1 4.15Å; H394-V449 WeakPolarHBondContact ND1-CG1 3.45Å; L396-V449 HydrophobicContact CD1-CG1 4.36Å; L445-V449 VanDerWaalsContact O-CG2 3.31Å; L445-V449 WeakPolarHBondContact O-CG2 3.14Å; L445-V449 PolarHBondContact O-N 3.15Å; D446-V449 PolarHBondContact O-N 2.89Å; V449-L483 HydrophobicContact CG2-CD2 4.19Å; V449-T486 HydrophobicContact CG2-CG2 4.47Å; V449-Y488 HydrophobicContact CG2-CD2 4.32Å; V449-Y488 HydrophobicContact CG2-CE2 4.37Å
450	K	89	Confident	78.7	Confident	89 Å²	89	54.2 Å²	54.2	39%	0.387	29%	0.287	S	S	.	.	H	α-helix	trans	-70.7	-43.9	178.7	-75.1	176.9	176.8	159.4	0	113.4	N392 H394 D446 N452	N392-K450 WeakPolarHBondContact O-CE 3.32Å; N392-K450 PolarHBondContact O-NZ 3.38Å; H394-K450 HydrophobicContact CB-CG 4.29Å; D446-K450 VanDerWaalsContact CG-NZ 3.28Å; D446-K450 WeakPolarHBondContact O-CB 3.38Å; D446-K450 WeakPolarHBondContact O-CG 3.35Å; D446-K450 PolarHBondContact O-N 3.36Å; D446-K450 WeakPolarHBondContact OD1-CE 3.14Å; D446-K450 IonicContact OD1-NZ 2.78Å; D446-K450 PolarHBondContact OD1-NZ 3.3Å; D446-K450 VanDerWaalsContact OD1-NZ 3.1Å; D446-K450 WeakPolarHBondContact OD2-CD 3.11Å; D446-K450 VanDerWaalsContact OD2-CE 3.29Å; D446-K450 WeakPolarHBondContact OD2-CE 3.36Å; D446-K450 IonicContact OD2-NZ 3.54Å; D446-K450 PolarHBondContact OD2-NZ 3.35Å; K450-N452 PolarHBondContact O-N 3.08Å
451	N	81.3	Confident	78.6	Confident	67 Å²	67	55.5 Å²	55.5	36%	0.358	30%	0.295	S	S	.	.	S	Bend	trans	-80.2	62	177.3	-59.1	-52.3	0	0	0	110	S447 D453 R535	S447-N451 VanDerWaalsContact O-CB 3.24Å; S447-N451 WeakPolarHBondContact O-CB 3.3Å; S447-N451 VanDerWaalsContact O-CG 3.29Å; S447-N451 PolarHBondContact O-N 3.16Å; S447-N451 VanDerWaalsContact O-N 3.09Å; S447-N451 PolarHBondContact O-ND2 3.26Å; S447-N451 PolarHBondContact OG-ND2 3.16Å; N451-D453 PolarHBondContact O-N 2.84Å; N451-R535 PolarHBondContact ND2-NH1 3.1Å; N451-R535 VanDerWaalsContact ND2-NH1 3.18Å; N451-R535 PolarHBondContact ND2-NH2 2.72Å
452	N	64.2	Low	78.6	Confident	102 Å²	102	55.3 Å²	55.3	55%	0.545	29%	0.294	S	S	.	.			trans	-73.9	65.3	-176	-172.1	14.2	0	0	0	111.7	K450 G454 Q487 Y488	K450-N452 PolarHBondContact O-N 3.08Å; N452-G454 PolarHBondContact O-N 3.16Å; N452-Q487 PolarHBondContact OD1-NE2 2.76Å; N452-Q487 VanDerWaalsContact OD1-NE2 3.16Å; N452-Y488 WeakPolarHBondContact CA-OH 3.3Å; N452-Y488 PolarHBondContact OD1-OH 3.42Å
453	D	56.5	Low	78.7	Confident	116 Å²	116	55.1 Å²	55.1	62%	0.62	29%	0.293	S	S	*	.			trans	-65.9	-11.3	-172.6	-72.7	-13	0	0	0	113.1	N451 L455	N451-D453 PolarHBondContact O-N 2.84Å; D453-L455 WeakPolarHBondContact O-CB 3.15Å; D453-L455 PolarHBondContact O-N 3.11Å
454	G	52.8	Low	78.8	Confident	56 Å²	56	54.8 Å²	54.8	58%	0.577	29%	0.291	S	S	*	.	S	Bend	trans	62.5	-7.7	170.3	0	0	0	0	0	117	N452	N452-G454 PolarHBondContact O-N 3.16Å
455	L	46.5	Very low	78.9	Confident	169 Å²	169	54.8 Å²	54.8	89%	0.885	29%	0.291	S	S	*	.	S	Bend	trans	-132.6	2.8	-159.5	-77.8	154.4	0	0	0	114.6	D453	D453-L455 WeakPolarHBondContact O-CB 3.15Å; D453-L455 PolarHBondContact O-N 3.11Å
456	S	47.9	Very low	79	Confident	59 Å²	59	54.8 Å²	54.8	41%	0.413	29%	0.291	S	S	.	.			trans	-134.4	43.3	-177.3	-172	0	0	0	0	114.8	R458	S456-R458 PolarHBondContact O-N 3.38Å
457	S	51.1	Low	78.8	Confident	82 Å²	82	54.5 Å²	54.5	57%	0.573	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	27.8	-176.6	55.8	0	0	0	0	117
458	R	60.6	Low	78.7	Confident	197 Å²	197	53.8 Å²	53.8	74%	0.743	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.1	16.9	-175.3	-67.2	-169.2	177.7	164.8	2	115.5	S456	S456-R458 PolarHBondContact O-N 3.38Å
459	R	78	Confident	78.7	Confident	128 Å²	128	57.3 Å²	57.3	48%	0.483	30%	0.297	S	S	.	.	S	Bend	trans	-121	143.2	177.6	-68.1	-176.6	177.9	167.7	-0.3	110.9	T461 C510	R459-T461 PolarHBondContact O-N 3.04Å; R459-C510 CarbonylContact C-O 3.53Å; R459-C510 VanDerWaalsContact O-O 3.05Å
460	C	90.7	Very high	78.6	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.007	30%	0.295	C	S	.	.			trans	-73.6	108.7	174.4	179.5	0	0	0	0	109.1	A462 C510 V513 I529 G533 C534	C460-A462 PolarHBondContact SG-O 3.21Å; C460-C510 WeakPolarHBondContact CA-O 3.25Å; C460-C510 PolarHBondContact N-O 2.78Å; C460-V513 HydrophobicContact CB-CG2 4.33Å; C460-I529 HydrophobicContact CB-CG2 4.41Å; C460-G533 CarbonylContact O-C 3.59Å; C460-C534 WeakPolarHBondContact O-CA 3.3Å; C460-C534 PolarHBondContact O-N 3.12Å
461	T	92.7	Very high	78.5	Confident	28 Å²	28	53.3 Å²	53.3	17%	0.172	28%	0.279	C	S	.	.	S	Bend	trans	-84.6	-35	178.4	-53.9	0	0	0	0	111.4	I448 R459 D511 R535 Y536	I448-T461 HydrophobicContact CD1-CG2 4.33Å; I448-T461 HydrophobicContact CG1-CG2 3.97Å; R459-T461 PolarHBondContact O-N 3.04Å; T461-D511 WeakPolarHBondContact CA-O 3.37Å; T461-D511 WeakPolarHBondContact CB-O 3.38Å; T461-D511 PolarHBondContact N-O 3.33Å; T461-R535 HydrophobicContact CG2-CG 4.25Å; T461-R535 PolarHBondContact O-N 2.87Å; T461-Y536 PolarHBondContact O-N 2.99Å
462	A	95.6	Very high	79.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	135.1	176.7	0	0	0	0	0	111.9	I444 C460 D511 I512 V513 Y536	I444-A462 HydrophobicContact CD1-CB 4.25Å; I444-A462 HydrophobicContact CG2-CB 3.52Å; C460-A462 PolarHBondContact SG-O 3.21Å; A462-D511 PolarHBondContact N-O 3.45Å; A462-I512 HydrophobicContact CB-CG1 4.3Å; A462-I512 HydrophobicContact CB-CG2 4.35Å; A462-I512 WeakPolarHBondContact O-CA 3.48Å; A462-V513 PolarHBondContact O-N 3.14Å; A462-Y536 WeakPolarHBondContact CA-O 3.44Å; A462-Y536 HydrophobicContact CB-CD2 4.25Å
463	L	97.1	Very high	80.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.6	175.7	-176.1	65.8	0	0	0	109.9	V513 L520 L531 Y536 F537 V538 I557 L561	L463-V513 HydrophobicContact CD1-CB 3.86Å; L463-V513 HydrophobicContact CD1-CG1 3.81Å; L463-L520 HydrophobicContact CD1-CD1 3.86Å; L463-L520 HydrophobicContact CD1-CD2 3.79Å; L463-L520 HydrophobicContact CD1-CG 4.43Å; L463-L520 HydrophobicContact CD2-CD2 4.28Å; L463-L520 HydrophobicContact CG-CD2 4.31Å; L463-L531 HydrophobicContact CD2-CD1 4.1Å; L463-L531 HydrophobicContact CD2-CD2 3.91Å; L463-Y536 PolarHBondContact N-O 2.72Å; L463-F537 HydrophobicContact CB-CD2 4.31Å; L463-F537 HydrophobicContact CD2-CD2 4.1Å; L463-F537 HydrophobicContact CD2-CE2 4.11Å; L463-F537 HydrophobicContact CG-CD2 4.3Å; L463-V538 PolarHBondContact O-N 3.16Å; L463-I557 HydrophobicContact CD2-CG2 3.69Å; L463-L561 HydrophobicContact CD2-CD1 4.39Å
464	V	97.6	Very high	81.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	112	178	-172.7	0	0	0	0	109.2	Y440 V466 I512 V513 V514 G515 V538	Y440-V464 HydrophobicContact CE2-CG1 4.08Å; Y440-V464 HydrophobicContact CE2-CG2 4.35Å; V464-V466 HydrophobicContact CG1-CG1 4.2Å; V464-I512 HydrophobicContact CG2-CG2 4.46Å; V464-V513 PolarHBondContact N-O 3.35Å; V464-V514 HydrophobicContact CB-CB 4.45Å; V464-V514 HydrophobicContact CB-CG1 4.2Å; V464-V514 HydrophobicContact CB-CG2 4.24Å; V464-V514 HydrophobicContact CG1-CG1 4.3Å; V464-V514 HydrophobicContact CG2-CG2 4.44Å; V464-V514 CarbonylContact O-C 3.58Å; V464-V514 WeakPolarHBondContact O-CA 3.41Å; V464-G515 PolarHBondContact O-N 3.33Å; V464-V538 CarbonylContact C-O 3.59Å; V464-V538 WeakPolarHBondContact CA-O 3.44Å; V464-V538 HydrophobicContact CB-CB 4.38Å; V464-V538 HydrophobicContact CG1-CB 4.15Å; V464-V538 HydrophobicContact CG1-CG1 4.15Å; V464-V538 HydrophobicContact CG2-CB 4.15Å; V464-V538 HydrophobicContact CG2-CG2 4.36Å
465	L	97.3	Very high	83.7	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	131.2	177.4	-170.1	68.5	0	0	0	110.4	P517 L520 F537 V538 D540 L545 F554 I557	L465-P517 HydrophobicContact CD1-CB 4.22Å; L465-P517 HydrophobicContact CD1-CG 3.78Å; L465-P517 HydrophobicContact CG-CG 4.27Å; L465-L520 HydrophobicContact CD1-CD2 3.74Å; L465-F537 HydrophobicContact CB-CE2 4.22Å; L465-V538 PolarHBondContact N-O 3.46Å; L465-D540 PolarHBondContact O-N 3.12Å; L465-L545 HydrophobicContact CD2-CD1 3.95Å; L465-L545 HydrophobicContact CG-CD1 4.02Å; L465-L545 HydrophobicContact CG-CD2 4.39Å; L465-F554 HydrophobicContact CD2-CB 4.17Å; L465-F554 HydrophobicContact CD2-CD2 3.72Å; L465-F554 HydrophobicContact CD2-CG 4.43Å; L465-I557 HydrophobicContact CD1-CD1 3.72Å; L465-I557 HydrophobicContact CD2-CD1 4.46Å
466	V	94.7	Very high	86	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.153	C	C	.	.			trans	-141.5	149	-178.2	-66.2	0	0	0	0	112.8	V464 L471 A472 I475 V514 G515 T516 P517 D540	V464-V466 HydrophobicContact CG1-CG1 4.2Å; V466-L471 HydrophobicContact CB-CD2 4.07Å; V466-L471 HydrophobicContact CB-CG 4.22Å; V466-L471 HydrophobicContact CG1-CD2 4.07Å; V466-L471 HydrophobicContact CG1-CG 4.12Å; V466-A472 HydrophobicContact CG2-CB 3.52Å; V466-I475 HydrophobicContact CG1-CD1 3.71Å; V466-V514 HydrophobicContact CG2-CG1 4.34Å; V466-G515 PolarHBondContact N-O 3.5Å; V466-G515 VanDerWaalsContact N-O 3.07Å; V466-T516 WeakPolarHBondContact O-CA 3.13Å; V466-P517 VanDerWaalsContact O-CD 3.23Å; V466-P517 WeakPolarHBondContact O-CD 3.43Å; V466-D540 HydrophobicContact CG1-CB 4.15Å
467	P	90.8	Very high	88	Confident	4 Å²	4	30.3 Å²	30.3	3%	0.026	14%	0.138	C	C	.	.	S	Bend	trans	-70.6	-35.9	-175.6	26.9	-36.7	0	0	0	114.2	D540 E541 R544 L545 M548	P467-D540 VanDerWaalsContact CD-O 3.28Å; P467-D540 WeakPolarHBondContact CD-O 3.38Å; P467-E541 HydrophobicContact CG-CB 3.72Å; P467-E541 WeakPolarHBondContact CG-OE2 3.26Å; P467-R544 HydrophobicContact CB-CB 4.25Å; P467-R544 HydrophobicContact CG-CB 4.07Å; P467-L545 HydrophobicContact CB-CD2 4.07Å; P467-L545 HydrophobicContact CB-CG 4.16Å; P467-M548 HydrophobicContact CB-SD 3.85Å
468	T	88.7	Confident	89.8	Confident	6 Å²	6	28.9 Å²	28.9	4%	0.037	13%	0.126	C	C	.	.			trans	-117.6	150.1	-172.4	72.6	0	0	0	0	113.4	E470 L471 A472 M548 R697	T468-E470 PolarHBondContact O-N 3.06Å; T468-L471 PolarHBondContact O-N 3.43Å; T468-L471 WeakPolarHBondContact OG1-CB 3.33Å; T468-L471 PolarHBondContact OG1-N 3.37Å; T468-A472 PolarHBondContact O-N 2.84Å; T468-A472 VanDerWaalsContact O-N 3.13Å; T468-M548 HydrophobicContact CG2-SD 4.47Å; T468-R697 HydrophobicContact CG2-CB 4.09Å; T468-R697 VanDerWaalsContact CG2-O 3.25Å; T468-R697 WeakPolarHBondContact CG2-O 3.4Å; T468-R697 PolarHBondContact OG1-O 3.24Å; T468-R697 VanDerWaalsContact OG1-O 3.04Å
469	R	90.3	Very high	91.3	Very high	83 Å²	83	19.5 Å²	19.5	31%	0.313	9%	0.09	S	C	.	.	H	α-helix	trans	-65.4	-35.6	-177.4	-52.6	174.3	-177.9	168.3	4.9	110.8	A472 I473 Y494 G495 T516	R469-A472 WeakPolarHBondContact O-CB 3.31Å; R469-A472 PolarHBondContact O-N 3.05Å; R469-I473 VanDerWaalsContact O-CG1 3.27Å; R469-I473 WeakPolarHBondContact O-CG1 3.3Å; R469-I473 PolarHBondContact O-N 3.17Å; R469-Y494 HydrophobicContact CB-CD2 3.77Å; R469-Y494 HydrophobicContact CB-CG 4.13Å; R469-Y494 HydrophobicContact CG-CD2 4.14Å; R469-G495 VanDerWaalsContact CD-O 3.27Å; R469-G495 WeakPolarHBondContact CD-O 3.47Å; R469-G495 PolarHBondContact NE-O 3.19Å; R469-T516 HydrophobicContact CB-CG2 4.41Å; R469-T516 HydrophobicContact CG-CG2 4.1Å
470	E	86.6	Confident	91.9	Very high	13 Å²	13	17.1 Å²	17.1	6%	0.061	9%	0.086	C	C	.	.	H	α-helix	trans	-70.8	-39.3	-176.5	-67.7	57.4	-129.8	0	0	111.3	T468 I473 Q474 Q671 R674 L678 L699	T468-E470 PolarHBondContact O-N 3.06Å; E470-I473 PolarHBondContact O-N 3.33Å; E470-Q474 WeakPolarHBondContact O-CB 3.4Å; E470-Q474 PolarHBondContact O-N 3.47Å; E470-Q671 PolarHBondContact OE1-NE2 3.02Å; E470-R674 IonicContact OE1-CZ 3.73Å; E470-R674 VanDerWaalsContact OE1-CZ 3.31Å; E470-R674 IonicContact OE1-NH1 3.48Å; E470-R674 PolarHBondContact OE1-NH1 2.84Å; E470-R674 IonicContact OE1-NH2 3.24Å; E470-R674 PolarHBondContact OE1-NH2 2.84Å; E470-R674 IonicContact OE2-CZ 2.75Å; E470-R674 VanDerWaalsContact OE2-CZ 3.3Å; E470-R674 IonicContact OE2-NH1 3.13Å; E470-R674 PolarHBondContact OE2-NH1 2.79Å; E470-R674 IonicContact OE2-NH2 3.56Å; E470-R674 PolarHBondContact OE2-NH2 3.42Å; E470-L678 HydrophobicContact CB-CD1 4.18Å; E470-L678 HydrophobicContact CG-CD1 3.41Å; E470-L678 VanDerWaalsContact CG-CD1 3.41Å; E470-L699 HydrophobicContact CB-CD2 3.45Å; E470-L699 VanDerWaalsContact CB-CD2 3.45Å; E470-L699 HydrophobicContact CG-CD2 3.81Å
471	L	88.2	Confident	91.8	Very high	9 Å²	9	18 Å²	18	5%	0.047	9%	0.091	C	C	.	.	H	α-helix	trans	-65.8	-39.6	170.5	-177.1	56.4	0	0	0	111.5	V466 T468 I473 Q474 I475 E541	V466-L471 HydrophobicContact CB-CD2 4.07Å; V466-L471 HydrophobicContact CB-CG 4.22Å; V466-L471 HydrophobicContact CG1-CD2 4.07Å; V466-L471 HydrophobicContact CG1-CG 4.12Å; T468-L471 PolarHBondContact O-N 3.43Å; T468-L471 WeakPolarHBondContact OG1-CB 3.33Å; T468-L471 PolarHBondContact OG1-N 3.37Å; L471-I473 VanDerWaalsContact C-N 3.34Å; L471-I473 PolarHBondContact O-N 2.89Å; L471-Q474 PolarHBondContact O-N 3.19Å; L471-I475 HydrophobicContact CD1-CD1 3.69Å; L471-I475 HydrophobicContact CD1-CG1 4.06Å; L471-I475 HydrophobicContact CG-CD1 3.77Å; L471-I475 PolarHBondContact O-N 2.88Å; L471-E541 HydrophobicContact CD2-CG 4.05Å
472	A	93	Very high	91.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60.8	-43.2	175.5	0	0	0	0	0	112.3	V466 T468 R469 N476 V514 T516	V466-A472 HydrophobicContact CG2-CB 3.52Å; T468-A472 PolarHBondContact O-N 2.84Å; T468-A472 VanDerWaalsContact O-N 3.13Å; R469-A472 WeakPolarHBondContact O-CB 3.31Å; R469-A472 PolarHBondContact O-N 3.05Å; A472-N476 WeakPolarHBondContact O-CB 3.33Å; A472-N476 PolarHBondContact O-N 2.84Å; A472-V514 HydrophobicContact CB-CG1 4.12Å; A472-T516 HydrophobicContact CB-CG2 4.35Å
473	I	91.2	Very high	91.2	Very high	22 Å²	22	17.8 Å²	17.8	11%	0.113	9%	0.088	C	C	.	.	H	α-helix	trans	-59.9	-50.5	173.8	-69.3	163.9	0	0	0	109.7	M351 R469 E470 L471 N476 T477 Y494 E675	M351-I473 HydrophobicContact CE-CG2 3.36Å; R469-I473 VanDerWaalsContact O-CG1 3.27Å; R469-I473 WeakPolarHBondContact O-CG1 3.3Å; R469-I473 PolarHBondContact O-N 3.17Å; E470-I473 PolarHBondContact O-N 3.33Å; L471-I473 VanDerWaalsContact C-N 3.34Å; L471-I473 PolarHBondContact O-N 2.89Å; I473-N476 WeakPolarHBondContact O-CB 3.38Å; I473-N476 PolarHBondContact O-N 3.05Å; I473-T477 PolarHBondContact O-N 3.23Å; I473-T477 PolarHBondContact O-OG1 2.67Å; I473-Y494 HydrophobicContact CD1-CE1 4.12Å; I473-Y494 HydrophobicContact CD1-CE2 3.9Å; I473-Y494 HydrophobicContact CG1-CD1 4.23Å; I473-Y494 HydrophobicContact CG1-CE1 3.58Å; I473-Y494 HydrophobicContact CG1-CE2 4.27Å; I473-E675 HydrophobicContact CD1-CG 4.15Å
474	Q	88	Confident	90.6	Very high	37 Å²	37	24 Å²	24	17%	0.173	11%	0.111	C	C	.	.	H	α-helix	trans	-58.6	-52.8	-177.2	177.6	-171.5	-31.9	0	0	113.5	E470 L471 N476 T477 V478 D700	E470-Q474 WeakPolarHBondContact O-CB 3.4Å; E470-Q474 PolarHBondContact O-N 3.47Å; L471-Q474 PolarHBondContact O-N 3.19Å; Q474-N476 VanDerWaalsContact C-N 3.28Å; Q474-N476 PolarHBondContact O-N 3.34Å; Q474-T477 WeakPolarHBondContact O-CB 3.45Å; Q474-T477 PolarHBondContact O-N 2.88Å; Q474-T477 VanDerWaalsContact O-N 3.08Å; Q474-V478 PolarHBondContact O-N 2.64Å; Q474-V478 VanDerWaalsContact O-N 3.08Å; Q474-D700 PolarHBondContact NE2-OD2 3.4Å
475	I	92.1	Very high	89.9	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-64.2	-38.6	-178.7	-64.8	156.6	0	0	0	110.2	T437 Y440 V466 L471 T477 V478 G479 V514	T437-I475 HydrophobicContact CG2-CG1 4Å; T437-I475 HydrophobicContact CG2-CG2 4.35Å; Y440-I475 HydrophobicContact CE2-CG2 4.32Å; Y440-I475 VanDerWaalsContact OH-CD1 3.31Å; Y440-I475 WeakPolarHBondContact OH-CD1 3.16Å; V466-I475 HydrophobicContact CG1-CD1 3.71Å; L471-I475 HydrophobicContact CD1-CD1 3.69Å; L471-I475 HydrophobicContact CD1-CG1 4.06Å; L471-I475 HydrophobicContact CG-CD1 3.77Å; L471-I475 PolarHBondContact O-N 2.88Å; I475-T477 PolarHBondContact O-N 3.44Å; I475-V478 PolarHBondContact O-N 3.45Å; I475-G479 PolarHBondContact O-N 3.05Å; I475-V514 HydrophobicContact CB-CG1 4.08Å; I475-V514 HydrophobicContact CG2-CG1 4.23Å; I475-V514 HydrophobicContact CG2-CG2 4.06Å
476	N	93.9	Very high	89.4	Confident	10 Å²	10	31.5 Å²	31.5	5%	0.053	15%	0.149	C	C	.	.	H	α-helix	trans	-60.9	-41.5	171.9	169.3	96.1	0	0	0	111.9	A472 I473 Q474 V478 G479 M480 T490 V491 A492 V514	A472-N476 WeakPolarHBondContact O-CB 3.33Å; A472-N476 PolarHBondContact O-N 2.84Å; I473-N476 WeakPolarHBondContact O-CB 3.38Å; I473-N476 PolarHBondContact O-N 3.05Å; Q474-N476 VanDerWaalsContact C-N 3.28Å; Q474-N476 PolarHBondContact O-N 3.34Å; N476-V478 VanDerWaalsContact C-N 3.35Å; N476-V478 PolarHBondContact O-N 3.06Å; N476-G479 PolarHBondContact O-N 3.34Å; N476-M480 WeakPolarHBondContact ND2-CE 3.32Å; N476-M480 PolarHBondContact ND2-SD 3.41Å; N476-M480 VanDerWaalsContact ND2-SD 3.42Å; N476-M480 WeakPolarHBondContact O-CG 3.25Å; N476-M480 PolarHBondContact O-N 3.18Å; N476-T490 WeakPolarHBondContact O-CG2 3.19Å; N476-T490 PolarHBondContact OD1-OG1 3.09Å; N476-V491 VanDerWaalsContact OD1-C 3.28Å; N476-V491 WeakPolarHBondContact OD1-CA 3.42Å; N476-V491 PolarHBondContact OD1-N 3.26Å; N476-A492 HydrophobicContact CB-CB 3.81Å; N476-A492 PolarHBondContact OD1-N 3.14Å; N476-V514 HydrophobicContact CB-CB 4.36Å; N476-V514 HydrophobicContact CB-CG2 4.21Å
477	T	90.2	Very high	89	Confident	15 Å²	15	37.2 Å²	37.2	9%	0.092	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-45.2	175.8	-58.3	0	0	0	0	111.7	M351 M356 I473 Q474 I475 M480 N481	M351-T477 VanDerWaalsContact CE-OG1 3.27Å; M351-T477 WeakPolarHBondContact CE-OG1 3.44Å; M351-T477 HydrophobicContact SD-CG2 3.71Å; M351-T477 PolarHBondContact SD-OG1 3.2Å; M356-T477 HydrophobicContact CB-CG2 4.33Å; M356-T477 HydrophobicContact CG-CG2 4.01Å; I473-T477 PolarHBondContact O-N 3.23Å; I473-T477 PolarHBondContact O-OG1 2.67Å; Q474-T477 WeakPolarHBondContact O-CB 3.45Å; Q474-T477 PolarHBondContact O-N 2.88Å; Q474-T477 VanDerWaalsContact O-N 3.08Å; I475-T477 PolarHBondContact O-N 3.44Å; T477-M480 PolarHBondContact O-N 3.02Å; T477-N481 PolarHBondContact O-N 3.34Å
478	V	88.8	Confident	89	Confident	52 Å²	52	38.5 Å²	38.5	32%	0.315	18%	0.18	S	C	.	.	H	α-helix	trans	-60.2	-49.1	175.8	-179.5	0	0	0	0	110.1	L441 Q474 I475 N476 M480 N481 F482	L441-V478 HydrophobicContact CD2-CB 4.02Å; L441-V478 HydrophobicContact CD2-CG1 3.6Å; Q474-V478 PolarHBondContact O-N 2.64Å; Q474-V478 VanDerWaalsContact O-N 3.08Å; I475-V478 PolarHBondContact O-N 3.45Å; N476-V478 VanDerWaalsContact C-N 3.35Å; N476-V478 PolarHBondContact O-N 3.06Å; V478-M480 VanDerWaalsContact C-N 3.33Å; V478-M480 PolarHBondContact O-N 2.79Å; V478-N481 PolarHBondContact O-N 2.87Å; V478-F482 HydrophobicContact CG1-CD2 3.87Å; V478-F482 HydrophobicContact CG1-CE2 3.82Å; V478-F482 WeakPolarHBondContact O-CD2 3.46Å; V478-F482 PolarHBondContact O-N 2.82Å; V478-F482 VanDerWaalsContact O-N 3.11Å
479	G	91.7	Very high	89.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.6	-37.6	176	0	0	0	0	0	113.9	I475 N476 L483	I475-G479 PolarHBondContact O-N 3.05Å; N476-G479 PolarHBondContact O-N 3.34Å; G479-L483 WeakPolarHBondContact O-CB 3.12Å; G479-L483 WeakPolarHBondContact O-CG 3.36Å; G479-L483 PolarHBondContact O-N 2.95Å
480	M	90.7	Very high	89.2	Confident	78 Å²	78	38.5 Å²	38.5	38%	0.384	18%	0.18	S	C	.	.	H	α-helix	trans	-65.5	-40.8	176.4	-75.4	-172.5	168.1	0	0	111.6	N476 T477 V478 L483 R484 T490	N476-M480 WeakPolarHBondContact ND2-CE 3.32Å; N476-M480 PolarHBondContact ND2-SD 3.41Å; N476-M480 VanDerWaalsContact ND2-SD 3.42Å; N476-M480 WeakPolarHBondContact O-CG 3.25Å; N476-M480 PolarHBondContact O-N 3.18Å; T477-M480 PolarHBondContact O-N 3.02Å; V478-M480 VanDerWaalsContact C-N 3.33Å; V478-M480 PolarHBondContact O-N 2.79Å; M480-L483 PolarHBondContact O-N 2.95Å; M480-R484 PolarHBondContact O-N 2.81Å; M480-R484 VanDerWaalsContact O-N 3.09Å; M480-T490 HydrophobicContact CB-CG2 4.16Å; M480-T490 HydrophobicContact CE-CG2 4.41Å; M480-T490 VanDerWaalsContact CE-O 3.29Å; M480-T490 WeakPolarHBondContact CE-O 3.42Å; M480-T490 HydrophobicContact CG-CG2 3.35Å; M480-T490 VanDerWaalsContact N-CG2 3.34Å
481	N	87.9	Confident	89.6	Confident	21 Å²	21	38.4 Å²	38.4	11%	0.112	18%	0.18	C	C	.	.	H	α-helix	trans	-62.9	-48	177.3	-170.4	51.5	0	0	0	111.1	M356 T477 V478 L483 R484	M356-N481 HydrophobicContact CB-CB 4.49Å; T477-N481 PolarHBondContact O-N 3.34Å; V478-N481 PolarHBondContact O-N 2.87Å; N481-L483 PolarHBondContact O-N 3.24Å; N481-R484 WeakPolarHBondContact O-CB 3.49Å; N481-R484 PolarHBondContact O-N 2.8Å
482	F	88.6	Confident	89.9	Confident	17 Å²	17	38.7 Å²	38.7	8%	0.075	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-32.5	178.2	-84.4	-82.7	0	0	0	114.1	I397 H400 L401 L442 L445 V478	I397-F482 HydrophobicContact CG2-CD1 4.37Å; I397-F482 HydrophobicContact CG2-CE1 4.12Å; H400-F482 HydrophobicContact CB-CD1 3.52Å; H400-F482 HydrophobicContact CB-CE1 3.45Å; H400-F482 VanDerWaalsContact CB-CE1 3.45Å; H400-F482 HydrophobicContact CB-CG 4.46Å; H400-F482 HydrophobicContact CB-CZ 4.34Å; H400-F482 PolarHBondContact CE1-O 3.27Å; H400-F482 VanDerWaalsContact CE1-O 3.32Å; H400-F482 PolarHBondContact ND1-O 2.89Å; L401-F482 HydrophobicContact CD2-CE1 4.42Å; L401-F482 HydrophobicContact CD2-CZ 4.09Å; L401-F482 HydrophobicContact CG-CE1 4.38Å; L442-F482 HydrophobicContact CD2-CE1 3.85Å; L442-F482 HydrophobicContact CD2-CE2 4.31Å; L442-F482 HydrophobicContact CD2-CZ 3.73Å; L445-F482 HydrophobicContact CD1-CB 3.57Å; L445-F482 HydrophobicContact CD1-CD1 4.23Å; L445-F482 HydrophobicContact CD1-CD2 4Å; L445-F482 HydrophobicContact CD1-CG 3.69Å; L445-F482 HydrophobicContact CD2-CB 4.24Å; V478-F482 HydrophobicContact CG1-CD2 3.87Å; V478-F482 HydrophobicContact CG1-CE2 3.82Å; V478-F482 WeakPolarHBondContact O-CD2 3.46Å; V478-F482 PolarHBondContact O-N 2.82Å; V478-F482 VanDerWaalsContact O-N 3.11Å
483	L	88.3	Confident	90.1	Very high	6 Å²	6	38.7 Å²	38.7	3%	0.031	18%	0.183	C	C	.	.	H	α-helix	trans	-94.7	1.2	-177.2	-66.1	179	0	0	0	114.6	L445 V449 G479 M480 N481 E485 T486 I512	L445-L483 HydrophobicContact CD2-CD1 3.79Å; L445-L483 HydrophobicContact CD2-CD2 3.52Å; L445-L483 HydrophobicContact CD2-CG 3.47Å; L445-L483 VanDerWaalsContact CD2-CG 3.47Å; V449-L483 HydrophobicContact CG2-CD2 4.19Å; G479-L483 WeakPolarHBondContact O-CB 3.12Å; G479-L483 WeakPolarHBondContact O-CG 3.36Å; G479-L483 PolarHBondContact O-N 2.95Å; M480-L483 PolarHBondContact O-N 2.95Å; N481-L483 PolarHBondContact O-N 3.24Å; L483-E485 PolarHBondContact O-N 3.25Å; L483-E485 VanDerWaalsContact O-N 3.1Å; L483-T486 HydrophobicContact CD2-CG2 4.34Å; L483-T486 WeakPolarHBondContact O-CB 3.41Å; L483-T486 PolarHBondContact O-N 3.34Å; L483-T486 PolarHBondContact O-OG1 2.93Å; L483-I512 HydrophobicContact CD1-CD1 4.19Å
484	R	84.1	Confident	90.3	Very high	131 Å²	131	38.1 Å²	38.1	49%	0.494	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-36.4	-171.3	-175.9	-179.1	175.5	-157.7	5.6	114.7	E353 M480 N481 T486	E353-R484 IonicContact OE1-CZ 2.77Å; E353-R484 IonicContact OE1-NE 3.03Å; E353-R484 PolarHBondContact OE1-NE 2.76Å; E353-R484 IonicContact OE1-NH1 3.66Å; E353-R484 IonicContact OE1-NH2 2.87Å; E353-R484 PolarHBondContact OE1-NH2 2.77Å; E353-R484 IonicContact OE2-CZ 2.69Å; E353-R484 IonicContact OE2-NE 3.28Å; E353-R484 IonicContact OE2-NH1 3.38Å; E353-R484 PolarHBondContact OE2-NH1 3.43Å; E353-R484 IonicContact OE2-NH2 3.99Å; E353-R484 PolarHBondContact OE2-NH2 3.14Å; M480-R484 PolarHBondContact O-N 2.81Å; M480-R484 VanDerWaalsContact O-N 3.09Å; N481-R484 WeakPolarHBondContact O-CB 3.49Å; N481-R484 PolarHBondContact O-N 2.8Å; R484-T486 VanDerWaalsContact C-N 3.33Å
485	E	83.8	Confident	90.5	Very high	120 Å²	120	37 Å²	37	56%	0.561	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	14.8	-178	-62.7	177.6	-171.8	0	0	112.5	L483	L483-E485 PolarHBondContact O-N 3.25Å; L483-E485 VanDerWaalsContact O-N 3.1Å
486	T	86.5	Confident	90.4	Very high	37 Å²	37	37.8 Å²	37.8	23%	0.227	19%	0.187	C	C	.	.	S	Bend	trans	-121	168.7	-176.2	80.3	0	0	0	0	112.5	L396 V449 L483 R484 Y488	L396-T486 HydrophobicContact CD1-CG2 4.14Å; V449-T486 HydrophobicContact CG2-CG2 4.47Å; L483-T486 HydrophobicContact CD2-CG2 4.34Å; L483-T486 WeakPolarHBondContact O-CB 3.41Å; L483-T486 PolarHBondContact O-N 3.34Å; L483-T486 PolarHBondContact O-OG1 2.93Å; R484-T486 VanDerWaalsContact C-N 3.33Å; T486-Y488 VanDerWaalsContact C-N 3.28Å; T486-Y488 PolarHBondContact OG1-N 2.65Å
487	Q	86.3	Confident	90.4	Very high	120 Å²	120	37.3 Å²	37.3	56%	0.561	18%	0.184	S	C	*	.	S	Bend	trans	-77.1	-13	171.5	64.2	-176.3	-18.7	0	0	113.9	N452	N452-Q487 PolarHBondContact OD1-NE2 2.76Å; N452-Q487 VanDerWaalsContact OD1-NE2 3.16Å
488	Y	90	Very high	90.5	Very high	31 Å²	31	37.4 Å²	37.4	12%	0.122	19%	0.185	C	C	.	.			trans	-84	149.9	-173.4	-55.5	-65.2	0	0	0	112	I448 V449 N452 T486 D511	I448-Y488 HydrophobicContact CG2-CD1 3.59Å; I448-Y488 HydrophobicContact CG2-CD2 3.65Å; I448-Y488 HydrophobicContact CG2-CE1 3.83Å; I448-Y488 HydrophobicContact CG2-CE2 3.87Å; I448-Y488 HydrophobicContact CG2-CG 3.48Å; I448-Y488 VanDerWaalsContact CG2-CG 3.48Å; I448-Y488 WeakPolarHBondContact O-CE2 3.43Å; I448-Y488 PolarHBondContact O-OH 3.43Å; V449-Y488 HydrophobicContact CG2-CD2 4.32Å; V449-Y488 HydrophobicContact CG2-CE2 4.37Å; N452-Y488 WeakPolarHBondContact CA-OH 3.3Å; N452-Y488 PolarHBondContact OD1-OH 3.42Å; T486-Y488 VanDerWaalsContact C-N 3.28Å; T486-Y488 PolarHBondContact OG1-N 2.65Å; Y488-D511 WeakPolarHBondContact CA-OD2 3.41Å; Y488-D511 HydrophobicContact CD1-CB 4.43Å
489	R	90.5	Very high	90.8	Very high	83 Å²	83	37 Å²	37	31%	0.313	18%	0.183	S	C	.	.			trans	-139.2	125.8	-168.7	-44.8	-166.5	-42.6	131.1	25	111.1	S505 K508 G509 D511 I512	R489-S505 PolarHBondContact NH2-O 2.7Å; R489-K508 PolarHBondContact NE-O 3.1Å; R489-K508 PolarHBondContact NH2-O 3.04Å; R489-G509 PolarHBondContact NH2-O 3.32Å; R489-D511 PolarHBondContact N-OD2 3.19Å; R489-D511 PolarHBondContact O-N 3.25Å; R489-I512 PolarHBondContact O-N 3.37Å
490	T	93	Very high	90.8	Very high	5 Å²	5	42 Å²	42	3%	0.031	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	148	167.1	-178.7	0	0	0	0	110.9	N476 M480 I512	N476-T490 WeakPolarHBondContact O-CG2 3.19Å; N476-T490 PolarHBondContact OD1-OG1 3.09Å; M480-T490 HydrophobicContact CB-CG2 4.16Å; M480-T490 HydrophobicContact CE-CG2 4.41Å; M480-T490 VanDerWaalsContact CE-O 3.29Å; M480-T490 WeakPolarHBondContact CE-O 3.42Å; M480-T490 HydrophobicContact CG-CG2 3.35Å; M480-T490 VanDerWaalsContact N-CG2 3.34Å; T490-I512 CarbonylContact C-O 3.58Å; T490-I512 VanDerWaalsContact CA-O 3.25Å; T490-I512 WeakPolarHBondContact CA-O 3.25Å
491	V	94.3	Very high	91	Very high	11 Å²	11	42.2 Å²	42.2	7%	0.067	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	124.6	179.4	-175	0	0	0	0	111.5	N476 V493 I506 C510 I512 V514	N476-V491 VanDerWaalsContact OD1-C 3.28Å; N476-V491 WeakPolarHBondContact OD1-CA 3.42Å; N476-V491 PolarHBondContact OD1-N 3.26Å; V491-V493 HydrophobicContact CG1-CG2 4.22Å; V491-I506 HydrophobicContact CG1-CG1 3.98Å; V491-C510 HydrophobicContact CB-CB 4.41Å; V491-C510 HydrophobicContact CG2-CB 3.85Å; V491-I512 PolarHBondContact N-O 3.36Å; V491-V514 PolarHBondContact O-N 2.8Å
492	A	95.5	Very high	91.3	Very high	15 Å²	15	41.3 Å²	41.3	12%	0.124	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.6	171.1	0	0	0	0	0	112.4	N476 Y494 V514	N476-A492 HydrophobicContact CB-CB 3.81Å; N476-A492 PolarHBondContact OD1-N 3.14Å; A492-Y494 HydrophobicContact CB-CD1 3.87Å; A492-Y494 HydrophobicContact CB-CE1 3.78Å; A492-V514 CarbonylContact C-O 3.56Å; A492-V514 VanDerWaalsContact CA-O 3.3Å; A492-V514 WeakPolarHBondContact CA-O 3.49Å
493	V	96.5	Very high	91.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	93.2	-173.4	178.1	0	0	0	0	110.4	V491 I506 V513 V514 G515 T516 R519 F523 I529	V491-V493 HydrophobicContact CG1-CG2 4.22Å; V493-I506 HydrophobicContact CG2-CD1 3.97Å; V493-V513 HydrophobicContact CB-CG1 4.24Å; V493-V513 HydrophobicContact CG2-CG1 3.77Å; V493-V514 PolarHBondContact N-O 2.71Å; V493-G515 WeakPolarHBondContact O-CA 3.48Å; V493-T516 PolarHBondContact O-N 3.38Å; V493-R519 HydrophobicContact CG1-CG 3.79Å; V493-F523 HydrophobicContact CG1-CD2 3.61Å; V493-F523 HydrophobicContact CG1-CE2 4.04Å; V493-F523 HydrophobicContact CG1-CG 4.22Å; V493-I529 HydrophobicContact CG1-CD1 4.33Å; V493-I529 HydrophobicContact CG2-CD1 4.27Å
494	Y	95.3	Very high	91.7	Very high	10 Å²	10	44.5 Å²	44.5	4%	0.039	22%	0.215	C	C	.	.			trans	-143.4	155.6	-171.6	63.3	-86.6	0	0	0	114.4	P348 R469 I473 A492 V497 Q502 T516 R519 Q671 E675	P348-Y494 VanDerWaalsContact CG-OH 3.25Å; P348-Y494 WeakPolarHBondContact CG-OH 3.48Å; R469-Y494 HydrophobicContact CB-CD2 3.77Å; R469-Y494 HydrophobicContact CB-CG 4.13Å; R469-Y494 HydrophobicContact CG-CD2 4.14Å; I473-Y494 HydrophobicContact CD1-CE1 4.12Å; I473-Y494 HydrophobicContact CD1-CE2 3.9Å; I473-Y494 HydrophobicContact CG1-CD1 4.23Å; I473-Y494 HydrophobicContact CG1-CE1 3.58Å; I473-Y494 HydrophobicContact CG1-CE2 4.27Å; A492-Y494 HydrophobicContact CB-CD1 3.87Å; A492-Y494 HydrophobicContact CB-CE1 3.78Å; Y494-V497 HydrophobicContact CD2-CG2 4.11Å; Y494-V497 HydrophobicContact CE2-CB 4.39Å; Y494-V497 HydrophobicContact CE2-CG2 3.35Å; Y494-Q502 VanDerWaalsContact N-NE2 3.17Å; Y494-Q502 PolarHBondContact O-NE2 3.47Å; Y494-Q502 PolarHBondContact O-OE1 3.17Å; Y494-T516 WeakPolarHBondContact CA-OG1 3.3Å; Y494-R519 PolarHBondContact O-NH1 3.44Å; Y494-Q671 HydrophobicContact CE2-CG 4.15Å; Y494-E675 PolarHBondContact OH-OE1 2.9Å
495	G	93.1	Very high	92	Very high	14 Å²	14	39.4 Å²	39.4	14%	0.144	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	162.4	-179.5	0	0	0	0	0	113.8	R469 V497	R469-G495 VanDerWaalsContact CD-O 3.27Å; R469-G495 WeakPolarHBondContact CD-O 3.47Å; R469-G495 PolarHBondContact NE-O 3.19Å; G495-V497 VanDerWaalsContact C-N 3.28Å; G495-V497 PolarHBondContact O-N 2.77Å
496	G	90.7	Very high	92.4	Very high	17 Å²	17	34.1 Å²	34.1	18%	0.175	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	0.7	-178.3	0	0	0	0	0	115	V344 Q671	V344-G496 VanDerWaalsContact CG1-C 3.49Å; V344-G496 WeakPolarHBondContact CG1-O 3.49Å; G496-Q671 WeakPolarHBondContact O-CB 3.36Å
497	V	92.6	Very high	92.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-115.5	152.7	172.4	169.4	0	0	0	0	110.6	Y346 P348 Y494 G495 V499 Y501 Q502 R519 Q671	Y346-V497 HydrophobicContact CD1-CG2 3.88Å; Y346-V497 HydrophobicContact CE1-CG2 4.22Å; P348-V497 HydrophobicContact CG-CG1 4.13Å; P348-V497 HydrophobicContact CG-CG2 3.63Å; Y494-V497 HydrophobicContact CD2-CG2 4.11Å; Y494-V497 HydrophobicContact CE2-CB 4.39Å; Y494-V497 HydrophobicContact CE2-CG2 3.35Å; G495-V497 VanDerWaalsContact C-N 3.28Å; G495-V497 PolarHBondContact O-N 2.77Å; V497-V499 PolarHBondContact O-N 2.59Å; V497-Y501 HydrophobicContact CG1-CD1 3.81Å; V497-Y501 HydrophobicContact CG1-CE1 4.46Å; V497-Q502 HydrophobicContact CG1-CG 3.86Å; V497-R519 PolarHBondContact O-NH1 3.39Å; V497-R519 PolarHBondContact O-NH2 3.33Å; V497-Q671 HydrophobicContact CG2-CG 4.44Å
498	S	93.3	Very high	92.6	Very high	17 Å²	17	40.6 Å²	40.6	12%	0.119	19%	0.194	C	C	.	.			trans	-52.5	122.6	174.4	173	0	0	0	0	112.6	V344 Y346 M500 Y501 Q502	V344-S498 WeakPolarHBondContact O-CA 3.25Å; Y346-S498 WeakPolarHBondContact O-CB 3.36Å; Y346-S498 PolarHBondContact O-N 3.05Å; S498-M500 VanDerWaalsContact C-N 3.26Å; S498-M500 PolarHBondContact O-N 2.91Å; S498-M500 PolarHBondContact OG-N 3.41Å; S498-Y501 PolarHBondContact O-N 3.33Å; S498-Y501 PolarHBondContact OG-N 3.06Å; S498-Q502 PolarHBondContact O-N 3.45Å; S498-Q502 VanDerWaalsContact O-N 3.13Å
499	V	93.7	Very high	92.4	Very high	45 Å²	45	39.2 Å²	39.2	27%	0.273	19%	0.19	S	C	.	.	H	α-helix	trans	-60.6	-38.1	175.4	169.8	0	0	0	0	110.8	V497 S503 F523 Y528	V497-V499 PolarHBondContact O-N 2.59Å; V499-S503 VanDerWaalsContact O-CB 3.26Å; V499-S503 WeakPolarHBondContact O-CB 3.37Å; V499-S503 PolarHBondContact O-N 3.04Å; V499-S503 PolarHBondContact O-OG 3.1Å; V499-F523 HydrophobicContact CB-CE1 4.45Å; V499-F523 HydrophobicContact CG1-CE1 3.83Å; V499-F523 HydrophobicContact CG1-CZ 4.17Å; V499-F523 HydrophobicContact CG2-CE1 4.29Å; V499-Y528 HydrophobicContact CG1-CE2 4.09Å
500	M	93.2	Very high	92.4	Very high	104 Å²	104	35.6 Å²	35.6	51%	0.512	18%	0.177	S	C	.	.	H	α-helix	trans	-67	-38.5	179	-170.3	61.4	175	0	0	111.4	S498 S503 Q504	S498-M500 VanDerWaalsContact C-N 3.26Å; S498-M500 PolarHBondContact O-N 2.91Å; S498-M500 PolarHBondContact OG-N 3.41Å; M500-S503 PolarHBondContact O-OG 3.43Å; M500-Q504 HydrophobicContact CE-CG 4.3Å; M500-Q504 WeakPolarHBondContact O-CB 3.35Å; M500-Q504 WeakPolarHBondContact O-CG 3.32Å; M500-Q504 PolarHBondContact O-N 2.88Å
501	Y	93.7	Very high	92.3	Very high	83 Å²	83	35.9 Å²	35.9	33%	0.325	18%	0.178	S	C	.	.	H	α-helix	trans	-64.3	-54.3	175.9	170.2	-99.8	0	0	0	111.9	V347 V497 S498 S503 Q504 S505	V347-Y501 HydrophobicContact CG1-CD1 4.4Å; V347-Y501 HydrophobicContact CG1-CD2 3.55Å; V347-Y501 HydrophobicContact CG1-CE1 4.48Å; V347-Y501 HydrophobicContact CG1-CE2 3.61Å; V347-Y501 HydrophobicContact CG1-CG 3.96Å; V347-Y501 HydrophobicContact CG2-CD2 4.32Å; V347-Y501 HydrophobicContact CG2-CG 4.22Å; V497-Y501 HydrophobicContact CG1-CD1 3.81Å; V497-Y501 HydrophobicContact CG1-CE1 4.46Å; S498-Y501 PolarHBondContact O-N 3.33Å; S498-Y501 PolarHBondContact OG-N 3.06Å; Y501-S503 PolarHBondContact O-N 3.23Å; Y501-Q504 PolarHBondContact O-N 3.49Å; Y501-S505 PolarHBondContact O-N 3.41Å; Y501-S505 PolarHBondContact O-OG 3.06Å
502	Q	93.8	Very high	92.4	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.009	18%	0.175	C	C	.	.	H	α-helix	trans	-64.2	-41.1	-178.8	-75.6	173.4	-14.1	0	0	112	Y494 V497 S498 Q504 S505 I506 F523	Y494-Q502 VanDerWaalsContact N-NE2 3.17Å; Y494-Q502 PolarHBondContact O-NE2 3.47Å; Y494-Q502 PolarHBondContact O-OE1 3.17Å; V497-Q502 HydrophobicContact CG1-CG 3.86Å; S498-Q502 PolarHBondContact O-N 3.45Å; S498-Q502 VanDerWaalsContact O-N 3.13Å; Q502-Q504 PolarHBondContact O-N 3.32Å; Q502-S505 WeakPolarHBondContact O-CB 3.42Å; Q502-S505 PolarHBondContact O-N 3.28Å; Q502-S505 VanDerWaalsContact O-N 3.13Å; Q502-I506 WeakPolarHBondContact O-CG1 3.27Å; Q502-I506 PolarHBondContact O-N 3.34Å; Q502-F523 HydrophobicContact CB-CE2 3.69Å; Q502-F523 HydrophobicContact CB-CZ 3.87Å
503	S	93.1	Very high	92.4	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-66.2	-33.9	176.8	60.7	0	0	0	0	113.1	V499 M500 Y501 R507	V499-S503 VanDerWaalsContact O-CB 3.26Å; V499-S503 WeakPolarHBondContact O-CB 3.37Å; V499-S503 PolarHBondContact O-N 3.04Å; V499-S503 PolarHBondContact O-OG 3.1Å; M500-S503 PolarHBondContact O-OG 3.43Å; Y501-S503 PolarHBondContact O-N 3.23Å; S503-R507 WeakPolarHBondContact O-CB 3.28Å; S503-R507 VanDerWaalsContact O-CG 3.23Å; S503-R507 WeakPolarHBondContact O-CG 3.47Å; S503-R507 PolarHBondContact O-N 3.15Å
504	Q	92.9	Very high	92.5	Very high	87 Å²	87	34.7 Å²	34.7	41%	0.407	17%	0.17	S	C	.	.	H	α-helix	trans	-65.7	-39.1	169.1	-77.2	-179.5	28.6	0	0	112.5	M500 Y501 Q502 R507 K508	M500-Q504 HydrophobicContact CE-CG 4.3Å; M500-Q504 WeakPolarHBondContact O-CB 3.35Å; M500-Q504 WeakPolarHBondContact O-CG 3.32Å; M500-Q504 PolarHBondContact O-N 2.88Å; Y501-Q504 PolarHBondContact O-N 3.49Å; Q502-Q504 PolarHBondContact O-N 3.32Å; Q504-R507 PolarHBondContact O-N 3.18Å; Q504-K508 WeakPolarHBondContact O-CG 3.5Å; Q504-K508 PolarHBondContact O-N 3.48Å
505	S	91	Very high	92.5	Very high	25 Å²	25	34.2 Å²	34.2	18%	0.175	17%	0.168	C	C	.	.	H	α-helix	trans	-62.8	-44.4	175.8	-69.1	0	0	0	0	111.6	R489 Y501 Q502 K508	R489-S505 PolarHBondContact NH2-O 2.7Å; Y501-S505 PolarHBondContact O-N 3.41Å; Y501-S505 PolarHBondContact O-OG 3.06Å; Q502-S505 WeakPolarHBondContact O-CB 3.42Å; Q502-S505 PolarHBondContact O-N 3.28Å; Q502-S505 VanDerWaalsContact O-N 3.13Å; S505-K508 PolarHBondContact O-N 3.09Å
506	I	92.4	Very high	92.7	Very high	9 Å²	9	34.1 Å²	34.1	5%	0.046	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-45.8	175.3	-68	163.9	0	0	0	111.7	V491 V493 Q502 K508 G509 F523 Y528 I529	V491-I506 HydrophobicContact CG1-CG1 3.98Å; V493-I506 HydrophobicContact CG2-CD1 3.97Å; Q502-I506 WeakPolarHBondContact O-CG1 3.27Å; Q502-I506 PolarHBondContact O-N 3.34Å; I506-K508 PolarHBondContact O-N 3.15Å; I506-G509 CarbonylContact O-C 3.52Å; I506-G509 WeakPolarHBondContact O-CA 3.4Å; I506-G509 PolarHBondContact O-N 3.04Å; I506-F523 HydrophobicContact CD1-CD2 3.37Å; I506-F523 HydrophobicContact CD1-CE2 3.52Å; I506-Y528 VanDerWaalsContact CG2-O 3.24Å; I506-Y528 WeakPolarHBondContact CG2-O 3.41Å; I506-I529 HydrophobicContact CD1-CD1 4Å; I506-I529 HydrophobicContact CD1-CG1 3.92Å; I506-I529 HydrophobicContact CG2-CG1 4.17Å
507	R	89.3	Confident	92.9	Very high	150 Å²	150	33.3 Å²	33.3	57%	0.566	16%	0.156	S	C	*	.	H	α-helix	trans	-59.2	-21.5	179.3	-78.8	171.9	-178.2	171.2	3	114.5	S503 Q504 G509	S503-R507 WeakPolarHBondContact O-CB 3.28Å; S503-R507 VanDerWaalsContact O-CG 3.23Å; S503-R507 WeakPolarHBondContact O-CG 3.47Å; S503-R507 PolarHBondContact O-N 3.15Å; Q504-R507 PolarHBondContact O-N 3.18Å; R507-G509 VanDerWaalsContact C-N 3.27Å
508	K	87.9	Confident	93	Very high	142 Å²	142	35.2 Å²	35.2	62%	0.617	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-3.7	174.2	-67.5	166.5	-178.5	176.1	0	113	R489 Q504 S505 I506	R489-K508 PolarHBondContact NE-O 3.1Å; R489-K508 PolarHBondContact NH2-O 3.04Å; Q504-K508 WeakPolarHBondContact O-CG 3.5Å; Q504-K508 PolarHBondContact O-N 3.48Å; S505-K508 PolarHBondContact O-N 3.09Å; I506-K508 PolarHBondContact O-N 3.15Å
509	G	85.7	Confident	93.1	Very high	3 Å²	3	35.9 Å²	35.9	3%	0.031	18%	0.175	C	C	.	.			trans	120.5	145.3	-177.8	0	0	0	0	0	112.2	R489 I506 R507	R489-G509 PolarHBondContact NH2-O 3.32Å; I506-G509 CarbonylContact O-C 3.52Å; I506-G509 WeakPolarHBondContact O-CA 3.4Å; I506-G509 PolarHBondContact O-N 3.04Å; R507-G509 VanDerWaalsContact C-N 3.27Å
510	C	89.3	Confident	93.2	Very high	7 Å²	7	33.7 Å²	33.7	5%	0.047	16%	0.162	C	C	.	.			trans	-155.1	98	175.1	55.4	0	0	0	0	110	R459 C460 V491 V513	R459-C510 CarbonylContact C-O 3.53Å; R459-C510 VanDerWaalsContact O-O 3.05Å; C460-C510 WeakPolarHBondContact CA-O 3.25Å; C460-C510 PolarHBondContact N-O 2.78Å; V491-C510 HydrophobicContact CB-CB 4.41Å; V491-C510 HydrophobicContact CG2-CB 3.85Å; C510-V513 HydrophobicContact CB-CG2 3.93Å
511	D	92.3	Very high	93.4	Very high	10 Å²	10	28.9 Å²	28.9	5%	0.053	14%	0.139	C	C	.	.	S	Bend	trans	-82.6	-35.9	-178.5	-48	-86.3	0	0	0	110.3	T461 A462 Y488 R489	T461-D511 WeakPolarHBondContact CA-O 3.37Å; T461-D511 WeakPolarHBondContact CB-O 3.38Å; T461-D511 PolarHBondContact N-O 3.33Å; A462-D511 PolarHBondContact N-O 3.45Å; Y488-D511 WeakPolarHBondContact CA-OD2 3.41Å; Y488-D511 HydrophobicContact CD1-CB 4.43Å; R489-D511 PolarHBondContact N-OD2 3.19Å; R489-D511 PolarHBondContact O-N 3.25Å
512	I	95.2	Very high	93.5	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.8	170.7	-52	179.7	0	0	0	108.6	L441 I444 L445 I448 A462 V464 L483 R489 T490 V491 V514	L441-I512 HydrophobicContact CD1-CD1 4.41Å; I444-I512 HydrophobicContact CG2-CD1 4Å; I444-I512 HydrophobicContact CG2-CG1 4.34Å; L445-I512 HydrophobicContact CD2-CD1 3.87Å; I448-I512 HydrophobicContact CD1-CD1 3.94Å; I448-I512 HydrophobicContact CD1-CG1 3.6Å; A462-I512 HydrophobicContact CB-CG1 4.3Å; A462-I512 HydrophobicContact CB-CG2 4.35Å; A462-I512 WeakPolarHBondContact O-CA 3.48Å; V464-I512 HydrophobicContact CG2-CG2 4.46Å; L483-I512 HydrophobicContact CD1-CD1 4.19Å; R489-I512 PolarHBondContact O-N 3.37Å; T490-I512 CarbonylContact C-O 3.58Å; T490-I512 VanDerWaalsContact CA-O 3.25Å; T490-I512 WeakPolarHBondContact CA-O 3.25Å; V491-I512 PolarHBondContact N-O 3.36Å; I512-V514 HydrophobicContact CG2-CG2 4.25Å
513	V	96.3	Very high	93.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124.5	170.4	173.9	0	0	0	0	108.7	C460 A462 L463 V464 V493 C510 L520 I529	C460-V513 HydrophobicContact CB-CG2 4.33Å; A462-V513 PolarHBondContact O-N 3.14Å; L463-V513 HydrophobicContact CD1-CB 3.86Å; L463-V513 HydrophobicContact CD1-CG1 3.81Å; V464-V513 PolarHBondContact N-O 3.35Å; V493-V513 HydrophobicContact CB-CG1 4.24Å; V493-V513 HydrophobicContact CG2-CG1 3.77Å; C510-V513 HydrophobicContact CB-CG2 3.93Å; V513-L520 HydrophobicContact CG1-CD1 4.13Å; V513-I529 HydrophobicContact CG1-CD1 4.12Å
514	V	97.3	Very high	93.7	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.6	172.6	-170.8	0	0	0	0	107.8	V464 V466 A472 I475 N476 V491 A492 V493 I512	V464-V514 HydrophobicContact CB-CB 4.45Å; V464-V514 HydrophobicContact CB-CG1 4.2Å; V464-V514 HydrophobicContact CB-CG2 4.24Å; V464-V514 HydrophobicContact CG1-CG1 4.3Å; V464-V514 HydrophobicContact CG2-CG2 4.44Å; V464-V514 CarbonylContact O-C 3.58Å; V464-V514 WeakPolarHBondContact O-CA 3.41Å; V466-V514 HydrophobicContact CG2-CG1 4.34Å; A472-V514 HydrophobicContact CB-CG1 4.12Å; I475-V514 HydrophobicContact CB-CG1 4.08Å; I475-V514 HydrophobicContact CG2-CG1 4.23Å; I475-V514 HydrophobicContact CG2-CG2 4.06Å; N476-V514 HydrophobicContact CB-CB 4.36Å; N476-V514 HydrophobicContact CB-CG2 4.21Å; V491-V514 PolarHBondContact O-N 2.8Å; A492-V514 CarbonylContact C-O 3.56Å; A492-V514 VanDerWaalsContact CA-O 3.3Å; A492-V514 WeakPolarHBondContact CA-O 3.49Å; V493-V514 PolarHBondContact N-O 2.71Å; I512-V514 HydrophobicContact CG2-CG2 4.25Å
515	G	96.7	Very high	93.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	150.2	-168.3	0	0	0	0	0	116.6	V464 V466 V493	V464-G515 PolarHBondContact O-N 3.33Å; V466-G515 PolarHBondContact N-O 3.5Å; V466-G515 VanDerWaalsContact N-O 3.07Å; V493-G515 WeakPolarHBondContact O-CA 3.48Å
516	T	95.7	Very high	93.9	Very high	13 Å²	13	35.4 Å²	35.4	8%	0.08	16%	0.163	C	C	.	.			trans	-87.8	136.7	169.5	59.8	0	0	0	0	110.3	V466 R469 A472 V493 Y494 G518 R519 L520	V466-T516 WeakPolarHBondContact O-CA 3.13Å; R469-T516 HydrophobicContact CB-CG2 4.41Å; R469-T516 HydrophobicContact CG-CG2 4.1Å; A472-T516 HydrophobicContact CB-CG2 4.35Å; V493-T516 PolarHBondContact O-N 3.38Å; Y494-T516 WeakPolarHBondContact CA-OG1 3.3Å; T516-G518 PolarHBondContact O-N 2.91Å; T516-R519 PolarHBondContact O-N 3.07Å; T516-L520 WeakPolarHBondContact O-CB 3.31Å; T516-L520 PolarHBondContact O-N 3.36Å; T516-L520 VanDerWaalsContact O-N 3.12Å
517	P	95.4	Very high	93.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-43.9	-59.6	-168.6	-26.4	24.6	0	0	0	114.9	L465 V466 R519 L520 C521 L545 F550 D553	L465-P517 HydrophobicContact CD1-CB 4.22Å; L465-P517 HydrophobicContact CD1-CG 3.78Å; L465-P517 HydrophobicContact CG-CG 4.27Å; V466-P517 VanDerWaalsContact O-CD 3.23Å; V466-P517 WeakPolarHBondContact O-CD 3.43Å; P517-R519 PolarHBondContact O-N 3.38Å; P517-L520 PolarHBondContact O-N 3.43Å; P517-L520 VanDerWaalsContact O-N 3.09Å; P517-C521 WeakPolarHBondContact O-CB 3.35Å; P517-C521 PolarHBondContact O-N 2.76Å; P517-C521 PolarHBondContact O-SG 3.35Å; P517-L545 HydrophobicContact CG-CD2 3.44Å; P517-L545 VanDerWaalsContact CG-CD2 3.44Å; P517-F550 HydrophobicContact CB-CB 4.18Å; P517-F550 HydrophobicContact CB-CD1 3.95Å; P517-F550 HydrophobicContact CB-CG 4.1Å; P517-F550 HydrophobicContact CG-CB 3.85Å; P517-F550 HydrophobicContact CG-CD1 4.05Å; P517-F550 HydrophobicContact CG-CD2 4.02Å; P517-F550 HydrophobicContact CG-CG 3.74Å; P517-D553 HydrophobicContact CB-CB 3.58Å
518	G	94.6	Very high	94	Very high	39 Å²	39	33.4 Å²	33.4	40%	0.402	17%	0.17	S	C	.	.	H	α-helix	trans	-59.5	-37.4	-173.6	0	0	0	0	0	116	T516 D522	T516-G518 PolarHBondContact O-N 2.91Å; G518-D522 PolarHBondContact O-N 2.95Å
519	R	95.4	Very high	94.3	Very high	31 Å²	31	26.9 Å²	26.9	12%	0.117	14%	0.141	C	C	.	.	H	α-helix	trans	-78.4	-33.9	176.6	177	59.6	66.7	94.3	-7.1	111.5	V493 Y494 V497 T516 P517 D522 F523	V493-R519 HydrophobicContact CG1-CG 3.79Å; Y494-R519 PolarHBondContact O-NH1 3.44Å; V497-R519 PolarHBondContact O-NH1 3.39Å; V497-R519 PolarHBondContact O-NH2 3.33Å; T516-R519 PolarHBondContact O-N 3.07Å; P517-R519 PolarHBondContact O-N 3.38Å; R519-D522 PolarHBondContact O-N 3.4Å; R519-F523 HydrophobicContact CG-CE1 4.41Å; R519-F523 PolarHBondContact O-N 3.48Å; R519-F523 VanDerWaalsContact O-N 3.12Å
520	L	96.8	Very high	94.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.4	-46.2	176.6	179.2	58.2	0	0	0	111.1	L463 L465 V513 T516 P517 D522 F523 I524 I529 I557	L463-L520 HydrophobicContact CD1-CD1 3.86Å; L463-L520 HydrophobicContact CD1-CD2 3.79Å; L463-L520 HydrophobicContact CD1-CG 4.43Å; L463-L520 HydrophobicContact CD2-CD2 4.28Å; L463-L520 HydrophobicContact CG-CD2 4.31Å; L465-L520 HydrophobicContact CD1-CD2 3.74Å; V513-L520 HydrophobicContact CG1-CD1 4.13Å; T516-L520 WeakPolarHBondContact O-CB 3.31Å; T516-L520 PolarHBondContact O-N 3.36Å; T516-L520 VanDerWaalsContact O-N 3.12Å; P517-L520 PolarHBondContact O-N 3.43Å; P517-L520 VanDerWaalsContact O-N 3.09Å; L520-D522 PolarHBondContact O-N 3.16Å; L520-F523 PolarHBondContact O-N 3.31Å; L520-F523 VanDerWaalsContact O-N 3.11Å; L520-I524 HydrophobicContact CD1-CD1 3.97Å; L520-I524 HydrophobicContact CD1-CG1 4.33Å; L520-I524 HydrophobicContact CG-CD1 3.88Å; L520-I524 WeakPolarHBondContact O-CG1 3.07Å; L520-I524 PolarHBondContact O-N 2.8Å; L520-I529 HydrophobicContact CD1-CD1 3.71Å; L520-I557 HydrophobicContact CB-CD1 4.48Å; L520-I557 HydrophobicContact CD2-CD1 3.76Å; L520-I557 HydrophobicContact CG-CD1 4.07Å
521	C	96.6	Very high	94.7	Very high	3 Å²	3	33 Å²	33	2%	0.02	17%	0.169	C	C	.	.	H	α-helix	trans	-54.7	-47	171.4	-71.8	0	0	0	0	112.4	P517 F523 I524 K525 D553 F556	P517-C521 WeakPolarHBondContact O-CB 3.35Å; P517-C521 PolarHBondContact O-N 2.76Å; P517-C521 PolarHBondContact O-SG 3.35Å; C521-F523 VanDerWaalsContact C-N 3.29Å; C521-F523 PolarHBondContact O-N 3.34Å; C521-I524 PolarHBondContact O-N 3.04Å; C521-K525 VanDerWaalsContact O-CB 3.29Å; C521-K525 WeakPolarHBondContact O-CB 3.38Å; C521-K525 WeakPolarHBondContact O-CG 3.38Å; C521-K525 PolarHBondContact O-N 3.09Å; C521-D553 PolarHBondContact SG-OD1 3.28Å; C521-F556 HydrophobicContact CB-CD1 4.28Å; C521-F556 HydrophobicContact CB-CE1 4.39Å
522	D	95.6	Very high	94.5	Very high	43 Å²	43	35.8 Å²	35.8	23%	0.23	19%	0.189	C	C	.	.	H	α-helix	trans	-58.3	-40.2	176	-179.9	58.9	0	0	0	111.9	G518 R519 L520 R526	G518-D522 PolarHBondContact O-N 2.95Å; R519-D522 PolarHBondContact O-N 3.4Å; L520-D522 PolarHBondContact O-N 3.16Å; D522-R526 VanDerWaalsContact CG-NE 3.28Å; D522-R526 WeakPolarHBondContact O-CB 3.31Å; D522-R526 VanDerWaalsContact O-CG 3.22Å; D522-R526 WeakPolarHBondContact O-CG 3.33Å; D522-R526 PolarHBondContact O-N 3.2Å; D522-R526 VanDerWaalsContact O-N 3.07Å; D522-R526 IonicContact OD1-CZ 3.68Å; D522-R526 IonicContact OD1-NE 2.67Å; D522-R526 PolarHBondContact OD1-NE 2.87Å; D522-R526 IonicContact OD1-NH2 2.75Å; D522-R526 PolarHBondContact OD1-NH2 2.93Å; D522-R526 IonicContact OD2-CZ 2.87Å; D522-R526 IonicContact OD2-NE 2.67Å; D522-R526 PolarHBondContact OD2-NE 3.11Å; D522-R526 IonicContact OD2-NH2 3.14Å
523	F	95.8	Very high	94.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-77.5	-33.5	-178	-80.8	19.8	0	0	0	113.6	V493 V499 Q502 I506 R519 L520 C521 G527 Y528 I529	V493-F523 HydrophobicContact CG1-CD2 3.61Å; V493-F523 HydrophobicContact CG1-CE2 4.04Å; V493-F523 HydrophobicContact CG1-CG 4.22Å; V499-F523 HydrophobicContact CB-CE1 4.45Å; V499-F523 HydrophobicContact CG1-CE1 3.83Å; V499-F523 HydrophobicContact CG1-CZ 4.17Å; V499-F523 HydrophobicContact CG2-CE1 4.29Å; Q502-F523 HydrophobicContact CB-CE2 3.69Å; Q502-F523 HydrophobicContact CB-CZ 3.87Å; I506-F523 HydrophobicContact CD1-CD2 3.37Å; I506-F523 HydrophobicContact CD1-CE2 3.52Å; R519-F523 HydrophobicContact CG-CE1 4.41Å; R519-F523 PolarHBondContact O-N 3.48Å; R519-F523 VanDerWaalsContact O-N 3.12Å; L520-F523 PolarHBondContact O-N 3.31Å; L520-F523 VanDerWaalsContact O-N 3.11Å; C521-F523 VanDerWaalsContact C-N 3.29Å; C521-F523 PolarHBondContact O-N 3.34Å; F523-G527 PolarHBondContact O-N 3.12Å; F523-Y528 HydrophobicContact CB-CD2 4.47Å; F523-Y528 AromaticContact CD1-CD2 3.81Å; F523-Y528 HydrophobicContact CD1-CD2 3.81Å; F523-Y528 HydrophobicContact CD1-CE2 4.37Å; F523-Y528 HydrophobicContact CD2-CD2 4.4Å; F523-Y528 HydrophobicContact CE1-CD2 4.03Å; F523-Y528 HydrophobicContact CE1-CE2 4.31Å; F523-Y528 AromaticContact CG-CD2 3.99Å; F523-Y528 HydrophobicContact CG-CD2 3.99Å; F523-Y528 HydrophobicContact CZ-CD2 4.42Å; F523-Y528 PolarHBondContact O-N 3.43Å; F523-I529 HydrophobicContact CB-CD1 3.81Å; F523-I529 HydrophobicContact CB-CG1 4.25Å; F523-I529 HydrophobicContact CD2-CD1 4.16Å; F523-I529 PolarHBondContact O-N 3.49Å
524	I	94.9	Very high	94	Very high	17 Å²	17	36.8 Å²	36.8	9%	0.087	20%	0.2	C	C	.	.	H	α-helix	trans	-66.9	-49.9	170.9	-67.1	161.5	0	0	0	109.5	L520 C521 R526 G527 I529 L531 F556 I557 Q560	L520-I524 HydrophobicContact CD1-CD1 3.97Å; L520-I524 HydrophobicContact CD1-CG1 4.33Å; L520-I524 HydrophobicContact CG-CD1 3.88Å; L520-I524 WeakPolarHBondContact O-CG1 3.07Å; L520-I524 PolarHBondContact O-N 2.8Å; C521-I524 PolarHBondContact O-N 3.04Å; I524-R526 VanDerWaalsContact C-N 3.25Å; I524-R526 PolarHBondContact O-N 3.23Å; I524-G527 PolarHBondContact O-N 3.23Å; I524-I529 HydrophobicContact CG1-CB 4.36Å; I524-L531 HydrophobicContact CD1-CD1 3.9Å; I524-L531 HydrophobicContact CG1-CD1 4.39Å; I524-F556 HydrophobicContact CG2-CE1 4.21Å; I524-F556 HydrophobicContact CG2-CZ 4.36Å; I524-I557 HydrophobicContact CD1-CG1 4.05Å; I524-Q560 HydrophobicContact CG2-CG 4.15Å
525	K	95.1	Very high	93.9	Very high	133 Å²	133	40.8 Å²	40.8	58%	0.578	21%	0.214	S	C	*	.	H	α-helix	trans	-60.5	-30.5	179.3	-71.7	169.7	-177.5	173.2	0	113.2	C521 F556	C521-K525 VanDerWaalsContact O-CB 3.29Å; C521-K525 WeakPolarHBondContact O-CB 3.38Å; C521-K525 WeakPolarHBondContact O-CG 3.38Å; C521-K525 PolarHBondContact O-N 3.09Å; K525-F556 HydrophobicContact CD-CE1 4.3Å; K525-F556 HydrophobicContact CD-CZ 4.07Å; K525-F556 VanDerWaalsContact CE-CE1 3.48Å; K525-F556 VanDerWaalsContact CE-CE2 3.49Å; K525-F556 HydrophobicContact CG-CE1 4Å; K525-F556 HydrophobicContact CG-CE2 4.35Å; K525-F556 HydrophobicContact CG-CZ 3.56Å
526	R	94.2	Very high	93.9	Very high	142 Å²	142	41.8 Å²	41.8	54%	0.536	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-3	173.2	-69.4	176.6	-160	-115.7	1.2	114.6	D522 I524 Y528	D522-R526 VanDerWaalsContact CG-NE 3.28Å; D522-R526 WeakPolarHBondContact O-CB 3.31Å; D522-R526 VanDerWaalsContact O-CG 3.22Å; D522-R526 WeakPolarHBondContact O-CG 3.33Å; D522-R526 PolarHBondContact O-N 3.2Å; D522-R526 VanDerWaalsContact O-N 3.07Å; D522-R526 IonicContact OD1-CZ 3.68Å; D522-R526 IonicContact OD1-NE 2.67Å; D522-R526 PolarHBondContact OD1-NE 2.87Å; D522-R526 IonicContact OD1-NH2 2.75Å; D522-R526 PolarHBondContact OD1-NH2 2.93Å; D522-R526 IonicContact OD2-CZ 2.87Å; D522-R526 IonicContact OD2-NE 2.67Å; D522-R526 PolarHBondContact OD2-NE 3.11Å; D522-R526 IonicContact OD2-NH2 3.14Å; I524-R526 VanDerWaalsContact C-N 3.25Å; I524-R526 PolarHBondContact O-N 3.23Å; R526-Y528 VanDerWaalsContact C-N 3.25Å; R526-Y528 HydrophobicContact CB-CD1 4.32Å; R526-Y528 HydrophobicContact CB-CD2 4.12Å; R526-Y528 HydrophobicContact CB-CE1 4.3Å; R526-Y528 HydrophobicContact CB-CE2 4.11Å; R526-Y528 HydrophobicContact CB-CG 4.23Å; R526-Y528 PolarHBondContact O-N 2.91Å
527	G	91.7	Very high	93.9	Very high	46 Å²	46	41.2 Å²	41.2	47%	0.474	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	21.7	-175.6	0	0	0	0	0	114.5	F523 I524	F523-G527 PolarHBondContact O-N 3.12Å; I524-G527 PolarHBondContact O-N 3.23Å
528	Y	92.3	Very high	94	Very high	72 Å²	72	41.2 Å²	41.2	28%	0.282	22%	0.215	S	C	.	.	S	Bend	trans	-74.6	-32.7	172.7	-65.1	-22.3	0	0	0	111.9	V499 I506 F523 R526	V499-Y528 HydrophobicContact CG1-CE2 4.09Å; I506-Y528 VanDerWaalsContact CG2-O 3.24Å; I506-Y528 WeakPolarHBondContact CG2-O 3.41Å; F523-Y528 HydrophobicContact CB-CD2 4.47Å; F523-Y528 AromaticContact CD1-CD2 3.81Å; F523-Y528 HydrophobicContact CD1-CD2 3.81Å; F523-Y528 HydrophobicContact CD1-CE2 4.37Å; F523-Y528 HydrophobicContact CD2-CD2 4.4Å; F523-Y528 HydrophobicContact CE1-CD2 4.03Å; F523-Y528 HydrophobicContact CE1-CE2 4.31Å; F523-Y528 AromaticContact CG-CD2 3.99Å; F523-Y528 HydrophobicContact CG-CD2 3.99Å; F523-Y528 HydrophobicContact CZ-CD2 4.42Å; F523-Y528 PolarHBondContact O-N 3.43Å; R526-Y528 VanDerWaalsContact C-N 3.25Å; R526-Y528 HydrophobicContact CB-CD1 4.32Å; R526-Y528 HydrophobicContact CB-CD2 4.12Å; R526-Y528 HydrophobicContact CB-CE1 4.3Å; R526-Y528 HydrophobicContact CB-CE2 4.11Å; R526-Y528 HydrophobicContact CB-CG 4.23Å; R526-Y528 PolarHBondContact O-N 2.91Å
529	I	93.1	Very high	94.1	Very high	5 Å²	5	39.5 Å²	39.5	3%	0.026	20%	0.197	C	C	.	.	S	Bend	trans	-114.6	131.7	173.4	-62.8	166.3	0	0	0	107.5	C460 V493 I506 V513 L520 F523 I524 L531	C460-I529 HydrophobicContact CB-CG2 4.41Å; V493-I529 HydrophobicContact CG1-CD1 4.33Å; V493-I529 HydrophobicContact CG2-CD1 4.27Å; I506-I529 HydrophobicContact CD1-CD1 4Å; I506-I529 HydrophobicContact CD1-CG1 3.92Å; I506-I529 HydrophobicContact CG2-CG1 4.17Å; V513-I529 HydrophobicContact CG1-CD1 4.12Å; L520-I529 HydrophobicContact CD1-CD1 3.71Å; F523-I529 HydrophobicContact CB-CD1 3.81Å; F523-I529 HydrophobicContact CB-CG1 4.25Å; F523-I529 HydrophobicContact CD2-CD1 4.16Å; F523-I529 PolarHBondContact O-N 3.49Å; I524-I529 HydrophobicContact CG1-CB 4.36Å; I529-L531 HydrophobicContact CG2-CD2 3.8Å
530	Q	90.4	Very high	94	Very high	126 Å²	126	38.3 Å²	38.3	59%	0.589	19%	0.192	S	C	*	.			trans	-113	124.7	172.7	-66.9	-178.2	-17.7	0	0	108.4
531	L	92.4	Very high	93.7	Very high	12 Å²	12	39.1 Å²	39.1	6%	0.063	20%	0.196	C	C	.	.			trans	-90.7	0.2	-177.5	-59.9	-178.1	0	0	0	113.4	L463 I524 I529 G533 C534 Q560 L561 I564	L463-L531 HydrophobicContact CD2-CD1 4.1Å; L463-L531 HydrophobicContact CD2-CD2 3.91Å; I524-L531 HydrophobicContact CD1-CD1 3.9Å; I524-L531 HydrophobicContact CG1-CD1 4.39Å; I529-L531 HydrophobicContact CG2-CD2 3.8Å; L531-G533 PolarHBondContact O-N 3.26Å; L531-C534 HydrophobicContact CB-CB 4.36Å; L531-C534 WeakPolarHBondContact O-CB 3.38Å; L531-C534 PolarHBondContact O-N 2.88Å; L531-Q560 HydrophobicContact CD1-CB 4.03Å; L531-L561 HydrophobicContact CB-CD2 3.89Å; L531-L561 HydrophobicContact CD1-CD2 4.01Å; L531-L561 HydrophobicContact CD1-CG 4.1Å; L531-L561 HydrophobicContact CG-CD2 4.43Å; L531-I564 WeakPolarHBondContact O-CD1 3.23Å
532	S	89.2	Confident	93.5	Very high	68 Å²	68	39.1 Å²	39.1	48%	0.476	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-2.4	-177	59.1	0	0	0	0	116.6
533	G	88	Confident	93.1	Very high	22 Å²	22	37.2 Å²	37.2	23%	0.227	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121	9.9	170.4	0	0	0	0	0	113.5	C460 L531 R535	C460-G533 CarbonylContact O-C 3.59Å; L531-G533 PolarHBondContact O-N 3.26Å; G533-R535 PolarHBondContact O-N 3.42Å
534	C	93.1	Very high	92.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.187	C	C	.	.			trans	-76.3	116.2	-175.7	-166.4	0	0	0	0	109.4	C460 L531 Y536 L561	C460-C534 WeakPolarHBondContact O-CA 3.3Å; C460-C534 PolarHBondContact O-N 3.12Å; L531-C534 HydrophobicContact CB-CB 4.36Å; L531-C534 WeakPolarHBondContact O-CB 3.38Å; L531-C534 PolarHBondContact O-N 2.88Å; C534-Y536 PolarHBondContact SG-O 3.02Å; C534-Y536 VanDerWaalsContact SG-O 3.32Å; C534-L561 HydrophobicContact CB-CD2 3.68Å
535	R	94.1	Very high	92.3	Very high	84 Å²	84	36.7 Å²	36.7	32%	0.317	18%	0.183	S	C	.	.			trans	-101.1	-20.4	177.6	-46.3	-167.8	-35.2	-164.5	8.9	112.5	S447 N451 T461 G533 H566 Q567	S447-R535 PolarHBondContact OG-NH2 3.1Å; N451-R535 PolarHBondContact ND2-NH1 3.1Å; N451-R535 VanDerWaalsContact ND2-NH1 3.18Å; N451-R535 PolarHBondContact ND2-NH2 2.72Å; T461-R535 HydrophobicContact CG2-CG 4.25Å; T461-R535 PolarHBondContact O-N 2.87Å; G533-R535 PolarHBondContact O-N 3.42Å; R535-H566 CarbonylContact O-C 3.34Å; R535-H566 WeakPolarHBondContact O-CA 3.46Å; R535-Q567 PolarHBondContact O-N 3.49Å
536	Y	96.7	Very high	92	Very high	22 Å²	22	31.6 Å²	31.6	9%	0.086	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	119.2	-176.5	-56.9	-76	0	0	0	110.4	I444 S447 T461 A462 L463 C534 Q567 M569	I444-Y536 HydrophobicContact CD1-CG 4.18Å; I444-Y536 HydrophobicContact CG1-CD1 3.98Å; I444-Y536 HydrophobicContact CG1-CD2 3.93Å; I444-Y536 HydrophobicContact CG1-CE1 4.43Å; I444-Y536 HydrophobicContact CG1-CE2 4.4Å; I444-Y536 HydrophobicContact CG1-CG 3.7Å; I444-Y536 HydrophobicContact CG2-CD2 4.34Å; S447-Y536 WeakPolarHBondContact CB-OH 3.42Å; S447-Y536 PolarHBondContact OG-OH 2.95Å; S447-Y536 VanDerWaalsContact OG-OH 3.06Å; T461-Y536 PolarHBondContact O-N 2.99Å; A462-Y536 WeakPolarHBondContact CA-O 3.44Å; A462-Y536 HydrophobicContact CB-CD2 4.25Å; L463-Y536 PolarHBondContact N-O 2.72Å; C534-Y536 PolarHBondContact SG-O 3.02Å; C534-Y536 VanDerWaalsContact SG-O 3.32Å; Y536-Q567 HydrophobicContact CD1-CB 4.31Å; Y536-M569 HydrophobicContact CD1-CE 3.68Å; Y536-M569 HydrophobicContact CG-CE 4.35Å
537	F	97	Very high	91.6	Very high	1 Å²	1	29.3 Å²	29.3	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.6	170.6	-178.1	-140.3	0	0	0	109.4	L463 L465 V539 F554 I557 A558 L561 Q567 T568 M569	L463-F537 HydrophobicContact CB-CD2 4.31Å; L463-F537 HydrophobicContact CD2-CD2 4.1Å; L463-F537 HydrophobicContact CD2-CE2 4.11Å; L463-F537 HydrophobicContact CG-CD2 4.3Å; L465-F537 HydrophobicContact CB-CE2 4.22Å; F537-V539 HydrophobicContact CE1-CG2 4.02Å; F537-V539 HydrophobicContact CE2-CG2 4.35Å; F537-V539 HydrophobicContact CZ-CG2 3.9Å; F537-F554 AromaticContact CE1-CE2 3.84Å; F537-F554 HydrophobicContact CE1-CE2 3.84Å; F537-F554 HydrophobicContact CZ-CD2 4.16Å; F537-F554 AromaticContact CZ-CE2 3.86Å; F537-F554 HydrophobicContact CZ-CE2 3.86Å; F537-I557 HydrophobicContact CE2-CG2 3.86Å; F537-I557 HydrophobicContact CZ-CG2 3.95Å; F537-A558 HydrophobicContact CE1-CB 4.13Å; F537-L561 HydrophobicContact CB-CD1 3.82Å; F537-L561 HydrophobicContact CD1-CD1 3.67Å; F537-L561 HydrophobicContact CD2-CD1 3.64Å; F537-L561 HydrophobicContact CE1-CD1 4.1Å; F537-L561 HydrophobicContact CE2-CD1 4.09Å; F537-L561 HydrophobicContact CG-CD1 3.43Å; F537-L561 VanDerWaalsContact CG-CD1 3.43Å; F537-L561 HydrophobicContact CZ-CD1 4.3Å; F537-Q567 PolarHBondContact N-O 3.49Å; F537-T568 HydrophobicContact CD1-CG2 3.95Å; F537-T568 CarbonylContact O-C 3.45Å; F537-T568 WeakPolarHBondContact O-CA 3.48Å; F537-M569 PolarHBondContact O-N 2.99Å
538	V	97.5	Very high	91.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.7	-179.3	-177.2	0	0	0	0	109.2	Y440 I444 L463 V464 L465 M569 F571	Y440-V538 HydrophobicContact CD1-CG1 3.79Å; Y440-V538 HydrophobicContact CD2-CB 4.42Å; Y440-V538 HydrophobicContact CD2-CG1 3.85Å; Y440-V538 HydrophobicContact CD2-CG2 4.02Å; Y440-V538 HydrophobicContact CE1-CG1 3.94Å; Y440-V538 HydrophobicContact CE2-CG1 4.07Å; Y440-V538 HydrophobicContact CG-CG1 3.71Å; Y440-V538 HydrophobicContact CG-CG2 4.1Å; I444-V538 HydrophobicContact CD1-CG2 3.74Å; L463-V538 PolarHBondContact O-N 3.16Å; V464-V538 CarbonylContact C-O 3.59Å; V464-V538 WeakPolarHBondContact CA-O 3.44Å; V464-V538 HydrophobicContact CB-CB 4.38Å; V464-V538 HydrophobicContact CG1-CB 4.15Å; V464-V538 HydrophobicContact CG1-CG1 4.15Å; V464-V538 HydrophobicContact CG2-CB 4.15Å; V464-V538 HydrophobicContact CG2-CG2 4.36Å; L465-V538 PolarHBondContact N-O 3.46Å; V538-M569 CarbonylContact C-O 3.57Å; V538-M569 WeakPolarHBondContact CA-O 3.24Å; V538-M569 HydrophobicContact CG2-CB 4.41Å; V538-M569 HydrophobicContact CG2-CE 3.95Å; V538-M569 HydrophobicContact CG2-SD 4.31Å; V538-F571 HydrophobicContact CG1-CD2 4.04Å; V538-F571 HydrophobicContact CG1-CE2 4.14Å
539	V	96.5	Very high	91	Very high	3 Å²	3	29 Å²	29	2%	0.018	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	107.6	172.1	-171	0	0	0	0	107.4	F537 A542 L545 F554 M569 M570 F571	F537-V539 HydrophobicContact CE1-CG2 4.02Å; F537-V539 HydrophobicContact CE2-CG2 4.35Å; F537-V539 HydrophobicContact CZ-CG2 3.9Å; V539-A542 HydrophobicContact CG1-CB 3.79Å; V539-L545 HydrophobicContact CG1-CD1 3.44Å; V539-L545 VanDerWaalsContact CG1-CD1 3.44Å; V539-F554 HydrophobicContact CG2-CD2 4.29Å; V539-F554 HydrophobicContact CG2-CE2 3.72Å; V539-M569 PolarHBondContact N-O 3.26Å; V539-M570 HydrophobicContact CB-CG 4.12Å; V539-M570 HydrophobicContact CG2-CG 4.23Å; V539-F571 PolarHBondContact O-N 3.36Å
540	D	94	Very high	90.9	Very high	5 Å²	5	31 Å²	31	3%	0.027	17%	0.174	C	C	.	.	S	Bend	trans	-109.2	144.2	179.6	-165.1	8.8	0	0	0	111	Y440 L465 V466 P467 A542	Y440-D540 HydrophobicContact CE1-CB 4.33Å; Y440-D540 PolarHBondContact OH-OD2 3.03Å; L465-D540 PolarHBondContact O-N 3.12Å; V466-D540 HydrophobicContact CG1-CB 4.15Å; P467-D540 VanDerWaalsContact CD-O 3.28Å; P467-D540 WeakPolarHBondContact CD-O 3.38Å; D540-A542 VanDerWaalsContact C-N 3.34Å
541	E	89.3	Confident	91	Very high	18 Å²	18	28.5 Å²	28.5	8%	0.084	16%	0.162	C	C	.	.	S	Bend	trans	47.4	52.7	-160.6	-63	-167	162.2	0	0	112.2	P467 L471 D543 R544 L545 F571 G698	P467-E541 HydrophobicContact CG-CB 3.72Å; P467-E541 WeakPolarHBondContact CG-OE2 3.26Å; L471-E541 HydrophobicContact CD2-CG 4.05Å; E541-D543 VanDerWaalsContact C-N 3.32Å; E541-D543 PolarHBondContact O-N 2.99Å; E541-R544 HydrophobicContact CB-CB 4.09Å; E541-R544 HydrophobicContact CB-CG 4.18Å; E541-R544 WeakPolarHBondContact O-CA 3.34Å; E541-R544 PolarHBondContact O-N 3.07Å; E541-L545 PolarHBondContact O-N 3.38Å; E541-L545 VanDerWaalsContact O-N 3.12Å; E541-F571 PolarHBondContact N-O 3.06Å; E541-G698 WeakPolarHBondContact OE1-CA 3.33Å; E541-G698 PolarHBondContact OE1-N 3.07Å; E541-G698 WeakPolarHBondContact OE2-CA 3.5Å; E541-G698 PolarHBondContact OE2-N 2.98Å; E541-G698 VanDerWaalsContact OE2-N 3.1Å
542	A	91.7	Very high	91	Very high	3 Å²	3	33.9 Å²	33.9	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-57.2	-40.4	-176.2	0	0	0	0	0	113.4	V539 D540 R544 L545 L546 M570 F571 I579	V539-A542 HydrophobicContact CG1-CB 3.79Å; D540-A542 VanDerWaalsContact C-N 3.34Å; A542-R544 PolarHBondContact O-N 3.47Å; A542-L545 WeakPolarHBondContact O-CB 3.18Å; A542-L545 PolarHBondContact O-N 2.92Å; A542-L546 PolarHBondContact O-N 3.47Å; A542-M570 HydrophobicContact CB-CE 4Å; A542-F571 PolarHBondContact N-O 3.27Å; A542-I579 HydrophobicContact CB-CD1 3.89Å; A542-I579 WeakPolarHBondContact O-CD1 3.37Å
543	D	87.6	Confident	91.2	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-51.1	-46.2	170.9	53.5	-50.4	0	0	0	111.3	E541 L545 L546 D547 S572 T574 I579 H721	E541-D543 VanDerWaalsContact C-N 3.32Å; E541-D543 PolarHBondContact O-N 2.99Å; D543-L545 PolarHBondContact O-N 3.27Å; D543-L546 PolarHBondContact O-N 3.28Å; D543-L546 VanDerWaalsContact O-N 3.16Å; D543-D547 PolarHBondContact O-N 2.8Å; D543-S572 WeakPolarHBondContact CB-OG 3.23Å; D543-S572 PolarHBondContact OD1-OG 3.1Å; D543-S572 VanDerWaalsContact OD1-OG 3.06Å; D543-T574 WeakPolarHBondContact CB-OG1 3.38Å; D543-I579 HydrophobicContact CB-CG1 4.41Å; D543-H721 IonicContact OD2-CE1 2.68Å; D543-H721 PolarHBondContact OD2-CE1 3.07Å
544	R	85.7	Confident	91.5	Very high	3 Å²	3	32 Å²	32	1%	0.011	17%	0.17	C	C	.	.	H	α-helix	trans	-77.4	-22.5	-174.7	-54.5	-43.7	-171.9	145	-175.4	113.5	P467 E541 A542 L546 D547 M548 D717 D718 H721	P467-R544 HydrophobicContact CB-CB 4.25Å; P467-R544 HydrophobicContact CG-CB 4.07Å; E541-R544 HydrophobicContact CB-CB 4.09Å; E541-R544 HydrophobicContact CB-CG 4.18Å; E541-R544 WeakPolarHBondContact O-CA 3.34Å; E541-R544 PolarHBondContact O-N 3.07Å; A542-R544 PolarHBondContact O-N 3.47Å; R544-L546 VanDerWaalsContact C-N 3.32Å; R544-D547 WeakPolarHBondContact CD-OD2 3.21Å; R544-D547 IonicContact CZ-OD2 2.73Å; R544-D547 IonicContact NE-OD2 3.03Å; R544-D547 IonicContact NH2-OD2 3.5Å; R544-D547 PolarHBondContact NH2-OD2 3.03Å; R544-M548 WeakPolarHBondContact O-CB 3.37Å; R544-M548 WeakPolarHBondContact O-CG 3.46Å; R544-M548 PolarHBondContact O-N 2.66Å; R544-D717 PolarHBondContact NH1-O 2.93Å; R544-D718 IonicContact CZ-OD1 3.47Å; R544-D718 VanDerWaalsContact CZ-OD1 3.28Å; R544-D718 IonicContact NH1-OD1 3.83Å; R544-D718 PolarHBondContact NH1-OD1 3.04Å; R544-D718 IonicContact NH2-OD1 3.29Å; R544-D718 PolarHBondContact NH2-OD1 3.18Å; R544-H721 PolarHBondContact NE-CE1 3.42Å; R544-H721 PolarHBondContact NE-ND1 3.03Å; R544-H721 VanDerWaalsContact NE-ND1 3.18Å; R544-H721 PolarHBondContact NH1-CE1 3.24Å; R544-H721 PolarHBondContact NH1-ND1 2.69Å
545	L	89.6	Confident	91.5	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-64	-39.3	167.8	-76.1	164.5	0	0	0	111.4	L465 P467 P517 V539 E541 A542 D543 F550	L465-L545 HydrophobicContact CD2-CD1 3.95Å; L465-L545 HydrophobicContact CG-CD1 4.02Å; L465-L545 HydrophobicContact CG-CD2 4.39Å; P467-L545 HydrophobicContact CB-CD2 4.07Å; P467-L545 HydrophobicContact CB-CG 4.16Å; P517-L545 HydrophobicContact CG-CD2 3.44Å; P517-L545 VanDerWaalsContact CG-CD2 3.44Å; V539-L545 HydrophobicContact CG1-CD1 3.44Å; V539-L545 VanDerWaalsContact CG1-CD1 3.44Å; E541-L545 PolarHBondContact O-N 3.38Å; E541-L545 VanDerWaalsContact O-N 3.12Å; A542-L545 WeakPolarHBondContact O-CB 3.18Å; A542-L545 PolarHBondContact O-N 2.92Å; D543-L545 PolarHBondContact O-N 3.27Å; L545-F550 HydrophobicContact CD2-CB 4.17Å; L545-F550 HydrophobicContact CD2-CD2 3.94Å; L545-F550 HydrophobicContact CD2-CG 4.41Å; L545-F550 WeakPolarHBondContact O-CB 3.29Å; L545-F550 PolarHBondContact O-N 3.42Å
546	L	88.7	Confident	91.6	Very high	27 Å²	27	32.9 Å²	32.9	14%	0.141	18%	0.175	C	C	.	.	H	α-helix	trans	-75.9	-44.5	178.7	-52.4	-170.4	0	0	0	112.2	A542 D543 R544 M548 G549 E551 A578 I579 I582	A542-L546 PolarHBondContact O-N 3.47Å; D543-L546 PolarHBondContact O-N 3.28Å; D543-L546 VanDerWaalsContact O-N 3.16Å; R544-L546 VanDerWaalsContact C-N 3.32Å; L546-M548 PolarHBondContact O-N 2.85Å; L546-M548 VanDerWaalsContact O-N 3.16Å; L546-G549 WeakPolarHBondContact O-CA 3.34Å; L546-G549 PolarHBondContact O-N 3.1Å; L546-E551 HydrophobicContact CD2-CB 3.95Å; L546-E551 HydrophobicContact CD2-CG 4.18Å; L546-A578 HydrophobicContact CD1-CB 3.78Å; L546-I579 HydrophobicContact CD1-CD1 3.45Å; L546-I579 VanDerWaalsContact CD1-CD1 3.45Å; L546-I579 HydrophobicContact CD1-CG1 3.91Å; L546-I579 HydrophobicContact CG-CD1 3.89Å; L546-I582 HydrophobicContact CD1-CD1 3.65Å; L546-I582 HydrophobicContact CD2-CD1 3.35Å; L546-I582 HydrophobicContact CG-CD1 4.11Å
547	D	84.4	Confident	91.5	Very high	94 Å²	94	31.8 Å²	31.8	50%	0.503	17%	0.17	S	C	.	.	H	α-helix	trans	-54	-35.5	174.9	-67.3	-13.6	0	0	0	112.5	D543 R544 G549	D543-D547 PolarHBondContact O-N 2.8Å; R544-D547 WeakPolarHBondContact CD-OD2 3.21Å; R544-D547 IonicContact CZ-OD2 2.73Å; R544-D547 IonicContact NE-OD2 3.03Å; R544-D547 IonicContact NH2-OD2 3.5Å; R544-D547 PolarHBondContact NH2-OD2 3.03Å; D547-G549 VanDerWaalsContact C-N 3.28Å; D547-G549 PolarHBondContact O-N 3.06Å
548	M	83.5	Confident	91.3	Very high	57 Å²	57	32 Å²	32	28%	0.281	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	2.4	179	-68	-177.8	69.2	0	0	113.7	P467 T468 R544 L546 F550 V694	P467-M548 HydrophobicContact CB-SD 3.85Å; T468-M548 HydrophobicContact CG2-SD 4.47Å; R544-M548 WeakPolarHBondContact O-CB 3.37Å; R544-M548 WeakPolarHBondContact O-CG 3.46Å; R544-M548 PolarHBondContact O-N 2.66Å; L546-M548 PolarHBondContact O-N 2.85Å; L546-M548 VanDerWaalsContact O-N 3.16Å; M548-F550 HydrophobicContact CB-CD2 3.62Å; M548-F550 HydrophobicContact CB-CE2 3.64Å; M548-F550 HydrophobicContact CE-CE2 3.75Å; M548-F550 HydrophobicContact CE-CZ 4.27Å; M548-F550 HydrophobicContact CG-CE2 4.47Å; M548-F550 HydrophobicContact SD-CE2 4.15Å; M548-V694 HydrophobicContact CE-CG1 4.25Å
549	G	89.3	Confident	91	Very high	55 Å²	55	36.6 Å²	36.6	57%	0.567	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.7	17.9	178.5	0	0	0	0	0	114.7	L546 D547 E551	L546-G549 WeakPolarHBondContact O-CA 3.34Å; L546-G549 PolarHBondContact O-N 3.1Å; D547-G549 VanDerWaalsContact C-N 3.28Å; D547-G549 PolarHBondContact O-N 3.06Å; G549-E551 VanDerWaalsContact C-N 3.25Å; G549-E551 PolarHBondContact O-N 3.35Å
550	F	90.7	Very high	90.8	Very high	47 Å²	47	40.5 Å²	40.5	21%	0.206	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	6.2	179.7	-63.4	-59	0	0	0	114.2	P517 L545 M548 N552 D553 F554	P517-F550 HydrophobicContact CB-CB 4.18Å; P517-F550 HydrophobicContact CB-CD1 3.95Å; P517-F550 HydrophobicContact CB-CG 4.1Å; P517-F550 HydrophobicContact CG-CB 3.85Å; P517-F550 HydrophobicContact CG-CD1 4.05Å; P517-F550 HydrophobicContact CG-CD2 4.02Å; P517-F550 HydrophobicContact CG-CG 3.74Å; L545-F550 HydrophobicContact CD2-CB 4.17Å; L545-F550 HydrophobicContact CD2-CD2 3.94Å; L545-F550 HydrophobicContact CD2-CG 4.41Å; L545-F550 WeakPolarHBondContact O-CB 3.29Å; L545-F550 PolarHBondContact O-N 3.42Å; M548-F550 HydrophobicContact CB-CD2 3.62Å; M548-F550 HydrophobicContact CB-CE2 3.64Å; M548-F550 HydrophobicContact CE-CE2 3.75Å; M548-F550 HydrophobicContact CE-CZ 4.27Å; M548-F550 HydrophobicContact CG-CE2 4.47Å; M548-F550 HydrophobicContact SD-CE2 4.15Å; F550-N552 VanDerWaalsContact C-N 3.25Å; F550-N552 PolarHBondContact O-N 3.37Å; F550-D553 PolarHBondContact O-N 3.11Å; F550-F554 WeakPolarHBondContact O-CB 3.49Å; F550-F554 PolarHBondContact O-N 3.43Å
551	E	91.4	Very high	90.7	Very high	73 Å²	73	40.3 Å²	40.3	34%	0.341	21%	0.21	S	C	.	.	H	α-helix	trans	-48.3	-44.5	178.7	-173.3	-179.6	167.1	0	0	112.8	L546 G549 F554 R555 I582	L546-E551 HydrophobicContact CD2-CB 3.95Å; L546-E551 HydrophobicContact CD2-CG 4.18Å; G549-E551 VanDerWaalsContact C-N 3.25Å; G549-E551 PolarHBondContact O-N 3.35Å; E551-F554 PolarHBondContact O-N 2.78Å; E551-R555 WeakPolarHBondContact O-CG 3.4Å; E551-R555 PolarHBondContact O-N 3.46Å; E551-R555 IonicContact OE1-CZ 2.67Å; E551-R555 VanDerWaalsContact OE1-CZ 3.29Å; E551-R555 IonicContact OE1-NH1 2.66Å; E551-R555 PolarHBondContact OE1-NH1 3.21Å; E551-R555 IonicContact OE1-NH2 3.1Å; E551-R555 PolarHBondContact OE1-NH2 3.41Å; E551-R555 VanDerWaalsContact OE1-NH2 3.14Å; E551-I582 HydrophobicContact CG-CD1 4.16Å
552	N	93.2	Very high	90.6	Very high	124 Å²	124	45.3 Å²	45.3	66%	0.663	23%	0.234	S	C	*	.	H	α-helix	trans	-68.3	-38.4	178.8	-69.7	-41.5	0	0	0	113.4	F550 F556	F550-N552 VanDerWaalsContact C-N 3.25Å; F550-N552 PolarHBondContact O-N 3.37Å; N552-F556 WeakPolarHBondContact O-CB 3.22Å; N552-F556 PolarHBondContact O-N 3.34Å
553	D	94.1	Very high	90.4	Very high	45 Å²	45	50.3 Å²	50.3	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-71.6	-37.6	176.5	-81.4	-31.7	0	0	0	110.8	P517 C521 F550 F556 I557	P517-D553 HydrophobicContact CB-CB 3.58Å; C521-D553 PolarHBondContact SG-OD1 3.28Å; F550-D553 PolarHBondContact O-N 3.11Å; D553-F556 PolarHBondContact O-N 3.31Å; D553-I557 WeakPolarHBondContact O-CD1 3.5Å; D553-I557 WeakPolarHBondContact O-CG1 3.4Å; D553-I557 PolarHBondContact O-N 3.47Å
554	F	93.4	Very high	90.5	Very high	5 Å²	5	52.2 Å²	52.2	2%	0.022	28%	0.278	C	S	.	.	H	α-helix	trans	-61.9	-52.4	173	162.2	-99.4	0	0	0	111.3	L465 F537 V539 F550 E551 F556 I557 A558 I582 F586	L465-F554 HydrophobicContact CD2-CB 4.17Å; L465-F554 HydrophobicContact CD2-CD2 3.72Å; L465-F554 HydrophobicContact CD2-CG 4.43Å; F537-F554 AromaticContact CE1-CE2 3.84Å; F537-F554 HydrophobicContact CE1-CE2 3.84Å; F537-F554 HydrophobicContact CZ-CD2 4.16Å; F537-F554 AromaticContact CZ-CE2 3.86Å; F537-F554 HydrophobicContact CZ-CE2 3.86Å; V539-F554 HydrophobicContact CG2-CD2 4.29Å; V539-F554 HydrophobicContact CG2-CE2 3.72Å; F550-F554 WeakPolarHBondContact O-CB 3.49Å; F550-F554 PolarHBondContact O-N 3.43Å; E551-F554 PolarHBondContact O-N 2.78Å; F554-F556 VanDerWaalsContact C-N 3.28Å; F554-F556 PolarHBondContact O-N 3.08Å; F554-I557 PolarHBondContact O-N 2.79Å; F554-A558 HydrophobicContact CE2-CB 4.45Å; F554-A558 HydrophobicContact CZ-CB 4.33Å; F554-A558 PolarHBondContact O-N 3.28Å; F554-I582 HydrophobicContact CD1-CD1 4.13Å; F554-I582 HydrophobicContact CD1-CG2 4.34Å; F554-I582 HydrophobicContact CE1-CD1 4.08Å; F554-I582 HydrophobicContact CE1-CG1 4.42Å; F554-I582 HydrophobicContact CE1-CG2 3.41Å; F554-I582 VanDerWaalsContact CE1-CG2 3.41Å; F554-I582 HydrophobicContact CZ-CG2 3.67Å; F554-F586 HydrophobicContact CD1-CE2 4.48Å; F554-F586 AromaticContact CE1-CD2 3.49Å; F554-F586 HydrophobicContact CE1-CD2 3.49Å; F554-F586 VanDerWaalsContact CE1-CD2 3.49Å; F554-F586 AromaticContact CE1-CE2 3.52Å; F554-F586 HydrophobicContact CE1-CE2 3.52Å; F554-F586 HydrophobicContact CE1-CG 4.24Å; F554-F586 HydrophobicContact CE1-CZ 4.32Å; F554-F586 HydrophobicContact CZ-CB 4.34Å; F554-F586 AromaticContact CZ-CD2 3.65Å; F554-F586 HydrophobicContact CZ-CD2 3.65Å; F554-F586 HydrophobicContact CZ-CE2 4.11Å; F554-F586 AromaticContact CZ-CG 3.98Å; F554-F586 HydrophobicContact CZ-CG 3.98Å
555	R	93.5	Very high	90.8	Very high	56 Å²	56	60.9 Å²	60.9	21%	0.211	32%	0.319	C	S	.	.	H	α-helix	trans	-56	-43.3	175.7	-77.7	-152.2	176	86.8	12.9	111.7	E551 I557 A558 Q559 E585 F586	E551-R555 WeakPolarHBondContact O-CG 3.4Å; E551-R555 PolarHBondContact O-N 3.46Å; E551-R555 IonicContact OE1-CZ 2.67Å; E551-R555 VanDerWaalsContact OE1-CZ 3.29Å; E551-R555 IonicContact OE1-NH1 2.66Å; E551-R555 PolarHBondContact OE1-NH1 3.21Å; E551-R555 IonicContact OE1-NH2 3.1Å; E551-R555 PolarHBondContact OE1-NH2 3.41Å; E551-R555 VanDerWaalsContact OE1-NH2 3.14Å; R555-I557 VanDerWaalsContact C-N 3.34Å; R555-I557 PolarHBondContact O-N 2.95Å; R555-A558 PolarHBondContact O-N 3.38Å; R555-Q559 WeakPolarHBondContact O-CB 3.32Å; R555-Q559 VanDerWaalsContact O-CG 3.25Å; R555-Q559 WeakPolarHBondContact O-CG 3.41Å; R555-Q559 PolarHBondContact O-N 3.34Å; R555-E585 IonicContact CZ-OE1 3.45Å; R555-E585 IonicContact CZ-OE2 2.86Å; R555-E585 IonicContact NE-OE1 3.34Å; R555-E585 PolarHBondContact NE-OE1 3.1Å; R555-E585 IonicContact NE-OE2 2.86Å; R555-E585 PolarHBondContact NE-OE2 3.34Å; R555-E585 IonicContact NH2-OE1 2.73Å; R555-E585 IonicContact NH2-OE2 2.69Å; R555-E585 PolarHBondContact NH2-OE2 2.99Å; R555-F586 HydrophobicContact CB-CZ 4.4Å; R555-F586 HydrophobicContact CG-CE2 4.05Å; R555-F586 HydrophobicContact CG-CZ 3.83Å
556	F	94.8	Very high	91	Very high	47 Å²	47	62.3 Å²	62.3	21%	0.206	33%	0.325	C	S	.	.	H	α-helix	trans	-58	-44.7	175.6	170.6	-95.5	0	0	0	112	C521 I524 K525 N552 D553 F554 Q560	C521-F556 HydrophobicContact CB-CD1 4.28Å; C521-F556 HydrophobicContact CB-CE1 4.39Å; I524-F556 HydrophobicContact CG2-CE1 4.21Å; I524-F556 HydrophobicContact CG2-CZ 4.36Å; K525-F556 HydrophobicContact CD-CE1 4.3Å; K525-F556 HydrophobicContact CD-CZ 4.07Å; K525-F556 VanDerWaalsContact CE-CE1 3.48Å; K525-F556 VanDerWaalsContact CE-CE2 3.49Å; K525-F556 HydrophobicContact CG-CE1 4Å; K525-F556 HydrophobicContact CG-CE2 4.35Å; K525-F556 HydrophobicContact CG-CZ 3.56Å; N552-F556 WeakPolarHBondContact O-CB 3.22Å; N552-F556 PolarHBondContact O-N 3.34Å; D553-F556 PolarHBondContact O-N 3.31Å; F554-F556 VanDerWaalsContact C-N 3.28Å; F554-F556 PolarHBondContact O-N 3.08Å; F556-Q560 HydrophobicContact CE1-CG 4.38Å; F556-Q560 HydrophobicContact CZ-CG 4.17Å; F556-Q560 WeakPolarHBondContact O-CG 3.48Å; F556-Q560 PolarHBondContact O-N 3.49Å
557	I	94.6	Very high	91.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.6	-45.6	178.7	-70.3	160.6	0	0	0	111.1	L463 L465 L520 I524 F537 D553 F554 R555 Q559 Q560 L561	L463-I557 HydrophobicContact CD2-CG2 3.69Å; L465-I557 HydrophobicContact CD1-CD1 3.72Å; L465-I557 HydrophobicContact CD2-CD1 4.46Å; L520-I557 HydrophobicContact CB-CD1 4.48Å; L520-I557 HydrophobicContact CD2-CD1 3.76Å; L520-I557 HydrophobicContact CG-CD1 4.07Å; I524-I557 HydrophobicContact CD1-CG1 4.05Å; F537-I557 HydrophobicContact CE2-CG2 3.86Å; F537-I557 HydrophobicContact CZ-CG2 3.95Å; D553-I557 WeakPolarHBondContact O-CD1 3.5Å; D553-I557 WeakPolarHBondContact O-CG1 3.4Å; D553-I557 PolarHBondContact O-N 3.47Å; F554-I557 PolarHBondContact O-N 2.79Å; R555-I557 VanDerWaalsContact C-N 3.34Å; R555-I557 PolarHBondContact O-N 2.95Å; I557-Q559 VanDerWaalsContact C-N 3.35Å; I557-Q559 PolarHBondContact O-N 3.27Å; I557-Q560 WeakPolarHBondContact O-CB 3.4Å; I557-Q560 PolarHBondContact O-N 3.17Å; I557-Q560 VanDerWaalsContact O-N 3.09Å; I557-L561 HydrophobicContact CG2-CD1 4.43Å
558	A	92.8	Very high	92	Very high	4 Å²	4	57.2 Å²	57.2	3%	0.033	30%	0.298	C	S	.	.	H	α-helix	trans	-61.2	-42	179.4	0	0	0	0	0	111.9	F537 F554 R555 Q560 L561 E562 F586	F537-A558 HydrophobicContact CE1-CB 4.13Å; F554-A558 HydrophobicContact CE2-CB 4.45Å; F554-A558 HydrophobicContact CZ-CB 4.33Å; F554-A558 PolarHBondContact O-N 3.28Å; R555-A558 PolarHBondContact O-N 3.38Å; A558-Q560 PolarHBondContact O-N 3.23Å; A558-L561 WeakPolarHBondContact O-CA 3.49Å; A558-L561 WeakPolarHBondContact O-CB 3.04Å; A558-L561 PolarHBondContact O-N 3.49Å; A558-E562 PolarHBondContact O-N 2.94Å; A558-F586 HydrophobicContact CB-CD1 3.45Å; A558-F586 VanDerWaalsContact CB-CD1 3.45Å; A558-F586 HydrophobicContact CB-CE1 3.46Å; A558-F586 VanDerWaalsContact CB-CE1 3.46Å; A558-F586 HydrophobicContact CB-CG 4.17Å; A558-F586 HydrophobicContact CB-CZ 4.18Å
559	Q	92	Very high	92.7	Very high	98 Å²	98	54.5 Å²	54.5	46%	0.458	29%	0.285	S	S	.	.	H	α-helix	trans	-61	-25.8	174.2	-75.6	169.2	-1.4	0	0	114.2	R555 I557 L561 E562	R555-Q559 WeakPolarHBondContact O-CB 3.32Å; R555-Q559 VanDerWaalsContact O-CG 3.25Å; R555-Q559 WeakPolarHBondContact O-CG 3.41Å; R555-Q559 PolarHBondContact O-N 3.34Å; I557-Q559 VanDerWaalsContact C-N 3.35Å; I557-Q559 PolarHBondContact O-N 3.27Å; Q559-L561 VanDerWaalsContact C-N 3.26Å; Q559-E562 WeakPolarHBondContact CA-OE1 3.19Å; Q559-E562 WeakPolarHBondContact CG-OE1 3.32Å
560	Q	92.3	Very high	93	Very high	85 Å²	85	52 Å²	52	40%	0.397	26%	0.258	S	S	.	.	H	α-helix	trans	-75.3	-17	172.2	-60.7	-55	-85	0	0	113	I524 L531 F556 I557 A558	I524-Q560 HydrophobicContact CG2-CG 4.15Å; L531-Q560 HydrophobicContact CD1-CB 4.03Å; F556-Q560 HydrophobicContact CE1-CG 4.38Å; F556-Q560 HydrophobicContact CZ-CG 4.17Å; F556-Q560 WeakPolarHBondContact O-CG 3.48Å; F556-Q560 PolarHBondContact O-N 3.49Å; I557-Q560 WeakPolarHBondContact O-CB 3.4Å; I557-Q560 PolarHBondContact O-N 3.17Å; I557-Q560 VanDerWaalsContact O-N 3.09Å; A558-Q560 PolarHBondContact O-N 3.23Å
561	L	92.8	Very high	93.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-98.7	-25.7	-178.9	-66.6	164.7	0	0	0	112.9	L463 L531 C534 F537 I557 A558 Q559 S563 I564 H566	L463-L561 HydrophobicContact CD2-CD1 4.39Å; L531-L561 HydrophobicContact CB-CD2 3.89Å; L531-L561 HydrophobicContact CD1-CD2 4.01Å; L531-L561 HydrophobicContact CD1-CG 4.1Å; L531-L561 HydrophobicContact CG-CD2 4.43Å; C534-L561 HydrophobicContact CB-CD2 3.68Å; F537-L561 HydrophobicContact CB-CD1 3.82Å; F537-L561 HydrophobicContact CD1-CD1 3.67Å; F537-L561 HydrophobicContact CD2-CD1 3.64Å; F537-L561 HydrophobicContact CE1-CD1 4.1Å; F537-L561 HydrophobicContact CE2-CD1 4.09Å; F537-L561 HydrophobicContact CG-CD1 3.43Å; F537-L561 VanDerWaalsContact CG-CD1 3.43Å; F537-L561 HydrophobicContact CZ-CD1 4.3Å; I557-L561 HydrophobicContact CG2-CD1 4.43Å; A558-L561 WeakPolarHBondContact O-CA 3.49Å; A558-L561 WeakPolarHBondContact O-CB 3.04Å; A558-L561 PolarHBondContact O-N 3.49Å; Q559-L561 VanDerWaalsContact C-N 3.26Å; L561-S563 PolarHBondContact O-N 3.48Å; L561-I564 PolarHBondContact O-N 3.37Å; L561-I564 VanDerWaalsContact O-O 3.12Å; L561-H566 PolarHBondContact O-CE1 2.94Å; L561-H566 VanDerWaalsContact O-CE1 3.26Å; L561-H566 PolarHBondContact O-ND1 3.41Å
562	E	87.5	Confident	93.1	Very high	124 Å²	124	46.2 Å²	46.2	58%	0.579	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-31.2	177.3	-76.1	171	-154	0	0	114.5	A558 Q559 I564	A558-E562 PolarHBondContact O-N 2.94Å; Q559-E562 WeakPolarHBondContact CA-OE1 3.19Å; Q559-E562 WeakPolarHBondContact CG-OE1 3.32Å; E562-I564 VanDerWaalsContact C-N 3.26Å; E562-I564 PolarHBondContact O-N 3.27Å
563	S	86.2	Confident	92.5	Very high	107 Å²	107	41 Å²	41	75%	0.748	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	0.4	-180	65.7	0	0	0	0	115.3	L561	L561-S563 PolarHBondContact O-N 3.48Å
564	I	90.6	Very high	91.8	Very high	43 Å²	43	39.6 Å²	39.6	22%	0.221	20%	0.199	C	C	.	.	S	Bend	trans	-133.7	140.2	-170.4	-57.6	149.9	0	0	0	109	L531 L561 E562 H566	L531-I564 WeakPolarHBondContact O-CD1 3.23Å; L561-I564 PolarHBondContact O-N 3.37Å; L561-I564 VanDerWaalsContact O-O 3.12Å; E562-I564 VanDerWaalsContact C-N 3.26Å; E562-I564 PolarHBondContact O-N 3.27Å; I564-H566 PolarHBondContact O-N 3.36Å; I564-H566 PolarHBondContact O-ND1 3.15Å
565	E	92.5	Very high	91.5	Very high	186 Å²	186	40.7 Å²	40.7	87%	0.869	20%	0.204	S	C	*	.			trans	-70.2	115.3	172.1	-172.2	176.6	-175.1	0	0	110.6
566	H	93.8	Very high	91.1	Very high	31 Å²	31	40.3 Å²	40.3	14%	0.144	21%	0.209	C	C	.	.			trans	-143.1	164.1	179.8	63.5	-78.3	0	0	0	110.8	R535 L561 I564 T568 K588	R535-H566 CarbonylContact O-C 3.34Å; R535-H566 WeakPolarHBondContact O-CA 3.46Å; L561-H566 PolarHBondContact O-CE1 2.94Å; L561-H566 VanDerWaalsContact O-CE1 3.26Å; L561-H566 PolarHBondContact O-ND1 3.41Å; I564-H566 PolarHBondContact O-N 3.36Å; I564-H566 PolarHBondContact O-ND1 3.15Å; H566-T568 PolarHBondContact CD2-OG1 3.46Å; H566-T568 VanDerWaalsContact CD2-OG1 3.22Å; H566-T568 PolarHBondContact NE2-OG1 3.49Å; H566-K588 WeakPolarHBondContact O-CE 3.31Å; H566-K588 PolarHBondContact O-NZ 3.24Å
567	Q	96.1	Very high	90.7	Very high	10 Å²	10	42.9 Å²	42.9	5%	0.047	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	128.7	170	-176.7	-175.5	16.8	0	0	108.9	V420 G423 R424 D425 R535 Y536 F537	V420-Q567 PolarHBondContact O-NE2 3.33Å; G423-Q567 VanDerWaalsContact C-NE2 3.34Å; R424-Q567 PolarHBondContact O-NE2 3.21Å; D425-Q567 WeakPolarHBondContact OD1-CA 3.4Å; R535-Q567 PolarHBondContact O-N 3.49Å; Y536-Q567 HydrophobicContact CD1-CB 4.31Å; F537-Q567 PolarHBondContact N-O 3.49Å
568	T	97	Very high	90.5	Very high	4 Å²	4	45.4 Å²	45.4	3%	0.025	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.9	177.8	-58.8	0	0	0	0	110.6	D425 Y426 F537 H566 L587	D425-T568 VanDerWaalsContact CA-O 3.31Å; D425-T568 WeakPolarHBondContact CA-O 3.24Å; D425-T568 PolarHBondContact OD1-N 2.86Å; Y426-T568 PolarHBondContact N-O 3.08Å; F537-T568 HydrophobicContact CD1-CG2 3.95Å; F537-T568 CarbonylContact O-C 3.45Å; F537-T568 WeakPolarHBondContact O-CA 3.48Å; H566-T568 PolarHBondContact CD2-OG1 3.46Å; H566-T568 VanDerWaalsContact CD2-OG1 3.22Å; H566-T568 PolarHBondContact NE2-OG1 3.49Å; T568-L587 HydrophobicContact CG2-CD2 3.52Å
569	M	97.4	Very high	90.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.7	178.1	-56.1	173.2	-114.6	0	0	110.5	V420 Y426 I444 Y536 F537 V538 V539 F571	V420-M569 HydrophobicContact CB-SD 4.28Å; V420-M569 HydrophobicContact CG1-CE 3.94Å; V420-M569 HydrophobicContact CG1-SD 3.56Å; V420-M569 VanDerWaalsContact CG1-SD 3.56Å; V420-M569 HydrophobicContact CG2-CG 4.45Å; V420-M569 HydrophobicContact CG2-SD 3.65Å; Y426-M569 CarbonylContact O-C 3.53Å; Y426-M569 VanDerWaalsContact O-CA 3.25Å; Y426-M569 WeakPolarHBondContact O-CA 3.33Å; I444-M569 HydrophobicContact CD1-CE 4Å; I444-M569 HydrophobicContact CG1-CE 4.27Å; Y536-M569 HydrophobicContact CD1-CE 3.68Å; Y536-M569 HydrophobicContact CG-CE 4.35Å; F537-M569 PolarHBondContact O-N 2.99Å; V538-M569 CarbonylContact C-O 3.57Å; V538-M569 WeakPolarHBondContact CA-O 3.24Å; V538-M569 HydrophobicContact CG2-CB 4.41Å; V538-M569 HydrophobicContact CG2-CE 3.95Å; V538-M569 HydrophobicContact CG2-SD 4.31Å; V539-M569 PolarHBondContact N-O 3.26Å; M569-F571 HydrophobicContact CB-CD2 4.46Å; M569-F571 HydrophobicContact CB-CE2 3.71Å
570	M	96.2	Very high	90.2	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.1	-179.9	-74.2	-176.5	72	0	0	110.9	Y426 M427 A428 V539 A542 I579 I582 A583 L587	Y426-M570 PolarHBondContact O-N 2.85Å; M427-M570 CarbonylContact C-O 3.57Å; M427-M570 WeakPolarHBondContact CA-O 3.16Å; M427-M570 HydrophobicContact CE-CB 4.45Å; M427-M570 HydrophobicContact SD-CB 3.38Å; M427-M570 WeakPolarHBondContact SD-CB 3.32Å; M427-M570 HydrophobicContact SD-CE 4.48Å; M427-M570 HydrophobicContact SD-CG 4.48Å; M427-M570 HydrophobicContact SD-SD 4.43Å; A428-M570 PolarHBondContact N-O 2.81Å; V539-M570 HydrophobicContact CB-CG 4.12Å; V539-M570 HydrophobicContact CG2-CG 4.23Å; A542-M570 HydrophobicContact CB-CE 4Å; M570-I579 HydrophobicContact CE-CG2 4.49Å; M570-I582 HydrophobicContact CE-CG2 3.62Å; M570-I582 HydrophobicContact SD-CG2 4.22Å; M570-A583 HydrophobicContact SD-CB 4.25Å; M570-L587 HydrophobicContact CG-CD2 4.16Å; M570-L587 HydrophobicContact SD-CD1 4.19Å; M570-L587 HydrophobicContact SD-CD2 4.24Å; M570-L587 HydrophobicContact SD-CG 4.14Å
571	F	94.2	Very high	90.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.7	-179.8	-65.8	-94.2	0	0	0	110	Y426 A428 K436 V439 Y440 V538 V539 E541 A542 M569	Y426-F571 HydrophobicContact CD1-CE1 4.19Å; Y426-F571 AromaticContact CD1-CZ 3.81Å; Y426-F571 HydrophobicContact CD1-CZ 3.81Å; Y426-F571 AromaticContact CE1-CE1 3.78Å; Y426-F571 HydrophobicContact CE1-CE1 3.78Å; Y426-F571 AromaticContact CE1-CZ 3.84Å; Y426-F571 HydrophobicContact CE1-CZ 3.84Å; A428-F571 HydrophobicContact CB-CD1 3.51Å; A428-F571 HydrophobicContact CB-CE1 3.69Å; A428-F571 HydrophobicContact CB-CG 4.33Å; K436-F571 HydrophobicContact CB-CD1 3.96Å; K436-F571 HydrophobicContact CD-CB 4.39Å; K436-F571 HydrophobicContact CD-CD1 4.2Å; K436-F571 HydrophobicContact CG-CD1 4.22Å; V439-F571 HydrophobicContact CB-CE1 3.88Å; V439-F571 HydrophobicContact CB-CZ 4.06Å; V439-F571 HydrophobicContact CG1-CE1 4.05Å; V439-F571 HydrophobicContact CG1-CZ 4.11Å; V439-F571 HydrophobicContact CG2-CE1 4.42Å; Y440-F571 AromaticContact CD1-CD2 3.72Å; Y440-F571 HydrophobicContact CD1-CD2 3.72Å; Y440-F571 HydrophobicContact CD1-CE1 4.27Å; Y440-F571 AromaticContact CD1-CE2 3.35Å; Y440-F571 HydrophobicContact CD1-CE2 3.35Å; Y440-F571 HydrophobicContact CD1-CG 4.34Å; Y440-F571 AromaticContact CD1-CZ 3.67Å; Y440-F571 HydrophobicContact CD1-CZ 3.67Å; Y440-F571 HydrophobicContact CE1-CD2 4.13Å; Y440-F571 HydrophobicContact CE1-CE2 4.21Å; Y440-F571 HydrophobicContact CG-CE2 4Å; Y440-F571 HydrophobicContact CG-CZ 4.35Å; V538-F571 HydrophobicContact CG1-CD2 4.04Å; V538-F571 HydrophobicContact CG1-CE2 4.14Å; V539-F571 PolarHBondContact O-N 3.36Å; E541-F571 PolarHBondContact N-O 3.06Å; A542-F571 PolarHBondContact N-O 3.27Å; M569-F571 HydrophobicContact CB-CD2 4.46Å; M569-F571 HydrophobicContact CB-CE2 3.71Å
572	S	89.3	Confident	90	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	163.7	-178.6	-173.7	0	0	0	0	110.8	A428 A430 K436 D543 T574	A428-S572 PolarHBondContact O-N 3.11Å; A430-S572 PolarHBondContact N-O 2.81Å; K436-S572 PolarHBondContact NZ-O 3.01Å; D543-S572 WeakPolarHBondContact CB-OG 3.23Å; D543-S572 PolarHBondContact OD1-OG 3.1Å; D543-S572 VanDerWaalsContact OD1-OG 3.06Å; S572-T574 VanDerWaalsContact CB-O 3.27Å; S572-T574 WeakPolarHBondContact CB-O 3.35Å; S572-T574 PolarHBondContact OG-N 3.25Å; S572-T574 PolarHBondContact OG-O 3.19Å
573	A	81.3	Confident	90.1	Very high	14 Å²	14	36.8 Å²	36.8	12%	0.116	22%	0.218	C	C	.	.	S	Bend	trans	-95.2	-28.2	166.1	0	0	0	0	0	112.2	H721	A573-H721 VanDerWaalsContact CB-NE2 3.3Å; A573-H721 WeakPolarHBondContact CB-NE2 3.43Å
574	T	80.2	Confident	90.3	Very high	16 Å²	16	37.8 Å²	37.8	10%	0.098	21%	0.209	C	C	.	.			trans	-120.6	173.9	-178.4	63.4	0	0	0	0	110.6	C429 D543 S572 P576	C429-T574 PolarHBondContact SG-O 2.86Å; D543-T574 WeakPolarHBondContact CB-OG1 3.38Å; S572-T574 VanDerWaalsContact CB-O 3.27Å; S572-T574 WeakPolarHBondContact CB-O 3.35Å; S572-T574 PolarHBondContact OG-N 3.25Å; S572-T574 PolarHBondContact OG-O 3.19Å; T574-P576 WeakPolarHBondContact OG1-CD 3.4Å
575	F	86.2	Confident	90.4	Very high	27 Å²	27	40 Å²	40	12%	0.118	22%	0.218	C	C	.	.			trans	-139.4	55.2	176.7	-156.2	-129	0	0	0	113.3	F5 M427 I579 Q580 F593	F5-F575 HydrophobicContact CE1-CE1 4.2Å; F5-F575 HydrophobicContact CZ-CD1 4.42Å; F5-F575 HydrophobicContact CZ-CE1 4.02Å; M427-F575 HydrophobicContact CE-CD2 3.84Å; M427-F575 HydrophobicContact CE-CE2 3.75Å; M427-F575 HydrophobicContact CG-CE2 4Å; M427-F575 HydrophobicContact CG-CZ 4.49Å; M427-F575 HydrophobicContact SD-CE2 4.07Å; F575-I579 HydrophobicContact CD2-CB 4.42Å; F575-I579 HydrophobicContact CD2-CG2 3.6Å; F575-I579 HydrophobicContact CE2-CG2 3.78Å; F575-Q580 HydrophobicContact CD1-CG 3.69Å; F575-Q580 HydrophobicContact CD2-CG 4.47Å; F575-Q580 HydrophobicContact CE1-CG 3.54Å; F575-Q580 HydrophobicContact CE2-CG 4.32Å; F575-Q580 HydrophobicContact CG-CG 4.17Å; F575-Q580 HydrophobicContact CZ-CG 3.87Å; F575-Q580 PolarHBondContact O-NE2 2.82Å; F575-F593 AromaticContact CD1-CE1 3.99Å; F575-F593 HydrophobicContact CD1-CE1 3.99Å; F575-F593 AromaticContact CD1-CZ 3.59Å; F575-F593 HydrophobicContact CD1-CZ 3.59Å; F575-F593 HydrophobicContact CD2-CE2 4.42Å; F575-F593 HydrophobicContact CD2-CZ 4.21Å; F575-F593 HydrophobicContact CE1-CD1 4.37Å; F575-F593 AromaticContact CE1-CE1 3.47Å; F575-F593 HydrophobicContact CE1-CE1 3.47Å; F575-F593 VanDerWaalsContact CE1-CE1 3.47Å; F575-F593 HydrophobicContact CE1-CE2 4.27Å; F575-F593 AromaticContact CE1-CZ 3.41Å; F575-F593 HydrophobicContact CE1-CZ 3.41Å; F575-F593 VanDerWaalsContact CE1-CZ 3.41Å; F575-F593 HydrophobicContact CE2-CE2 4.19Å; F575-F593 HydrophobicContact CE2-CZ 4.09Å; F575-F593 AromaticContact CG-CZ 3.99Å; F575-F593 HydrophobicContact CG-CZ 3.99Å; F575-F593 AromaticContact CZ-CE1 3.92Å; F575-F593 HydrophobicContact CZ-CE1 3.92Å; F575-F593 HydrophobicContact CZ-CE2 4.11Å; F575-F593 AromaticContact CZ-CZ 3.69Å; F575-F593 HydrophobicContact CZ-CZ 3.69Å
576	P	84.6	Confident	90.3	Very high	48 Å²	48	32.3 Å²	32.3	31%	0.312	18%	0.182	S	C	.	.			trans	-65	161.7	-179.7	29.7	-37	0	0	0	112	T574 A578 I579 Q580	T574-P576 WeakPolarHBondContact OG1-CD 3.4Å; P576-A578 PolarHBondContact O-N 2.85Å; P576-I579 HydrophobicContact CG-CB 4.26Å; P576-I579 HydrophobicContact CG-CG1 3.84Å; P576-I579 PolarHBondContact O-N 3.27Å; P576-Q580 PolarHBondContact O-N 3.1Å; P576-Q580 VanDerWaalsContact O-N 3.11Å
577	P	87.8	Confident	90.3	Very high	102 Å²	102	31.5 Å²	31.5	66%	0.662	18%	0.178	S	C	*	.	H	α-helix	trans	-53.7	-31.3	-177.5	-28.8	36.1	0	0	0	115.1	Q580 S581	P577-Q580 WeakPolarHBondContact O-CB 3.5Å; P577-Q580 PolarHBondContact O-N 3.3Å; P577-S581 PolarHBondContact O-N 3.11Å
578	A	88.9	Confident	90.1	Very high	52 Å²	52	35 Å²	35	43%	0.43	19%	0.193	S	C	.	.	H	α-helix	trans	-64.2	-42.1	175.2	0	0	0	0	0	112.5	L546 P576 S581 I582	L546-A578 HydrophobicContact CD1-CB 3.78Å; P576-A578 PolarHBondContact O-N 2.85Å; A578-S581 WeakPolarHBondContact O-CB 3.3Å; A578-S581 PolarHBondContact O-N 3.21Å; A578-I582 PolarHBondContact O-N 2.77Å; A578-I582 VanDerWaalsContact O-N 3.1Å
579	I	88.9	Confident	89.8	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-68.6	-37.8	175.4	-66.6	-71	0	0	0	110.8	M427 A542 D543 L546 M570 F575 P576 S581 I582 A583	M427-I579 HydrophobicContact CE-CG2 4.1Å; A542-I579 HydrophobicContact CB-CD1 3.89Å; A542-I579 WeakPolarHBondContact O-CD1 3.37Å; D543-I579 HydrophobicContact CB-CG1 4.41Å; L546-I579 HydrophobicContact CD1-CD1 3.45Å; L546-I579 VanDerWaalsContact CD1-CD1 3.45Å; L546-I579 HydrophobicContact CD1-CG1 3.91Å; L546-I579 HydrophobicContact CG-CD1 3.89Å; M570-I579 HydrophobicContact CE-CG2 4.49Å; F575-I579 HydrophobicContact CD2-CB 4.42Å; F575-I579 HydrophobicContact CD2-CG2 3.6Å; F575-I579 HydrophobicContact CE2-CG2 3.78Å; P576-I579 HydrophobicContact CG-CB 4.26Å; P576-I579 HydrophobicContact CG-CG1 3.84Å; P576-I579 PolarHBondContact O-N 3.27Å; I579-S581 VanDerWaalsContact C-N 3.31Å; I579-S581 PolarHBondContact O-N 3.48Å; I579-I582 PolarHBondContact O-N 3.39Å; I579-A583 WeakPolarHBondContact O-CB 3.4Å; I579-A583 PolarHBondContact O-N 3.02Å
580	Q	90.4	Very high	89.6	Confident	55 Å²	55	43.2 Å²	43.2	26%	0.257	25%	0.247	S	C	.	.	H	α-helix	trans	-61	-40.5	173.9	-62	173.7	26.2	0	0	111.9	F5 F575 P576 P577 K584	F5-Q580 HydrophobicContact CE1-CG 4.21Å; F575-Q580 HydrophobicContact CD1-CG 3.69Å; F575-Q580 HydrophobicContact CD2-CG 4.47Å; F575-Q580 HydrophobicContact CE1-CG 3.54Å; F575-Q580 HydrophobicContact CE2-CG 4.32Å; F575-Q580 HydrophobicContact CG-CG 4.17Å; F575-Q580 HydrophobicContact CZ-CG 3.87Å; F575-Q580 PolarHBondContact O-NE2 2.82Å; P576-Q580 PolarHBondContact O-N 3.1Å; P576-Q580 VanDerWaalsContact O-N 3.11Å; P577-Q580 WeakPolarHBondContact O-CB 3.5Å; P577-Q580 PolarHBondContact O-N 3.3Å; Q580-K584 WeakPolarHBondContact O-CG 3.23Å; Q580-K584 PolarHBondContact O-N 3.21Å; Q580-K584 VanDerWaalsContact O-N 3.16Å
581	S	91	Very high	89.5	Confident	68 Å²	68	44.3 Å²	44.3	48%	0.476	25%	0.251	S	S	.	.	H	α-helix	trans	-63.7	-45.1	176.1	-166.9	0	0	0	0	111.6	P577 A578 I579 K584 E585	P577-S581 PolarHBondContact O-N 3.11Å; A578-S581 WeakPolarHBondContact O-CB 3.3Å; A578-S581 PolarHBondContact O-N 3.21Å; I579-S581 VanDerWaalsContact C-N 3.31Å; I579-S581 PolarHBondContact O-N 3.48Å; S581-K584 PolarHBondContact O-N 3.09Å; S581-E585 WeakPolarHBondContact O-CB 3.35Å; S581-E585 PolarHBondContact O-N 2.72Å
582	I	90.5	Very high	89.6	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-69.8	-40	-179.2	-75.6	-175.9	0	0	0	112.3	L546 E551 F554 M570 A578 I579 K584 E585 F586	L546-I582 HydrophobicContact CD1-CD1 3.65Å; L546-I582 HydrophobicContact CD2-CD1 3.35Å; L546-I582 HydrophobicContact CG-CD1 4.11Å; E551-I582 HydrophobicContact CG-CD1 4.16Å; F554-I582 HydrophobicContact CD1-CD1 4.13Å; F554-I582 HydrophobicContact CD1-CG2 4.34Å; F554-I582 HydrophobicContact CE1-CD1 4.08Å; F554-I582 HydrophobicContact CE1-CG1 4.42Å; F554-I582 HydrophobicContact CE1-CG2 3.41Å; F554-I582 VanDerWaalsContact CE1-CG2 3.41Å; F554-I582 HydrophobicContact CZ-CG2 3.67Å; M570-I582 HydrophobicContact CE-CG2 3.62Å; M570-I582 HydrophobicContact SD-CG2 4.22Å; A578-I582 PolarHBondContact O-N 2.77Å; A578-I582 VanDerWaalsContact O-N 3.1Å; I579-I582 PolarHBondContact O-N 3.39Å; I582-K584 VanDerWaalsContact C-N 3.27Å; I582-K584 PolarHBondContact O-N 2.84Å; I582-E585 PolarHBondContact O-N 3.29Å; I582-E585 VanDerWaalsContact O-N 3.1Å; I582-F586 HydrophobicContact CG2-CD2 4.04Å; I582-F586 PolarHBondContact O-N 3.17Å
583	A	90	Very high	89.9	Confident	2 Å²	2	44.7 Å²	44.7	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-58	-42.2	173.3	0	0	0	0	0	111.2	M570 I579 E585 L587	M570-A583 HydrophobicContact SD-CB 4.25Å; I579-A583 WeakPolarHBondContact O-CB 3.4Å; I579-A583 PolarHBondContact O-N 3.02Å; A583-E585 VanDerWaalsContact C-N 3.34Å; A583-E585 PolarHBondContact O-N 2.82Å; A583-L587 HydrophobicContact CB-CD1 3.92Å; A583-L587 WeakPolarHBondContact O-CB 3.4Å; A583-L587 WeakPolarHBondContact O-CG 3.36Å; A583-L587 PolarHBondContact O-N 3.06Å
584	K	90.7	Very high	90.5	Very high	127 Å²	127	44 Å²	44	55%	0.552	25%	0.247	S	C	*	.	H	α-helix	trans	-70.4	-24.2	175.2	-71.8	178.5	176.8	-167.8	0	114.6	Q580 S581 I582	Q580-K584 WeakPolarHBondContact O-CG 3.23Å; Q580-K584 PolarHBondContact O-N 3.21Å; Q580-K584 VanDerWaalsContact O-N 3.16Å; S581-K584 PolarHBondContact O-N 3.09Å; I582-K584 VanDerWaalsContact C-N 3.27Å; I582-K584 PolarHBondContact O-N 2.84Å
585	E	91.1	Very high	91	Very high	89 Å²	89	43.5 Å²	43.5	42%	0.416	24%	0.244	S	C	.	.	H	α-helix	trans	-83.9	-35.2	-178.8	-169.3	-178.9	166.5	0	0	111.7	R555 S581 I582 A583	R555-E585 IonicContact CZ-OE1 3.45Å; R555-E585 IonicContact CZ-OE2 2.86Å; R555-E585 IonicContact NE-OE1 3.34Å; R555-E585 PolarHBondContact NE-OE1 3.1Å; R555-E585 IonicContact NE-OE2 2.86Å; R555-E585 PolarHBondContact NE-OE2 3.34Å; R555-E585 IonicContact NH2-OE1 2.73Å; R555-E585 IonicContact NH2-OE2 2.69Å; R555-E585 PolarHBondContact NH2-OE2 2.99Å; S581-E585 WeakPolarHBondContact O-CB 3.35Å; S581-E585 PolarHBondContact O-N 2.72Å; I582-E585 PolarHBondContact O-N 3.29Å; I582-E585 VanDerWaalsContact O-N 3.1Å; A583-E585 VanDerWaalsContact C-N 3.34Å; A583-E585 PolarHBondContact O-N 2.82Å
586	F	91.4	Very high	91.1	Very high	25 Å²	25	43.1 Å²	43.1	11%	0.11	24%	0.244	C	C	.	.	H	α-helix	trans	-123.7	-6.8	-168.2	-63	-73.8	0	0	0	116.8	F554 R555 A558 I582	F554-F586 HydrophobicContact CD1-CE2 4.48Å; F554-F586 AromaticContact CE1-CD2 3.49Å; F554-F586 HydrophobicContact CE1-CD2 3.49Å; F554-F586 VanDerWaalsContact CE1-CD2 3.49Å; F554-F586 AromaticContact CE1-CE2 3.52Å; F554-F586 HydrophobicContact CE1-CE2 3.52Å; F554-F586 HydrophobicContact CE1-CG 4.24Å; F554-F586 HydrophobicContact CE1-CZ 4.32Å; F554-F586 HydrophobicContact CZ-CB 4.34Å; F554-F586 AromaticContact CZ-CD2 3.65Å; F554-F586 HydrophobicContact CZ-CD2 3.65Å; F554-F586 HydrophobicContact CZ-CE2 4.11Å; F554-F586 AromaticContact CZ-CG 3.98Å; F554-F586 HydrophobicContact CZ-CG 3.98Å; R555-F586 HydrophobicContact CB-CZ 4.4Å; R555-F586 HydrophobicContact CG-CE2 4.05Å; R555-F586 HydrophobicContact CG-CZ 3.83Å; A558-F586 HydrophobicContact CB-CD1 3.45Å; A558-F586 VanDerWaalsContact CB-CD1 3.45Å; A558-F586 HydrophobicContact CB-CE1 3.46Å; A558-F586 VanDerWaalsContact CB-CE1 3.46Å; A558-F586 HydrophobicContact CB-CG 4.17Å; A558-F586 HydrophobicContact CB-CZ 4.18Å; I582-F586 HydrophobicContact CG2-CD2 4.04Å; I582-F586 PolarHBondContact O-N 3.17Å
587	L	93.1	Very high	90.9	Very high	14 Å²	14	42 Å²	42	7%	0.073	24%	0.242	C	C	.	.	S	Bend	trans	-95.3	146.4	167.7	-55.4	174.6	0	0	0	109.8	D425 M427 T568 M570 A583 F591	D425-L587 HydrophobicContact CB-CD2 4.37Å; M427-L587 HydrophobicContact CB-CD1 3.95Å; T568-L587 HydrophobicContact CG2-CD2 3.52Å; M570-L587 HydrophobicContact CG-CD2 4.16Å; M570-L587 HydrophobicContact SD-CD1 4.19Å; M570-L587 HydrophobicContact SD-CD2 4.24Å; M570-L587 HydrophobicContact SD-CG 4.14Å; A583-L587 HydrophobicContact CB-CD1 3.92Å; A583-L587 WeakPolarHBondContact O-CB 3.4Å; A583-L587 WeakPolarHBondContact O-CG 3.36Å; A583-L587 PolarHBondContact O-N 3.06Å; L587-F591 HydrophobicContact CB-CB 3.96Å; L587-F591 HydrophobicContact CB-CD1 4.19Å; L587-F591 HydrophobicContact CB-CD2 4.41Å; L587-F591 HydrophobicContact CB-CG 3.95Å; L587-F591 HydrophobicContact CD1-CB 4.3Å; L587-F591 HydrophobicContact CD1-CD2 3.44Å; L587-F591 VanDerWaalsContact CD1-CD2 3.44Å; L587-F591 HydrophobicContact CD1-CE2 3.75Å; L587-F591 HydrophobicContact CD1-CG 3.86Å; L587-F591 HydrophobicContact CD1-CZ 4.44Å
588	K	93.1	Very high	90.1	Very high	83 Å²	83	43.7 Å²	43.7	36%	0.361	25%	0.245	S	C	.	.			trans	-59.9	152.3	170.7	-64.9	163.5	-163.6	139	0	110.9	D425 H566 D590 F591	D425-K588 HydrophobicContact CB-CB 4.47Å; D425-K588 IonicContact OD1-NZ 2.71Å; D425-K588 PolarHBondContact OD1-NZ 2.9Å; D425-K588 VanDerWaalsContact OD2-CG 3.32Å; D425-K588 WeakPolarHBondContact OD2-CG 3.29Å; D425-K588 PolarHBondContact OD2-N 3.02Å; D425-K588 IonicContact OD2-NZ 3.88Å; H566-K588 WeakPolarHBondContact O-CE 3.31Å; H566-K588 PolarHBondContact O-NZ 3.24Å; K588-D590 VanDerWaalsContact CB-OD1 3.24Å; K588-D590 WeakPolarHBondContact CB-OD1 3.43Å; K588-D590 PolarHBondContact O-N 2.77Å; K588-F591 WeakPolarHBondContact O-CB 3.49Å; K588-F591 VanDerWaalsContact O-CD1 3.25Å; K588-F591 WeakPolarHBondContact O-CD1 3.22Å; K588-F591 PolarHBondContact O-N 2.75Å
589	S	89.9	Confident	89.2	Confident	115 Å²	115	44.7 Å²	44.7	80%	0.804	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-22	-177.4	52.6	0	0	0	0	114.8
590	D	92	Very high	87.7	Confident	63 Å²	63	46.3 Å²	46.3	34%	0.337	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	13.7	178.9	73.1	-60.1	0	0	0	113.5	R424 K588	R424-D590 IonicContact CZ-OD2 2.99Å; R424-D590 IonicContact NE-OD2 2.69Å; R424-D590 PolarHBondContact NE-OD2 3.13Å; R424-D590 PolarHBondContact NH2-O 3.22Å; R424-D590 IonicContact NH2-OD2 3.27Å; K588-D590 VanDerWaalsContact CB-OD1 3.24Å; K588-D590 WeakPolarHBondContact CB-OD1 3.43Å; K588-D590 PolarHBondContact O-N 2.77Å
591	F	94.7	Very high	86.3	Confident	24 Å²	24	44.8 Å²	44.8	11%	0.105	26%	0.259	C	S	.	.			trans	-57.3	146.9	179.3	79.3	-74.7	0	0	0	112.9	F7 D425 M427 L587 K588 F593	F7-F591 HydrophobicContact CZ-CE1 4.3Å; D425-F591 HydrophobicContact CB-CB 3.76Å; D425-F591 CarbonylContact O-C 3.27Å; D425-F591 VanDerWaalsContact O-CA 3.29Å; D425-F591 WeakPolarHBondContact O-CA 3.49Å; D425-F591 WeakPolarHBondContact O-CB 3.32Å; M427-F591 HydrophobicContact CB-CD2 3.88Å; M427-F591 HydrophobicContact CB-CE2 3.8Å; L587-F591 HydrophobicContact CB-CB 3.96Å; L587-F591 HydrophobicContact CB-CD1 4.19Å; L587-F591 HydrophobicContact CB-CD2 4.41Å; L587-F591 HydrophobicContact CB-CG 3.95Å; L587-F591 HydrophobicContact CD1-CB 4.3Å; L587-F591 HydrophobicContact CD1-CD2 3.44Å; L587-F591 VanDerWaalsContact CD1-CD2 3.44Å; L587-F591 HydrophobicContact CD1-CE2 3.75Å; L587-F591 HydrophobicContact CD1-CG 3.86Å; L587-F591 HydrophobicContact CD1-CZ 4.44Å; K588-F591 WeakPolarHBondContact O-CB 3.49Å; K588-F591 VanDerWaalsContact O-CD1 3.25Å; K588-F591 WeakPolarHBondContact O-CD1 3.22Å; K588-F591 PolarHBondContact O-N 2.75Å; F591-F593 HydrophobicContact CD2-CB 4.31Å; F591-F593 HydrophobicContact CE2-CB 3.83Å
592	I	96.5	Very high	85.1	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.2	171.6	-57	-56.2	0	0	0	108.7	T376 Q379 C381 V419 R424 D425 Y426 M427 Q594	T376-I592 HydrophobicContact CG2-CG2 4.11Å; Q379-I592 WeakPolarHBondContact O-CD1 3.5Å; C381-I592 HydrophobicContact CB-CD1 4.01Å; V419-I592 HydrophobicContact CG1-CB 3.77Å; V419-I592 HydrophobicContact CG1-CG1 3.85Å; V419-I592 HydrophobicContact CG1-CG2 4.24Å; V419-I592 HydrophobicContact CG2-CB 4.42Å; V419-I592 HydrophobicContact CG2-CG1 4.45Å; V419-I592 HydrophobicContact CG2-CG2 4.04Å; R424-I592 HydrophobicContact CB-CG1 4.42Å; D425-I592 PolarHBondContact O-N 3.29Å; Y426-I592 CarbonylContact C-O 3.6Å; Y426-I592 WeakPolarHBondContact CA-O 3.49Å; Y426-I592 HydrophobicContact CD2-CB 4.34Å; Y426-I592 HydrophobicContact CD2-CG2 4.44Å; Y426-I592 WeakPolarHBondContact CD2-O 3.46Å; M427-I592 PolarHBondContact N-O 2.78Å; I592-Q594 HydrophobicContact CG2-CG 4.15Å
593	F	95.2	Very high	84.2	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.035	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.8	173.8	177.1	-146.2	0	0	0	110.2	T376 I377 M427 C429 F575 F591 I595	T376-F593 WeakPolarHBondContact CA-O 3.39Å; I377-F593 HydrophobicContact CB-CB 4.24Å; I377-F593 HydrophobicContact CB-CD1 4.31Å; I377-F593 HydrophobicContact CD1-CD1 3.82Å; I377-F593 HydrophobicContact CD1-CE1 4.18Å; I377-F593 PolarHBondContact N-O 2.75Å; I377-F593 PolarHBondContact O-N 3.13Å; M427-F593 HydrophobicContact CB-CB 4.28Å; M427-F593 HydrophobicContact CB-CD2 3.71Å; M427-F593 HydrophobicContact CB-CE2 4.5Å; M427-F593 HydrophobicContact CB-CG 4.33Å; M427-F593 HydrophobicContact CG-CD2 3.38Å; M427-F593 HydrophobicContact CG-CE2 3.69Å; M427-F593 HydrophobicContact CG-CG 4.27Å; M427-F593 WeakPolarHBondContact O-CA 3.15Å; C429-F593 HydrophobicContact CB-CE2 4.19Å; F575-F593 AromaticContact CD1-CE1 3.99Å; F575-F593 HydrophobicContact CD1-CE1 3.99Å; F575-F593 AromaticContact CD1-CZ 3.59Å; F575-F593 HydrophobicContact CD1-CZ 3.59Å; F575-F593 HydrophobicContact CD2-CE2 4.42Å; F575-F593 HydrophobicContact CD2-CZ 4.21Å; F575-F593 HydrophobicContact CE1-CD1 4.37Å; F575-F593 AromaticContact CE1-CE1 3.47Å; F575-F593 HydrophobicContact CE1-CE1 3.47Å; F575-F593 VanDerWaalsContact CE1-CE1 3.47Å; F575-F593 HydrophobicContact CE1-CE2 4.27Å; F575-F593 AromaticContact CE1-CZ 3.41Å; F575-F593 HydrophobicContact CE1-CZ 3.41Å; F575-F593 VanDerWaalsContact CE1-CZ 3.41Å; F575-F593 HydrophobicContact CE2-CE2 4.19Å; F575-F593 HydrophobicContact CE2-CZ 4.09Å; F575-F593 AromaticContact CG-CZ 3.99Å; F575-F593 HydrophobicContact CG-CZ 3.99Å; F575-F593 AromaticContact CZ-CE1 3.92Å; F575-F593 HydrophobicContact CZ-CE1 3.92Å; F575-F593 HydrophobicContact CZ-CE2 4.11Å; F575-F593 AromaticContact CZ-CZ 3.69Å; F575-F593 HydrophobicContact CZ-CZ 3.69Å; F591-F593 HydrophobicContact CD2-CB 4.31Å; F591-F593 HydrophobicContact CE2-CB 3.83Å; F593-I595 HydrophobicContact CE1-CD1 3.74Å; F593-I595 HydrophobicContact CE1-CG1 3.97Å; F593-I595 HydrophobicContact CE2-CD1 4.47Å; F593-I595 HydrophobicContact CE2-CG1 3.8Å; F593-I595 HydrophobicContact CZ-CD1 3.66Å; F593-I595 HydrophobicContact CZ-CG1 3.45Å; F593-I595 VanDerWaalsContact CZ-CG1 3.45Å
594	Q	94.1	Very high	83.7	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	131.6	176.5	-74.1	170.9	-1.1	0	0	111.4	V374 E375 T376 Y415 Y426 M427 A428 C429 I592	V374-Q594 HydrophobicContact CG1-CB 4.45Å; V374-Q594 HydrophobicContact CG1-CG 4.49Å; E375-Q594 WeakPolarHBondContact O-CA 3.29Å; T376-Q594 HydrophobicContact CG2-CG 4.04Å; Y415-Q594 VanDerWaalsContact CB-OE1 3.3Å; Y415-Q594 PolarHBondContact O-NE2 2.92Å; Y415-Q594 VanDerWaalsContact O-NE2 3.17Å; Y415-Q594 PolarHBondContact O-OE1 2.95Å; Y426-Q594 HydrophobicContact CE2-CB 4.07Å; Y426-Q594 HydrophobicContact CE2-CG 4.06Å; Y426-Q594 PolarHBondContact OH-OE1 3.45Å; M427-Q594 PolarHBondContact O-N 2.71Å; A428-Q594 WeakPolarHBondContact CA-O 3.15Å; C429-Q594 PolarHBondContact N-O 3.32Å; I592-Q594 HydrophobicContact CG2-CG 4.15Å
595	I	91.7	Very high	83.2	Confident	5 Å²	5	42.6 Å²	42.6	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.4	173.2	-61.9	163.2	0	0	0	107.4	V374 E375 C429 F593 L599	V374-I595 CarbonylContact C-O 3.5Å; V374-I595 VanDerWaalsContact CA-O 3.32Å; V374-I595 WeakPolarHBondContact CA-O 3.44Å; E375-I595 HydrophobicContact CB-CB 4.32Å; E375-I595 PolarHBondContact N-O 2.94Å; E375-I595 PolarHBondContact O-N 3.13Å; C429-I595 HydrophobicContact CB-CG1 4.33Å; C429-I595 WeakPolarHBondContact O-CA 3.49Å; F593-I595 HydrophobicContact CE1-CD1 3.74Å; F593-I595 HydrophobicContact CE1-CG1 3.97Å; F593-I595 HydrophobicContact CE2-CD1 4.47Å; F593-I595 HydrophobicContact CE2-CG1 3.8Å; F593-I595 HydrophobicContact CZ-CD1 3.66Å; F593-I595 HydrophobicContact CZ-CG1 3.45Å; F593-I595 VanDerWaalsContact CZ-CG1 3.45Å; I595-L599 HydrophobicContact CD1-CD1 4.07Å; I595-L599 HydrophobicContact CG1-CD2 4.28Å; I595-L599 HydrophobicContact CG2-CD1 4.4Å; I595-L599 HydrophobicContact CG2-CD2 3.67Å; I595-L599 HydrophobicContact CG2-CG 3.72Å
596	V	87.7	Confident	83	Confident	19 Å²	19	38.4 Å²	38.4	12%	0.115	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.7	177.9	179.2	0	0	0	0	110	A372 V374 V411 I412 C429 A430	A372-V596 HydrophobicContact CB-CG1 4.09Å; V374-V596 HydrophobicContact CG1-CG2 4.22Å; V374-V596 HydrophobicContact CG2-CG2 4.11Å; V411-V596 HydrophobicContact CB-CG1 4.1Å; V411-V596 HydrophobicContact CG1-CG1 3.85Å; V411-V596 HydrophobicContact CG1-CG2 4.38Å; I412-V596 HydrophobicContact CB-CG2 4.14Å; I412-V596 HydrophobicContact CD1-CG2 3.5Å; I412-V596 HydrophobicContact CG1-CG2 4.4Å; C429-V596 PolarHBondContact O-N 2.93Å; A430-V596 HydrophobicContact CB-CB 3.93Å; A430-V596 HydrophobicContact CB-CG2 4.46Å
597	G	80.5	Confident	83.1	Confident	26 Å²	26	41.2 Å²	41.2	27%	0.268	24%	0.244	S	C	.	.	S	Bend	trans	73.6	-165.9	-173.5	0	0	0	0	0	113.1	K373	K373-G597 PolarHBondContact O-N 3.46Å
598	N	71.2	Confident	83.1	Confident	136 Å²	136	41 Å²	41	73%	0.727	24%	0.242	S	C	*	.	S	Bend	trans	-80	124.8	179.3	-65.2	-4.3	0	0	0	110.1	G600 G601	N598-G600 PolarHBondContact O-N 2.72Å; N598-G601 PolarHBondContact O-N 3.02Å
599	L	68.5	Low	83.1	Confident	73 Å²	73	40 Å²	40	38%	0.382	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	129.5	173.2	-69.5	174.1	0	0	0	110.6	C429 I595 G601	C429-L599 HydrophobicContact CB-CD2 3.59Å; I595-L599 HydrophobicContact CD1-CD1 4.07Å; I595-L599 HydrophobicContact CG1-CD2 4.28Å; I595-L599 HydrophobicContact CG2-CD1 4.4Å; I595-L599 HydrophobicContact CG2-CD2 3.67Å; I595-L599 HydrophobicContact CG2-CG 3.72Å; L599-G601 PolarHBondContact O-N 3.28Å
600	G	57.8	Low	83.4	Confident	36 Å²	36	34.9 Å²	34.9	37%	0.371	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	76	-7.3	177.4	0	0	0	0	0	116.2	N598	N598-G600 PolarHBondContact O-N 2.72Å
601	G	62.4	Low	83.5	Confident	24 Å²	24	33.1 Å²	33.1	25%	0.247	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-67.6	139.7	177.5	0	0	0	0	0	112.6	N598 L599	N598-G601 PolarHBondContact O-N 3.02Å; L599-G601 PolarHBondContact O-N 3.28Å
602	A	64.4	Low	83.5	Confident	9 Å²	9	35.9 Å²	35.9	7%	0.074	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-75.7	152.8	169	0	0	0	0	0	111.8	K604 V720 I723 T754 C758	A602-K604 PolarHBondContact O-N 3.24Å; A602-V720 HydrophobicContact CB-CG1 4Å; A602-V720 HydrophobicContact CB-CG2 4.16Å; A602-I723 HydrophobicContact CB-CD1 3.74Å; A602-T754 HydrophobicContact CB-CG2 4.26Å; A602-C758 VanDerWaalsContact CB-SG 3.58Å; A602-C758 PolarHBondContact O-SG 2.92Å
603	N	72.4	Confident	83.4	Confident	21 Å²	21	36.3 Å²	36.3	11%	0.112	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-68.3	126.8	-178.1	-170.8	8.5	0	0	0	110.9	D605 I606 G727	N603-D605 WeakPolarHBondContact ND2-CB 3.44Å; N603-D605 PolarHBondContact ND2-OD2 3.47Å; N603-D605 PolarHBondContact O-N 3.34Å; N603-D605 PolarHBondContact OD1-N 3.36Å; N603-D605 PolarHBondContact OD1-OD2 3.13Å; N603-I606 HydrophobicContact CB-CD1 3.95Å; N603-I606 HydrophobicContact CB-CG1 4.29Å; N603-I606 WeakPolarHBondContact O-CB 3.18Å; N603-I606 PolarHBondContact O-N 2.71Å; N603-I606 VanDerWaalsContact O-N 3.1Å; N603-G727 PolarHBondContact ND2-O 3.1Å
604	K	79.2	Confident	83.3	Confident	110 Å²	110	39.2 Å²	39.2	48%	0.478	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.8	175.9	-62.2	-165.7	178.8	-169.3	0	113.6	A602 I606 E759	A602-K604 PolarHBondContact O-N 3.24Å; K604-I606 PolarHBondContact O-N 2.91Å; K604-I606 VanDerWaalsContact O-N 3.13Å; K604-E759 IonicContact NZ-OE1 3.31Å; K604-E759 PolarHBondContact NZ-OE1 3.49Å; K604-E759 IonicContact NZ-OE2 3.9Å; K604-E759 PolarHBondContact NZ-OE2 3.39Å
605	D	81.1	Confident	83.2	Confident	15 Å²	15	43.4 Å²	43.4	8%	0.08	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-5.1	173.1	-58.1	-44.1	0	0	0	113.7	N365 Q369 N603 P732 G733	N365-D605 WeakPolarHBondContact CB-OD1 3.26Å; N365-D605 PolarHBondContact ND2-OD1 2.97Å; Q369-D605 PolarHBondContact NE2-OD2 3.22Å; N603-D605 WeakPolarHBondContact ND2-CB 3.44Å; N603-D605 PolarHBondContact ND2-OD2 3.47Å; N603-D605 PolarHBondContact O-N 3.34Å; N603-D605 PolarHBondContact OD1-N 3.36Å; N603-D605 PolarHBondContact OD1-OD2 3.13Å; D605-P732 CarbonylContact O-C 3.56Å; D605-P732 WeakPolarHBondContact O-CA 3.26Å; D605-G733 PolarHBondContact O-N 2.96Å
606	I	87	Confident	83.1	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112	-178	-54.2	164.8	0	0	0	109.7	N603 K604 Q608 I723 T726 G733 A735 Q760	N603-I606 HydrophobicContact CB-CD1 3.95Å; N603-I606 HydrophobicContact CB-CG1 4.29Å; N603-I606 WeakPolarHBondContact O-CB 3.18Å; N603-I606 PolarHBondContact O-N 2.71Å; N603-I606 VanDerWaalsContact O-N 3.1Å; K604-I606 PolarHBondContact O-N 2.91Å; K604-I606 VanDerWaalsContact O-N 3.13Å; I606-Q608 HydrophobicContact CG2-CG 4.12Å; I606-Q608 PolarHBondContact O-N 2.99Å; I606-I723 HydrophobicContact CD1-CB 4.42Å; I606-I723 HydrophobicContact CD1-CG1 4.15Å; I606-I723 HydrophobicContact CG2-CB 4.36Å; I606-T726 HydrophobicContact CG1-CG2 4.39Å; I606-T726 HydrophobicContact CG2-CG2 4.08Å; I606-G733 WeakPolarHBondContact CA-O 3.2Å; I606-A735 HydrophobicContact CG2-CB 3.79Å; I606-Q760 PolarHBondContact O-OE1 2.9Å
607	T	92.1	Very high	83.4	Confident	84 Å²	84	51.6 Å²	51.6	52%	0.515	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	119	166.8	-50.6	0	0	0	0	109.4	G733 K734 A735	T607-G733 PolarHBondContact N-O 2.97Å; T607-K734 WeakPolarHBondContact O-CA 3.34Å; T607-A735 PolarHBondContact O-N 3.16Å
608	Q	93.4	Very high	84.1	Confident	10 Å²	10	50.4 Å²	50.4	5%	0.047	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.7	-176	-65.7	167	72.1	0	0	110.5	I606 Y719 I723 A735 L755 Q760	I606-Q608 HydrophobicContact CG2-CG 4.12Å; I606-Q608 PolarHBondContact O-N 2.99Å; Q608-Y719 PolarHBondContact OE1-OH 2.74Å; Q608-I723 VanDerWaalsContact CD-CD1 3.48Å; Q608-I723 HydrophobicContact CG-CD1 3.91Å; Q608-I723 VanDerWaalsContact OE1-CD1 3.29Å; Q608-A735 WeakPolarHBondContact CA-O 3.49Å; Q608-L755 HydrophobicContact CB-CD2 3.66Å; Q608-L755 HydrophobicContact CG-CD2 4.5Å; Q608-Q760 HydrophobicContact CB-CG 4.07Å; Q608-Q760 HydrophobicContact CG-CG 4.39Å
609	E	94.1	Very high	85.2	Confident	62 Å²	62	46.5 Å²	46.5	29%	0.29	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.3	178.3	179.9	-173.3	-159.8	0	0	108.6	L611 K734 A735 T736 S737	E609-L611 HydrophobicContact CG-CD1 4.41Å; E609-L611 HydrophobicContact CG-CD2 3.89Å; E609-L611 HydrophobicContact CG-CG 4Å; E609-K734 IonicContact OE1-NZ 3.68Å; E609-K734 WeakPolarHBondContact OE2-CE 3.41Å; E609-K734 IonicContact OE2-NZ 1.82Å; E609-K734 PolarHBondContact OE2-NZ 2.94Å; E609-A735 PolarHBondContact N-O 2.74Å; E609-T736 HydrophobicContact CB-CG2 4.42Å; E609-T736 HydrophobicContact CG-CG2 4.26Å; E609-T736 CarbonylContact O-C 3.6Å; E609-T736 WeakPolarHBondContact O-CA 3.45Å; E609-T736 WeakPolarHBondContact OE2-CG2 3.36Å; E609-T736 PolarHBondContact OE2-OG1 3.31Å; E609-S737 PolarHBondContact O-N 3.25Å
610	V	94.9	Very high	86.4	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	124.1	176.1	-168.7	0	0	0	0	109.1	L751 L755 P763 F765 L766	V610-L751 HydrophobicContact CG1-CD2 4.14Å; V610-L751 HydrophobicContact CG2-CD2 4.25Å; V610-L755 HydrophobicContact CG2-CD1 4.03Å; V610-L755 HydrophobicContact CG2-CD2 4.49Å; V610-P763 HydrophobicContact CB-CG 4.37Å; V610-F765 HydrophobicContact CB-CZ 4.42Å; V610-F765 HydrophobicContact CG1-CE2 4.48Å; V610-F765 HydrophobicContact CG1-CZ 4.04Å; V610-L766 HydrophobicContact CG1-CD1 4.39Å
611	L	95.1	Very high	88.3	Confident	26 Å²	26	47.8 Å²	47.8	14%	0.136	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	131.4	-173.5	-60.1	177.3	0	0	0	109.7	E609 V613 K621 I625 T736 S737 Y739	E609-L611 HydrophobicContact CG-CD1 4.41Å; E609-L611 HydrophobicContact CG-CD2 3.89Å; E609-L611 HydrophobicContact CG-CG 4Å; L611-V613 HydrophobicContact CB-CG2 4Å; L611-V613 PolarHBondContact O-N 3.14Å; L611-K621 VanDerWaalsContact CD1-CE 3.45Å; L611-I625 HydrophobicContact CD1-CD1 4.18Å; L611-T736 HydrophobicContact CD1-CG2 3.51Å; L611-T736 HydrophobicContact CG-CG2 4.12Å; L611-S737 PolarHBondContact N-O 2.98Å; L611-Y739 PolarHBondContact O-N 2.85Å
612	P	94.7	Very high	89.9	Confident	82 Å²	82	46.7 Å²	46.7	53%	0.532	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	120.7	173.6	31.2	-28	0	0	0	108.1	Y739 F765	P612-Y739 WeakPolarHBondContact CA-O 3.4Å; P612-F765 HydrophobicContact CB-CD1 4.3Å; P612-F765 HydrophobicContact CB-CD2 4.33Å; P612-F765 HydrophobicContact CB-CE1 4.19Å; P612-F765 HydrophobicContact CB-CE2 4.22Å; P612-F765 HydrophobicContact CB-CG 4.37Å; P612-F765 HydrophobicContact CB-CZ 4.16Å; P612-F765 VanDerWaalsContact CD-CE1 3.47Å; P612-F765 HydrophobicContact CG-CD1 3.96Å; P612-F765 HydrophobicContact CG-CE1 3.84Å; P612-F765 HydrophobicContact CG-CG 4.48Å; P612-F765 HydrophobicContact CG-CZ 4.26Å
613	V	94.5	Very high	91.4	Very high	8 Å²	8	48.6 Å²	48.6	5%	0.048	27%	0.273	C	S	.	.			trans	-147.9	120.7	-174.1	-172.4	0	0	0	0	109.5	L611 E617 K618 K621 F738 Y739	L611-V613 HydrophobicContact CB-CG2 4Å; L611-V613 PolarHBondContact O-N 3.14Å; V613-E617 HydrophobicContact CG1-CB 3.72Å; V613-K618 HydrophobicContact CB-CG 4.5Å; V613-K618 HydrophobicContact CG1-CB 4.33Å; V613-K618 HydrophobicContact CG1-CG 3.84Å; V613-K621 HydrophobicContact CG1-CB 4.17Å; V613-K621 HydrophobicContact CG1-CG 4.46Å; V613-K621 HydrophobicContact CG2-CG 4.03Å; V613-F738 HydrophobicContact CB-CB 4.16Å; V613-F738 HydrophobicContact CB-CG 4.3Å; V613-F738 HydrophobicContact CG2-CB 4.25Å; V613-F738 HydrophobicContact CG2-CD1 3.87Å; V613-F738 HydrophobicContact CG2-CG 4.09Å; V613-Y739 PolarHBondContact N-O 2.71Å
614	T	93.3	Very high	92.5	Very high	70 Å²	70	53.3 Å²	53.3	43%	0.429	29%	0.292	S	S	.	.			trans	-71.9	154	175.6	68.4	0	0	0	0	111.3	A616 E617 K618 D740	T614-A616 PolarHBondContact O-N 3.4Å; T614-E617 WeakPolarHBondContact CB-OE2 3.31Å; T614-E617 WeakPolarHBondContact CG2-OE2 3.45Å; T614-E617 PolarHBondContact N-OE2 3.45Å; T614-E617 PolarHBondContact O-N 3.14Å; T614-E617 VanDerWaalsContact OG1-CD 3.23Å; T614-E617 WeakPolarHBondContact OG1-CG 3.41Å; T614-E617 PolarHBondContact OG1-OE2 3.15Å; T614-K618 WeakPolarHBondContact O-CG 3.3Å; T614-K618 PolarHBondContact O-N 3.04Å; T614-D740 WeakPolarHBondContact CA-OD2 3.41Å
615	M	90.3	Very high	93.2	Very high	88 Å²	88	48.7 Å²	48.7	43%	0.433	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.1	-35.3	176.1	-72.1	-61.1	147.9	0	0	115.2	K618 D740 T743	M615-K618 HydrophobicContact SD-CD 4.06Å; M615-D740 HydrophobicContact CE-CB 3.74Å; M615-D740 WeakPolarHBondContact CG-OD2 3.28Å; M615-D740 PolarHBondContact N-OD2 2.99Å; M615-T743 HydrophobicContact CE-CG2 3.66Å; M615-T743 VanDerWaalsContact CE-OG1 3.3Å; M615-T743 WeakPolarHBondContact CE-OG1 3.39Å
616	A	91.2	Very high	93.9	Very high	91 Å²	91	48 Å²	48	75%	0.752	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-30	-179.6	0	0	0	0	0	113.3	T614	T614-A616 PolarHBondContact O-N 3.4Å
617	E	94.3	Very high	94.1	Very high	105 Å²	105	48.7 Å²	48.7	49%	0.491	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-21.1	-176.3	-66.1	164.1	134.7	0	0	112.8	V613 T614 Q619 A620 K621	V613-E617 HydrophobicContact CG1-CB 3.72Å; T614-E617 WeakPolarHBondContact CB-OE2 3.31Å; T614-E617 WeakPolarHBondContact CG2-OE2 3.45Å; T614-E617 PolarHBondContact N-OE2 3.45Å; T614-E617 PolarHBondContact O-N 3.14Å; T614-E617 VanDerWaalsContact OG1-CD 3.23Å; T614-E617 WeakPolarHBondContact OG1-CG 3.41Å; T614-E617 PolarHBondContact OG1-OE2 3.15Å; E617-Q619 VanDerWaalsContact C-N 3.25Å; E617-Q619 PolarHBondContact O-N 3.5Å; E617-Q619 VanDerWaalsContact O-N 3.12Å; E617-A620 PolarHBondContact O-N 3.46Å; E617-A620 VanDerWaalsContact O-N 3.13Å; E617-K621 WeakPolarHBondContact O-CB 3.36Å; E617-K621 PolarHBondContact O-N 3.13Å
618	K	94.7	Very high	94.2	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-49.3	-41.6	-175.2	-68.5	-171.9	175.9	-155.8	0	113.6	V613 T614 M615 L622 Y710 D711 F738	V613-K618 HydrophobicContact CB-CG 4.5Å; V613-K618 HydrophobicContact CG1-CB 4.33Å; V613-K618 HydrophobicContact CG1-CG 3.84Å; T614-K618 WeakPolarHBondContact O-CG 3.3Å; T614-K618 PolarHBondContact O-N 3.04Å; M615-K618 HydrophobicContact SD-CD 4.06Å; K618-L622 WeakPolarHBondContact O-CB 3.25Å; K618-L622 PolarHBondContact O-N 2.95Å; K618-Y710 HydrophobicContact CB-CD2 4.25Å; K618-Y710 HydrophobicContact CB-CE1 3.94Å; K618-Y710 HydrophobicContact CB-CE2 3.61Å; K618-Y710 VanDerWaalsContact CB-CZ 3.41Å; K618-Y710 WeakPolarHBondContact CB-OH 3.4Å; K618-Y710 HydrophobicContact CD-CD1 4.09Å; K618-Y710 HydrophobicContact CD-CE1 3.82Å; K618-Y710 WeakPolarHBondContact CD-O 3.45Å; K618-Y710 WeakPolarHBondContact CE-O 3.4Å; K618-Y710 PolarHBondContact NZ-O 3.29Å; K618-D711 IonicContact NZ-OD1 2.21Å; K618-D711 PolarHBondContact NZ-OD1 2.82Å; K618-F738 HydrophobicContact CB-CD2 3.99Å; K618-F738 HydrophobicContact CB-CE2 4.32Å; K618-F738 HydrophobicContact CD-CD2 4.42Å; K618-F738 HydrophobicContact CG-CD2 3.97Å; K618-F738 VanDerWaalsContact O-CE2 3.3Å; K618-F738 WeakPolarHBondContact O-CE2 3.21Å
619	Q	93.8	Very high	94.1	Very high	54 Å²	54	52.2 Å²	52.2	25%	0.252	28%	0.284	S	S	.	.	H	α-helix	trans	-67.6	-52	179.5	-173	-173.9	-38	0	0	112.2	E617 K621 L622 E623 S654	E617-Q619 VanDerWaalsContact C-N 3.25Å; E617-Q619 PolarHBondContact O-N 3.5Å; E617-Q619 VanDerWaalsContact O-N 3.12Å; Q619-K621 VanDerWaalsContact C-N 3.26Å; Q619-K621 PolarHBondContact O-N 2.98Å; Q619-L622 WeakPolarHBondContact O-CB 3.32Å; Q619-L622 PolarHBondContact O-N 3.46Å; Q619-L622 VanDerWaalsContact O-N 3.14Å; Q619-E623 WeakPolarHBondContact CG-OE1 3.27Å; Q619-E623 PolarHBondContact NE2-OE1 3.02Å; Q619-E623 PolarHBondContact O-N 3.46Å; Q619-S654 PolarHBondContact NE2-OG 2.84Å
620	A	94.8	Very high	94.1	Very high	66 Å²	66	50.5 Å²	50.5	55%	0.545	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-36.1	179.7	0	0	0	0	0	111.7	E617 K624	E617-A620 PolarHBondContact O-N 3.46Å; E617-A620 VanDerWaalsContact O-N 3.13Å; A620-K624 PolarHBondContact O-N 3.33Å
621	K	96.1	Very high	93.9	Very high	69 Å²	69	57 Å²	57	30%	0.3	31%	0.31	S	S	.	.	H	α-helix	trans	-66.7	-40.2	174.6	-170.1	69.6	178.9	-170.9	0	112.1	L611 V613 E617 Q619 K624 I625 F738	L611-K621 VanDerWaalsContact CD1-CE 3.45Å; V613-K621 HydrophobicContact CG1-CB 4.17Å; V613-K621 HydrophobicContact CG1-CG 4.46Å; V613-K621 HydrophobicContact CG2-CG 4.03Å; E617-K621 WeakPolarHBondContact O-CB 3.36Å; E617-K621 PolarHBondContact O-N 3.13Å; Q619-K621 VanDerWaalsContact C-N 3.26Å; Q619-K621 PolarHBondContact O-N 2.98Å; K621-K624 PolarHBondContact O-N 3Å; K621-I625 HydrophobicContact CG-CD1 4.12Å; K621-I625 WeakPolarHBondContact O-CD1 3.46Å; K621-I625 WeakPolarHBondContact O-CG1 3.45Å; K621-I625 PolarHBondContact O-N 3.28Å; K621-I625 VanDerWaalsContact O-N 3.1Å; K621-F738 HydrophobicContact CB-CE1 4.42Å; K621-F738 HydrophobicContact CB-CE2 4.47Å; K621-F738 HydrophobicContact CB-CZ 4.04Å; K621-F738 HydrophobicContact CG-CD1 4.45Å; K621-F738 HydrophobicContact CG-CE1 3.72Å; K621-F738 HydrophobicContact CG-CZ 3.81Å
622	L	96.5	Very high	93.6	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-61.5	-51.2	173.7	179.8	64.2	0	0	0	111	K618 Q619 K624 I625 L626 V640 V651 L655 V708 Y710 F738	K618-L622 WeakPolarHBondContact O-CB 3.25Å; K618-L622 PolarHBondContact O-N 2.95Å; Q619-L622 WeakPolarHBondContact O-CB 3.32Å; Q619-L622 PolarHBondContact O-N 3.46Å; Q619-L622 VanDerWaalsContact O-N 3.14Å; L622-K624 VanDerWaalsContact C-N 3.28Å; L622-K624 PolarHBondContact O-N 3.41Å; L622-I625 PolarHBondContact O-N 3.08Å; L622-I625 VanDerWaalsContact O-N 3.11Å; L622-L626 HydrophobicContact CD1-CD1 4.48Å; L622-L626 HydrophobicContact CD1-CG 4.28Å; L622-L626 HydrophobicContact CG-CD1 4.13Å; L622-L626 HydrophobicContact CG-CG 4.35Å; L622-L626 VanDerWaalsContact O-CG 3.32Å; L622-L626 WeakPolarHBondContact O-CG 3.28Å; L622-L626 PolarHBondContact O-N 2.95Å; L622-V640 HydrophobicContact CD1-CG1 4.19Å; L622-V640 HydrophobicContact CD1-CG2 4.05Å; L622-V640 HydrophobicContact CD2-CG1 4.18Å; L622-V651 HydrophobicContact CD2-CG1 3.79Å; L622-L655 HydrophobicContact CD2-CD1 3.84Å; L622-L655 HydrophobicContact CD2-CD2 4.37Å; L622-V708 HydrophobicContact CD1-CB 4.37Å; L622-V708 HydrophobicContact CD1-CG1 3.95Å; L622-V708 HydrophobicContact CD1-CG2 4.37Å; L622-Y710 HydrophobicContact CB-CD2 4.34Å; L622-Y710 HydrophobicContact CB-CE2 4.38Å; L622-Y710 HydrophobicContact CD2-CD2 3.89Å; L622-Y710 HydrophobicContact CD2-CE2 4.11Å; L622-F738 HydrophobicContact CB-CE2 4.12Å; L622-F738 HydrophobicContact CB-CZ 4.22Å
623	E	95.3	Very high	93.4	Very high	50 Å²	50	61.2 Å²	61.2	23%	0.234	33%	0.329	C	S	.	.	H	α-helix	trans	-57.7	-40.1	179.3	-72.3	172.5	-158.5	0	0	112.1	Q619 L626 G627 L655	Q619-E623 WeakPolarHBondContact CG-OE1 3.27Å; Q619-E623 PolarHBondContact NE2-OE1 3.02Å; Q619-E623 PolarHBondContact O-N 3.46Å; E623-L626 PolarHBondContact O-N 2.97Å; E623-G627 PolarHBondContact O-N 3.11Å; E623-L655 HydrophobicContact CG-CD2 3.71Å
624	K	95.2	Very high	93.1	Very high	119 Å²	119	65 Å²	65	52%	0.517	35%	0.353	S	S	.	.	H	α-helix	trans	-60.5	-48.7	173	177.2	170.5	174.9	169.6	0	112.6	A620 K621 L622 L626 G627 E628	A620-K624 PolarHBondContact O-N 3.33Å; K621-K624 PolarHBondContact O-N 3Å; L622-K624 VanDerWaalsContact C-N 3.28Å; L622-K624 PolarHBondContact O-N 3.41Å; K624-L626 VanDerWaalsContact C-N 3.33Å; K624-L626 PolarHBondContact O-N 3.01Å; K624-G627 PolarHBondContact O-N 2.92Å; K624-E628 WeakPolarHBondContact CE-OE1 3.17Å; K624-E628 IonicContact NZ-OE1 2.74Å; K624-E628 WeakPolarHBondContact O-CG 3.39Å; K624-E628 PolarHBondContact O-N 3.32Å
625	I	94.9	Very high	92.8	Very high	14 Å²	14	67.8 Å²	67.8	7%	0.072	37%	0.366	C	S	.	.	H	α-helix	trans	-65.2	-37.2	-179.7	-71.6	163.5	0	0	0	111.5	L611 K621 L622 R629 L706 T736 F738	L611-I625 HydrophobicContact CD1-CD1 4.18Å; K621-I625 HydrophobicContact CG-CD1 4.12Å; K621-I625 WeakPolarHBondContact O-CD1 3.46Å; K621-I625 WeakPolarHBondContact O-CG1 3.45Å; K621-I625 PolarHBondContact O-N 3.28Å; K621-I625 VanDerWaalsContact O-N 3.1Å; L622-I625 PolarHBondContact O-N 3.08Å; L622-I625 VanDerWaalsContact O-N 3.11Å; I625-R629 WeakPolarHBondContact O-CB 3.45Å; I625-R629 PolarHBondContact O-N 3.32Å; I625-L706 HydrophobicContact CG2-CD2 3.66Å; I625-T736 HydrophobicContact CD1-CG2 3.92Å; I625-F738 HydrophobicContact CD1-CE1 3.56Å; I625-F738 HydrophobicContact CD1-CZ 3.86Å
626	L	94.8	Very high	92.8	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.5	-48.8	173.4	-66.1	176.2	0	0	0	110.5	L622 E623 K624 R629 F630 I638 L655 W660 V688	L622-L626 HydrophobicContact CD1-CD1 4.48Å; L622-L626 HydrophobicContact CD1-CG 4.28Å; L622-L626 HydrophobicContact CG-CD1 4.13Å; L622-L626 HydrophobicContact CG-CG 4.35Å; L622-L626 VanDerWaalsContact O-CG 3.32Å; L622-L626 WeakPolarHBondContact O-CG 3.28Å; L622-L626 PolarHBondContact O-N 2.95Å; E623-L626 PolarHBondContact O-N 2.97Å; K624-L626 VanDerWaalsContact C-N 3.33Å; K624-L626 PolarHBondContact O-N 3.01Å; L626-R629 PolarHBondContact O-N 3.3Å; L626-F630 HydrophobicContact CB-CD2 4.24Å; L626-F630 HydrophobicContact CB-CE2 4.27Å; L626-F630 HydrophobicContact CD2-CE2 4.2Å; L626-F630 WeakPolarHBondContact O-CB 3.44Å; L626-F630 WeakPolarHBondContact O-CD2 3.44Å; L626-F630 PolarHBondContact O-N 2.92Å; L626-I638 HydrophobicContact CD2-CB 4.22Å; L626-I638 HydrophobicContact CD2-CD1 3.52Å; L626-I638 HydrophobicContact CD2-CG1 4.44Å; L626-I638 HydrophobicContact CD2-CG2 3.86Å; L626-L655 HydrophobicContact CD1-CD1 3.96Å; L626-L655 HydrophobicContact CD1-CD2 3.56Å; L626-L655 HydrophobicContact CD1-CG 4.36Å; L626-W660 HydrophobicContact CB-CD2 4.39Å; L626-W660 HydrophobicContact CB-CH2 4.5Å; L626-W660 HydrophobicContact CB-CZ2 4.14Å; L626-W660 HydrophobicContact CD1-CD2 4.45Å; L626-W660 HydrophobicContact CD1-CG 4.24Å; L626-V688 HydrophobicContact CD1-CG2 4.5Å; L626-V688 HydrophobicContact CD2-CG1 4.44Å; L626-V688 HydrophobicContact CD2-CG2 3.97Å
627	G	93.1	Very high	92.9	Very high	16 Å²	16	61.1 Å²	61.1	17%	0.165	32%	0.317	C	S	.	.	H	α-helix	trans	-54.5	-56.8	175.6	0	0	0	0	0	112.7	E623 K624 R629 F630 D631	E623-G627 PolarHBondContact O-N 3.11Å; K624-G627 PolarHBondContact O-N 2.92Å; G627-R629 PolarHBondContact O-N 3.07Å; G627-F630 PolarHBondContact O-N 3.22Å; G627-D631 WeakPolarHBondContact O-CB 3.31Å; G627-D631 PolarHBondContact O-N 2.86Å
628	E	93.1	Very high	92.9	Very high	98 Å²	98	56.1 Å²	56.1	46%	0.458	29%	0.294	S	S	.	.	H	α-helix	trans	-56.3	-36.4	178.5	-70.5	171.8	171.3	0	0	112.6	K624 N632	K624-E628 WeakPolarHBondContact CE-OE1 3.17Å; K624-E628 IonicContact NZ-OE1 2.74Å; K624-E628 WeakPolarHBondContact O-CG 3.39Å; K624-E628 PolarHBondContact O-N 3.32Å; E628-N632 PolarHBondContact O-ND2 2.83Å
629	R	91.8	Very high	92.9	Very high	70 Å²	70	56 Å²	56	26%	0.264	29%	0.294	S	S	.	.	H	α-helix	trans	-75.9	-40.6	178.3	-170.2	62	179.3	-153.3	4.5	112.6	I625 L626 G627 N632 N633 A636 I638 D705 L706	I625-R629 WeakPolarHBondContact O-CB 3.45Å; I625-R629 PolarHBondContact O-N 3.32Å; L626-R629 PolarHBondContact O-N 3.3Å; G627-R629 PolarHBondContact O-N 3.07Å; R629-N632 PolarHBondContact O-N 3.3Å; R629-N633 PolarHBondContact O-N 3.01Å; R629-A636 HydrophobicContact CG-CB 3.86Å; R629-I638 HydrophobicContact CB-CD1 3.92Å; R629-I638 HydrophobicContact CG-CD1 3.82Å; R629-I638 HydrophobicContact CG-CG1 4.45Å; R629-D705 IonicContact CZ-OD1 3.51Å; R629-D705 IonicContact NE-OD1 2.69Å; R629-D705 IonicContact NH2-OD1 3.72Å; R629-D705 PolarHBondContact NH2-OD1 3.44Å; R629-L706 HydrophobicContact CG-CD2 4.42Å
630	F	92.7	Very high	93	Very high	25 Å²	25	53.5 Å²	53.5	11%	0.11	28%	0.282	C	S	.	.	H	α-helix	trans	-73.9	-30.8	-179.5	-76.1	-58.1	0	0	0	113.4	L626 G627 N632 N633 P634 A636 I638 W660 N687 V688	L626-F630 HydrophobicContact CB-CD2 4.24Å; L626-F630 HydrophobicContact CB-CE2 4.27Å; L626-F630 HydrophobicContact CD2-CE2 4.2Å; L626-F630 WeakPolarHBondContact O-CB 3.44Å; L626-F630 WeakPolarHBondContact O-CD2 3.44Å; L626-F630 PolarHBondContact O-N 2.92Å; G627-F630 PolarHBondContact O-N 3.22Å; F630-N632 VanDerWaalsContact C-N 3.29Å; F630-N632 PolarHBondContact O-N 2.96Å; F630-N633 CarbonylContact O-C 3.5Å; F630-N633 VanDerWaalsContact O-C 3.32Å; F630-P634 WeakPolarHBondContact O-CA 3.31Å; F630-P634 VanDerWaalsContact O-N 3.17Å; F630-A636 HydrophobicContact CD1-CB 4.48Å; F630-A636 HydrophobicContact CE1-CB 4.33Å; F630-A636 VanDerWaalsContact CE1-O 3.24Å; F630-A636 WeakPolarHBondContact CE1-O 3.27Å; F630-I638 HydrophobicContact CD2-CD1 4.37Å; F630-I638 HydrophobicContact CE1-CD1 4.43Å; F630-I638 HydrophobicContact CE2-CD1 3.79Å; F630-I638 HydrophobicContact CZ-CD1 3.8Å; F630-I638 HydrophobicContact CZ-CG1 4.3Å; F630-W660 HydrophobicContact CB-CZ3 4.07Å; F630-W660 AromaticContact CD2-CE3 3.54Å; F630-W660 HydrophobicContact CD2-CE3 3.54Å; F630-W660 HydrophobicContact CD2-CH2 4.06Å; F630-W660 AromaticContact CD2-CZ3 3.25Å; F630-W660 HydrophobicContact CD2-CZ3 3.25Å; F630-W660 AromaticContact CE2-CE3 3.76Å; F630-W660 HydrophobicContact CE2-CE3 3.76Å; F630-W660 AromaticContact CE2-CZ3 3.98Å; F630-W660 HydrophobicContact CE2-CZ3 3.98Å; F630-W660 HydrophobicContact CG-CE3 4.47Å; F630-W660 AromaticContact CG-CZ3 3.93Å; F630-W660 HydrophobicContact CG-CZ3 3.93Å; F630-N687 HydrophobicContact CE1-CB 3.58Å; F630-N687 HydrophobicContact CZ-CB 3.58Å; F630-V688 HydrophobicContact CE2-CG2 3.85Å; F630-V688 HydrophobicContact CZ-CG2 3.85Å
631	D	91.3	Very high	93	Very high	144 Å²	144	50.5 Å²	50.5	77%	0.77	26%	0.256	S	S	*	.	H	α-helix	trans	-64	-35.4	171.8	-74.8	-23.5	0	0	0	111.6	G627	G627-D631 WeakPolarHBondContact O-CB 3.31Å; G627-D631 PolarHBondContact O-N 2.86Å
632	N	89.6	Confident	93	Very high	142 Å²	142	47.2 Å²	47.2	76%	0.759	24%	0.242	S	C	*	.	H	α-helix	trans	-81.7	-37.8	176.6	-76.4	-63.8	0	0	0	113.4	E628 R629 F630	E628-N632 PolarHBondContact O-ND2 2.83Å; R629-N632 PolarHBondContact O-N 3.3Å; F630-N632 VanDerWaalsContact C-N 3.29Å; F630-N632 PolarHBondContact O-N 2.96Å
633	N	89.3	Confident	92.7	Very high	55 Å²	55	49.4 Å²	49.4	29%	0.294	27%	0.265	S	S	.	.			trans	-143.5	98.1	177.4	176.5	10	0	0	0	110.3	R629 F630 N635 A636 D705	R629-N633 PolarHBondContact O-N 3.01Å; F630-N633 CarbonylContact O-C 3.5Å; F630-N633 VanDerWaalsContact O-C 3.32Å; N633-N635 PolarHBondContact O-N 3.42Å; N633-N635 VanDerWaalsContact O-N 3.07Å; N633-N635 PolarHBondContact OD1-N 3.31Å; N633-N635 VanDerWaalsContact OD1-N 3.11Å; N633-A636 HydrophobicContact CB-CB 4.06Å; N633-A636 WeakPolarHBondContact O-CB 3.34Å; N633-A636 PolarHBondContact O-N 3.41Å; N633-A636 PolarHBondContact OD1-N 3.01Å; N633-D705 PolarHBondContact ND2-OD1 2.77Å; N633-D705 VanDerWaalsContact ND2-OD1 3.12Å
634	P	88.1	Confident	92.6	Very high	87 Å²	87	56.2 Å²	56.2	57%	0.565	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.1	-179.4	-27.8	36	0	0	0	114.8	F630 N687	F630-P634 WeakPolarHBondContact O-CA 3.31Å; F630-P634 VanDerWaalsContact O-N 3.17Å; P634-N687 PolarHBondContact O-ND2 3.45Å
635	N	87.5	Confident	92.5	Very high	128 Å²	128	54.5 Å²	54.5	68%	0.684	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	9.2	-179.9	-64.7	-35.2	0	0	0	113	N633 K637	N633-N635 PolarHBondContact O-N 3.42Å; N633-N635 VanDerWaalsContact O-N 3.07Å; N633-N635 PolarHBondContact OD1-N 3.31Å; N633-N635 VanDerWaalsContact OD1-N 3.11Å; N635-K637 PolarHBondContact O-N 2.88Å
636	A	91	Very high	92.5	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.318	C	S	.	.			trans	-61.4	133	-177.4	0	0	0	0	0	112.3	R629 F630 N633 D705	R629-A636 HydrophobicContact CG-CB 3.86Å; F630-A636 HydrophobicContact CD1-CB 4.48Å; F630-A636 HydrophobicContact CE1-CB 4.33Å; F630-A636 VanDerWaalsContact CE1-O 3.24Å; F630-A636 WeakPolarHBondContact CE1-O 3.27Å; N633-A636 HydrophobicContact CB-CB 4.06Å; N633-A636 WeakPolarHBondContact O-CB 3.34Å; N633-A636 PolarHBondContact O-N 3.41Å; N633-A636 PolarHBondContact OD1-N 3.01Å; A636-D705 VanDerWaalsContact CA-OD2 3.23Å; A636-D705 WeakPolarHBondContact CA-OD2 3.49Å; A636-D705 HydrophobicContact CB-CB 3.97Å
637	K	92.6	Very high	92.4	Very high	39 Å²	39	66.5 Å²	66.5	17%	0.17	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	117.5	175.9	-68.8	169.6	174.8	168.7	0	111.1	N635 F681 K682 G703 D705 L706	N635-K637 PolarHBondContact O-N 2.88Å; K637-F681 HydrophobicContact CB-CE2 4.06Å; K637-F681 HydrophobicContact CB-CZ 3.91Å; K637-F681 VanDerWaalsContact CE-O 3.31Å; K637-F681 WeakPolarHBondContact CE-O 3.41Å; K637-K682 WeakPolarHBondContact CE-O 3.19Å; K637-K682 PolarHBondContact NZ-O 2.84Å; K637-G703 WeakPolarHBondContact CB-O 3.41Å; K637-D705 PolarHBondContact N-OD2 2.79Å; K637-D705 PolarHBondContact O-N 2.92Å; K637-L706 PolarHBondContact O-N 2.79Å
638	I	94.4	Very high	92.5	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	122.1	-171.8	-51.5	-179.3	0	0	0	110.1	L626 R629 F630 V640 F681 N687 V688 L689 L706 V708	L626-I638 HydrophobicContact CD2-CB 4.22Å; L626-I638 HydrophobicContact CD2-CD1 3.52Å; L626-I638 HydrophobicContact CD2-CG1 4.44Å; L626-I638 HydrophobicContact CD2-CG2 3.86Å; R629-I638 HydrophobicContact CB-CD1 3.92Å; R629-I638 HydrophobicContact CG-CD1 3.82Å; R629-I638 HydrophobicContact CG-CG1 4.45Å; F630-I638 HydrophobicContact CD2-CD1 4.37Å; F630-I638 HydrophobicContact CE1-CD1 4.43Å; F630-I638 HydrophobicContact CE2-CD1 3.79Å; F630-I638 HydrophobicContact CZ-CD1 3.8Å; F630-I638 HydrophobicContact CZ-CG1 4.3Å; I638-V640 HydrophobicContact CG2-CG2 4.22Å; I638-F681 WeakPolarHBondContact O-CE2 3.45Å; I638-F681 WeakPolarHBondContact O-CZ 3.27Å; I638-N687 PolarHBondContact N-O 3.11Å; I638-V688 WeakPolarHBondContact O-CA 3.38Å; I638-L689 PolarHBondContact O-N 2.69Å; I638-L706 WeakPolarHBondContact CA-O 3.4Å; I638-L706 HydrophobicContact CD1-CD2 4.36Å; I638-L706 HydrophobicContact CG1-CB 4.26Å; I638-L706 HydrophobicContact CG2-CB 4.21Å; I638-L706 HydrophobicContact CG2-CD2 4.06Å; I638-L706 HydrophobicContact CG2-CG 4.2Å; I638-V708 HydrophobicContact CG2-CG2 4Å
639	L	94.5	Very high	92.6	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	115.4	178.6	177.4	62.4	0	0	0	109.8	F641 F681 L689 A691 V704 L706 V707 V708 R725	L639-F641 HydrophobicContact CD2-CE2 3.65Å; L639-F641 HydrophobicContact CD2-CZ 3.98Å; L639-F641 HydrophobicContact CG-CD2 4.34Å; L639-F641 HydrophobicContact CG-CE2 3.9Å; L639-F641 HydrophobicContact CG-CZ 4.44Å; L639-F681 HydrophobicContact CB-CZ 4.41Å; L639-L689 HydrophobicContact CD1-CB 4.09Å; L639-L689 HydrophobicContact CD1-CD2 3.89Å; L639-L689 HydrophobicContact CD1-CG 3.88Å; L639-A691 HydrophobicContact CD1-CB 3.87Å; L639-V704 HydrophobicContact CB-CG1 3.95Å; L639-L706 PolarHBondContact N-O 3.3Å; L639-V707 CarbonylContact O-C 3.32Å; L639-V707 WeakPolarHBondContact O-CA 3.44Å; L639-V708 PolarHBondContact O-N 3.07Å; L639-R725 HydrophobicContact CD2-CB 3.6Å; L639-R725 HydrophobicContact CD2-CG 3.75Å
640	V	95.8	Very high	92.8	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	122.7	-176.7	-172.2	0	0	0	0	110.2	L622 I638 V688 L689 I690 A691 V708	L622-V640 HydrophobicContact CD1-CG1 4.19Å; L622-V640 HydrophobicContact CD1-CG2 4.05Å; L622-V640 HydrophobicContact CD2-CG1 4.18Å; I638-V640 HydrophobicContact CG2-CG2 4.22Å; V640-V688 HydrophobicContact CG2-CG1 3.97Å; V640-L689 PolarHBondContact N-O 3.35Å; V640-I690 HydrophobicContact CB-CD1 3.6Å; V640-I690 HydrophobicContact CG1-CD1 4.2Å; V640-I690 HydrophobicContact CG2-CD1 3.73Å; V640-I690 CarbonylContact O-C 3.54Å; V640-I690 WeakPolarHBondContact O-CA 3.36Å; V640-A691 PolarHBondContact O-N 3.42Å; V640-V708 CarbonylContact C-O 3.57Å; V640-V708 WeakPolarHBondContact CA-O 3Å; V640-V708 HydrophobicContact CG1-CB 4.29Å; V640-V708 HydrophobicContact CG2-CB 4.28Å
641	F	95.6	Very high	92.9	Very high	3 Å²	3	65.2 Å²	65.2	1%	0.013	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126.7	179.7	-83.4	-79.1	0	0	0	112.7	L639 A691 A696 V707 V708 Y710 D711 R722 R725	L639-F641 HydrophobicContact CD2-CE2 3.65Å; L639-F641 HydrophobicContact CD2-CZ 3.98Å; L639-F641 HydrophobicContact CG-CD2 4.34Å; L639-F641 HydrophobicContact CG-CE2 3.9Å; L639-F641 HydrophobicContact CG-CZ 4.44Å; F641-A691 WeakPolarHBondContact CA-O 3.36Å; F641-A696 HydrophobicContact CD1-CB 4.43Å; F641-A696 HydrophobicContact CE1-CB 3.26Å; F641-A696 HydrophobicContact CZ-CB 3.43Å; F641-A696 VanDerWaalsContact CZ-CB 3.43Å; F641-V707 HydrophobicContact CD2-CG1 3.77Å; F641-V707 HydrophobicContact CE2-CG1 3.93Å; F641-V708 PolarHBondContact N-O 3.42Å; F641-Y710 WeakPolarHBondContact O-CA 3.41Å; F641-Y710 VanDerWaalsContact O-CB 3.26Å; F641-Y710 WeakPolarHBondContact O-CB 3.27Å; F641-Y710 PolarHBondContact O-N 2.92Å; F641-D711 PolarHBondContact O-N 2.87Å; F641-R722 HydrophobicContact CD1-CG 3.8Å; F641-R722 HydrophobicContact CD2-CB 3.88Å; F641-R722 HydrophobicContact CD2-CG 3.97Å; F641-R722 HydrophobicContact CE1-CB 4.43Å; F641-R722 HydrophobicContact CE1-CG 3.67Å; F641-R722 HydrophobicContact CE2-CB 3.7Å; F641-R722 HydrophobicContact CE2-CG 3.87Å; F641-R722 HydrophobicContact CG-CB 4.33Å; F641-R722 HydrophobicContact CG-CG 3.92Å; F641-R722 HydrophobicContact CZ-CB 3.99Å; F641-R722 HydrophobicContact CZ-CG 3.72Å; F641-R725 HydrophobicContact CE2-CG 4.13Å; F641-R725 HydrophobicContact CZ-CG 4.01Å
642	V	95.3	Very high	93.1	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	149.4	177.3	-63	0	0	0	0	111.6	V647 A648 I690 A691 T692 Y710	V642-V647 HydrophobicContact CB-CB 4.45Å; V642-V647 HydrophobicContact CB-CG1 4.07Å; V642-V647 HydrophobicContact CG1-CG1 4.02Å; V642-A648 HydrophobicContact CG2-CB 3.57Å; V642-I690 HydrophobicContact CG1-CG2 4.02Å; V642-I690 HydrophobicContact CG2-CG2 4.03Å; V642-A691 PolarHBondContact N-O 3.46Å; V642-T692 HydrophobicContact CG2-CG2 4.23Å; V642-Y710 HydrophobicContact CG1-CD1 3.97Å; V642-Y710 HydrophobicContact CG1-CG 4.1Å
643	G	91.4	Very high	93.4	Very high	48 Å²	48	55.1 Å²	55.1	50%	0.495	28%	0.28	S	S	.	.	S	Bend	trans	-76.6	-26.2	-174.4	0	0	0	0	0	114.6	D711	G643-D711 PolarHBondContact N-OD2 3.08Å
644	R	92.3	Very high	93.7	Very high	192 Å²	192	53.8 Å²	53.8	73%	0.725	28%	0.275	S	S	*	.	S	Bend	trans	-129.5	139.8	-172.4	-62.1	179.8	-177.4	171	2.3	112.4	R646 V647 A648	R644-R646 VanDerWaalsContact C-N 3.34Å; R644-R646 PolarHBondContact O-N 2.87Å; R644-V647 HydrophobicContact CB-CB 4.36Å; R644-V647 HydrophobicContact CB-CG2 3.97Å; R644-V647 WeakPolarHBondContact O-CA 3.32Å; R644-V647 WeakPolarHBondContact O-CB 3.46Å; R644-V647 PolarHBondContact O-N 3.14Å; R644-A648 PolarHBondContact O-N 3.1Å
645	K	93.6	Very high	94	Very high	84 Å²	84	49.7 Å²	49.7	37%	0.365	25%	0.248	S	C	.	.	H	α-helix	trans	-54.4	-44	179.3	-53.7	-178.9	-175	171	0	113.4	V647 A648 D649 H666 D668 T692	K645-V647 VanDerWaalsContact C-N 3.28Å; K645-V647 PolarHBondContact O-N 3.15Å; K645-A648 VanDerWaalsContact O-CB 3.3Å; K645-A648 WeakPolarHBondContact O-CB 3.41Å; K645-A648 PolarHBondContact O-N 3.39Å; K645-A648 VanDerWaalsContact O-N 3.09Å; K645-D649 PolarHBondContact O-N 3.42Å; K645-H666 HydrophobicContact CB-CB 4.37Å; K645-H666 HydrophobicContact CG-CB 4.19Å; K645-D668 HydrophobicContact CD-CB 4.23Å; K645-D668 WeakPolarHBondContact CD-OD2 3.29Å; K645-D668 VanDerWaalsContact NZ-CG 3.34Å; K645-D668 IonicContact NZ-OD1 2.88Å; K645-D668 PolarHBondContact NZ-OD1 3.01Å; K645-D668 IonicContact NZ-OD2 3.52Å; K645-D668 PolarHBondContact NZ-OD2 3.36Å; K645-T692 HydrophobicContact CB-CG2 4.47Å; K645-T692 HydrophobicContact CG-CG2 4.14Å
646	R	94.1	Very high	94.3	Very high	224 Å²	224	45.9 Å²	45.9	85%	0.845	23%	0.234	S	C	*	.	H	α-helix	trans	-61.7	-33.6	175.4	-67.4	-175.9	-177.9	169.5	0.5	113.2	R644 F650	R644-R646 VanDerWaalsContact C-N 3.34Å; R644-R646 PolarHBondContact O-N 2.87Å; R646-F650 WeakPolarHBondContact O-CB 3.27Å; R646-F650 PolarHBondContact O-N 3.13Å; R646-F650 VanDerWaalsContact O-N 3.08Å
647	V	94.2	Very high	94.4	Very high	41 Å²	41	54.1 Å²	54.1	25%	0.248	27%	0.273	C	S	.	.	H	α-helix	trans	-71.9	-34.9	175.7	179	0	0	0	0	109.8	V642 R644 K645 D649 F650 V651 Y710	V642-V647 HydrophobicContact CB-CB 4.45Å; V642-V647 HydrophobicContact CB-CG1 4.07Å; V642-V647 HydrophobicContact CG1-CG1 4.02Å; R644-V647 HydrophobicContact CB-CB 4.36Å; R644-V647 HydrophobicContact CB-CG2 3.97Å; R644-V647 WeakPolarHBondContact O-CA 3.32Å; R644-V647 WeakPolarHBondContact O-CB 3.46Å; R644-V647 PolarHBondContact O-N 3.14Å; K645-V647 VanDerWaalsContact C-N 3.28Å; K645-V647 PolarHBondContact O-N 3.15Å; V647-D649 PolarHBondContact O-N 2.74Å; V647-F650 PolarHBondContact O-N 2.93Å; V647-V651 HydrophobicContact CG1-CG2 3.9Å; V647-V651 WeakPolarHBondContact O-CB 3.46Å; V647-V651 VanDerWaalsContact O-CG2 3.32Å; V647-V651 WeakPolarHBondContact O-CG2 3.16Å; V647-V651 PolarHBondContact O-N 2.89Å; V647-Y710 HydrophobicContact CG1-CE1 4.29Å
648	A	95	Very high	94.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-46.3	175.6	0	0	0	0	0	112.6	V642 R644 K645 A652 I690 T692	V642-A648 HydrophobicContact CG2-CB 3.57Å; R644-A648 PolarHBondContact O-N 3.1Å; K645-A648 VanDerWaalsContact O-CB 3.3Å; K645-A648 WeakPolarHBondContact O-CB 3.41Å; K645-A648 PolarHBondContact O-N 3.39Å; K645-A648 VanDerWaalsContact O-N 3.09Å; A648-A652 WeakPolarHBondContact O-CB 3.44Å; A648-A652 PolarHBondContact O-N 3.24Å; A648-I690 HydrophobicContact CB-CG2 4.08Å; A648-T692 HydrophobicContact CB-CG2 4.17Å
649	D	94.7	Very high	94.2	Very high	59 Å²	59	58.3 Å²	58.3	32%	0.316	31%	0.313	S	S	.	.	H	α-helix	trans	-71	-37.7	176.8	-68.6	-36.8	0	0	0	112.4	K645 V647 A653 S664 H666	K645-D649 PolarHBondContact O-N 3.42Å; V647-D649 PolarHBondContact O-N 2.74Å; D649-A653 VanDerWaalsContact O-CB 3.24Å; D649-A653 WeakPolarHBondContact O-CB 3.29Å; D649-A653 PolarHBondContact O-N 2.89Å; D649-S664 PolarHBondContact OD1-OG 3.23Å; D649-H666 IonicContact OD1-CD2 3.59Å; D649-H666 IonicContact OD1-CE1 3.62Å; D649-H666 CovalentContact OD1-NE2 1.82Å; D649-H666 IonicContact OD1-NE2 2.97Å; D649-H666 PolarHBondContact OD1-NE2 3.5Å; D649-H666 IonicContact OD2-CE1 3.24Å; D649-H666 PolarHBondContact OD2-CE1 2.73Å; D649-H666 IonicContact OD2-NE2 3.64Å; D649-H666 PolarHBondContact OD2-NE2 2.88Å
650	F	95.4	Very high	94.1	Very high	121 Å²	121	61.6 Å²	61.6	53%	0.531	33%	0.326	S	S	.	.	H	α-helix	trans	-61.7	-52.3	175.5	174.8	-96.9	0	0	0	112.2	R646 V647 A652 A653 S654	R646-F650 WeakPolarHBondContact O-CB 3.27Å; R646-F650 PolarHBondContact O-N 3.13Å; R646-F650 VanDerWaalsContact O-N 3.08Å; V647-F650 PolarHBondContact O-N 2.93Å; F650-A652 PolarHBondContact O-N 3.37Å; F650-A653 PolarHBondContact O-N 3.09Å; F650-S654 WeakPolarHBondContact O-CB 3.25Å; F650-S654 PolarHBondContact O-N 3.38Å
651	V	95.8	Very high	94	Very high	2 Å²	2	69.4 Å²	69.4	1%	0.012	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-42.6	179.4	173.2	0	0	0	0	110.4	L622 V647 A653 S654 L655 I690 Y710	L622-V651 HydrophobicContact CD2-CG1 3.79Å; V647-V651 HydrophobicContact CG1-CG2 3.9Å; V647-V651 WeakPolarHBondContact O-CB 3.46Å; V647-V651 VanDerWaalsContact O-CG2 3.32Å; V647-V651 WeakPolarHBondContact O-CG2 3.16Å; V647-V651 PolarHBondContact O-N 2.89Å; V651-A653 PolarHBondContact O-N 2.81Å; V651-S654 PolarHBondContact O-N 3.24Å; V651-L655 HydrophobicContact CG1-CD1 3.81Å; V651-L655 HydrophobicContact CG1-CG 4.29Å; V651-L655 WeakPolarHBondContact O-CB 3.45Å; V651-L655 VanDerWaalsContact O-CG 3.28Å; V651-L655 WeakPolarHBondContact O-CG 3.48Å; V651-L655 PolarHBondContact O-N 2.69Å; V651-I690 HydrophobicContact CB-CG2 4.38Å; V651-I690 HydrophobicContact CG1-CD1 3.98Å; V651-I690 HydrophobicContact CG1-CG1 4.29Å; V651-I690 HydrophobicContact CG1-CG2 4.38Å; V651-Y710 HydrophobicContact CG2-CE1 4.37Å; V651-Y710 HydrophobicContact CG2-CE2 4.32Å
652	A	95.3	Very high	94	Very high	10 Å²	10	70.1 Å²	70.1	8%	0.083	36%	0.36	C	S	.	.	H	α-helix	trans	-63.2	-42.5	177.3	0	0	0	0	0	112.8	A648 F650 A656 T662 I690	A648-A652 WeakPolarHBondContact O-CB 3.44Å; A648-A652 PolarHBondContact O-N 3.24Å; F650-A652 PolarHBondContact O-N 3.37Å; A652-A656 VanDerWaalsContact O-CB 3.29Å; A652-A656 WeakPolarHBondContact O-CB 3.38Å; A652-A656 PolarHBondContact O-N 3.27Å; A652-T662 HydrophobicContact CB-CG2 4.1Å; A652-I690 HydrophobicContact CB-CB 4.34Å; A652-I690 HydrophobicContact CB-CG1 3.83Å
653	A	95.2	Very high	94	Very high	64 Å²	64	71 Å²	71	53%	0.529	37%	0.366	S	S	.	.	H	α-helix	trans	-66.2	-41	176.7	0	0	0	0	0	112.1	D649 F650 V651 A656 H657	D649-A653 VanDerWaalsContact O-CB 3.24Å; D649-A653 WeakPolarHBondContact O-CB 3.29Å; D649-A653 PolarHBondContact O-N 2.89Å; F650-A653 PolarHBondContact O-N 3.09Å; V651-A653 PolarHBondContact O-N 2.81Å; A653-A656 PolarHBondContact O-N 2.94Å; A653-H657 WeakPolarHBondContact O-CB 3.45Å; A653-H657 PolarHBondContact O-N 3.33Å
654	S	95.1	Very high	94.1	Very high	27 Å²	27	68.9 Å²	68.9	19%	0.189	34%	0.343	C	S	.	.	H	α-helix	trans	-65.4	-45.6	178.7	-163	0	0	0	0	112	Q619 F650 V651 A656 H657 T658	Q619-S654 PolarHBondContact NE2-OG 2.84Å; F650-S654 WeakPolarHBondContact O-CB 3.25Å; F650-S654 PolarHBondContact O-N 3.38Å; V651-S654 PolarHBondContact O-N 3.24Å; S654-A656 PolarHBondContact O-N 3.05Å; S654-H657 WeakPolarHBondContact O-CB 3.33Å; S654-H657 PolarHBondContact O-N 3.31Å; S654-T658 PolarHBondContact O-N 3.25Å; S654-T658 VanDerWaalsContact O-N 3.07Å; S654-T658 PolarHBondContact O-OG1 3.46Å
655	L	95.6	Very high	94.1	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-67	-35.4	177	-67.6	175.5	0	0	0	112.7	L622 E623 L626 V651 H657 T658 G659 W660 T662 V688 I690	L622-L655 HydrophobicContact CD2-CD1 3.84Å; L622-L655 HydrophobicContact CD2-CD2 4.37Å; E623-L655 HydrophobicContact CG-CD2 3.71Å; L626-L655 HydrophobicContact CD1-CD1 3.96Å; L626-L655 HydrophobicContact CD1-CD2 3.56Å; L626-L655 HydrophobicContact CD1-CG 4.36Å; V651-L655 HydrophobicContact CG1-CD1 3.81Å; V651-L655 HydrophobicContact CG1-CG 4.29Å; V651-L655 WeakPolarHBondContact O-CB 3.45Å; V651-L655 VanDerWaalsContact O-CG 3.28Å; V651-L655 WeakPolarHBondContact O-CG 3.48Å; V651-L655 PolarHBondContact O-N 2.69Å; L655-H657 VanDerWaalsContact C-N 3.33Å; L655-T658 WeakPolarHBondContact CA-OG1 3.48Å; L655-T658 PolarHBondContact O-N 3.13Å; L655-T658 PolarHBondContact O-OG1 3.41Å; L655-T658 VanDerWaalsContact O-OG1 3.09Å; L655-G659 PolarHBondContact O-N 3.36Å; L655-W660 HydrophobicContact CB-CB 4.25Å; L655-W660 WeakPolarHBondContact O-CB 3.28Å; L655-W660 PolarHBondContact O-N 2.71Å; L655-T662 HydrophobicContact CB-CG2 4.13Å; L655-T662 HydrophobicContact CD1-CG2 4.21Å; L655-V688 HydrophobicContact CD1-CG1 4.27Å; L655-I690 HydrophobicContact CD1-CD1 3.82Å
656	A	94	Very high	94	Very high	48 Å²	48	56.4 Å²	56.4	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-38.7	171.9	0	0	0	0	0	111.6	A652 A653 S654 T658 G659	A652-A656 VanDerWaalsContact O-CB 3.29Å; A652-A656 WeakPolarHBondContact O-CB 3.38Å; A652-A656 PolarHBondContact O-N 3.27Å; A653-A656 PolarHBondContact O-N 2.94Å; S654-A656 PolarHBondContact O-N 3.05Å; A656-T658 VanDerWaalsContact C-N 3.35Å; A656-T658 PolarHBondContact O-N 3.41Å; A656-G659 PolarHBondContact O-N 3.25Å; A656-G659 VanDerWaalsContact O-N 3.11Å
657	H	93	Very high	93.6	Very high	174 Å²	174	48 Å²	48	81%	0.806	28%	0.277	S	S	*	.	H	α-helix	trans	-67.6	-31.9	177.1	-169.8	67.4	0	0	0	113.2	A653 S654 L655 G659	A653-H657 WeakPolarHBondContact O-CB 3.45Å; A653-H657 PolarHBondContact O-N 3.33Å; S654-H657 WeakPolarHBondContact O-CB 3.33Å; S654-H657 PolarHBondContact O-N 3.31Å; L655-H657 VanDerWaalsContact C-N 3.33Å; H657-G659 PolarHBondContact O-N 2.83Å
658	T	91.6	Very high	93.4	Very high	68 Å²	68	51.2 Å²	51.2	42%	0.417	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	0.6	172.1	55.2	0	0	0	0	113.9	S654 L655 A656	S654-T658 PolarHBondContact O-N 3.25Å; S654-T658 VanDerWaalsContact O-N 3.07Å; S654-T658 PolarHBondContact O-OG1 3.46Å; L655-T658 WeakPolarHBondContact CA-OG1 3.48Å; L655-T658 PolarHBondContact O-N 3.13Å; L655-T658 PolarHBondContact O-OG1 3.41Å; L655-T658 VanDerWaalsContact O-OG1 3.09Å; A656-T658 VanDerWaalsContact C-N 3.35Å; A656-T658 PolarHBondContact O-N 3.41Å
659	G	90.9	Very high	93.1	Very high	59 Å²	59	54.2 Å²	54.2	61%	0.608	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	98	1.9	173.2	0	0	0	0	0	115.7	L655 A656 H657	L655-G659 PolarHBondContact O-N 3.36Å; A656-G659 PolarHBondContact O-N 3.25Å; A656-G659 VanDerWaalsContact O-N 3.11Å; H657-G659 PolarHBondContact O-N 2.83Å
660	W	93.1	Very high	92.9	Very high	68 Å²	68	57.4 Å²	57.4	26%	0.258	32%	0.317	S	S	.	.			trans	-75.7	130.5	176.6	-57.3	111.8	0	0	0	111.4	L626 F630 L655 T662	L626-W660 HydrophobicContact CB-CD2 4.39Å; L626-W660 HydrophobicContact CB-CH2 4.5Å; L626-W660 HydrophobicContact CB-CZ2 4.14Å; L626-W660 HydrophobicContact CD1-CD2 4.45Å; L626-W660 HydrophobicContact CD1-CG 4.24Å; F630-W660 HydrophobicContact CB-CZ3 4.07Å; F630-W660 AromaticContact CD2-CE3 3.54Å; F630-W660 HydrophobicContact CD2-CE3 3.54Å; F630-W660 HydrophobicContact CD2-CH2 4.06Å; F630-W660 AromaticContact CD2-CZ3 3.25Å; F630-W660 HydrophobicContact CD2-CZ3 3.25Å; F630-W660 AromaticContact CE2-CE3 3.76Å; F630-W660 HydrophobicContact CE2-CE3 3.76Å; F630-W660 AromaticContact CE2-CZ3 3.98Å; F630-W660 HydrophobicContact CE2-CZ3 3.98Å; F630-W660 HydrophobicContact CG-CE3 4.47Å; F630-W660 AromaticContact CG-CZ3 3.93Å; F630-W660 HydrophobicContact CG-CZ3 3.93Å; L655-W660 HydrophobicContact CB-CB 4.25Å; L655-W660 WeakPolarHBondContact O-CB 3.28Å; L655-W660 PolarHBondContact O-N 2.71Å; W660-T662 VanDerWaalsContact C-N 3.33Å; W660-T662 WeakPolarHBondContact CB-OG1 3.36Å; W660-T662 WeakPolarHBondContact O-CB 3.18Å; W660-T662 PolarHBondContact O-N 2.72Å; W660-T662 PolarHBondContact O-OG1 3.34Å
661	R	93.9	Very high	92.7	Very high	164 Å²	164	52 Å²	52	62%	0.619	29%	0.293	S	S	*	.			trans	-68.9	87	177	-57.1	-175.9	-168.9	168.3	3.4	110.8	A685 N686 N687 V688	R661-A685 WeakPolarHBondContact CD-O 3.36Å; R661-N686 CarbonylContact O-C 3.53Å; R661-N686 WeakPolarHBondContact O-CA 3.25Å; R661-N687 PolarHBondContact O-N 2.73Å; R661-V688 PolarHBondContact O-N 2.87Å; R661-V688 VanDerWaalsContact O-N 3.1Å
662	T	95	Very high	92.5	Very high	18 Å²	18	56.5 Å²	56.5	11%	0.11	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	143.1	-164.3	-50.9	0	0	0	0	111.9	A652 L655 W660 V688 I690	A652-T662 HydrophobicContact CB-CG2 4.1Å; L655-T662 HydrophobicContact CB-CG2 4.13Å; L655-T662 HydrophobicContact CD1-CG2 4.21Å; W660-T662 VanDerWaalsContact C-N 3.33Å; W660-T662 WeakPolarHBondContact CB-OG1 3.36Å; W660-T662 WeakPolarHBondContact O-CB 3.18Å; W660-T662 PolarHBondContact O-N 2.72Å; W660-T662 PolarHBondContact O-OG1 3.34Å; T662-V688 WeakPolarHBondContact CA-O 3.45Å; T662-V688 HydrophobicContact CG2-CB 4.06Å; T662-V688 HydrophobicContact CG2-CG1 4.01Å; T662-I690 HydrophobicContact CG2-CD1 4.01Å; T662-I690 HydrophobicContact CG2-CG1 3.71Å
663	T	94.4	Very high	92.3	Very high	20 Å²	20	60 Å²	60	12%	0.123	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	161	170.7	-163.9	0	0	0	0	111.5	A677 N686 V688 L689 I690	T663-A677 HydrophobicContact CG2-CB 3.82Å; T663-N686 HydrophobicContact CG2-CB 4.11Å; T663-V688 PolarHBondContact N-O 3.19Å; T663-L689 HydrophobicContact CG2-CD1 3.72Å; T663-L689 WeakPolarHBondContact O-CA 3.2Å; T663-I690 PolarHBondContact O-N 3.29Å
664	S	94.4	Very high	92.1	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	150.2	-179.2	67.8	0	0	0	0	113.1	D649 H666 R669 I690	D649-S664 PolarHBondContact OD1-OG 3.23Å; S664-H666 PolarHBondContact OG-NE2 3.03Å; S664-R669 WeakPolarHBondContact O-CD 3.47Å; S664-R669 PolarHBondContact O-NH1 3.23Å; S664-R669 WeakPolarHBondContact OG-CD 3.47Å; S664-R669 PolarHBondContact OG-NE 2.98Å; S664-R669 VanDerWaalsContact OG-NE 3.16Å; S664-R669 PolarHBondContact OG-NH1 3.06Å; S664-I690 CarbonylContact C-O 3.48Å; S664-I690 VanDerWaalsContact CA-O 3.26Å; S664-I690 WeakPolarHBondContact CA-O 3.38Å
665	I	91.9	Very high	91.8	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	120.5	169.9	-161.3	-173.3	0	0	0	111.4	R674 L678 L689 I690 A691 T692 A695	I665-R674 HydrophobicContact CD1-CB 4.19Å; I665-R674 HydrophobicContact CG1-CB 4.07Å; I665-R674 HydrophobicContact CG1-CG 3.95Å; I665-L678 HydrophobicContact CD1-CD1 3.79Å; I665-L678 HydrophobicContact CD1-CD2 3.96Å; I665-L678 HydrophobicContact CD1-CG 3.82Å; I665-L689 HydrophobicContact CB-CD1 4.13Å; I665-L689 HydrophobicContact CG2-CD1 3.83Å; I665-L689 HydrophobicContact CG2-CD2 4.35Å; I665-L689 HydrophobicContact CG2-CG 4.23Å; I665-I690 PolarHBondContact N-O 3.31Å; I665-A691 HydrophobicContact CG2-CB 3.69Å; I665-A691 WeakPolarHBondContact O-CA 3.49Å; I665-T692 PolarHBondContact O-N 2.86Å; I665-T692 VanDerWaalsContact O-N 3.12Å; I665-A695 HydrophobicContact CB-CB 4.43Å; I665-A695 HydrophobicContact CD1-CB 4.31Å; I665-A695 HydrophobicContact CG1-CB 4Å; I665-A695 HydrophobicContact CG2-CB 4.11Å; I665-A695 WeakPolarHBondContact O-CB 3.39Å
666	H	91.4	Very high	91.6	Very high	14 Å²	14	60.9 Å²	60.9	7%	0.065	33%	0.325	C	S	.	.			trans	-157.6	170.3	177.7	57.3	87.9	0	0	0	110.4	K645 D649 S664 D668 R669 T692	K645-H666 HydrophobicContact CB-CB 4.37Å; K645-H666 HydrophobicContact CG-CB 4.19Å; D649-H666 IonicContact OD1-CD2 3.59Å; D649-H666 IonicContact OD1-CE1 3.62Å; D649-H666 CovalentContact OD1-NE2 1.82Å; D649-H666 IonicContact OD1-NE2 2.97Å; D649-H666 PolarHBondContact OD1-NE2 3.5Å; D649-H666 IonicContact OD2-CE1 3.24Å; D649-H666 PolarHBondContact OD2-CE1 2.73Å; D649-H666 IonicContact OD2-NE2 3.64Å; D649-H666 PolarHBondContact OD2-NE2 2.88Å; S664-H666 PolarHBondContact OG-NE2 3.03Å; H666-D668 VanDerWaalsContact CE1-CB 3.46Å; H666-D668 WeakPolarHBondContact CE1-CB 3.08Å; H666-D668 PolarHBondContact ND1-N 2.92Å; H666-D668 PolarHBondContact O-N 2.68Å; H666-R669 PolarHBondContact O-N 2.87Å; H666-T692 WeakPolarHBondContact CA-OG1 3.39Å; H666-T692 HydrophobicContact CB-CG2 3.72Å; H666-T692 WeakPolarHBondContact CB-OG1 3.34Å
667	G	85.9	Confident	91.5	Very high	46 Å²	46	58.7 Å²	58.7	47%	0.474	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-9.7	-172	0	0	0	0	0	116.4
668	D	89	Confident	91.3	Very high	109 Å²	109	51.3 Å²	51.3	58%	0.583	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-9.1	177.8	-64.2	-12.9	0	0	0	112.8	K645 H666	K645-D668 HydrophobicContact CD-CB 4.23Å; K645-D668 WeakPolarHBondContact CD-OD2 3.29Å; K645-D668 VanDerWaalsContact NZ-CG 3.34Å; K645-D668 IonicContact NZ-OD1 2.88Å; K645-D668 PolarHBondContact NZ-OD1 3.01Å; K645-D668 IonicContact NZ-OD2 3.52Å; K645-D668 PolarHBondContact NZ-OD2 3.36Å; H666-D668 VanDerWaalsContact CE1-CB 3.46Å; H666-D668 WeakPolarHBondContact CE1-CB 3.08Å; H666-D668 PolarHBondContact ND1-N 2.92Å; H666-D668 PolarHBondContact O-N 2.68Å
669	R	89.4	Confident	91.1	Very high	63 Å²	63	51.7 Å²	51.7	24%	0.238	27%	0.267	C	S	.	.	S	Bend	trans	-76.2	145.8	171.7	-51.1	-162.1	97	-160.2	5	110.8	S664 H666 Q673 R674	S664-R669 WeakPolarHBondContact O-CD 3.47Å; S664-R669 PolarHBondContact O-NH1 3.23Å; S664-R669 WeakPolarHBondContact OG-CD 3.47Å; S664-R669 PolarHBondContact OG-NE 2.98Å; S664-R669 VanDerWaalsContact OG-NE 3.16Å; S664-R669 PolarHBondContact OG-NH1 3.06Å; H666-R669 PolarHBondContact O-N 2.87Å; R669-Q673 HydrophobicContact CB-CB 4.26Å; R669-R674 HydrophobicContact CB-CG 3.87Å; R669-R674 WeakPolarHBondContact O-CD 3.43Å
670	E	91	Very high	91	Very high	126 Å²	126	49.4 Å²	49.4	59%	0.589	24%	0.243	S	C	*	.			trans	-64.7	153.1	176.1	-61.7	-166.4	150.8	0	0	111.6	M672 Q673 R674	E670-M672 VanDerWaalsContact C-N 3.27Å; E670-M672 PolarHBondContact O-N 3.3Å; E670-Q673 HydrophobicContact CB-CG 4.12Å; E670-Q673 WeakPolarHBondContact O-CA 3.22Å; E670-Q673 WeakPolarHBondContact O-CB 3.3Å; E670-Q673 PolarHBondContact O-N 2.94Å; E670-R674 WeakPolarHBondContact O-CG 3.22Å; E670-R674 PolarHBondContact O-N 3Å
671	Q	89.9	Confident	90.9	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-37.5	-176.7	-171.5	59.3	28.2	0	0	112.5	Y346 E470 Y494 G496 V497 Q673 R674 E675	Y346-Q671 HydrophobicContact CD1-CB 4.03Å; Y346-Q671 HydrophobicContact CD1-CG 4.16Å; Y346-Q671 HydrophobicContact CE1-CB 4.26Å; Y346-Q671 HydrophobicContact CE1-CG 4.04Å; E470-Q671 PolarHBondContact OE1-NE2 3.02Å; Y494-Q671 HydrophobicContact CE2-CG 4.15Å; G496-Q671 WeakPolarHBondContact O-CB 3.36Å; V497-Q671 HydrophobicContact CG2-CG 4.44Å; Q671-Q673 VanDerWaalsContact C-N 3.3Å; Q671-Q673 PolarHBondContact O-N 2.89Å; Q671-R674 PolarHBondContact O-N 3.08Å; Q671-E675 VanDerWaalsContact CG-OE1 3.29Å; Q671-E675 WeakPolarHBondContact CG-OE1 3.21Å; Q671-E675 PolarHBondContact NE2-OE1 3.29Å; Q671-E675 PolarHBondContact O-N 3.03Å
672	M	91.6	Very high	90.5	Very high	97 Å²	97	41.8 Å²	41.8	48%	0.478	22%	0.216	S	C	.	.	H	α-helix	trans	-57.5	-41.9	172.1	-173.4	-169.7	-67.1	0	0	112.3	Y346 E670 T676	Y346-M672 HydrophobicContact CD1-CB 4.47Å; Y346-M672 HydrophobicContact CD2-CB 3.77Å; Y346-M672 HydrophobicContact CD2-CE 3.48Å; Y346-M672 VanDerWaalsContact CD2-CE 3.48Å; Y346-M672 HydrophobicContact CD2-CG 4.11Å; Y346-M672 HydrophobicContact CE1-CB 4.27Å; Y346-M672 HydrophobicContact CE2-CB 3.54Å; Y346-M672 HydrophobicContact CE2-CE 3.71Å; Y346-M672 HydrophobicContact CE2-CG 3.58Å; Y346-M672 HydrophobicContact CE2-SD 4.47Å; Y346-M672 HydrophobicContact CG-CB 4.24Å; E670-M672 VanDerWaalsContact C-N 3.27Å; E670-M672 PolarHBondContact O-N 3.3Å; M672-T676 VanDerWaalsContact O-CB 3.24Å; M672-T676 WeakPolarHBondContact O-CB 3.43Å; M672-T676 PolarHBondContact O-N 3.47Å; M672-T676 PolarHBondContact O-OG1 3.42Å
673	Q	92.1	Very high	90.1	Very high	83 Å²	83	44.7 Å²	44.7	39%	0.388	24%	0.237	S	C	.	.	H	α-helix	trans	-70	-39.9	179.2	-62.8	170	-13.7	0	0	110.9	R669 E670 Q671 T676 A677	R669-Q673 HydrophobicContact CB-CB 4.26Å; E670-Q673 HydrophobicContact CB-CG 4.12Å; E670-Q673 WeakPolarHBondContact O-CA 3.22Å; E670-Q673 WeakPolarHBondContact O-CB 3.3Å; E670-Q673 PolarHBondContact O-N 2.94Å; Q671-Q673 VanDerWaalsContact C-N 3.3Å; Q671-Q673 PolarHBondContact O-N 2.89Å; Q673-T676 PolarHBondContact O-N 3.06Å; Q673-A677 VanDerWaalsContact O-CB 3.26Å; Q673-A677 WeakPolarHBondContact O-CB 3.33Å; Q673-A677 PolarHBondContact O-N 3.33Å
674	R	90.6	Very high	89.7	Confident	14 Å²	14	44.8 Å²	44.8	5%	0.053	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-46.7	176.7	-63.4	179	72.2	-118.5	-5.5	111.4	E470 I665 R669 E670 Q671 A677 L678	E470-R674 IonicContact OE1-CZ 3.73Å; E470-R674 VanDerWaalsContact OE1-CZ 3.31Å; E470-R674 IonicContact OE1-NH1 3.48Å; E470-R674 PolarHBondContact OE1-NH1 2.84Å; E470-R674 IonicContact OE1-NH2 3.24Å; E470-R674 PolarHBondContact OE1-NH2 2.84Å; E470-R674 IonicContact OE2-CZ 2.75Å; E470-R674 VanDerWaalsContact OE2-CZ 3.3Å; E470-R674 IonicContact OE2-NH1 3.13Å; E470-R674 PolarHBondContact OE2-NH1 2.79Å; E470-R674 IonicContact OE2-NH2 3.56Å; E470-R674 PolarHBondContact OE2-NH2 3.42Å; I665-R674 HydrophobicContact CD1-CB 4.19Å; I665-R674 HydrophobicContact CG1-CB 4.07Å; I665-R674 HydrophobicContact CG1-CG 3.95Å; R669-R674 HydrophobicContact CB-CG 3.87Å; R669-R674 WeakPolarHBondContact O-CD 3.43Å; E670-R674 WeakPolarHBondContact O-CG 3.22Å; E670-R674 PolarHBondContact O-N 3Å; Q671-R674 PolarHBondContact O-N 3.08Å; R674-A677 PolarHBondContact O-N 2.78Å; R674-L678 WeakPolarHBondContact O-CG 3.41Å; R674-L678 PolarHBondContact O-N 3.23Å
675	E	88.9	Confident	89.5	Confident	20 Å²	20	47.3 Å²	47.3	9%	0.093	26%	0.263	C	S	.	.	H	α-helix	trans	-65.8	-38.4	175.8	-74	176.6	-140.7	0	0	112.3	Y346 I473 Y494 Q671 R679	Y346-E675 PolarHBondContact OH-OE2 3.37Å; I473-E675 HydrophobicContact CD1-CG 4.15Å; Y494-E675 PolarHBondContact OH-OE1 2.9Å; Q671-E675 VanDerWaalsContact CG-OE1 3.29Å; Q671-E675 WeakPolarHBondContact CG-OE1 3.21Å; Q671-E675 PolarHBondContact NE2-OE1 3.29Å; Q671-E675 PolarHBondContact O-N 3.03Å; E675-R679 WeakPolarHBondContact O-CB 3.48Å; E675-R679 PolarHBondContact O-N 2.63Å
676	T	91.3	Very high	89.5	Confident	77 Å²	77	49.3 Å²	49.3	47%	0.472	27%	0.274	S	S	.	.	H	α-helix	trans	-66.7	-42.1	175.5	-59.6	0	0	0	0	112.2	M672 Q673 R679 G680	M672-T676 VanDerWaalsContact O-CB 3.24Å; M672-T676 WeakPolarHBondContact O-CB 3.43Å; M672-T676 PolarHBondContact O-N 3.47Å; M672-T676 PolarHBondContact O-OG1 3.42Å; Q673-T676 PolarHBondContact O-N 3.06Å; T676-R679 PolarHBondContact O-N 2.84Å; T676-G680 PolarHBondContact O-N 3.04Å
677	A	91.6	Very high	89.5	Confident	2 Å²	2	49.2 Å²	49.2	2%	0.017	27%	0.274	C	S	.	.	H	α-helix	trans	-60.4	-46	175.9	0	0	0	0	0	111.5	T663 Q673 R674 G680 F681	T663-A677 HydrophobicContact CG2-CB 3.82Å; Q673-A677 VanDerWaalsContact O-CB 3.26Å; Q673-A677 WeakPolarHBondContact O-CB 3.33Å; Q673-A677 PolarHBondContact O-N 3.33Å; R674-A677 PolarHBondContact O-N 2.78Å; A677-G680 PolarHBondContact O-N 2.83Å; A677-F681 WeakPolarHBondContact O-CB 3.44Å; A677-F681 PolarHBondContact O-N 2.95Å
678	L	88.5	Confident	90	Very high	18 Å²	18	47 Å²	47	9%	0.094	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-41.4	177.1	-68.2	172.6	0	0	0	112.8	E470 I665 R674 F681 K682 L689 L699	E470-L678 HydrophobicContact CB-CD1 4.18Å; E470-L678 HydrophobicContact CG-CD1 3.41Å; E470-L678 VanDerWaalsContact CG-CD1 3.41Å; I665-L678 HydrophobicContact CD1-CD1 3.79Å; I665-L678 HydrophobicContact CD1-CD2 3.96Å; I665-L678 HydrophobicContact CD1-CG 3.82Å; R674-L678 WeakPolarHBondContact O-CG 3.41Å; R674-L678 PolarHBondContact O-N 3.23Å; L678-F681 PolarHBondContact O-N 3.09Å; L678-K682 WeakPolarHBondContact O-CB 3.36Å; L678-K682 WeakPolarHBondContact O-CG 3.26Å; L678-K682 PolarHBondContact O-N 3.33Å; L678-L689 HydrophobicContact CD2-CD2 3.92Å; L678-L699 HydrophobicContact CD1-CD2 3.82Å; L678-L699 HydrophobicContact CD2-CD1 3.77Å; L678-L699 HydrophobicContact CD2-CD2 3.99Å
679	R	87.8	Confident	90.3	Very high	77 Å²	77	41.9 Å²	41.9	29%	0.291	22%	0.224	S	C	.	.	H	α-helix	trans	-59.9	-48.5	175	-176.6	-178.7	-68.6	102.4	5	110.9	E355 E675 T676 F681 K682 S683	E355-R679 WeakPolarHBondContact OE1-CD 3.43Å; E355-R679 IonicContact OE1-CZ 2.75Å; E355-R679 IonicContact OE1-NE 3.61Å; E355-R679 PolarHBondContact OE1-NE 2.71Å; E355-R679 IonicContact OE1-NH2 2.71Å; E675-R679 WeakPolarHBondContact O-CB 3.48Å; E675-R679 PolarHBondContact O-N 2.63Å; T676-R679 PolarHBondContact O-N 2.84Å; R679-F681 VanDerWaalsContact C-N 3.31Å; R679-F681 PolarHBondContact O-N 2.81Å; R679-K682 PolarHBondContact O-N 2.76Å; R679-S683 WeakPolarHBondContact O-CB 3.41Å; R679-S683 PolarHBondContact O-N 2.96Å; R679-S683 PolarHBondContact O-OG 2.73Å
680	G	90	Very high	90.6	Very high	10 Å²	10	38.9 Å²	38.9	10%	0.103	21%	0.213	C	C	.	.	H	α-helix	trans	-63.2	-33.8	178.6	0	0	0	0	0	113.6	T676 A677 S683 G684 A685 N686	T676-G680 PolarHBondContact O-N 3.04Å; A677-G680 PolarHBondContact O-N 2.83Å; G680-S683 PolarHBondContact O-OG 2.71Å; G680-G684 PolarHBondContact O-N 3.31Å; G680-A685 PolarHBondContact O-N 3.39Å; G680-N686 PolarHBondContact O-N 2.88Å
681	F	90.1	Very high	90.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-74.8	-40	174.2	-171.3	-118.8	0	0	0	112.6	K637 I638 L639 A677 L678 R679 S683 G684 N686 N687 L689 I701 V704	K637-F681 HydrophobicContact CB-CE2 4.06Å; K637-F681 HydrophobicContact CB-CZ 3.91Å; K637-F681 VanDerWaalsContact CE-O 3.31Å; K637-F681 WeakPolarHBondContact CE-O 3.41Å; I638-F681 WeakPolarHBondContact O-CE2 3.45Å; I638-F681 WeakPolarHBondContact O-CZ 3.27Å; L639-F681 HydrophobicContact CB-CZ 4.41Å; A677-F681 WeakPolarHBondContact O-CB 3.44Å; A677-F681 PolarHBondContact O-N 2.95Å; L678-F681 PolarHBondContact O-N 3.09Å; R679-F681 VanDerWaalsContact C-N 3.31Å; R679-F681 PolarHBondContact O-N 2.81Å; F681-S683 PolarHBondContact O-N 3.47Å; F681-G684 PolarHBondContact O-N 2.63Å; F681-N686 WeakPolarHBondContact CA-O 3.44Å; F681-N686 WeakPolarHBondContact CD2-O 3.48Å; F681-N687 WeakPolarHBondContact CE2-O 3.36Å; F681-L689 HydrophobicContact CB-CB 4.38Å; F681-L689 HydrophobicContact CB-CD2 4.33Å; F681-L689 HydrophobicContact CD1-CB 3.85Å; F681-L689 HydrophobicContact CD1-CD2 3.54Å; F681-L689 HydrophobicContact CD1-CG 4.33Å; F681-L689 HydrophobicContact CD2-CB 3.58Å; F681-L689 HydrophobicContact CE1-CB 3.88Å; F681-L689 HydrophobicContact CE1-CD2 3.92Å; F681-L689 HydrophobicContact CE2-CB 3.64Å; F681-L689 HydrophobicContact CG-CB 3.69Å; F681-L689 HydrophobicContact CG-CD2 3.98Å; F681-L689 HydrophobicContact CG-CG 4.41Å; F681-L689 HydrophobicContact CZ-CB 3.78Å; F681-I701 HydrophobicContact CD1-CD1 3.88Å; F681-I701 HydrophobicContact CD1-CG2 3.73Å; F681-I701 HydrophobicContact CE1-CD1 3.76Å; F681-I701 HydrophobicContact CE1-CG2 3.72Å; F681-V704 HydrophobicContact CE1-CG2 4.27Å
682	K	85.3	Confident	90.8	Very high	72 Å²	72	32.9 Å²	32.9	31%	0.313	19%	0.185	S	C	.	.	H	α-helix	trans	-63.9	-39.7	175.4	-74.9	-171.3	178.4	-159.4	0	112	K637 L678 R679 D700 I701	K637-K682 WeakPolarHBondContact CE-O 3.19Å; K637-K682 PolarHBondContact NZ-O 2.84Å; L678-K682 WeakPolarHBondContact O-CB 3.36Å; L678-K682 WeakPolarHBondContact O-CG 3.26Å; L678-K682 PolarHBondContact O-N 3.33Å; R679-K682 PolarHBondContact O-N 2.76Å; K682-D700 WeakPolarHBondContact CE-O 3.4Å; K682-D700 PolarHBondContact NZ-O 2.88Å; K682-I701 HydrophobicContact CG-CG2 4.26Å
683	S	85.8	Confident	90.2	Very high	79 Å²	79	30.1 Å²	30.1	55%	0.552	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-10.8	178.7	68.4	0	0	0	0	115.2	R679 G680 F681 A685	R679-S683 WeakPolarHBondContact O-CB 3.41Å; R679-S683 PolarHBondContact O-N 2.96Å; R679-S683 PolarHBondContact O-OG 2.73Å; G680-S683 PolarHBondContact O-OG 2.71Å; F681-S683 PolarHBondContact O-N 3.47Å; S683-A685 VanDerWaalsContact C-N 3.3Å; S683-A685 PolarHBondContact OG-N 3.22Å
684	G	86.9	Confident	89.2	Confident	22 Å²	22	29.8 Å²	29.8	23%	0.227	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	16	-172.9	0	0	0	0	0	114.3	G680 F681 N686 N687	G680-G684 PolarHBondContact O-N 3.31Å; F681-G684 PolarHBondContact O-N 2.63Å; G684-N686 VanDerWaalsContact C-N 3.33Å; G684-N687 PolarHBondContact O-OD1 3.12Å; G684-N687 VanDerWaalsContact O-OD1 3.09Å
685	A	89.6	Confident	88.1	Confident	56 Å²	56	29.1 Å²	29.1	46%	0.463	17%	0.172	S	C	.	.	S	Bend	trans	-69	-36.9	168	0	0	0	0	0	111	R661 G680 S683	R661-A685 WeakPolarHBondContact CD-O 3.36Å; G680-A685 PolarHBondContact O-N 3.39Å; S683-A685 VanDerWaalsContact C-N 3.3Å; S683-A685 PolarHBondContact OG-N 3.22Å
686	N	91.9	Very high	86.9	Confident	42 Å²	42	28.2 Å²	28.2	23%	0.225	17%	0.168	C	C	.	.			trans	-114.5	131.7	164.8	-64.8	-60.1	0	0	0	108.5	R661 T663 G680 F681 G684	R661-N686 CarbonylContact O-C 3.53Å; R661-N686 WeakPolarHBondContact O-CA 3.25Å; T663-N686 HydrophobicContact CG2-CB 4.11Å; G680-N686 PolarHBondContact O-N 2.88Å; F681-N686 WeakPolarHBondContact CA-O 3.44Å; F681-N686 WeakPolarHBondContact CD2-O 3.48Å; G684-N686 VanDerWaalsContact C-N 3.33Å
687	N	92.8	Very high	86	Confident	13 Å²	13	25.8 Å²	25.8	7%	0.07	15%	0.15	C	C	.	.	S	Bend	trans	-101.1	-7.7	180	-70.6	0.4	0	0	0	112.4	F630 P634 I638 R661 F681 G684	F630-N687 HydrophobicContact CE1-CB 3.58Å; F630-N687 HydrophobicContact CZ-CB 3.58Å; P634-N687 PolarHBondContact O-ND2 3.45Å; I638-N687 PolarHBondContact N-O 3.11Å; R661-N687 PolarHBondContact O-N 2.73Å; F681-N687 WeakPolarHBondContact CE2-O 3.36Å; G684-N687 PolarHBondContact O-OD1 3.12Å; G684-N687 VanDerWaalsContact O-OD1 3.09Å
688	V	95.3	Very high	84.6	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.8	175.1	-171.8	0	0	0	0	110.2	L626 F630 I638 V640 L655 R661 T662 T663 I690	L626-V688 HydrophobicContact CD1-CG2 4.5Å; L626-V688 HydrophobicContact CD2-CG1 4.44Å; L626-V688 HydrophobicContact CD2-CG2 3.97Å; F630-V688 HydrophobicContact CE2-CG2 3.85Å; F630-V688 HydrophobicContact CZ-CG2 3.85Å; I638-V688 WeakPolarHBondContact O-CA 3.38Å; V640-V688 HydrophobicContact CG2-CG1 3.97Å; L655-V688 HydrophobicContact CD1-CG1 4.27Å; R661-V688 PolarHBondContact O-N 2.87Å; R661-V688 VanDerWaalsContact O-N 3.1Å; T662-V688 WeakPolarHBondContact CA-O 3.45Å; T662-V688 HydrophobicContact CG2-CB 4.06Å; T662-V688 HydrophobicContact CG2-CG1 4.01Å; T663-V688 PolarHBondContact N-O 3.19Å; V688-I690 HydrophobicContact CG1-CD1 3.71Å
689	L	94.8	Very high	83.7	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.7	174.4	176.5	61.1	0	0	0	110	I638 L639 V640 T663 I665 L678 F681 I701	I638-L689 PolarHBondContact O-N 2.69Å; L639-L689 HydrophobicContact CD1-CB 4.09Å; L639-L689 HydrophobicContact CD1-CD2 3.89Å; L639-L689 HydrophobicContact CD1-CG 3.88Å; V640-L689 PolarHBondContact N-O 3.35Å; T663-L689 HydrophobicContact CG2-CD1 3.72Å; T663-L689 WeakPolarHBondContact O-CA 3.2Å; I665-L689 HydrophobicContact CB-CD1 4.13Å; I665-L689 HydrophobicContact CG2-CD1 3.83Å; I665-L689 HydrophobicContact CG2-CD2 4.35Å; I665-L689 HydrophobicContact CG2-CG 4.23Å; L678-L689 HydrophobicContact CD2-CD2 3.92Å; F681-L689 HydrophobicContact CB-CB 4.38Å; F681-L689 HydrophobicContact CB-CD2 4.33Å; F681-L689 HydrophobicContact CD1-CB 3.85Å; F681-L689 HydrophobicContact CD1-CD2 3.54Å; F681-L689 HydrophobicContact CD1-CG 4.33Å; F681-L689 HydrophobicContact CD2-CB 3.58Å; F681-L689 HydrophobicContact CE1-CB 3.88Å; F681-L689 HydrophobicContact CE1-CD2 3.92Å; F681-L689 HydrophobicContact CE2-CB 3.64Å; F681-L689 HydrophobicContact CG-CB 3.69Å; F681-L689 HydrophobicContact CG-CD2 3.98Å; F681-L689 HydrophobicContact CG-CG 4.41Å; F681-L689 HydrophobicContact CZ-CB 3.78Å; L689-I701 HydrophobicContact CD2-CD1 4.05Å
690	I	95.7	Very high	82.7	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	115.3	175.2	-44.1	-54.4	0	0	0	109.1	V640 V642 A648 V651 A652 L655 T662 T663 S664 I665 V688	V640-I690 HydrophobicContact CB-CD1 3.6Å; V640-I690 HydrophobicContact CG1-CD1 4.2Å; V640-I690 HydrophobicContact CG2-CD1 3.73Å; V640-I690 CarbonylContact O-C 3.54Å; V640-I690 WeakPolarHBondContact O-CA 3.36Å; V642-I690 HydrophobicContact CG1-CG2 4.02Å; V642-I690 HydrophobicContact CG2-CG2 4.03Å; A648-I690 HydrophobicContact CB-CG2 4.08Å; V651-I690 HydrophobicContact CB-CG2 4.38Å; V651-I690 HydrophobicContact CG1-CD1 3.98Å; V651-I690 HydrophobicContact CG1-CG1 4.29Å; V651-I690 HydrophobicContact CG1-CG2 4.38Å; A652-I690 HydrophobicContact CB-CB 4.34Å; A652-I690 HydrophobicContact CB-CG1 3.83Å; L655-I690 HydrophobicContact CD1-CD1 3.82Å; T662-I690 HydrophobicContact CG2-CD1 4.01Å; T662-I690 HydrophobicContact CG2-CG1 3.71Å; T663-I690 PolarHBondContact O-N 3.29Å; S664-I690 CarbonylContact C-O 3.48Å; S664-I690 VanDerWaalsContact CA-O 3.26Å; S664-I690 WeakPolarHBondContact CA-O 3.38Å; I665-I690 PolarHBondContact N-O 3.31Å; V688-I690 HydrophobicContact CG1-CD1 3.71Å
691	A	93.9	Very high	81.8	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.6	-174.4	0	0	0	0	0	112.4	L639 V640 F641 V642 I665 A696	L639-A691 HydrophobicContact CD1-CB 3.87Å; V640-A691 PolarHBondContact O-N 3.42Å; F641-A691 WeakPolarHBondContact CA-O 3.36Å; V642-A691 PolarHBondContact N-O 3.46Å; I665-A691 HydrophobicContact CG2-CB 3.69Å; I665-A691 WeakPolarHBondContact O-CA 3.49Å; A691-A696 HydrophobicContact CB-CB 4.05Å
692	T	91.5	Very high	80.6	Confident	9 Å²	9	25.1 Å²	25.1	6%	0.055	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	148.7	156.8	56.8	0	0	0	0	109.8	V642 K645 A648 I665 H666 V694 A695 A696	V642-T692 HydrophobicContact CG2-CG2 4.23Å; K645-T692 HydrophobicContact CB-CG2 4.47Å; K645-T692 HydrophobicContact CG-CG2 4.14Å; A648-T692 HydrophobicContact CB-CG2 4.17Å; I665-T692 PolarHBondContact O-N 2.86Å; I665-T692 VanDerWaalsContact O-N 3.12Å; H666-T692 WeakPolarHBondContact CA-OG1 3.39Å; H666-T692 HydrophobicContact CB-CG2 3.72Å; H666-T692 WeakPolarHBondContact CB-OG1 3.34Å; T692-V694 PolarHBondContact O-N 2.94Å; T692-A695 WeakPolarHBondContact O-CA 3.41Å; T692-A695 WeakPolarHBondContact O-CB 3.23Å; T692-A695 PolarHBondContact O-N 3.2Å; T692-A696 PolarHBondContact O-N 2.85Å
693	E	80.6	Confident	80.2	Confident	38 Å²	38	24.1 Å²	24.1	18%	0.178	17%	0.165	C	C	.	.	H	α-helix	trans	-44.1	-52.7	179.9	-172.9	174.9	-83.6	0	0	115	A695 A696 R697 R722	E693-A695 PolarHBondContact O-N 3.03Å; E693-A696 PolarHBondContact O-N 3.12Å; E693-R697 PolarHBondContact O-N 3.25Å; E693-R697 VanDerWaalsContact O-N 3.15Å; E693-R697 IonicContact OE2-CZ 3.21Å; E693-R697 IonicContact OE2-NH1 3.4Å; E693-R697 IonicContact OE2-NH2 3.05Å; E693-R697 PolarHBondContact OE2-NH2 2.92Å; E693-R722 IonicContact OE1-CZ 3.68Å; E693-R722 IonicContact OE1-NE 2.77Å; E693-R722 PolarHBondContact OE1-NE 3.49Å; E693-R722 IonicContact OE1-NH2 3.21Å; E693-R722 PolarHBondContact OE1-NH2 3.47Å
694	V	70.6	Confident	80.2	Confident	76 Å²	76	20.7 Å²	20.7	46%	0.461	14%	0.141	S	C	.	.	H	α-helix	trans	-55.3	-28.3	178.3	177.6	0	0	0	0	113	M548 T692	M548-V694 HydrophobicContact CE-CG1 4.25Å; T692-V694 PolarHBondContact O-N 2.94Å
695	A	68	Low	80.4	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-93.1	-10.8	-179.3	0	0	0	0	0	114.2	I665 T692 E693 L699	I665-A695 HydrophobicContact CB-CB 4.43Å; I665-A695 HydrophobicContact CD1-CB 4.31Å; I665-A695 HydrophobicContact CG1-CB 4Å; I665-A695 HydrophobicContact CG2-CB 4.11Å; I665-A695 WeakPolarHBondContact O-CB 3.39Å; T692-A695 WeakPolarHBondContact O-CA 3.41Å; T692-A695 WeakPolarHBondContact O-CB 3.23Å; T692-A695 PolarHBondContact O-N 3.2Å; E693-A695 PolarHBondContact O-N 3.03Å; A695-L699 WeakPolarHBondContact O-CD1 3.44Å
696	A	63.2	Low	80.6	Confident	1 Å²	1	18.8 Å²	18.8	1%	0.008	12%	0.118	C	C	.	.	H	α-helix	trans	-105.8	-17.2	178.7	0	0	0	0	0	114.9	F641 A691 T692 E693 L699	F641-A696 HydrophobicContact CD1-CB 4.43Å; F641-A696 HydrophobicContact CE1-CB 3.26Å; F641-A696 HydrophobicContact CZ-CB 3.43Å; F641-A696 VanDerWaalsContact CZ-CB 3.43Å; A691-A696 HydrophobicContact CB-CB 4.05Å; T692-A696 PolarHBondContact O-N 2.85Å; E693-A696 PolarHBondContact O-N 3.12Å; A696-L699 HydrophobicContact CB-CD1 4.16Å; A696-L699 WeakPolarHBondContact O-CB 3.49Å; A696-L699 PolarHBondContact O-N 2.86Å
697	R	71.4	Confident	80.8	Confident	25 Å²	25	16.8 Å²	16.8	9%	0.094	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	138.3	168.8	-70.9	-175.3	-179.8	118.8	5.5	109.6	T468 E693 L699 D718	T468-R697 HydrophobicContact CG2-CB 4.09Å; T468-R697 VanDerWaalsContact CG2-O 3.25Å; T468-R697 WeakPolarHBondContact CG2-O 3.4Å; T468-R697 PolarHBondContact OG1-O 3.24Å; T468-R697 VanDerWaalsContact OG1-O 3.04Å; E693-R697 PolarHBondContact O-N 3.25Å; E693-R697 VanDerWaalsContact O-N 3.15Å; E693-R697 IonicContact OE2-CZ 3.21Å; E693-R697 IonicContact OE2-NH1 3.4Å; E693-R697 IonicContact OE2-NH2 3.05Å; E693-R697 PolarHBondContact OE2-NH2 2.92Å; R697-L699 PolarHBondContact O-N 3.39Å; R697-L699 VanDerWaalsContact O-N 3.14Å; R697-D718 IonicContact CZ-OD1 2.59Å; R697-D718 IonicContact NE-OD1 3.63Å; R697-D718 IonicContact NH2-OD1 2.71Å; R697-D718 PolarHBondContact NH2-OD1 3.15Å; R697-D718 IonicContact NH2-OD2 3.96Å; R697-D718 PolarHBondContact NH2-OD2 3.4Å; R697-D718 VanDerWaalsContact NH2-OD2 3.13Å
698	G	61.9	Low	80.9	Confident	3 Å²	3	16.2 Å²	16.2	3%	0.031	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-1.9	-172.9	0	0	0	0	0	117.7	E541 D700	E541-G698 WeakPolarHBondContact OE1-CA 3.33Å; E541-G698 PolarHBondContact OE1-N 3.07Å; E541-G698 WeakPolarHBondContact OE2-CA 3.5Å; E541-G698 PolarHBondContact OE2-N 2.98Å; E541-G698 VanDerWaalsContact OE2-N 3.1Å; G698-D700 PolarHBondContact O-N 2.93Å
699	L	70	Confident	81	Confident	7 Å²	7	16.2 Å²	16.2	4%	0.037	10%	0.104	C	C	.	.			trans	-72.5	120.4	176.2	-66.7	-173	0	0	0	111.6	E470 L678 A695 A696 R697 I701 R725 R728	E470-L699 HydrophobicContact CB-CD2 3.45Å; E470-L699 VanDerWaalsContact CB-CD2 3.45Å; E470-L699 HydrophobicContact CG-CD2 3.81Å; L678-L699 HydrophobicContact CD1-CD2 3.82Å; L678-L699 HydrophobicContact CD2-CD1 3.77Å; L678-L699 HydrophobicContact CD2-CD2 3.99Å; A695-L699 WeakPolarHBondContact O-CD1 3.44Å; A696-L699 HydrophobicContact CB-CD1 4.16Å; A696-L699 WeakPolarHBondContact O-CB 3.49Å; A696-L699 PolarHBondContact O-N 2.86Å; R697-L699 PolarHBondContact O-N 3.39Å; R697-L699 VanDerWaalsContact O-N 3.14Å; L699-I701 HydrophobicContact CB-CD1 4.28Å; L699-I701 HydrophobicContact CB-CG1 4.14Å; L699-I701 HydrophobicContact CD1-CD1 4.01Å; L699-R725 PolarHBondContact O-NH1 2.97Å; L699-R728 PolarHBondContact O-NH1 3.29Å
700	D	66.8	Low	81.1	Confident	44 Å²	44	17 Å²	17	24%	0.235	11%	0.108	C	C	.	.			trans	-98.7	117.6	156.6	-161.7	24.2	0	0	0	110.8	I360 Q474 K682 G698 R728	I360-D700 VanDerWaalsContact CD1-OD1 3.31Å; I360-D700 WeakPolarHBondContact CD1-OD1 3.43Å; Q474-D700 PolarHBondContact NE2-OD2 3.4Å; K682-D700 WeakPolarHBondContact CE-O 3.4Å; K682-D700 PolarHBondContact NZ-O 2.88Å; G698-D700 PolarHBondContact O-N 2.93Å; D700-R728 IonicContact OD1-CZ 2.72Å; D700-R728 IonicContact OD1-NH1 3.52Å; D700-R728 PolarHBondContact OD1-NH1 3.24Å
701	I	70.8	Confident	81.1	Confident	5 Å²	5	18.3 Å²	18.3	3%	0.026	11%	0.114	C	C	.	.			trans	-127.1	112.9	-179.9	-48.8	175	0	0	0	106.4	F681 K682 L689 L699 G703 V704	F681-I701 HydrophobicContact CD1-CD1 3.88Å; F681-I701 HydrophobicContact CD1-CG2 3.73Å; F681-I701 HydrophobicContact CE1-CD1 3.76Å; F681-I701 HydrophobicContact CE1-CG2 3.72Å; K682-I701 HydrophobicContact CG-CG2 4.26Å; L689-I701 HydrophobicContact CD2-CD1 4.05Å; L699-I701 HydrophobicContact CB-CD1 4.28Å; L699-I701 HydrophobicContact CB-CG1 4.14Å; L699-I701 HydrophobicContact CD1-CD1 4.01Å; I701-G703 PolarHBondContact O-N 3.23Å; I701-V704 HydrophobicContact CB-CG2 3.73Å; I701-V704 HydrophobicContact CG2-CG2 3.8Å
702	A	66.8	Low	81.1	Confident	35 Å²	35	18.9 Å²	18.9	29%	0.289	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	130.9	178.6	0	0	0	0	0	111.2	I360	I360-A702 HydrophobicContact CD1-CB 4.4Å; I360-A702 HydrophobicContact CG1-CB 3.63Å
703	G	75	Confident	81.1	Confident	50 Å²	50	18.9 Å²	18.9	52%	0.515	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	42.3	173.9	0	0	0	0	0	114.6	K637 I701 D705	K637-G703 WeakPolarHBondContact CB-O 3.41Å; I701-G703 PolarHBondContact O-N 3.23Å; G703-D705 PolarHBondContact O-N 2.9Å
704	V	87.8	Confident	81.4	Confident	8 Å²	8	22.7 Å²	22.7	5%	0.048	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	110.3	165	178.4	0	0	0	0	108.4	L639 F681 I701 V707 T726	L639-V704 HydrophobicContact CB-CG1 3.95Å; F681-V704 HydrophobicContact CE1-CG2 4.27Å; I701-V704 HydrophobicContact CB-CG2 3.73Å; I701-V704 HydrophobicContact CG2-CG2 3.8Å; V704-V707 HydrophobicContact CG1-CG2 4.02Å; V704-T726 VanDerWaalsContact O-CB 3.29Å; V704-T726 WeakPolarHBondContact O-CB 3.4Å; V704-T726 PolarHBondContact O-OG1 3.36Å
705	D	91.1	Very high	82.2	Confident	34 Å²	34	20.5 Å²	20.5	18%	0.182	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	-43.9	178.9	-86.2	-100.9	0	0	0	113.2	R629 N633 A636 K637 G703 K734	R629-D705 IonicContact CZ-OD1 3.51Å; R629-D705 IonicContact NE-OD1 2.69Å; R629-D705 IonicContact NH2-OD1 3.72Å; R629-D705 PolarHBondContact NH2-OD1 3.44Å; N633-D705 PolarHBondContact ND2-OD1 2.77Å; N633-D705 VanDerWaalsContact ND2-OD1 3.12Å; A636-D705 VanDerWaalsContact CA-OD2 3.23Å; A636-D705 WeakPolarHBondContact CA-OD2 3.49Å; A636-D705 HydrophobicContact CB-CB 3.97Å; K637-D705 PolarHBondContact N-OD2 2.79Å; K637-D705 PolarHBondContact O-N 2.92Å; G703-D705 PolarHBondContact O-N 2.9Å; D705-K734 PolarHBondContact O-N 3.47Å
706	L	93.8	Very high	83.1	Confident	4 Å²	4	21.8 Å²	21.8	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	126.5	-170.3	177.5	64.4	0	0	0	109.8	I625 R629 K637 I638 L639 V708 K734	I625-L706 HydrophobicContact CG2-CD2 3.66Å; R629-L706 HydrophobicContact CG-CD2 4.42Å; K637-L706 PolarHBondContact O-N 2.79Å; I638-L706 WeakPolarHBondContact CA-O 3.4Å; I638-L706 HydrophobicContact CD1-CD2 4.36Å; I638-L706 HydrophobicContact CG1-CB 4.26Å; I638-L706 HydrophobicContact CG2-CB 4.21Å; I638-L706 HydrophobicContact CG2-CD2 4.06Å; I638-L706 HydrophobicContact CG2-CG 4.2Å; L639-L706 PolarHBondContact N-O 3.3Å; L706-V708 HydrophobicContact CD1-CG2 4.47Å; L706-V708 HydrophobicContact CD2-CG2 3.8Å; L706-V708 HydrophobicContact CG-CG2 3.82Å; L706-K734 WeakPolarHBondContact CA-O 3.46Å; L706-K734 HydrophobicContact CD1-CB 3.97Å; L706-K734 HydrophobicContact CD1-CD 4.2Å; L706-K734 HydrophobicContact CD1-CG 3.85Å
707	V	94.3	Very high	84	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	130.4	163.4	176.1	0	0	0	0	108.3	L639 F641 V704 R725 T726 K734 A735 T736	L639-V707 CarbonylContact O-C 3.32Å; L639-V707 WeakPolarHBondContact O-CA 3.44Å; F641-V707 HydrophobicContact CD2-CG1 3.77Å; F641-V707 HydrophobicContact CE2-CG1 3.93Å; V704-V707 HydrophobicContact CG1-CG2 4.02Å; V707-R725 HydrophobicContact CG2-CB 4.02Å; V707-T726 HydrophobicContact CB-CG2 4.43Å; V707-T726 HydrophobicContact CG2-CG2 3.81Å; V707-K734 PolarHBondContact N-O 2.84Å; V707-A735 HydrophobicContact CB-CB 4.33Å; V707-A735 CarbonylContact O-C 3.46Å; V707-A735 VanDerWaalsContact O-CA 3.28Å; V707-A735 WeakPolarHBondContact O-CA 3.24Å; V707-T736 PolarHBondContact O-N 2.94Å
708	V	96.7	Very high	84.6	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	115.3	172.6	-173.7	0	0	0	0	109.7	L622 I638 L639 V640 F641 L706 Y710 T736 F738	L622-V708 HydrophobicContact CD1-CB 4.37Å; L622-V708 HydrophobicContact CD1-CG1 3.95Å; L622-V708 HydrophobicContact CD1-CG2 4.37Å; I638-V708 HydrophobicContact CG2-CG2 4Å; L639-V708 PolarHBondContact O-N 3.07Å; V640-V708 CarbonylContact C-O 3.57Å; V640-V708 WeakPolarHBondContact CA-O 3Å; V640-V708 HydrophobicContact CG1-CB 4.29Å; V640-V708 HydrophobicContact CG2-CB 4.28Å; F641-V708 PolarHBondContact N-O 3.42Å; L706-V708 HydrophobicContact CD1-CG2 4.47Å; L706-V708 HydrophobicContact CD2-CG2 3.8Å; L706-V708 HydrophobicContact CG-CG2 3.82Å; V708-Y710 PolarHBondContact O-N 2.85Å; V708-T736 CarbonylContact C-O 3.53Å; V708-T736 VanDerWaalsContact CA-O 3.23Å; V708-T736 WeakPolarHBondContact CA-O 3.36Å; V708-F738 HydrophobicContact CG1-CE1 4.38Å; V708-F738 HydrophobicContact CG1-CE2 4.41Å; V708-F738 HydrophobicContact CG1-CZ 4.1Å
709	N	96.4	Very high	85.8	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	94	166.1	-68.2	-57.5	0	0	0	108.3	L712 R722 T736 S737 F738	N709-L712 HydrophobicContact CB-CD2 4.26Å; N709-R722 WeakPolarHBondContact OD1-CD 3.41Å; N709-T736 PolarHBondContact N-O 2.95Å; N709-S737 PolarHBondContact ND2-OG 3.43Å; N709-F738 PolarHBondContact O-N 2.83Å
710	Y	96.8	Very high	86.5	Confident	18 Å²	18	25 Å²	25	7%	0.071	16%	0.162	C	C	.	.	S	Bend	trans	-68.5	-42.1	175	-176.3	-82.9	0	0	0	110.5	K618 L622 F641 V642 V647 V651 V708 F738	K618-Y710 HydrophobicContact CB-CD2 4.25Å; K618-Y710 HydrophobicContact CB-CE1 3.94Å; K618-Y710 HydrophobicContact CB-CE2 3.61Å; K618-Y710 VanDerWaalsContact CB-CZ 3.41Å; K618-Y710 WeakPolarHBondContact CB-OH 3.4Å; K618-Y710 HydrophobicContact CD-CD1 4.09Å; K618-Y710 HydrophobicContact CD-CE1 3.82Å; K618-Y710 WeakPolarHBondContact CD-O 3.45Å; K618-Y710 WeakPolarHBondContact CE-O 3.4Å; K618-Y710 PolarHBondContact NZ-O 3.29Å; L622-Y710 HydrophobicContact CB-CD2 4.34Å; L622-Y710 HydrophobicContact CB-CE2 4.38Å; L622-Y710 HydrophobicContact CD2-CD2 3.89Å; L622-Y710 HydrophobicContact CD2-CE2 4.11Å; F641-Y710 WeakPolarHBondContact O-CA 3.41Å; F641-Y710 VanDerWaalsContact O-CB 3.26Å; F641-Y710 WeakPolarHBondContact O-CB 3.27Å; F641-Y710 PolarHBondContact O-N 2.92Å; V642-Y710 HydrophobicContact CG1-CD1 3.97Å; V642-Y710 HydrophobicContact CG1-CG 4.1Å; V647-Y710 HydrophobicContact CG1-CE1 4.29Å; V651-Y710 HydrophobicContact CG2-CE1 4.37Å; V651-Y710 HydrophobicContact CG2-CE2 4.32Å; V708-Y710 PolarHBondContact O-N 2.85Å; Y710-F738 HydrophobicContact CD2-CD2 4.09Å; Y710-F738 AromaticContact CD2-CE2 3.84Å; Y710-F738 HydrophobicContact CD2-CE2 3.84Å; Y710-F738 HydrophobicContact CE2-CE2 4.4Å; Y710-F738 HydrophobicContact CG-CD2 4.37Å
711	D	95.1	Very high	87.1	Confident	26 Å²	26	23.6 Å²	23.6	14%	0.139	15%	0.154	C	C	.	.	S	Bend	trans	-116.5	130.3	163.2	-57.2	-48.3	0	0	0	108.5	K618 F641 G643 R722	K618-D711 IonicContact NZ-OD1 2.21Å; K618-D711 PolarHBondContact NZ-OD1 2.82Å; F641-D711 PolarHBondContact O-N 2.87Å; G643-D711 PolarHBondContact N-OD2 3.08Å; D711-R722 PolarHBondContact O-NH1 3.37Å
712	L	94	Very high	87.9	Confident	13 Å²	13	23.8 Å²	23.8	7%	0.068	15%	0.154	C	C	.	.			trans	-62.3	151	170.1	-79.3	169.9	0	0	0	110.9	N709 Y719 Y739 D744 L747 L751	N709-L712 HydrophobicContact CB-CD2 4.26Å; L712-Y719 HydrophobicContact CD2-CD2 3.69Å; L712-Y719 HydrophobicContact CD2-CE2 3.87Å; L712-Y739 HydrophobicContact CD1-CD2 3.84Å; L712-Y739 HydrophobicContact CD1-CG 4.49Å; L712-D744 HydrophobicContact CB-CB 4.49Å; L712-D744 HydrophobicContact CD1-CB 3.87Å; L712-L747 HydrophobicContact CB-CD2 4.26Å; L712-L747 HydrophobicContact CD1-CD2 4.47Å; L712-L747 HydrophobicContact CD2-CD2 4.37Å; L712-L751 HydrophobicContact CD1-CD2 4.45Å
713	P	91.2	Very high	88.9	Confident	8 Å²	8	22.1 Å²	22.1	5%	0.052	14%	0.14	C	C	.	.			trans	-70.2	167.9	170.3	26.1	-27.3	0	0	0	111.7	S715 D718 Y719	P713-S715 VanDerWaalsContact C-N 3.33Å; P713-S715 WeakPolarHBondContact CG-O 3.49Å; P713-D718 HydrophobicContact CB-CB 3.56Å; P713-D718 HydrophobicContact CG-CB 4.06Å; P713-Y719 VanDerWaalsContact CG-N 3.35Å
714	S	88	Confident	89.3	Confident	118 Å²	118	20 Å²	20	83%	0.825	12%	0.119	S	C	*	.	S	Bend	trans	-83.5	-4	172.4	53.6	0	0	0	0	114.3
715	S	87.2	Confident	89.2	Confident	31 Å²	31	20 Å²	20	22%	0.217	12%	0.118	C	C	.	.	S	Bend	trans	-137.2	148.8	180	78.3	0	0	0	0	110.9	P713 D718 Y719	P713-S715 VanDerWaalsContact C-N 3.33Å; P713-S715 WeakPolarHBondContact CG-O 3.49Å; S715-D718 PolarHBondContact O-N 2.93Å; S715-D718 VanDerWaalsContact OG-CB 3.28Å; S715-D718 WeakPolarHBondContact OG-CB 3.31Å; S715-D718 PolarHBondContact OG-N 2.94Å; S715-D718 VanDerWaalsContact OG-N 3.14Å; S715-D718 PolarHBondContact OG-OD2 3.35Å; S715-Y719 PolarHBondContact O-N 2.85Å
716	I	87.3	Confident	89	Confident	28 Å²	28	18.7 Å²	18.7	14%	0.144	11%	0.111	C	C	.	.	H	α-helix	trans	-70.7	-33.3	176.7	-163	66.8	0	0	0	112.3	D718 Y719 V720 L747 E750 L751 T754	I716-D718 VanDerWaalsContact C-N 3.27Å; I716-D718 PolarHBondContact O-N 2.94Å; I716-Y719 HydrophobicContact CD1-CD1 3.92Å; I716-Y719 HydrophobicContact CD1-CG 4.24Å; I716-Y719 WeakPolarHBondContact O-CA 3.23Å; I716-Y719 VanDerWaalsContact O-CB 3.3Å; I716-Y719 WeakPolarHBondContact O-CB 3.5Å; I716-Y719 PolarHBondContact O-N 2.75Å; I716-V720 WeakPolarHBondContact O-CG2 3.03Å; I716-V720 PolarHBondContact O-N 3.4Å; I716-L747 HydrophobicContact CB-CD1 4.11Å; I716-L747 HydrophobicContact CD1-CD1 4.34Å; I716-E750 HydrophobicContact CB-CB 3.98Å; I716-E750 WeakPolarHBondContact CB-OE2 3.46Å; I716-E750 HydrophobicContact CD1-CB 4.26Å; I716-E750 HydrophobicContact CG1-CB 4.1Å; I716-E750 HydrophobicContact CG2-CB 4.3Å; I716-E750 WeakPolarHBondContact CG2-OE2 3.32Å; I716-L751 HydrophobicContact CD1-CB 4.43Å; I716-L751 HydrophobicContact CD1-CD1 4.4Å; I716-T754 WeakPolarHBondContact CD1-OG1 3.41Å; I716-T754 VanDerWaalsContact CG1-OG1 3.23Å; I716-T754 WeakPolarHBondContact CG1-OG1 3.39Å
717	D	80.9	Confident	88.4	Confident	70 Å²	70	18.7 Å²	18.7	37%	0.374	11%	0.112	S	C	.	.	H	α-helix	trans	-58.6	-39.5	174.4	-68.1	-55.1	0	0	0	112	R544 H721	R544-D717 PolarHBondContact NH1-O 2.93Å; D717-H721 WeakPolarHBondContact O-CB 3.37Å; D717-H721 PolarHBondContact O-CD2 3.18Å; D717-H721 PolarHBondContact O-N 3.28Å; D717-H721 VanDerWaalsContact O-N 3.07Å
718	D	83.8	Confident	87.6	Confident	14 Å²	14	19.6 Å²	19.6	8%	0.075	12%	0.116	C	C	.	.	H	α-helix	trans	-69.3	-35.8	173.1	-72.5	-42.8	0	0	0	112.5	R544 R697 P713 S715 I716 H721 R722	R544-D718 IonicContact CZ-OD1 3.47Å; R544-D718 VanDerWaalsContact CZ-OD1 3.28Å; R544-D718 IonicContact NH1-OD1 3.83Å; R544-D718 PolarHBondContact NH1-OD1 3.04Å; R544-D718 IonicContact NH2-OD1 3.29Å; R544-D718 PolarHBondContact NH2-OD1 3.18Å; R697-D718 IonicContact CZ-OD1 2.59Å; R697-D718 IonicContact NE-OD1 3.63Å; R697-D718 IonicContact NH2-OD1 2.71Å; R697-D718 PolarHBondContact NH2-OD1 3.15Å; R697-D718 IonicContact NH2-OD2 3.96Å; R697-D718 PolarHBondContact NH2-OD2 3.4Å; R697-D718 VanDerWaalsContact NH2-OD2 3.13Å; P713-D718 HydrophobicContact CB-CB 3.56Å; P713-D718 HydrophobicContact CG-CB 4.06Å; S715-D718 PolarHBondContact O-N 2.93Å; S715-D718 VanDerWaalsContact OG-CB 3.28Å; S715-D718 WeakPolarHBondContact OG-CB 3.31Å; S715-D718 PolarHBondContact OG-N 2.94Å; S715-D718 VanDerWaalsContact OG-N 3.14Å; S715-D718 PolarHBondContact OG-OD2 3.35Å; I716-D718 VanDerWaalsContact C-N 3.27Å; I716-D718 PolarHBondContact O-N 2.94Å; D718-H721 PolarHBondContact O-N 3.46Å; D718-R722 WeakPolarHBondContact O-CB 3.34Å; D718-R722 WeakPolarHBondContact O-CG 3.38Å; D718-R722 PolarHBondContact O-N 3.01Å
719	Y	88.3	Confident	86.5	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.2	-52	175.1	173.5	-96.3	0	0	0	110.7	Q608 L712 P713 S715 I716 H721 R722 I723 S737 L751 T754	Q608-Y719 PolarHBondContact OE1-OH 2.74Å; L712-Y719 HydrophobicContact CD2-CD2 3.69Å; L712-Y719 HydrophobicContact CD2-CE2 3.87Å; P713-Y719 VanDerWaalsContact CG-N 3.35Å; S715-Y719 PolarHBondContact O-N 2.85Å; I716-Y719 HydrophobicContact CD1-CD1 3.92Å; I716-Y719 HydrophobicContact CD1-CG 4.24Å; I716-Y719 WeakPolarHBondContact O-CA 3.23Å; I716-Y719 VanDerWaalsContact O-CB 3.3Å; I716-Y719 WeakPolarHBondContact O-CB 3.5Å; I716-Y719 PolarHBondContact O-N 2.75Å; Y719-H721 VanDerWaalsContact C-N 3.28Å; Y719-H721 PolarHBondContact O-N 2.87Å; Y719-R722 PolarHBondContact O-N 3.46Å; Y719-R722 VanDerWaalsContact O-N 3.11Å; Y719-I723 HydrophobicContact CD1-CD1 4.27Å; Y719-I723 HydrophobicContact CD2-CG2 4.49Å; Y719-I723 HydrophobicContact CE1-CD1 3.73Å; Y719-I723 HydrophobicContact CE1-CG2 4.34Å; Y719-I723 HydrophobicContact CE2-CG2 4.1Å; Y719-I723 PolarHBondContact O-N 2.91Å; Y719-S737 WeakPolarHBondContact CE2-OG 3.45Å; Y719-L751 HydrophobicContact CD1-CD1 4.12Å; Y719-L751 HydrophobicContact CD2-CD1 4.35Å; Y719-L751 HydrophobicContact CE1-CD1 3.65Å; Y719-L751 HydrophobicContact CE2-CD1 3.88Å; Y719-L751 HydrophobicContact CG-CD1 4.45Å; Y719-T754 HydrophobicContact CE1-CG2 4.42Å
720	V	84.1	Confident	85.4	Confident	20 Å²	20	20.9 Å²	20.9	12%	0.121	12%	0.124	C	C	.	.	H	α-helix	trans	-55.8	-43.4	176.3	176.6	0	0	0	0	111	A602 I716 R722 I723 G724 T754	A602-V720 HydrophobicContact CB-CG1 4Å; A602-V720 HydrophobicContact CB-CG2 4.16Å; I716-V720 WeakPolarHBondContact O-CG2 3.03Å; I716-V720 PolarHBondContact O-N 3.4Å; V720-R722 PolarHBondContact O-N 2.81Å; V720-I723 WeakPolarHBondContact O-CG1 3.3Å; V720-G724 PolarHBondContact O-N 2.67Å; V720-T754 HydrophobicContact CG2-CG2 4.19Å
721	H	79.6	Confident	84.7	Confident	13 Å²	13	22.8 Å²	22.8	6%	0.06	14%	0.135	C	C	.	.	H	α-helix	trans	-71.3	-25.9	179.6	-79.6	-141.7	0	0	0	114.6	D543 R544 A573 D717 D718 Y719 R725	D543-H721 IonicContact OD2-CE1 2.68Å; D543-H721 PolarHBondContact OD2-CE1 3.07Å; R544-H721 PolarHBondContact NE-CE1 3.42Å; R544-H721 PolarHBondContact NE-ND1 3.03Å; R544-H721 VanDerWaalsContact NE-ND1 3.18Å; R544-H721 PolarHBondContact NH1-CE1 3.24Å; R544-H721 PolarHBondContact NH1-ND1 2.69Å; A573-H721 VanDerWaalsContact CB-NE2 3.3Å; A573-H721 WeakPolarHBondContact CB-NE2 3.43Å; D717-H721 WeakPolarHBondContact O-CB 3.37Å; D717-H721 PolarHBondContact O-CD2 3.18Å; D717-H721 PolarHBondContact O-N 3.28Å; D717-H721 VanDerWaalsContact O-N 3.07Å; D718-H721 PolarHBondContact O-N 3.46Å; Y719-H721 VanDerWaalsContact C-N 3.28Å; Y719-H721 PolarHBondContact O-N 2.87Å; H721-R725 PolarHBondContact O-NE 3.25Å; H721-R725 PolarHBondContact O-NH2 3.01Å
722	R	87.2	Confident	84.2	Confident	9 Å²	9	25.7 Å²	25.7	3%	0.034	16%	0.155	C	C	.	.	H	α-helix	trans	-75.9	-50	174.4	-72.8	175.8	-173.9	-161.3	7	110.9	F641 E693 N709 D711 D718 Y719 V720 G724 R725	F641-R722 HydrophobicContact CD1-CG 3.8Å; F641-R722 HydrophobicContact CD2-CB 3.88Å; F641-R722 HydrophobicContact CD2-CG 3.97Å; F641-R722 HydrophobicContact CE1-CB 4.43Å; F641-R722 HydrophobicContact CE1-CG 3.67Å; F641-R722 HydrophobicContact CE2-CB 3.7Å; F641-R722 HydrophobicContact CE2-CG 3.87Å; F641-R722 HydrophobicContact CG-CB 4.33Å; F641-R722 HydrophobicContact CG-CG 3.92Å; F641-R722 HydrophobicContact CZ-CB 3.99Å; F641-R722 HydrophobicContact CZ-CG 3.72Å; E693-R722 IonicContact OE1-CZ 3.68Å; E693-R722 IonicContact OE1-NE 2.77Å; E693-R722 PolarHBondContact OE1-NE 3.49Å; E693-R722 IonicContact OE1-NH2 3.21Å; E693-R722 PolarHBondContact OE1-NH2 3.47Å; N709-R722 WeakPolarHBondContact OD1-CD 3.41Å; D711-R722 PolarHBondContact O-NH1 3.37Å; D718-R722 WeakPolarHBondContact O-CB 3.34Å; D718-R722 WeakPolarHBondContact O-CG 3.38Å; D718-R722 PolarHBondContact O-N 3.01Å; Y719-R722 PolarHBondContact O-N 3.46Å; Y719-R722 VanDerWaalsContact O-N 3.11Å; V720-R722 PolarHBondContact O-N 2.81Å; R722-G724 VanDerWaalsContact C-N 3.28Å; R722-G724 PolarHBondContact O-N 3.37Å; R722-R725 WeakPolarHBondContact O-CB 3.46Å; R722-R725 VanDerWaalsContact O-CG 3.25Å; R722-R725 WeakPolarHBondContact O-CG 3.49Å; R722-R725 PolarHBondContact O-N 2.66Å; R722-R725 VanDerWaalsContact O-N 3.11Å
723	I	88.1	Confident	84	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.2	-35.6	178.6	67.9	174.4	0	0	0	111.1	A602 I606 Q608 Y719 V720 R725 T726 A735	A602-I723 HydrophobicContact CB-CD1 3.74Å; I606-I723 HydrophobicContact CD1-CB 4.42Å; I606-I723 HydrophobicContact CD1-CG1 4.15Å; I606-I723 HydrophobicContact CG2-CB 4.36Å; Q608-I723 VanDerWaalsContact CD-CD1 3.48Å; Q608-I723 HydrophobicContact CG-CD1 3.91Å; Q608-I723 VanDerWaalsContact OE1-CD1 3.29Å; Y719-I723 HydrophobicContact CD1-CD1 4.27Å; Y719-I723 HydrophobicContact CD2-CG2 4.49Å; Y719-I723 HydrophobicContact CE1-CD1 3.73Å; Y719-I723 HydrophobicContact CE1-CG2 4.34Å; Y719-I723 HydrophobicContact CE2-CG2 4.1Å; Y719-I723 PolarHBondContact O-N 2.91Å; V720-I723 WeakPolarHBondContact O-CG1 3.3Å; I723-R725 PolarHBondContact O-N 2.77Å; I723-T726 VanDerWaalsContact O-CG2 3.31Å; I723-T726 WeakPolarHBondContact O-CG2 3.35Å; I723-T726 PolarHBondContact O-N 3.12Å; I723-A735 HydrophobicContact CB-CB 3.75Å; I723-A735 HydrophobicContact CG2-CB 3.5Å; I723-A735 VanDerWaalsContact CG2-CB 3.5Å
724	G	83.1	Confident	84.1	Confident	7 Å²	7	28.2 Å²	28.2	7%	0.072	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	8.9	170.8	0	0	0	0	0	116.2	T432 V720 R722 T726 R728	T432-G724 PolarHBondContact OG1-O 2.84Å; V720-G724 PolarHBondContact O-N 2.67Å; R722-G724 VanDerWaalsContact C-N 3.28Å; R722-G724 PolarHBondContact O-N 3.37Å; G724-T726 CarbonylContact C-O 3.51Å; G724-R728 VanDerWaalsContact O-CZ 3.25Å; G724-R728 PolarHBondContact O-NE 2.95Å; G724-R728 PolarHBondContact O-NH2 3.09Å
725	R	85.5	Confident	84.4	Confident	8 Å²	8	22.6 Å²	22.6	3%	0.03	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.3	164	-58.5	-60.3	127	177.7	2.9	112.7	L639 F641 L699 V707 H721 R722 I723	L639-R725 HydrophobicContact CD2-CB 3.6Å; L639-R725 HydrophobicContact CD2-CG 3.75Å; F641-R725 HydrophobicContact CE2-CG 4.13Å; F641-R725 HydrophobicContact CZ-CG 4.01Å; L699-R725 PolarHBondContact O-NH1 2.97Å; V707-R725 HydrophobicContact CG2-CB 4.02Å; H721-R725 PolarHBondContact O-NE 3.25Å; H721-R725 PolarHBondContact O-NH2 3.01Å; R722-R725 WeakPolarHBondContact O-CB 3.46Å; R722-R725 VanDerWaalsContact O-CG 3.25Å; R722-R725 WeakPolarHBondContact O-CG 3.49Å; R722-R725 PolarHBondContact O-N 2.66Å; R722-R725 VanDerWaalsContact O-N 3.11Å; I723-R725 PolarHBondContact O-N 2.77Å
726	T	87.3	Confident	84.9	Confident	5 Å²	5	21.2 Å²	21.2	3%	0.031	12%	0.118	C	C	.	.	S	Bend	trans	-103.8	-176.2	161.5	-170.2	0	0	0	0	109.8	I606 V704 V707 I723 G724 G733 K734	I606-T726 HydrophobicContact CG1-CG2 4.39Å; I606-T726 HydrophobicContact CG2-CG2 4.08Å; V704-T726 VanDerWaalsContact O-CB 3.29Å; V704-T726 WeakPolarHBondContact O-CB 3.4Å; V704-T726 PolarHBondContact O-OG1 3.36Å; V707-T726 HydrophobicContact CB-CG2 4.43Å; V707-T726 HydrophobicContact CG2-CG2 3.81Å; I723-T726 VanDerWaalsContact O-CG2 3.31Å; I723-T726 WeakPolarHBondContact O-CG2 3.35Å; I723-T726 PolarHBondContact O-N 3.12Å; G724-T726 CarbonylContact C-O 3.51Å; T726-G733 WeakPolarHBondContact OG1-CA 3.16Å; T726-K734 WeakPolarHBondContact CG2-O 3.26Å
727	G	80.9	Confident	85.3	Confident	4 Å²	4	19.9 Å²	19.9	4%	0.041	11%	0.111	C	C	.	.	S	Bend	trans	68.1	41	173.7	0	0	0	0	0	114.7	N603 N731	N603-G727 PolarHBondContact ND2-O 3.1Å; G727-N731 CarbonylContact C-O 3.56Å; G727-N731 WeakPolarHBondContact CA-O 3.36Å
728	R	77.9	Confident	86.1	Confident	19 Å²	19	16.5 Å²	16.5	7%	0.072	9%	0.093	C	C	.	.			trans	-106.1	141	-169.7	-67.6	-171.8	172.2	-159	-4	113.2	I360 L699 D700 G724 G730 N731	I360-R728 HydrophobicContact CD1-CB 3.95Å; L699-R728 PolarHBondContact O-NH1 3.29Å; D700-R728 IonicContact OD1-CZ 2.72Å; D700-R728 IonicContact OD1-NH1 3.52Å; D700-R728 PolarHBondContact OD1-NH1 3.24Å; G724-R728 VanDerWaalsContact O-CZ 3.25Å; G724-R728 PolarHBondContact O-NE 2.95Å; G724-R728 PolarHBondContact O-NH2 3.09Å; R728-G730 PolarHBondContact O-N 2.87Å; R728-N731 WeakPolarHBondContact O-CB 3.3Å; R728-N731 PolarHBondContact O-N 2.78Å; R728-N731 PolarHBondContact O-ND2 2.79Å
729	V	73.9	Confident	86.7	Confident	28 Å²	28	16.2 Å²	16.2	17%	0.17	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	38.1	176.5	-155.6	0	0	0	0	112.4	I360 A362 G363 F366 N731	I360-V729 HydrophobicContact CB-CG2 4.04Å; I360-V729 HydrophobicContact CG2-CB 4.07Å; I360-V729 HydrophobicContact CG2-CG2 3.69Å; A362-V729 HydrophobicContact CB-CG1 4.34Å; G363-V729 PolarHBondContact N-O 3.06Å; F366-V729 HydrophobicContact CD2-CG1 3.75Å; F366-V729 HydrophobicContact CE2-CG1 3.8Å; V729-N731 VanDerWaalsContact C-N 3.3Å; V729-N731 PolarHBondContact O-N 3.47Å
730	G	74	Confident	86.9	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	7.4	-177	0	0	0	0	0	115.7	G363 V364 N365 Q369 R728	G363-G730 CarbonylContact C-O 3.6Å; G363-G730 VanDerWaalsContact C-O 3.27Å; V364-G730 PolarHBondContact N-O 2.86Å; N365-G730 WeakPolarHBondContact CB-O 3.46Å; N365-G730 PolarHBondContact N-O 2.88Å; Q369-G730 VanDerWaalsContact NE2-N 3.13Å; R728-G730 PolarHBondContact O-N 2.87Å
731	N	81.6	Confident	87.2	Confident	57 Å²	57	21.6 Å²	21.6	31%	0.305	12%	0.115	S	C	.	.			trans	-78.8	134.2	167.6	-64.3	-82.6	0	0	0	108.9	R361 G363 G727 R728 V729	R361-N731 PolarHBondContact O-ND2 1.82Å; G363-N731 VanDerWaalsContact CA-OD1 3.29Å; G363-N731 WeakPolarHBondContact CA-OD1 3.49Å; G727-N731 CarbonylContact C-O 3.56Å; G727-N731 WeakPolarHBondContact CA-O 3.36Å; R728-N731 WeakPolarHBondContact O-CB 3.3Å; R728-N731 PolarHBondContact O-N 2.78Å; R728-N731 PolarHBondContact O-ND2 2.79Å; V729-N731 VanDerWaalsContact C-N 3.3Å; V729-N731 PolarHBondContact O-N 3.47Å
732	P	85.3	Confident	87.6	Confident	87 Å²	87	27.2 Å²	27.2	57%	0.565	15%	0.15	S	C	*	.			trans	-66.1	148.1	175.3	28.6	-35	0	0	0	111	D605	D605-P732 CarbonylContact O-C 3.56Å; D605-P732 WeakPolarHBondContact O-CA 3.26Å
733	G	88.7	Confident	87.8	Confident	7 Å²	7	30.7 Å²	30.7	7%	0.072	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	157.5	177.1	0	0	0	0	0	112.4	D605 I606 T607 T726	D605-G733 PolarHBondContact O-N 2.96Å; I606-G733 WeakPolarHBondContact CA-O 3.2Å; T607-G733 PolarHBondContact N-O 2.97Å; T726-G733 WeakPolarHBondContact OG1-CA 3.16Å
734	K	93.5	Very high	88	Confident	68 Å²	68	31.4 Å²	31.4	30%	0.296	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	137.8	167.8	-171	173.8	179	-174.6	0	110.9	T607 E609 D705 L706 V707 T726 T736	T607-K734 WeakPolarHBondContact O-CA 3.34Å; E609-K734 IonicContact OE1-NZ 3.68Å; E609-K734 WeakPolarHBondContact OE2-CE 3.41Å; E609-K734 IonicContact OE2-NZ 1.82Å; E609-K734 PolarHBondContact OE2-NZ 2.94Å; D705-K734 PolarHBondContact O-N 3.47Å; L706-K734 WeakPolarHBondContact CA-O 3.46Å; L706-K734 HydrophobicContact CD1-CB 3.97Å; L706-K734 HydrophobicContact CD1-CD 4.2Å; L706-K734 HydrophobicContact CD1-CG 3.85Å; V707-K734 PolarHBondContact N-O 2.84Å; T726-K734 WeakPolarHBondContact CG2-O 3.26Å; K734-T736 WeakPolarHBondContact CE-OG1 3.24Å
735	A	94.4	Very high	88.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.1	169.7	0	0	0	0	0	110.4	I606 T607 Q608 E609 V707 I723	I606-A735 HydrophobicContact CG2-CB 3.79Å; T607-A735 PolarHBondContact O-N 3.16Å; Q608-A735 WeakPolarHBondContact CA-O 3.49Å; E609-A735 PolarHBondContact N-O 2.74Å; V707-A735 HydrophobicContact CB-CB 4.33Å; V707-A735 CarbonylContact O-C 3.46Å; V707-A735 VanDerWaalsContact O-CA 3.28Å; V707-A735 WeakPolarHBondContact O-CA 3.24Å; I723-A735 HydrophobicContact CB-CB 3.75Å; I723-A735 HydrophobicContact CG2-CB 3.5Å; I723-A735 VanDerWaalsContact CG2-CB 3.5Å
736	T	96.6	Very high	88.6	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.4	174.5	-57.7	0	0	0	0	109.4	E609 L611 I625 V707 V708 N709 K734 F738	E609-T736 HydrophobicContact CB-CG2 4.42Å; E609-T736 HydrophobicContact CG-CG2 4.26Å; E609-T736 CarbonylContact O-C 3.6Å; E609-T736 WeakPolarHBondContact O-CA 3.45Å; E609-T736 WeakPolarHBondContact OE2-CG2 3.36Å; E609-T736 PolarHBondContact OE2-OG1 3.31Å; L611-T736 HydrophobicContact CD1-CG2 3.51Å; L611-T736 HydrophobicContact CG-CG2 4.12Å; I625-T736 HydrophobicContact CD1-CG2 3.92Å; V707-T736 PolarHBondContact O-N 2.94Å; V708-T736 CarbonylContact C-O 3.53Å; V708-T736 VanDerWaalsContact CA-O 3.23Å; V708-T736 WeakPolarHBondContact CA-O 3.36Å; N709-T736 PolarHBondContact N-O 2.95Å; K734-T736 WeakPolarHBondContact CE-OG1 3.24Å; T736-F738 HydrophobicContact CG2-CE1 4.43Å
737	S	96.9	Very high	88.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131	-173.6	-55.3	0	0	0	0	111.6	E609 L611 N709 Y719	E609-S737 PolarHBondContact O-N 3.25Å; L611-S737 PolarHBondContact N-O 2.98Å; N709-S737 PolarHBondContact ND2-OG 3.43Å; Y719-S737 WeakPolarHBondContact CE2-OG 3.45Å
738	F	97.3	Very high	89.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	117.3	175.1	-60.6	-14.7	0	0	0	109.2	V613 K618 K621 L622 I625 V708 N709 Y710 T736	V613-F738 HydrophobicContact CB-CB 4.16Å; V613-F738 HydrophobicContact CB-CG 4.3Å; V613-F738 HydrophobicContact CG2-CB 4.25Å; V613-F738 HydrophobicContact CG2-CD1 3.87Å; V613-F738 HydrophobicContact CG2-CG 4.09Å; K618-F738 HydrophobicContact CB-CD2 3.99Å; K618-F738 HydrophobicContact CB-CE2 4.32Å; K618-F738 HydrophobicContact CD-CD2 4.42Å; K618-F738 HydrophobicContact CG-CD2 3.97Å; K618-F738 VanDerWaalsContact O-CE2 3.3Å; K618-F738 WeakPolarHBondContact O-CE2 3.21Å; K621-F738 HydrophobicContact CB-CE1 4.42Å; K621-F738 HydrophobicContact CB-CE2 4.47Å; K621-F738 HydrophobicContact CB-CZ 4.04Å; K621-F738 HydrophobicContact CG-CD1 4.45Å; K621-F738 HydrophobicContact CG-CE1 3.72Å; K621-F738 HydrophobicContact CG-CZ 3.81Å; L622-F738 HydrophobicContact CB-CE2 4.12Å; L622-F738 HydrophobicContact CB-CZ 4.22Å; I625-F738 HydrophobicContact CD1-CE1 3.56Å; I625-F738 HydrophobicContact CD1-CZ 3.86Å; V708-F738 HydrophobicContact CG1-CE1 4.38Å; V708-F738 HydrophobicContact CG1-CE2 4.41Å; V708-F738 HydrophobicContact CG1-CZ 4.1Å; N709-F738 PolarHBondContact O-N 2.83Å; Y710-F738 HydrophobicContact CD2-CD2 4.09Å; Y710-F738 AromaticContact CD2-CE2 3.84Å; Y710-F738 HydrophobicContact CD2-CE2 3.84Å; Y710-F738 HydrophobicContact CE2-CE2 4.4Å; Y710-F738 HydrophobicContact CG-CD2 4.37Å; T736-F738 HydrophobicContact CG2-CE1 4.43Å
739	Y	96.2	Very high	89.8	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.027	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	117.8	175.6	177.4	-90.4	0	0	0	109.2	L611 P612 V613 L712 E741 D744 A748 F765 L766	L611-Y739 PolarHBondContact O-N 2.85Å; P612-Y739 WeakPolarHBondContact CA-O 3.4Å; V613-Y739 PolarHBondContact N-O 2.71Å; L712-Y739 HydrophobicContact CD1-CD2 3.84Å; L712-Y739 HydrophobicContact CD1-CG 4.49Å; Y739-E741 HydrophobicContact CE1-CB 4.2Å; Y739-E741 HydrophobicContact CE1-CG 4.39Å; Y739-D744 HydrophobicContact CD2-CB 3.75Å; Y739-D744 HydrophobicContact CE2-CB 3.77Å; Y739-A748 HydrophobicContact CE2-CB 4.1Å; Y739-F765 HydrophobicContact CD1-CD2 4.01Å; Y739-F765 AromaticContact CD1-CE2 3.57Å; Y739-F765 HydrophobicContact CD1-CE2 3.57Å; Y739-F765 HydrophobicContact CE1-CD2 4.22Å; Y739-F765 HydrophobicContact CE1-CE2 4.17Å; Y739-F765 AromaticContact CG-CE2 3.92Å; Y739-F765 HydrophobicContact CG-CE2 3.92Å; Y739-L766 HydrophobicContact CD1-CD2 4.42Å; Y739-L766 HydrophobicContact CD2-CD2 4Å; Y739-L766 HydrophobicContact CE1-CD2 4.24Å; Y739-L766 HydrophobicContact CE2-CD2 3.81Å; Y739-L766 HydrophobicContact CG-CD2 4.31Å
740	D	93	Very high	90.6	Very high	11 Å²	11	41.2 Å²	41.2	6%	0.059	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-102.8	120.6	168.6	-171.6	-48.4	0	0	0	109.1	T614 M615 V742 T743 D744	T614-D740 WeakPolarHBondContact CA-OD2 3.41Å; M615-D740 HydrophobicContact CE-CB 3.74Å; M615-D740 WeakPolarHBondContact CG-OD2 3.28Å; M615-D740 PolarHBondContact N-OD2 2.99Å; D740-V742 PolarHBondContact O-N 3.1Å; D740-V742 VanDerWaalsContact O-N 3.12Å; D740-V742 WeakPolarHBondContact OD1-CB 3.37Å; D740-V742 PolarHBondContact OD1-N 2.97Å; D740-T743 PolarHBondContact O-N 3.47Å; D740-D744 PolarHBondContact N-OD2 2.99Å; D740-D744 WeakPolarHBondContact O-CB 3.38Å; D740-D744 PolarHBondContact O-N 2.92Å
741	E	89.5	Confident	91.4	Very high	122 Å²	122	41.2 Å²	41.2	57%	0.57	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-26.8	-176.6	-160.1	-164.4	156.9	0	0	113.3	Y739 A745 R769	Y739-E741 HydrophobicContact CE1-CB 4.2Å; Y739-E741 HydrophobicContact CE1-CG 4.39Å; E741-A745 WeakPolarHBondContact O-CB 3.34Å; E741-R769 IonicContact OE1-CZ 3.75Å; E741-R769 IonicContact OE1-NH1 3.02Å; E741-R769 PolarHBondContact OE1-NH1 2.9Å
742	V	89.1	Confident	91.8	Very high	132 Å²	132	38.6 Å²	38.6	80%	0.8	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-36	-177.8	-175.9	0	0	0	0	111.6	D740	D740-V742 PolarHBondContact O-N 3.1Å; D740-V742 VanDerWaalsContact O-N 3.12Å; D740-V742 WeakPolarHBondContact OD1-CB 3.37Å; D740-V742 PolarHBondContact OD1-N 2.97Å
743	T	90.2	Very high	92	Very high	81 Å²	81	40.4 Å²	40.4	50%	0.497	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-32.6	-176.9	57.5	0	0	0	0	113.9	M615 D740	M615-T743 HydrophobicContact CE-CG2 3.66Å; M615-T743 VanDerWaalsContact CE-OG1 3.3Å; M615-T743 WeakPolarHBondContact CE-OG1 3.39Å; D740-T743 PolarHBondContact O-N 3.47Å
744	D	92.9	Very high	91.9	Very high	15 Å²	15	40.8 Å²	40.8	8%	0.08	23%	0.233	C	C	.	.	S	Bend	trans	-105.3	1.3	-162.8	-49.8	-22.5	0	0	0	112.4	L712 Y739 D740 A746 L747	L712-D744 HydrophobicContact CB-CB 4.49Å; L712-D744 HydrophobicContact CD1-CB 3.87Å; Y739-D744 HydrophobicContact CD2-CB 3.75Å; Y739-D744 HydrophobicContact CE2-CB 3.77Å; D740-D744 PolarHBondContact N-OD2 2.99Å; D740-D744 WeakPolarHBondContact O-CB 3.38Å; D740-D744 PolarHBondContact O-N 2.92Å; D744-A746 PolarHBondContact O-N 3.47Å; D744-L747 PolarHBondContact O-N 3.46Å
745	A	90.1	Very high	91.7	Very high	31 Å²	31	37.6 Å²	37.6	26%	0.256	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-29.1	179.7	0	0	0	0	0	115.4	E741 R769	E741-A745 WeakPolarHBondContact O-CB 3.34Å; A745-R769 VanDerWaalsContact CB-NH2 3.35Å
746	A	90.9	Very high	91.4	Very high	89 Å²	89	44.7 Å²	44.7	74%	0.736	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-27	178.9	0	0	0	0	0	113	D744	D744-A746 PolarHBondContact O-N 3.47Å
747	L	91.5	Very high	90.7	Very high	10 Å²	10	49.5 Å²	49.5	5%	0.052	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-14.1	-178.8	-166	70.2	0	0	0	112.4	L712 I716 D744 S749 E750 L751	L712-L747 HydrophobicContact CB-CD2 4.26Å; L712-L747 HydrophobicContact CD1-CD2 4.47Å; L712-L747 HydrophobicContact CD2-CD2 4.37Å; I716-L747 HydrophobicContact CB-CD1 4.11Å; I716-L747 HydrophobicContact CD1-CD1 4.34Å; D744-L747 PolarHBondContact O-N 3.46Å; L747-S749 VanDerWaalsContact C-N 3.33Å; L747-S749 PolarHBondContact O-N 2.95Å; L747-E750 PolarHBondContact O-N 3.32Å; L747-L751 VanDerWaalsContact O-CB 3.31Å; L747-L751 WeakPolarHBondContact O-CB 3.47Å; L747-L751 PolarHBondContact O-N 3.09Å
748	A	90.9	Very high	90	Very high	2 Å²	2	49.6 Å²	49.6	2%	0.017	27%	0.272	C	S	.	.	H	α-helix	trans	-56.8	-39.9	-168.9	0	0	0	0	0	114	Y739 V752 L766	Y739-A748 HydrophobicContact CE2-CB 4.1Å; A748-V752 WeakPolarHBondContact O-CG2 3.24Å; A748-V752 PolarHBondContact O-N 2.76Å; A748-V752 VanDerWaalsContact O-N 3.08Å; A748-L766 HydrophobicContact CB-CD2 4.32Å
749	S	89.9	Confident	89.4	Confident	61 Å²	61	56.4 Å²	56.4	43%	0.427	30%	0.304	S	S	.	.	H	α-helix	trans	-67.8	-48.7	179.3	46	0	0	0	0	112.4	L747 L751 V752 E753	L747-S749 VanDerWaalsContact C-N 3.33Å; L747-S749 PolarHBondContact O-N 2.95Å; S749-L751 VanDerWaalsContact C-N 3.29Å; S749-L751 PolarHBondContact O-N 2.92Å; S749-V752 PolarHBondContact O-N 3.44Å; S749-E753 PolarHBondContact O-N 2.89Å; S749-E753 VanDerWaalsContact O-N 3.11Å
750	E	89.5	Confident	89	Confident	85 Å²	85	57.8 Å²	57.8	40%	0.397	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-34.5	178	-63.5	175.6	-168.8	0	0	111.6	I716 L747 E753 T754	I716-E750 HydrophobicContact CB-CB 3.98Å; I716-E750 WeakPolarHBondContact CB-OE2 3.46Å; I716-E750 HydrophobicContact CD1-CB 4.26Å; I716-E750 HydrophobicContact CG1-CB 4.1Å; I716-E750 HydrophobicContact CG2-CB 4.3Å; I716-E750 WeakPolarHBondContact CG2-OE2 3.32Å; L747-E750 PolarHBondContact O-N 3.32Å; E750-E753 PolarHBondContact O-N 3.4Å; E750-T754 WeakPolarHBondContact O-CB 3.17Å; E750-T754 PolarHBondContact O-N 3.2Å; E750-T754 PolarHBondContact O-OG1 3.07Å
751	L	90.8	Very high	88.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-67	-42.2	175.5	-176	60.7	0	0	0	111.9	V610 L712 I716 Y719 L747 S749 T754 L755 L766	V610-L751 HydrophobicContact CG1-CD2 4.14Å; V610-L751 HydrophobicContact CG2-CD2 4.25Å; L712-L751 HydrophobicContact CD1-CD2 4.45Å; I716-L751 HydrophobicContact CD1-CB 4.43Å; I716-L751 HydrophobicContact CD1-CD1 4.4Å; Y719-L751 HydrophobicContact CD1-CD1 4.12Å; Y719-L751 HydrophobicContact CD2-CD1 4.35Å; Y719-L751 HydrophobicContact CE1-CD1 3.65Å; Y719-L751 HydrophobicContact CE2-CD1 3.88Å; Y719-L751 HydrophobicContact CG-CD1 4.45Å; L747-L751 VanDerWaalsContact O-CB 3.31Å; L747-L751 WeakPolarHBondContact O-CB 3.47Å; L747-L751 PolarHBondContact O-N 3.09Å; S749-L751 VanDerWaalsContact C-N 3.29Å; S749-L751 PolarHBondContact O-N 2.92Å; L751-T754 PolarHBondContact O-N 3.01Å; L751-L755 HydrophobicContact CD1-CG 4.49Å; L751-L755 HydrophobicContact CG-CD1 4.26Å; L751-L755 VanDerWaalsContact O-CG 3.28Å; L751-L755 WeakPolarHBondContact O-CG 3.44Å; L751-L755 PolarHBondContact O-N 3.29Å; L751-L766 HydrophobicContact CD2-CD1 4.08Å; L751-L766 HydrophobicContact CG-CD1 4.36Å
752	V	91.1	Very high	88.8	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.012	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-42.7	174.5	168.7	0	0	0	0	111.4	A748 S749 L755 R756 V762 L766	A748-V752 WeakPolarHBondContact O-CG2 3.24Å; A748-V752 PolarHBondContact O-N 2.76Å; A748-V752 VanDerWaalsContact O-N 3.08Å; S749-V752 PolarHBondContact O-N 3.44Å; V752-L755 PolarHBondContact O-N 3.17Å; V752-R756 VanDerWaalsContact O-CG 3.31Å; V752-R756 WeakPolarHBondContact O-CG 3.34Å; V752-R756 PolarHBondContact O-N 2.21Å; V752-R756 VanDerWaalsContact O-N 3.08Å; V752-V762 HydrophobicContact CB-CG1 4.48Å; V752-V762 HydrophobicContact CG1-CG1 4.07Å; V752-V762 HydrophobicContact CG2-CG1 3.93Å; V752-L766 HydrophobicContact CG2-CB 3.51Å; V752-L766 HydrophobicContact CG2-CD1 4.2Å; V752-L766 HydrophobicContact CG2-CG 4.45Å
753	E	88.1	Confident	88.9	Confident	125 Å²	125	56.9 Å²	56.9	58%	0.584	30%	0.302	S	S	*	.	H	α-helix	trans	-61.2	-46.5	176	-174	172	-175.3	0	0	111.2	S749 E750 L755 R756 L757	S749-E753 PolarHBondContact O-N 2.89Å; S749-E753 VanDerWaalsContact O-N 3.11Å; E750-E753 PolarHBondContact O-N 3.4Å; E753-L755 PolarHBondContact O-N 3.11Å; E753-R756 PolarHBondContact O-N 2.65Å; E753-L757 HydrophobicContact CG-CD1 4.02Å; E753-L757 VanDerWaalsContact O-CG 3.31Å; E753-L757 WeakPolarHBondContact O-CG 3.29Å; E753-L757 PolarHBondContact O-N 2.88Å
754	T	86.4	Confident	88.8	Confident	14 Å²	14	59.6 Å²	59.6	9%	0.086	31%	0.314	C	S	.	.	H	α-helix	trans	-61.4	-44.5	178.2	-58	0	0	0	0	112.4	A602 I716 Y719 V720 E750 L751 R756 L757 C758	A602-T754 HydrophobicContact CB-CG2 4.26Å; I716-T754 WeakPolarHBondContact CD1-OG1 3.41Å; I716-T754 VanDerWaalsContact CG1-OG1 3.23Å; I716-T754 WeakPolarHBondContact CG1-OG1 3.39Å; Y719-T754 HydrophobicContact CE1-CG2 4.42Å; V720-T754 HydrophobicContact CG2-CG2 4.19Å; E750-T754 WeakPolarHBondContact O-CB 3.17Å; E750-T754 PolarHBondContact O-N 3.2Å; E750-T754 PolarHBondContact O-OG1 3.07Å; L751-T754 PolarHBondContact O-N 3.01Å; T754-R756 PolarHBondContact O-N 2.95Å; T754-L757 PolarHBondContact O-N 2.85Å; T754-C758 PolarHBondContact O-N 2.92Å; T754-C758 PolarHBondContact O-SG 3.45Å; T754-C758 VanDerWaalsContact O-SG 3.37Å
755	L	89.4	Confident	88.6	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-62.4	-42.6	177.3	-70.9	168.7	0	0	0	111.7	Q608 V610 L751 V752 E753 C758 E759 Q760 V762 L766	Q608-L755 HydrophobicContact CB-CD2 3.66Å; Q608-L755 HydrophobicContact CG-CD2 4.5Å; V610-L755 HydrophobicContact CG2-CD1 4.03Å; V610-L755 HydrophobicContact CG2-CD2 4.49Å; L751-L755 HydrophobicContact CD1-CG 4.49Å; L751-L755 HydrophobicContact CG-CD1 4.26Å; L751-L755 VanDerWaalsContact O-CG 3.28Å; L751-L755 WeakPolarHBondContact O-CG 3.44Å; L751-L755 PolarHBondContact O-N 3.29Å; V752-L755 PolarHBondContact O-N 3.17Å; E753-L755 PolarHBondContact O-N 3.11Å; L755-C758 CarbonylContact O-C 3.38Å; L755-C758 PolarHBondContact O-N 3.34Å; L755-E759 PolarHBondContact O-N 3.07Å; L755-Q760 HydrophobicContact CB-CB 4.23Å; L755-Q760 HydrophobicContact CD2-CB 3.83Å; L755-Q760 HydrophobicContact CD2-CG 4.25Å; L755-Q760 WeakPolarHBondContact O-CB 3.45Å; L755-Q760 PolarHBondContact O-N 3.08Å; L755-V762 HydrophobicContact CB-CG2 4Å; L755-L766 HydrophobicContact CD1-CD1 4.16Å
756	R	88.6	Confident	88.5	Confident	150 Å²	150	60.3 Å²	60.3	57%	0.566	31%	0.311	S	S	*	.	H	α-helix	trans	-63.8	-44.9	176.8	-71.8	175.1	178.9	-176.6	0.2	112.3	V752 E753 T754 C758 E759 V762	V752-R756 VanDerWaalsContact O-CG 3.31Å; V752-R756 WeakPolarHBondContact O-CG 3.34Å; V752-R756 PolarHBondContact O-N 2.21Å; V752-R756 VanDerWaalsContact O-N 3.08Å; E753-R756 PolarHBondContact O-N 2.65Å; T754-R756 PolarHBondContact O-N 2.95Å; R756-C758 PolarHBondContact O-N 3.48Å; R756-E759 PolarHBondContact O-N 3.23Å; R756-E759 VanDerWaalsContact O-N 3.1Å; R756-V762 HydrophobicContact CG-CG2 3.8Å
757	L	82.9	Confident	87.8	Confident	101 Å²	101	57.8 Å²	57.8	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-61.2	-25.8	177	-73.2	169.5	0	0	0	113.1	E753 T754	E753-L757 HydrophobicContact CG-CD1 4.02Å; E753-L757 VanDerWaalsContact O-CG 3.31Å; E753-L757 WeakPolarHBondContact O-CG 3.29Å; E753-L757 PolarHBondContact O-N 2.88Å; T754-L757 PolarHBondContact O-N 2.85Å
758	C	81.1	Confident	86.6	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.014	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	11.4	178.2	-63.6	0	0	0	0	114	A602 T754 L755 R756 Q760	A602-C758 VanDerWaalsContact CB-SG 3.58Å; A602-C758 PolarHBondContact O-SG 2.92Å; T754-C758 PolarHBondContact O-N 2.92Å; T754-C758 PolarHBondContact O-SG 3.45Å; T754-C758 VanDerWaalsContact O-SG 3.37Å; L755-C758 CarbonylContact O-C 3.38Å; L755-C758 PolarHBondContact O-N 3.34Å; R756-C758 PolarHBondContact O-N 3.48Å; C758-Q760 HydrophobicContact CB-CG 3.84Å; C758-Q760 PolarHBondContact O-N 3.03Å; C758-Q760 PolarHBondContact O-NE2 3.34Å
759	E	84.8	Confident	85.1	Confident	144 Å²	144	65.5 Å²	65.5	67%	0.673	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	35.2	-179.7	-68	149.6	-157.9	0	0	113	K604 L755 R756	K604-E759 IonicContact NZ-OE1 3.31Å; K604-E759 PolarHBondContact NZ-OE1 3.49Å; K604-E759 IonicContact NZ-OE2 3.9Å; K604-E759 PolarHBondContact NZ-OE2 3.39Å; L755-E759 PolarHBondContact O-N 3.07Å; R756-E759 PolarHBondContact O-N 3.23Å; R756-E759 VanDerWaalsContact O-N 3.1Å
760	Q	87.7	Confident	83.4	Confident	35 Å²	35	64.8 Å²	64.8	16%	0.164	32%	0.318	C	S	.	.			trans	-96.1	151.8	178.8	-54.4	-61.8	-68.4	0	0	111.4	I606 Q608 L755 C758 V762	I606-Q760 PolarHBondContact O-OE1 2.9Å; Q608-Q760 HydrophobicContact CB-CG 4.07Å; Q608-Q760 HydrophobicContact CG-CG 4.39Å; L755-Q760 HydrophobicContact CB-CB 4.23Å; L755-Q760 HydrophobicContact CD2-CB 3.83Å; L755-Q760 HydrophobicContact CD2-CG 4.25Å; L755-Q760 WeakPolarHBondContact O-CB 3.45Å; L755-Q760 PolarHBondContact O-N 3.08Å; C758-Q760 HydrophobicContact CB-CG 3.84Å; C758-Q760 PolarHBondContact O-N 3.03Å; C758-Q760 PolarHBondContact O-NE2 3.34Å; Q760-V762 PolarHBondContact O-N 3.13Å
761	E	88.3	Confident	81.5	Confident	180 Å²	180	65.4 Å²	65.4	84%	0.841	32%	0.324	S	S	*	.			trans	-62.3	129.4	171.9	-65.7	-174.8	166.6	0	0	110.4	P763	E761-P763 WeakPolarHBondContact O-CD 3.43Å
762	V	90.5	Very high	79.2	Confident	34 Å²	34	67 Å²	67	21%	0.206	34%	0.341	C	S	.	.			trans	-98.8	115.1	177.1	-177.7	0	0	0	0	109	V752 L755 R756 Q760 L766 T767	V752-V762 HydrophobicContact CB-CG1 4.48Å; V752-V762 HydrophobicContact CG1-CG1 4.07Å; V752-V762 HydrophobicContact CG2-CG1 3.93Å; L755-V762 HydrophobicContact CB-CG2 4Å; R756-V762 HydrophobicContact CG-CG2 3.8Å; Q760-V762 PolarHBondContact O-N 3.13Å; V762-L766 HydrophobicContact CG1-CB 4.48Å; V762-T767 WeakPolarHBondContact CG1-OG1 3.28Å
763	P	90.8	Very high	77	Confident	32 Å²	32	74.7 Å²	74.7	21%	0.208	37%	0.374	C	S	.	.			trans	-63.4	140.1	177.8	-25.2	35.4	0	0	0	113.7	V610 E761 F765 L766 T767	V610-P763 HydrophobicContact CB-CG 4.37Å; E761-P763 WeakPolarHBondContact O-CD 3.43Å; P763-F765 HydrophobicContact CB-CD1 3.49Å; P763-F765 VanDerWaalsContact CB-CD1 3.49Å; P763-F765 HydrophobicContact CB-CE1 3.17Å; P763-F765 HydrophobicContact CB-CG 4.41Å; P763-F765 HydrophobicContact CB-CZ 3.89Å; P763-F765 HydrophobicContact CG-CE1 3.85Å; P763-F765 HydrophobicContact CG-CZ 4.23Å; P763-F765 PolarHBondContact O-N 3.12Å; P763-F765 VanDerWaalsContact O-N 3.08Å; P763-L766 PolarHBondContact O-N 2.95Å; P763-T767 PolarHBondContact O-N 2.97Å
764	D	89	Confident	74.9	Confident	139 Å²	139	70.9 Å²	70.9	74%	0.743	36%	0.364	S	S	*	.	H	α-helix	trans	-54.6	-32.6	-176.7	-61.2	-33.8	0	0	0	114.3	L766 T767 S768	D764-L766 PolarHBondContact O-N 3.49Å; D764-T767 PolarHBondContact O-N 3.37Å; D764-S768 WeakPolarHBondContact O-CB 3.32Å; D764-S768 PolarHBondContact O-N 3.11Å; D764-S768 PolarHBondContact O-OG 3.32Å
765	F	89	Confident	72.8	Confident	60 Å²	60	73.8 Å²	73.8	26%	0.263	38%	0.382	S	S	.	.	H	α-helix	trans	-67.3	-19.9	179.1	71.2	-97.3	0	0	0	113.4	V610 P612 Y739 P763	V610-F765 HydrophobicContact CB-CZ 4.42Å; V610-F765 HydrophobicContact CG1-CE2 4.48Å; V610-F765 HydrophobicContact CG1-CZ 4.04Å; P612-F765 HydrophobicContact CB-CD1 4.3Å; P612-F765 HydrophobicContact CB-CD2 4.33Å; P612-F765 HydrophobicContact CB-CE1 4.19Å; P612-F765 HydrophobicContact CB-CE2 4.22Å; P612-F765 HydrophobicContact CB-CG 4.37Å; P612-F765 HydrophobicContact CB-CZ 4.16Å; P612-F765 VanDerWaalsContact CD-CE1 3.47Å; P612-F765 HydrophobicContact CG-CD1 3.96Å; P612-F765 HydrophobicContact CG-CE1 3.84Å; P612-F765 HydrophobicContact CG-CG 4.48Å; P612-F765 HydrophobicContact CG-CZ 4.26Å; Y739-F765 HydrophobicContact CD1-CD2 4.01Å; Y739-F765 AromaticContact CD1-CE2 3.57Å; Y739-F765 HydrophobicContact CD1-CE2 3.57Å; Y739-F765 HydrophobicContact CE1-CD2 4.22Å; Y739-F765 HydrophobicContact CE1-CE2 4.17Å; Y739-F765 AromaticContact CG-CE2 3.92Å; Y739-F765 HydrophobicContact CG-CE2 3.92Å; P763-F765 HydrophobicContact CB-CD1 3.49Å; P763-F765 VanDerWaalsContact CB-CD1 3.49Å; P763-F765 HydrophobicContact CB-CE1 3.17Å; P763-F765 HydrophobicContact CB-CG 4.41Å; P763-F765 HydrophobicContact CB-CZ 3.89Å; P763-F765 HydrophobicContact CG-CE1 3.85Å; P763-F765 HydrophobicContact CG-CZ 4.23Å; P763-F765 PolarHBondContact O-N 3.12Å; P763-F765 VanDerWaalsContact O-N 3.08Å
766	L	86.9	Confident	70.5	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-86.4	-43	170.9	-62.5	179.6	0	0	0	111.3	V610 Y739 A748 L751 V752 L755 V762 P763 D764 R769	V610-L766 HydrophobicContact CG1-CD1 4.39Å; Y739-L766 HydrophobicContact CD1-CD2 4.42Å; Y739-L766 HydrophobicContact CD2-CD2 4Å; Y739-L766 HydrophobicContact CE1-CD2 4.24Å; Y739-L766 HydrophobicContact CE2-CD2 3.81Å; Y739-L766 HydrophobicContact CG-CD2 4.31Å; A748-L766 HydrophobicContact CB-CD2 4.32Å; L751-L766 HydrophobicContact CD2-CD1 4.08Å; L751-L766 HydrophobicContact CG-CD1 4.36Å; V752-L766 HydrophobicContact CG2-CB 3.51Å; V752-L766 HydrophobicContact CG2-CD1 4.2Å; V752-L766 HydrophobicContact CG2-CG 4.45Å; L755-L766 HydrophobicContact CD1-CD1 4.16Å; V762-L766 HydrophobicContact CG1-CB 4.48Å; P763-L766 PolarHBondContact O-N 2.95Å; D764-L766 PolarHBondContact O-N 3.49Å; L766-R769 PolarHBondContact O-N 3Å
767	T	77	Confident	68.5	Low	36 Å²	36	77 Å²	77	22%	0.221	40%	0.403	C	S	.	.	H	α-helix	trans	-64.2	-46.3	-176.8	-55.8	0	0	0	0	112.3	V762 P763 D764 R769 N770 D771	V762-T767 WeakPolarHBondContact CG1-OG1 3.28Å; P763-T767 PolarHBondContact O-N 2.97Å; D764-T767 PolarHBondContact O-N 3.37Å; T767-R769 PolarHBondContact O-N 2.97Å; T767-N770 PolarHBondContact O-N 3.14Å; T767-D771 PolarHBondContact O-N 3.1Å
768	S	65.9	Low	66.8	Low	80 Å²	80	78.2 Å²	78.2	56%	0.559	41%	0.406	S	S	*	.	H	α-helix	trans	-55.4	-23.4	-179.3	51.1	0	0	0	0	114.7	D764	D764-S768 WeakPolarHBondContact O-CB 3.32Å; D764-S768 PolarHBondContact O-N 3.11Å; D764-S768 PolarHBondContact O-OG 3.32Å
769	R	58.3	Low	65.1	Low	94 Å²	94	83.6 Å²	83.6	36%	0.355	43%	0.431	S	S	.	.	H	α-helix	trans	-83.7	-32.9	177.1	-162.3	178.6	-170	105.7	-6	113.2	E741 A745 L766 T767 G772 F773	E741-R769 IonicContact OE1-CZ 3.75Å; E741-R769 IonicContact OE1-NH1 3.02Å; E741-R769 PolarHBondContact OE1-NH1 2.9Å; A745-R769 VanDerWaalsContact CB-NH2 3.35Å; L766-R769 PolarHBondContact O-N 3Å; T767-R769 PolarHBondContact O-N 2.97Å; R769-G772 PolarHBondContact O-N 3.49Å; R769-F773 PolarHBondContact O-N 2.84Å; R769-F773 VanDerWaalsContact O-N 3.13Å
770	N	54.6	Low	63.5	Low	47 Å²	47	81.6 Å²	81.6	25%	0.251	42%	0.421	S	S	.	.	H	α-helix	trans	-68.6	-41.3	177.7	-78.4	-14.5	0	0	0	111.1	T767 G772 F773 A774	T767-N770 PolarHBondContact O-N 3.14Å; N770-G772 VanDerWaalsContact C-N 3.27Å; N770-G772 PolarHBondContact O-N 3.35Å; N770-F773 PolarHBondContact O-N 2.82Å; N770-F773 VanDerWaalsContact O-N 3.1Å; N770-A774 PolarHBondContact O-N 2.97Å
771	D	49.5	Very low	61.7	Low	98 Å²	98	86.6 Å²	86.6	52%	0.524	45%	0.445	S	S	.	.	H	α-helix	trans	-63.7	-35.3	174.5	-62.2	-27.2	0	0	0	111.5	T767 F773 A774 T775	T767-D771 PolarHBondContact O-N 3.1Å; D771-F773 VanDerWaalsContact C-N 3.34Å; D771-F773 PolarHBondContact O-N 2.94Å; D771-A774 PolarHBondContact O-N 3.26Å; D771-T775 WeakPolarHBondContact O-CB 3.43Å; D771-T775 WeakPolarHBondContact O-CG2 3.37Å; D771-T775 PolarHBondContact O-N 2.89Å; D771-T775 PolarHBondContact O-OG1 3.24Å
772	G	43.8	Very low	59.9	Low	34 Å²	34	84.1 Å²	84.1	35%	0.351	43%	0.433	S	S	.	.	H	α-helix	trans	-63.8	-32.7	172.4	0	0	0	0	0	114.1	R769 N770 T775 R776	R769-G772 PolarHBondContact O-N 3.49Å; N770-G772 VanDerWaalsContact C-N 3.27Å; N770-G772 PolarHBondContact O-N 3.35Å; G772-T775 WeakPolarHBondContact CA-OG1 3.43Å; G772-T775 PolarHBondContact O-OG1 3.06Å; G772-R776 WeakPolarHBondContact O-CB 3.36Å; G772-R776 PolarHBondContact O-N 2.91Å; G772-R776 VanDerWaalsContact O-N 3.13Å
773	F	44.7	Very low	58	Low	162 Å²	162	86.3 Å²	86.3	71%	0.711	44%	0.443	S	S	*	.	H	α-helix	trans	-80.9	-36.6	176.7	-133.6	-87.6	0	0	0	112.2	R769 N770 D771 S777	R769-F773 PolarHBondContact O-N 2.84Å; R769-F773 VanDerWaalsContact O-N 3.13Å; N770-F773 PolarHBondContact O-N 2.82Å; N770-F773 VanDerWaalsContact O-N 3.1Å; D771-F773 VanDerWaalsContact C-N 3.34Å; D771-F773 PolarHBondContact O-N 2.94Å; F773-S777 WeakPolarHBondContact O-CB 3.48Å; F773-S777 PolarHBondContact O-N 2.88Å; F773-S777 PolarHBondContact O-OG 2.84Å
774	A	42.7	Very low	56.1	Low	46 Å²	46	89.9 Å²	89.9	38%	0.38	46%	0.461	S	S	.	.	H	α-helix	trans	-64	-46.1	173.3	0	0	0	0	0	111.7	N770 D771 S777 Q778	N770-A774 PolarHBondContact O-N 2.97Å; D771-A774 PolarHBondContact O-N 3.26Å; A774-S777 PolarHBondContact O-OG 3.02Å; A774-S777 VanDerWaalsContact O-OG 3.1Å; A774-Q778 WeakPolarHBondContact O-CG 3.4Å; A774-Q778 PolarHBondContact O-N 3.18Å; A774-Q778 VanDerWaalsContact O-N 3.1Å
775	T	42.5	Very low	54.2	Low	75 Å²	75	92.6 Å²	92.6	46%	0.46	46%	0.462	S	S	.	.	H	α-helix	trans	-67.9	-38.8	177	48.6	0	0	0	0	112.6	D771 G772 Q778 Q779	D771-T775 WeakPolarHBondContact O-CB 3.43Å; D771-T775 WeakPolarHBondContact O-CG2 3.37Å; D771-T775 PolarHBondContact O-N 2.89Å; D771-T775 PolarHBondContact O-OG1 3.24Å; G772-T775 WeakPolarHBondContact CA-OG1 3.43Å; G772-T775 PolarHBondContact O-OG1 3.06Å; T775-Q778 PolarHBondContact O-N 2.98Å; T775-Q779 WeakPolarHBondContact O-CB 2.75Å; T775-Q779 WeakPolarHBondContact O-CG 3.45Å; T775-Q779 PolarHBondContact O-N 3.07Å
776	R	42.8	Very low	52.3	Low	162 Å²	162	93.8 Å²	93.8	61%	0.611	48%	0.478	S	S	*	.	H	α-helix	trans	-73.9	-28.9	179.4	-162.9	174.4	-171.4	171.4	5.8	113.9	G772 H780	G772-R776 WeakPolarHBondContact O-CB 3.36Å; G772-R776 PolarHBondContact O-N 2.91Å; G772-R776 VanDerWaalsContact O-N 3.13Å; R776-H780 WeakPolarHBondContact O-CB 3.45Å; R776-H780 PolarHBondContact O-CD2 3.48Å; R776-H780 PolarHBondContact O-N 3.4Å
777	S	45.3	Very low	50.5	Low	57 Å²	57	101.4 Å²	101.4	40%	0.399	51%	0.513	S	S	.	.	H	α-helix	trans	-74.8	-34.7	171.3	50.5	0	0	0	0	112.2	F773 A774 Q781	F773-S777 WeakPolarHBondContact O-CB 3.48Å; F773-S777 PolarHBondContact O-N 2.88Å; F773-S777 PolarHBondContact O-OG 2.84Å; A774-S777 PolarHBondContact O-OG 3.02Å; A774-S777 VanDerWaalsContact O-OG 3.1Å; S777-Q781 WeakPolarHBondContact O-CG 3.1Å; S777-Q781 PolarHBondContact O-N 3.44Å
778	Q	47.8	Very low	49	Very low	125 Å²	125	107.8 Å²	107.8	58%	0.584	54%	0.541	S	S	*	.	H	α-helix	trans	-65.9	-40.9	168.6	-71.5	179.6	24.2	0	0	112.4	A774 T775 Q781 Q782	A774-Q778 WeakPolarHBondContact O-CG 3.4Å; A774-Q778 PolarHBondContact O-N 3.18Å; A774-Q778 VanDerWaalsContact O-N 3.1Å; T775-Q778 PolarHBondContact O-N 2.98Å; Q778-Q781 PolarHBondContact O-N 3.09Å; Q778-Q782 WeakPolarHBondContact O-CB 3.47Å; Q778-Q782 PolarHBondContact O-N 2.91Å
779	Q	45.9	Very low	47.9	Very low	115 Å²	115	108.9 Å²	108.9	54%	0.537	55%	0.548	S	S	.	.	H	α-helix	trans	-64.1	-45	174	-77	176.4	-6	0	0	112	T775 Q781 Q782 D783	T775-Q779 WeakPolarHBondContact O-CB 2.75Å; T775-Q779 WeakPolarHBondContact O-CG 3.45Å; T775-Q779 PolarHBondContact O-N 3.07Å; Q779-Q781 VanDerWaalsContact C-N 3.3Å; Q779-Q781 PolarHBondContact O-N 3.5Å; Q779-Q782 PolarHBondContact O-N 3.11Å; Q779-D783 WeakPolarHBondContact O-CB 3.47Å; Q779-D783 VanDerWaalsContact O-CG 3.27Å; Q779-D783 PolarHBondContact O-N 3.3Å
780	H	49.9	Very low	47	Very low	103 Å²	103	107.7 Å²	107.7	48%	0.477	57%	0.565	S	S	.	*	H	α-helix	trans	-67.2	-26.1	176	-82.3	-50.2	0	0	0	114.2	R776 N784	R776-H780 WeakPolarHBondContact O-CB 3.45Å; R776-H780 PolarHBondContact O-CD2 3.48Å; R776-H780 PolarHBondContact O-N 3.4Å; H780-N784 PolarHBondContact O-N 3.44Å
781	Q	50.4	Low	46.1	Very low	140 Å²	140	114.7 Å²	114.7	65%	0.654	59%	0.593	S	S	*	*	H	α-helix	trans	-75.6	-39.8	169.5	-74.6	-176	2.1	0	0	112.2	S777 Q778 Q779 Y785	S777-Q781 WeakPolarHBondContact O-CG 3.1Å; S777-Q781 PolarHBondContact O-N 3.44Å; Q778-Q781 PolarHBondContact O-N 3.09Å; Q779-Q781 VanDerWaalsContact C-N 3.3Å; Q779-Q781 PolarHBondContact O-N 3.5Å; Q781-Y785 WeakPolarHBondContact O-CD2 3.49Å; Q781-Y785 PolarHBondContact O-N 3.41Å
782	Q	50.9	Low	45.3	Very low	128 Å²	128	116.6 Å²	116.6	60%	0.598	61%	0.609	S	S	*	*	H	α-helix	trans	-69	-38.1	175.4	-77.6	-175.8	-7.5	0	0	112.9	Q778 Q779 N784 Y785 S786	Q778-Q782 WeakPolarHBondContact O-CB 3.47Å; Q778-Q782 PolarHBondContact O-N 2.91Å; Q779-Q782 PolarHBondContact O-N 3.11Å; Q782-N784 PolarHBondContact O-N 3.5Å; Q782-Y785 PolarHBondContact O-N 3.19Å; Q782-S786 WeakPolarHBondContact O-CB 3.48Å; Q782-S786 PolarHBondContact O-N 3.28Å; Q782-S786 PolarHBondContact O-OG 3.31Å
783	D	49.6	Very low	44.9	Very low	79 Å²	79	122.6 Å²	122.6	42%	0.422	63%	0.632	S	S	.	*	H	α-helix	trans	-65.3	-39	177.7	-74.2	-25	0	0	0	111.5	Q779 S786 Q787	Q779-D783 WeakPolarHBondContact O-CB 3.47Å; Q779-D783 VanDerWaalsContact O-CG 3.27Å; Q779-D783 PolarHBondContact O-N 3.3Å; D783-S786 PolarHBondContact O-N 3.29Å; D783-Q787 WeakPolarHBondContact O-CG 3.47Å; D783-Q787 PolarHBondContact O-N 3.27Å
784	N	51.4	Low	44.4	Very low	107 Å²	107	119.9 Å²	119.9	57%	0.572	63%	0.634	S	S	*	*	H	α-helix	trans	-69.9	-43.1	174.4	-77.6	-6.9	0	0	0	112.1	H780 Q782 S786 Q787 E788	H780-N784 PolarHBondContact O-N 3.44Å; Q782-N784 PolarHBondContact O-N 3.5Å; N784-S786 PolarHBondContact O-N 3.26Å; N784-Q787 PolarHBondContact O-N 3.37Å; N784-E788 PolarHBondContact O-N 3.35Å
785	Y	49.5	Very low	44.1	Very low	197 Å²	197	127.8 Å²	127.8	77%	0.773	66%	0.66	S	S	*	*	H	α-helix	trans	-65.9	-25.4	174.1	-95.7	-91.6	0	0	0	113.5	Q781 Q782 S789	Q781-Y785 WeakPolarHBondContact O-CD2 3.49Å; Q781-Y785 PolarHBondContact O-N 3.41Å; Q782-Y785 PolarHBondContact O-N 3.19Å; Y785-S789 PolarHBondContact O-OG 3.32Å
786	S	49.3	Very low	43.8	Very low	85 Å²	85	131 Å²	131	59%	0.594	67%	0.674	S	S	*	*	H	α-helix	trans	-85.9	-14.2	179.7	-57.3	0	0	0	0	113.9	Q782 D783 N784	Q782-S786 WeakPolarHBondContact O-CB 3.48Å; Q782-S786 PolarHBondContact O-N 3.28Å; Q782-S786 PolarHBondContact O-OG 3.31Å; D783-S786 PolarHBondContact O-N 3.29Å; N784-S786 PolarHBondContact O-N 3.26Å
787	Q	48.5	Very low	43.6	Very low	160 Å²	160	128.2 Å²	128.2	75%	0.748	67%	0.672	S	S	*	*	H	α-helix	trans	-101.3	-25.1	177.6	-70.2	-174.2	35.7	0	0	114	D783 N784	D783-Q787 WeakPolarHBondContact O-CG 3.47Å; D783-Q787 PolarHBondContact O-N 3.27Å; N784-Q787 PolarHBondContact O-N 3.37Å
788	E	44.9	Very low	43.1	Very low	170 Å²	170	135.3 Å²	135.3	79%	0.794	69%	0.689	S	S	*	*	H	α-helix	trans	-82.5	-12.7	177.7	-76.1	-168.8	134.3	0	0	114.8	N784 G790	N784-E788 PolarHBondContact O-N 3.35Å; E788-G790 PolarHBondContact O-N 3.32Å
789	S	43.3	Very low	42.6	Very low	103 Å²	103	140.7 Å²	140.7	72%	0.72	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	5.6	179.8	48	0	0	0	0	115	Y785	Y785-S789 PolarHBondContact O-OG 3.32Å
790	G	38.8	Very low	42.2	Very low	68 Å²	68	139.3 Å²	139.3	70%	0.701	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-9.2	-173	0	0	0	0	0	117.8	E788	E788-G790 PolarHBondContact O-N 3.32Å
791	F	36.7	Very low	41.8	Very low	194 Å²	194	140.7 Å²	140.7	85%	0.851	72%	0.719	S	S	*	*			trans	-149.7	62.4	-165.5	-160.1	-99.5	0	0	0	116.6
792	V	33.7	Very low	41.5	Very low	139 Å²	139	140.9 Å²	140.9	84%	0.842	72%	0.724	S	S	*	*			trans	-144.1	117.6	150.8	-163.8	0	0	0	0	111
793	N	33.5	Very low	41	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	74%	0.737	S	S	*	*			trans	-150	135	160	-121.9	-25.2	0	0	0	108.8
794	S	35	Very low	40.6	Very low	106 Å²	106	145.3 Å²	145.3	74%	0.741	74%	0.742	S	S	*	*			trans	64.8	103.6	-169.6	70.7	0	0	0	0	116.2
795	F	35.7	Very low	40.1	Very low	212 Å²	212	149.8 Å²	149.8	93%	0.93	75%	0.751	S	S	*	*				-157.8	148.1	108.1	-123.9	-92.6	0	0	0	110.8
796	D	37.7	Very low	39.5	Very low	142 Å²	142	145.8 Å²	145.8	76%	0.759	75%	0.748	S	S	*	*			trans	-93.8	164.8	-164.1	-114.2	-42	0	0	0	115.1
797	D	37.9	Very low	38.9	Very low	104 Å²	104	148.9 Å²	148.9	56%	0.556	76%	0.763	S	S	*	*			trans	71.8	111	145.8	-87.9	-35.8	0	0	0	123.2
798	R	35.3	Very low	38.4	Very low	205 Å²	205	147.6 Å²	147.6	77%	0.774	77%	0.766	S	S	*	*				99	134	122	-71.8	167.5	-155.5	-178.9	19.3	122.4
799	R	35.8	Very low	37.9	Very low	239 Å²	239	145.4 Å²	145.4	90%	0.902	77%	0.765	S	S	*	*			trans	81.4	137.5	163.8	-64.4	173	176.2	167.2	-1.8	116.8
800	S	38.4	Very low	37.5	Very low	85 Å²	85	146.1 Å²	146.1	59%	0.594	77%	0.765	S	S	*	*			cis	168.9	144.5	-36.4	52.6	0	0	0	0	106.7
801	D	42.4	Very low	37.5	Very low	133 Å²	133	151.1 Å²	151.1	71%	0.711	77%	0.767	S	S	*	*			trans	86.7	107.7	155.6	-42.6	-36.6	0	0	0	120.3
802	D	44.1	Very low	37.5	Very low	144 Å²	144	150.2 Å²	150.2	77%	0.77	77%	0.765	S	S	*	*			trans	60.8	124.7	136.1	-51.4	-19.7	0	0	0	120.8
803	F	39	Very low	37.7	Very low	199 Å²	199	152.3 Å²	152.3	87%	0.873	76%	0.763	S	S	*	*				-158.1	151.1	60.8	-145	-99.5	0	0	0	114.8
804	D	42.5	Very low	38	Very low	100 Å²	100	153 Å²	153	54%	0.535	76%	0.761	S	S	.	*			trans	-41.7	169	165.8	-85.3	-13.2	0	0	0	116.1
805	R	40.7	Very low	38.1	Very low	201 Å²	201	156.9 Å²	156.9	76%	0.758	77%	0.768	S	S	*	*			cis	-177.2	170.6	-9	-100	171.9	173.1	139.6	-6.9	105.8
806	T	36.9	Very low	38.4	Very low	113 Å²	113	152.6 Å²	152.6	69%	0.693	76%	0.759	S	S	*	*			cis	-161.6	154.8	-10	19.7	0	0	0	0	107.1
807	T	35.7	Very low	38.3	Very low	150 Å²	150	152 Å²	152	92%	0.92	76%	0.76	S	S	*	*			trans	-137.7	134.4	162.5	15.2	0	0	0	0	110.4
808	V	39.4	Very low	38.3	Very low	134 Å²	134	153.8 Å²	153.8	81%	0.812	77%	0.77	S	S	*	*			trans	-116.3	126	-176.6	174.5	0	0	0	0	110
809	T	32.6	Very low	38.2	Very low	124 Å²	124	153.3 Å²	153.3	76%	0.761	78%	0.776	S	S	*	*			trans	-88.4	150.1	169.3	47.4	0	0	0	0	110.8
810	T	35.7	Very low	38.2	Very low	118 Å²	118	149.7 Å²	149.7	72%	0.724	77%	0.774	S	S	*	*			trans	-177.9	139.6	135	26.9	0	0	0	0	115
811	K	39.4	Very low	38.1	Very low	172 Å²	172	154.4 Å²	154.4	75%	0.748	79%	0.786	S	S	*	*			trans	77.6	103	138.7	-69.8	168.2	-177.7	-176.8	0	122.5
812	E	35.3	Very low	37.6	Very low	175 Å²	175	156.5 Å²	156.5	82%	0.818	80%	0.796	S	S	*	*				36.6	125.7	108.9	-61.9	171.2	150.7	0	0	120.7
813	K	39.1	Very low	37.2	Very low	184 Å²	184	158.9 Å²	158.9	80%	0.8	80%	0.803	S	S	*	*			trans	-169.8	113.7	134.6	-104.1	175.3	174.6	-169.1	0	109.2
814	E	40	Very low	36.9	Very low	172 Å²	172	156.3 Å²	156.3	80%	0.804	80%	0.798	S	S	*	*				76.1	113	95.2	-76.7	-175.9	145.2	0	0	113.9
815	E	37.3	Very low	36.5	Very low	188 Å²	188	159.6 Å²	159.6	88%	0.879	82%	0.816	S	S	*	*			trans	-72.1	144.8	170.1	-68.1	173.1	122.6	0	0	111.1
816	V	40.4	Very low	35.8	Very low	122 Å²	122	153.4 Å²	153.4	74%	0.739	81%	0.814	S	S	*	*			trans	-130.7	115.2	160.3	179	0	0	0	0	107.7
817	T	36.1	Very low	35.3	Very low	130 Å²	130	163.9 Å²	163.9	80%	0.798	84%	0.841	S	S	*	*			trans	-93.5	122.1	166.9	50.6	0	0	0	0	108.7
818	D	37.9	Very low	35.3	Very low	142 Å²	142	164.6 Å²	164.6	76%	0.759	84%	0.837	S	S	*	*			trans	-118	122.1	166	-82.4	-41	0	0	0	109.7
819	E	32.8	Very low	35.1	Very low	194 Å²	194	166.2 Å²	166.2	91%	0.907	84%	0.839	S	S	*	*			trans	-74.4	130.6	166.7	-60.1	174.2	135.3	0	0	108.7
820	I	36.9	Very low	35.2	Very low	164 Å²	164	168.5 Å²	168.5	84%	0.841	84%	0.843	S	S	*	*			trans	-131.6	130.7	161	-61.7	-175.3	0	0	0	108.9
821	E	37.1	Very low	35.2	Very low	184 Å²	184	171.5 Å²	171.5	86%	0.86	85%	0.85	S	S	*	*			trans	-75.9	164	-168.9	-61.8	175.4	119	0	0	113.7
822	L	31.6	Very low	34.9	Very low	176 Å²	176	171.4 Å²	171.4	92%	0.921	86%	0.856	S	S	*	*			trans	-64.6	133.6	168.3	-70	145.4	0	0	0	110.8
823	E	35	Very low	34.9	Very low	194 Å²	194	171.2 Å²	171.2	91%	0.907	86%	0.859	S	S	*	*			trans	-152.5	151	143.3	-122.3	175.2	-150.2	0	0	111.6
824	D	33.4	Very low	34.6	Very low	146 Å²	146	170.3 Å²	170.3	78%	0.781	86%	0.863	S	S	*	*			trans	-61.4	149.9	-174	-65.7	-64.5	0	0	0	113.1
825	N	33.1	Very low	34.2	Very low	169 Å²	169	170.2 Å²	170.2	90%	0.904	87%	0.868	S	S	*	*				178.4	133.2	121	-91	-60.9	0	0	0	109.7
826	G	26.8	Very low	34	Very low	70 Å²	70	168.7 Å²	168.7	72%	0.722	87%	0.867	S	S	*	*			trans	-86	160.8	-163.5	0	0	0	0	0	116.5
827	W	26.5	Very low	33.4	Very low	333 Å²	333	172.9 Å²	172.9	100%	1.261	88%	0.878	S	S	*	*			trans	-146.3	0	138.3	-96.7	94.3	0	0	0	108.9

Retrieved 827 of 827 residues in 506.8 ms (Link to these results)

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