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G protein-activated inward rectifier potassium channel 2

Inward rectifier potassium channels are characterized by a greater tendency to allow potassium to flow into the cell rather than out of it. Their voltage dependence is regulated by the concentration of extracellular potassium; as external potassium is raised, the voltage range of the channel opening shifts to more positive voltages. The inward rectification is mainly due to the blockage of outward current by internal magnesium. This potassium channel may be involved in the regulation of insulin secretion by glucose and/or neurotransmitters acting through G-protein-coupled receptors.

AlphaFold DB , UniProt , Accession P48051, Species HUMAN (Homo sapiens, Human), Gene KCNJ6, Length 423 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.8	Very low	40.5	Very low	208 Å²	208	111.1 Å²	111.1	100%	1.025	60%	0.602	S	S	*	*				0	-48.4	0	-72	-135.3	-162.8	0	0	112.8	K3 L4 T5	M1-K3 VanDerWaalsContact C-N 3.33Å; M1-K3 PolarHBondContact O-N 3.23Å; M1-L4 PolarHBondContact O-N 2.61Å; M1-L4 VanDerWaalsContact O-N 3.15Å; M1-T5 PolarHBondContact O-N 3.36Å; M1-T5 PolarHBondContact O-OG1 3.27Å
2	A	38.3	Very low	40.4	Very low	77 Å²	77	110.8 Å²	110.8	64%	0.636	60%	0.599	S	S	*	*	H	α-helix	trans	-55.6	-38.9	176.1	0	0	0	0	0	114.9	L4 T5 E6	A2-L4 PolarHBondContact O-N 2.88Å; A2-T5 PolarHBondContact O-OG1 3.26Å; A2-E6 PolarHBondContact O-N 2.87Å; A2-E6 VanDerWaalsContact O-N 3.16Å
3	K	38.7	Very low	40	Very low	175 Å²	175	114.5 Å²	114.5	76%	0.761	61%	0.61	S	S	*	*	H	α-helix	trans	-72.2	-21.7	178.2	-73.4	-174.6	174.6	-176.4	0	115.4	M1 S7	M1-K3 VanDerWaalsContact C-N 3.33Å; M1-K3 PolarHBondContact O-N 3.23Å; K3-S7 PolarHBondContact O-N 3.26Å
4	L	39.9	Very low	39.2	Very low	131 Å²	131	110.5 Å²	110.5	69%	0.686	61%	0.61	S	S	*	*	H	α-helix	trans	-81	-34.8	177.8	-92.6	150.7	0	0	0	111.1	M1 A2 M8	M1-L4 PolarHBondContact O-N 2.61Å; M1-L4 VanDerWaalsContact O-N 3.15Å; A2-L4 PolarHBondContact O-N 2.88Å; L4-M8 PolarHBondContact O-N 2.91Å
5	T	46.7	Very low	38.6	Very low	62 Å²	62	110.7 Å²	110.7	38%	0.38	61%	0.609	S	S	.	*	H	α-helix	trans	-68.9	-38.8	169.9	27.2	0	0	0	0	112.6	M1 A2 S7 M8 T9	M1-T5 PolarHBondContact O-N 3.36Å; M1-T5 PolarHBondContact O-OG1 3.27Å; A2-T5 PolarHBondContact O-OG1 3.26Å; T5-S7 VanDerWaalsContact C-N 3.31Å; T5-S7 PolarHBondContact O-N 3.12Å; T5-M8 PolarHBondContact O-N 3.03Å; T5-M8 VanDerWaalsContact O-N 3.13Å; T5-T9 PolarHBondContact O-N 2.96Å; T5-T9 VanDerWaalsContact O-N 3.13Å; T5-T9 PolarHBondContact O-OG1 2.96Å
6	E	38.5	Very low	38	Very low	117 Å²	117	111.7 Å²	111.7	55%	0.547	63%	0.627	S	S	.	*	H	α-helix	trans	-63.2	-36.4	175.7	-124.4	169.2	-176.8	0	0	112.2	A2 T9 N10	A2-E6 PolarHBondContact O-N 2.87Å; A2-E6 VanDerWaalsContact O-N 3.16Å; E6-T9 WeakPolarHBondContact CA-OG1 3.28Å; E6-T9 PolarHBondContact O-N 3.39Å; E6-T9 PolarHBondContact O-OG1 2.85Å; E6-N10 WeakPolarHBondContact O-CB 3.39Å; E6-N10 PolarHBondContact O-N 3.41Å
7	S	39.8	Very low	37.4	Very low	64 Å²	64	115.2 Å²	115.2	45%	0.448	64%	0.64	S	S	.	*	H	α-helix	trans	-67.8	-31.7	173.3	178	0	0	0	0	113	K3 T5 V11	K3-S7 PolarHBondContact O-N 3.26Å; T5-S7 VanDerWaalsContact C-N 3.31Å; T5-S7 PolarHBondContact O-N 3.12Å; S7-V11 WeakPolarHBondContact O-CB 3.43Å; S7-V11 WeakPolarHBondContact O-CG2 3.45Å; S7-V11 PolarHBondContact O-N 3.38Å
8	M	40.1	Very low	37.1	Very low	128 Å²	128	118.3 Å²	118.3	63%	0.631	66%	0.655	S	S	*	*	H	α-helix	trans	-77.8	-28.3	177.5	-71.3	-177.2	82.2	0	0	112.3	L4 T5	L4-M8 PolarHBondContact O-N 2.91Å; T5-M8 PolarHBondContact O-N 3.03Å; T5-M8 VanDerWaalsContact O-N 3.13Å
9	T	41.4	Very low	36.7	Very low	84 Å²	84	121.8 Å²	121.8	52%	0.515	67%	0.666	S	S	.	*	H	α-helix	trans	-75.1	-38.9	170.7	28.9	0	0	0	0	112.9	T5 E6 V11 L12	T5-T9 PolarHBondContact O-N 2.96Å; T5-T9 VanDerWaalsContact O-N 3.13Å; T5-T9 PolarHBondContact O-OG1 2.96Å; E6-T9 WeakPolarHBondContact CA-OG1 3.28Å; E6-T9 PolarHBondContact O-N 3.39Å; E6-T9 PolarHBondContact O-OG1 2.85Å; T9-V11 VanDerWaalsContact C-N 3.35Å; T9-V11 PolarHBondContact O-N 2.89Å; T9-L12 PolarHBondContact O-N 2.8Å
10	N	36.4	Very low	36.2	Very low	99 Å²	99	124 Å²	124	53%	0.529	68%	0.677	S	S	.	*	H	α-helix	trans	-76.1	-19.9	178.7	-71.5	-2.4	0	0	0	113.5	E6 L12 E13	E6-N10 WeakPolarHBondContact O-CB 3.39Å; E6-N10 PolarHBondContact O-N 3.41Å; N10-L12 VanDerWaalsContact C-N 3.27Å; N10-E13 PolarHBondContact O-N 2.91Å
11	V	41.5	Very low	36.3	Very low	77 Å²	77	124.4 Å²	124.4	47%	0.467	68%	0.683	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.6	-10	172.7	170.1	0	0	0	0	112.2	S7 T9 F91	S7-V11 WeakPolarHBondContact O-CB 3.43Å; S7-V11 WeakPolarHBondContact O-CG2 3.45Å; S7-V11 PolarHBondContact O-N 3.38Å; T9-V11 VanDerWaalsContact C-N 3.35Å; T9-V11 PolarHBondContact O-N 2.89Å; V11-F91 HydrophobicContact CG1-CE1 4.06Å; V11-F91 HydrophobicContact CG1-CZ 3.79Å
12	L	40	Very low	35.7	Very low	108 Å²	108	123.2 Å²	123.2	57%	0.565	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-11.2	167.8	-68.3	169.1	0	0	0	112.7	T9 N10	T9-L12 PolarHBondContact O-N 2.8Å; N10-L12 VanDerWaalsContact C-N 3.27Å
13	E	34.6	Very low	35.2	Very low	158 Å²	158	125.5 Å²	125.5	74%	0.738	69%	0.686	S	S	*	*	S	Bend	trans	-102.6	77.5	172.9	-75.7	-177.2	141	0	0	110.4	N10	N10-E13 PolarHBondContact O-N 2.91Å
14	G	29.1	Very low	35	Very low	59 Å²	59	122.8 Å²	122.8	61%	0.608	69%	0.686	S	S	*	*			trans	167.2	64.1	178.3	0	0	0	0	0	112.2
15	D	29.9	Very low	34.7	Very low	113 Å²	113	122.8 Å²	122.8	60%	0.604	69%	0.691	S	S	*	*			trans	-173.5	71.9	163.9	-98.2	-18.2	0	0	0	107.8	R90	D15-R90 IonicContact OD2-CZ 3.2Å; D15-R90 IonicContact OD2-NH1 2.73Å; D15-R90 IonicContact OD2-NH2 3.57Å; D15-R90 PolarHBondContact OD2-NH2 3.37Å
16	S	29.9	Very low	34.1	Very low	127 Å²	127	124.6 Å²	124.6	89%	0.888	71%	0.713	S	S	*	*			trans	-111.8	79.5	158	61.7	0	0	0	0	107
17	M	27.9	Very low	34.1	Very low	172 Å²	172	126.2 Å²	126.2	85%	0.847	72%	0.724	S	S	*	*			trans	-126.7	82.2	173	-158.6	166.1	83.8	0	0	107.1
18	D	32	Very low	33.8	Very low	170 Å²	170	132.2 Å²	132.2	91%	0.909	74%	0.744	S	S	*	*			trans	-142	81.2	162.7	-83.3	-38.5	0	0	0	106
19	Q	28.6	Very low	34.1	Very low	185 Å²	185	134.4 Å²	134.4	86%	0.864	75%	0.753	S	S	*	*			trans	-119	101.4	161.8	-84.5	-172.8	-12.6	0	0	105.6
20	D	27	Very low	33.9	Very low	166 Å²	166	136.1 Å²	136.1	89%	0.888	77%	0.766	S	S	*	*			trans	-163.3	77.7	163.1	-85.5	-35.4	0	0	0	109.4
21	V	37.9	Very low	34	Very low	132 Å²	132	141.5 Å²	141.5	80%	0.8	78%	0.784	S	S	*	*	S	Bend	trans	-145.4	102.9	157.8	-175.4	0	0	0	0	109.4
22	E	31.1	Very low	34.4	Very low	184 Å²	184	145.6 Å²	145.6	86%	0.86	80%	0.803	S	S	*	*			trans	45.5	110.5	149.3	-65.6	179.6	150	0	0	120.6
23	S	28.6	Very low	34.6	Very low	125 Å²	125	145.8 Å²	145.8	87%	0.874	81%	0.811	S	S	*	*			trans	-93.4	129.8	163.1	-64.2	0	0	0	0	111.4
24	P	34.8	Very low	35	Very low	118 Å²	118	148.6 Å²	148.6	77%	0.766	82%	0.82	S	S	*	*			trans	-99.5	116.1	158.4	27	-14.6	0	0	0	111.2
25	V	33.4	Very low	35.9	Very low	130 Å²	130	154.9 Å²	154.9	79%	0.788	83%	0.834	S	S	*	*			trans	30.9	104.3	146.9	-170	0	0	0	0	117.7
26	A	33.5	Very low	36.6	Very low	101 Å²	101	154.3 Å²	154.3	84%	0.835	84%	0.844	S	S	*	*			trans	-83.8	113.8	166	0	0	0	0	0	111.3
27	I	39	Very low	37.2	Very low	151 Å²	151	160 Å²	160	77%	0.774	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-80.1	121.8	168	-63.6	174.2	0	0	0	108.7	Q29	I27-Q29 PolarHBondContact O-N 3.33Å
28	H	33.8	Very low	38	Very low	189 Å²	189	159.3 Å²	159.3	88%	0.875	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-70	120.1	178.8	-125.4	33.4	0	0	0	111
29	Q	45.3	Very low	38.6	Very low	174 Å²	174	158.6 Å²	158.6	81%	0.813	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-99.9	143.7	165.8	-79.1	-172.5	-14.1	0	0	111.1	I27	I27-Q29 PolarHBondContact O-N 3.33Å
30	P	38.1	Very low	39.4	Very low	121 Å²	121	157.5 Å²	157.5	79%	0.786	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-78.1	140.1	-172.5	-0.1	18.4	0	0	0	111.3	L32	P30-L32 PolarHBondContact O-N 2.91Å
31	K	38.5	Very low	40	Very low	212 Å²	212	155.1 Å²	155.1	92%	0.922	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-74.3	119.5	177.8	-70.2	176	178.1	171.3	0	110.9
32	L	50.4	Low	40	Very low	162 Å²	162	160.3 Å²	160.3	85%	0.848	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-76.6	154.7	166.8	-95.4	108.6	0	0	0	112.4	P30	P30-L32 PolarHBondContact O-N 2.91Å
33	P	42.8	Very low	40.6	Very low	113 Å²	113	160.1 Å²	160.1	73%	0.734	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-77.4	152.2	-167.5	-7.6	25.7	0	0	0	114	Q35	P33-Q35 VanDerWaalsContact C-N 3.29Å; P33-Q35 PolarHBondContact O-N 3.38Å
34	K	42.9	Very low	41.3	Very low	216 Å²	216	161.3 Å²	161.3	94%	0.939	83%	0.834	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	26.2	-167.3	-78.3	-178.6	170.2	-179.8	0	117.3
35	Q	48.3	Very low	41.5	Very low	192 Å²	192	160.7 Å²	160.7	90%	0.897	83%	0.833	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.9	15.6	-169	-101.8	173.2	-20.2	0	0	117.2	P33	P33-Q35 VanDerWaalsContact C-N 3.29Å; P33-Q35 PolarHBondContact O-N 3.38Å
36	A	44.7	Very low	41.7	Very low	100 Å²	100	165 Å²	165	83%	0.826	84%	0.835	S	S	*	*	S	Bend	trans	-130.5	34.3	-177.6	0	0	0	0	0	114.5
37	R	42.5	Very low	41.9	Very low	246 Å²	246	167 Å²	167	93%	0.928	83%	0.831	S	S	*	*			trans	-117.1	10.9	-171.7	-109.7	-176.3	-176.3	172	1.8	116.8
38	D	44.9	Very low	41.9	Very low	158 Å²	158	170.1 Å²	170.1	85%	0.845	83%	0.834	S	S	*	*	S	Bend	trans	-98.7	2.3	-174.5	-77.4	-20.6	0	0	0	116.1
39	D	43.5	Very low	42.2	Very low	156 Å²	156	167.2 Å²	167.2	83%	0.834	83%	0.829	S	S	*	*			trans	-134.6	68.6	-177.8	-72	-49.8	0	0	0	113.7
40	L	46.9	Very low	42.2	Very low	161 Å²	161	168 Å²	168	84%	0.843	83%	0.83	S	S	*	*			trans	-150.5	133.3	158.9	-142.4	69.4	0	0	0	113.2	R42	L40-R42 PolarHBondContact O-N 2.92Å
41	P	40.1	Very low	42.6	Very low	116 Å²	116	173.7 Å²	173.7	75%	0.753	84%	0.836	S	S	*	*			trans	-69.5	131.2	-170.2	-8.7	25	0	0	0	110.5	H43	P41-H43 PolarHBondContact O-N 2.92Å
42	R	37.7	Very low	43.6	Very low	242 Å²	242	173 Å²	173	91%	0.913	83%	0.833	S	S	*	*			trans	-62.6	92.7	173	-79.3	178.3	173.5	166.1	-1.3	110.3	L40 I44	L40-R42 PolarHBondContact O-N 2.92Å; R42-I44 PolarHBondContact O-N 3.4Å; R42-I44 VanDerWaalsContact O-N 3.12Å
43	H	43.8	Very low	44.4	Very low	180 Å²	180	170.2 Å²	170.2	83%	0.833	82%	0.818	S	S	*	*			trans	-62.1	109.5	154.8	-111.3	-80.5	0	0	0	107.4	P41 S45	P41-H43 PolarHBondContact O-N 2.92Å; H43-S45 PolarHBondContact O-N 2.89Å
44	I	43	Very low	46.4	Very low	150 Å²	150	171.6 Å²	171.6	77%	0.769	81%	0.814	S	S	*	*			trans	-65.9	87.2	172.7	-63.7	169.1	0	0	0	106.9	R42 R46	R42-I44 PolarHBondContact O-N 3.4Å; R42-I44 VanDerWaalsContact O-N 3.12Å; I44-R46 VanDerWaalsContact C-N 3.28Å; I44-R46 PolarHBondContact O-N 3.4Å
45	S	39.3	Very low	48.7	Very low	105 Å²	105	163.5 Å²	163.5	73%	0.734	78%	0.778	S	S	*	*			trans	-66.6	95.4	161.4	40.1	0	0	0	0	106.9	H43 D47	H43-S45 PolarHBondContact O-N 2.89Å; S45-D47 PolarHBondContact O-N 3.36Å
46	R	37.5	Very low	50.9	Low	219 Å²	219	157.5 Å²	157.5	83%	0.826	75%	0.747	S	S	*	*			trans	-71.6	69.3	173.9	-150	176.4	-179	-178.6	0.9	107.9	I44 R48	I44-R46 VanDerWaalsContact C-N 3.28Å; I44-R46 PolarHBondContact O-N 3.4Å; R46-R48 VanDerWaalsContact C-N 3.31Å; R46-R48 PolarHBondContact O-N 2.87Å
47	D	37.6	Very low	53.3	Low	143 Å²	143	152.8 Å²	152.8	77%	0.765	71%	0.709	S	S	*	*			trans	-70.8	93.8	176.4	-145	-2.3	0	0	0	106.9	S45 T49	S45-D47 PolarHBondContact O-N 3.36Å; D47-T49 PolarHBondContact O-N 3.47Å
48	R	37.4	Very low	55.8	Low	218 Å²	218	147 Å²	147	82%	0.823	69%	0.687	S	S	*	*			trans	-60.4	91.5	169.3	-79.3	178.8	171.5	176.5	-2.6	106.1	R46 K50	R46-R48 VanDerWaalsContact C-N 3.31Å; R46-R48 PolarHBondContact O-N 2.87Å; R48-K50 PolarHBondContact O-N 3.37Å
49	T	40.3	Very low	58.2	Low	128 Å²	128	142.3 Å²	142.3	79%	0.785	66%	0.659	S	S	*	*			trans	-52.4	93.5	158.7	25.9	0	0	0	0	106.5	D47 R51	D47-T49 PolarHBondContact O-N 3.47Å; T49-R51 PolarHBondContact O-N 2.94Å
50	K	46	Very low	60.5	Low	191 Å²	191	139.2 Å²	139.2	83%	0.83	64%	0.642	S	S	*	*			trans	-52.5	105.8	172.6	-77.1	-177.4	177.1	-178.5	0	105.4	R48 K52	R48-K50 PolarHBondContact O-N 3.37Å; K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 3.07Å
51	R	47.3	Very low	62.7	Low	240 Å²	240	131.7 Å²	131.7	91%	0.906	60%	0.603	S	S	*	*			trans	-55.5	102.7	171.5	-80.2	-179.6	169.9	179.1	-3.9	105.6	T49 I53	T49-R51 PolarHBondContact O-N 2.94Å; R51-I53 PolarHBondContact O-N 2.9Å
52	K	58.5	Low	65.2	Low	198 Å²	198	132.2 Å²	132.2	86%	0.861	59%	0.594	S	S	*	*			trans	-63.4	106.6	172.7	-75.2	-175.6	177.9	-177.8	0	105.6	K50 Q54	K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 3.07Å; K52-Q54 PolarHBondContact O-N 2.9Å
53	I	67.2	Low	67.9	Low	103 Å²	103	123.7 Å²	123.7	53%	0.528	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-62.3	126.2	174.1	-68	174.1	0	0	0	107	R51 R55 E301	R51-I53 PolarHBondContact O-N 2.9Å; I53-R55 PolarHBondContact O-N 3.16Å; I53-E301 HydrophobicContact CD1-CB 3.88Å; I53-E301 HydrophobicContact CD1-CG 3.58Å; I53-E301 WeakPolarHBondContact CD1-OE1 3.3Å; I53-E301 WeakPolarHBondContact CD1-OE2 3.43Å
54	Q	84.5	Confident	70.2	Confident	141 Å²	141	117.1 Å²	117.1	66%	0.659	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-69.7	126.3	179.6	-174	67.5	16.3	0	0	108.6	K52 N64	K52-Q54 PolarHBondContact O-N 2.9Å; Q54-N64 PolarHBondContact NE2-ND2 3.14Å
55	R	92.4	Very high	72.6	Confident	46 Å²	46	112.5 Å²	112.5	17%	0.174	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-62.8	142.4	174.1	68.4	-164.6	-48.7	149.9	16	111.7	I53 V57 N64 E303 S324 I326 E329	I53-R55 PolarHBondContact O-N 3.16Å; R55-V57 WeakPolarHBondContact CD-O 3.37Å; R55-V57 VanDerWaalsContact CG-O 3.31Å; R55-V57 WeakPolarHBondContact CG-O 3.38Å; R55-V57 PolarHBondContact NE-O 3.37Å; R55-N64 PolarHBondContact O-ND2 3.3Å; R55-E303 WeakPolarHBondContact CA-OE2 3.33Å; R55-S324 PolarHBondContact NE-OG 3.46Å; R55-S324 PolarHBondContact NH2-O 3Å; R55-S324 PolarHBondContact NH2-OG 3.05Å; R55-I326 HydrophobicContact CB-CG2 3.88Å; R55-E329 IonicContact CZ-OE1 3.5Å; R55-E329 IonicContact CZ-OE2 2.87Å; R55-E329 IonicContact NH1-OE1 3.67Å; R55-E329 PolarHBondContact NH1-OE1 3.13Å; R55-E329 IonicContact NH1-OE2 2.75Å; R55-E329 IonicContact NH2-OE1 2.72Å; R55-E329 PolarHBondContact NH2-OE1 3.27Å; R55-E329 IonicContact NH2-OE2 3.54Å; R55-E329 PolarHBondContact NH2-OE2 3.43Å
56	Y	94.1	Very high	74.9	Confident	66 Å²	66	116.3 Å²	116.3	26%	0.259	53%	0.526	S	S	.	.	S	Bend	trans	-71.4	-43.3	176	-174.4	-113.8	0	0	0	111.5	N64 V65 I242 L255 E303	Y56-N64 PolarHBondContact O-N 2.76Å; Y56-V65 HydrophobicContact CD2-CG2 3.85Å; Y56-V65 HydrophobicContact CE2-CG2 3.21Å; Y56-I242 HydrophobicContact CD1-CD1 3.35Å; Y56-I242 HydrophobicContact CE1-CD1 3.95Å; Y56-I242 HydrophobicContact CG-CD1 4.06Å; Y56-L255 HydrophobicContact CD2-CD1 3.69Å; Y56-L255 HydrophobicContact CE2-CD1 4.05Å; Y56-E303 WeakPolarHBondContact CB-OE2 3.34Å; Y56-E303 PolarHBondContact N-OE1 3.41Å; Y56-E303 PolarHBondContact N-OE2 3.48Å
57	V	95.8	Very high	77.2	Confident	2 Å²	2	113.2 Å²	113.2	1%	0.012	52%	0.521	C	S	.	.	B	Isolated β-bridge	trans	-119.9	138.4	175.8	-176.8	0	0	0	0	109	R55 E303 V305 R322 S324	R55-V57 WeakPolarHBondContact CD-O 3.37Å; R55-V57 VanDerWaalsContact CG-O 3.31Å; R55-V57 WeakPolarHBondContact CG-O 3.38Å; R55-V57 PolarHBondContact NE-O 3.37Å; V57-E303 PolarHBondContact N-OE1 2.8Å; V57-V305 HydrophobicContact CB-CG2 4.17Å; V57-V305 HydrophobicContact CG2-CG1 4.03Å; V57-V305 HydrophobicContact CG2-CG2 3.82Å; V57-R322 HydrophobicContact CG1-CB 4.49Å; V57-S324 PolarHBondContact O-OG 2.97Å
58	R	95.1	Very high	79.5	Confident	123 Å²	123	109.3 Å²	109.3	46%	0.464	51%	0.514	S	S	.	.			trans	-79.5	163.4	173.1	-67.7	-176.2	-171.2	-158.8	0.2	110.6	D60 G61 K62 N64	R58-D60 WeakPolarHBondContact CB-OD1 3.43Å; R58-D60 PolarHBondContact O-N 2.8Å; R58-G61 PolarHBondContact O-N 2.88Å; R58-K62 PolarHBondContact N-O 2.87Å; R58-N64 PolarHBondContact NE-OD1 2.77Å; R58-N64 PolarHBondContact NH2-OD1 3.13Å
59	K	93.8	Very high	82	Confident	60 Å²	60	107 Å²	107	26%	0.261	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.2	175.6	-74.3	-73.6	-176.3	-172.4	0	113.6	G61 T207 S323 S324 E329	K59-G61 PolarHBondContact O-N 3.3Å; K59-T207 WeakPolarHBondContact CE-O 3.35Å; K59-T207 PolarHBondContact NZ-O 2.86Å; K59-S323 PolarHBondContact O-OG 3.45Å; K59-S324 VanDerWaalsContact CD-O 3.31Å; K59-S324 WeakPolarHBondContact CD-O 3.34Å; K59-S324 WeakPolarHBondContact CE-O 3.39Å; K59-S324 PolarHBondContact NZ-O 3.25Å; K59-E329 WeakPolarHBondContact CE-OE1 3.43Å; K59-E329 WeakPolarHBondContact CE-OE2 3.25Å; K59-E329 VanDerWaalsContact NZ-CD 3.27Å; K59-E329 IonicContact NZ-OE1 3.45Å; K59-E329 IonicContact NZ-OE2 3.66Å; K59-E329 PolarHBondContact NZ-OE2 2.99Å
60	D	92.4	Very high	84.1	Confident	91 Å²	91	103.8 Å²	103.8	49%	0.487	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	0.3	175.6	73.6	-16.7	0	0	0	113.7	R58 K62	R58-D60 WeakPolarHBondContact CB-OD1 3.43Å; R58-D60 PolarHBondContact O-N 2.8Å; D60-K62 PolarHBondContact O-N 3.4Å; D60-K62 WeakPolarHBondContact OD1-CB 3.47Å; D60-K62 PolarHBondContact OD1-N 3.38Å; D60-K62 VanDerWaalsContact OD1-N 3.11Å; D60-K62 WeakPolarHBondContact OD2-CD 3.25Å; D60-K62 VanDerWaalsContact OD2-CE 3.28Å; D60-K62 WeakPolarHBondContact OD2-CE 3.34Å; D60-K62 IonicContact OD2-NZ 3.64Å; D60-K62 PolarHBondContact OD2-NZ 3.39Å; D60-K62 VanDerWaalsContact OD2-NZ 3.14Å
61	G	92.5	Very high	85.9	Confident	3 Å²	3	106.3 Å²	106.3	3%	0.031	50%	0.503	C	S	.	.	S	Bend	trans	83.2	2.8	178.4	0	0	0	0	0	115.4	R58 K59 R322	R58-G61 PolarHBondContact O-N 2.88Å; K59-G61 PolarHBondContact O-N 3.3Å; G61-R322 WeakPolarHBondContact CA-O 3.42Å; G61-R322 PolarHBondContact N-O 3.02Å; G61-R322 PolarHBondContact O-NE 2.87Å; G61-R322 VanDerWaalsContact O-NE 3.12Å; G61-R322 PolarHBondContact O-NH2 3.13Å
62	K	93.1	Very high	87.9	Confident	128 Å²	128	98.2 Å²	98.2	56%	0.557	48%	0.475	S	S	*	.			trans	-74.5	134	171.4	-66.9	179.2	-169.9	146	0	110.5	R58 D60	R58-K62 PolarHBondContact N-O 2.87Å; D60-K62 PolarHBondContact O-N 3.4Å; D60-K62 WeakPolarHBondContact OD1-CB 3.47Å; D60-K62 PolarHBondContact OD1-N 3.38Å; D60-K62 VanDerWaalsContact OD1-N 3.11Å; D60-K62 WeakPolarHBondContact OD2-CD 3.25Å; D60-K62 VanDerWaalsContact OD2-CE 3.28Å; D60-K62 WeakPolarHBondContact OD2-CE 3.34Å; D60-K62 IonicContact OD2-NZ 3.64Å; D60-K62 PolarHBondContact OD2-NZ 3.39Å; D60-K62 VanDerWaalsContact OD2-NZ 3.14Å
63	C	94.5	Very high	89.3	Confident	62 Å²	62	92 Å²	92	42%	0.419	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-86	133	177.9	-54.6	0	0	0	0	110.3	V65	C63-V65 HydrophobicContact CB-CG2 4.39Å; C63-V65 PolarHBondContact O-N 3.02Å; C63-V65 VanDerWaalsContact O-N 3.09Å
64	N	93	Very high	90.4	Very high	42 Å²	42	93 Å²	93	23%	0.225	45%	0.452	C	S	.	.			trans	-86.2	56.7	175.6	-68.5	-36.7	0	0	0	110.6	Q54 R55 Y56 R58	Q54-N64 PolarHBondContact NE2-ND2 3.14Å; R55-N64 PolarHBondContact O-ND2 3.3Å; Y56-N64 PolarHBondContact O-N 2.76Å; R58-N64 PolarHBondContact NE-OD1 2.77Å; R58-N64 PolarHBondContact NH2-OD1 3.13Å
65	V	91.5	Very high	90.6	Very high	53 Å²	53	93.2 Å²	93.2	32%	0.321	45%	0.447	S	S	.	.			trans	-126.9	124.2	-177.7	-177	0	0	0	0	109.3	Y56 C63	Y56-V65 HydrophobicContact CD2-CG2 3.85Å; Y56-V65 HydrophobicContact CE2-CG2 3.21Å; C63-V65 HydrophobicContact CB-CG2 4.39Å; C63-V65 PolarHBondContact O-N 3.02Å; C63-V65 VanDerWaalsContact O-N 3.09Å
66	H	89	Confident	90.4	Very high	186 Å²	186	97 Å²	97	86%	0.861	46%	0.462	S	S	*	.			trans	-109.1	125.7	171.8	-69.6	-76.7	0	0	0	109.6	G68	H66-G68 PolarHBondContact O-N 3.24Å
67	H	86.1	Confident	90.1	Very high	154 Å²	154	99.6 Å²	99.6	71%	0.713	48%	0.48	S	S	*	.			trans	-85.3	95	176.8	-60.5	-74.1	0	0	0	109.9	V70	H67-V70 HydrophobicContact CB-CG2 4.29Å
68	G	86	Confident	89.9	Confident	61 Å²	61	104.9 Å²	104.9	63%	0.629	51%	0.512	S	S	*	.			trans	-85.1	161.3	174.4	0	0	0	0	0	113.2	H66 V70	H66-G68 PolarHBondContact O-N 3.24Å; G68-V70 VanDerWaalsContact C-N 3.3Å; G68-V70 PolarHBondContact O-N 3.33Å
69	N	88.3	Confident	89.8	Confident	168 Å²	168	102.7 Å²	102.7	90%	0.898	51%	0.51	S	S	*	.			trans	56.2	32.2	170.5	-63.2	-7	0	0	0	116.1	R71	N69-R71 PolarHBondContact O-N 2.87Å
70	V	85	Confident	89.8	Confident	62 Å²	62	103.3 Å²	103.3	38%	0.376	52%	0.515	S	S	.	.			trans	-70.8	99	172.8	-175.7	0	0	0	0	109	H67 G68 E72 T73	H67-V70 HydrophobicContact CB-CG2 4.29Å; G68-V70 VanDerWaalsContact C-N 3.3Å; G68-V70 PolarHBondContact O-N 3.33Å; V70-E72 PolarHBondContact O-N 2.87Å; V70-T73 WeakPolarHBondContact O-CG2 3.43Å
71	R	84.8	Confident	89.8	Confident	243 Å²	243	102.5 Å²	102.5	92%	0.917	51%	0.507	S	S	*	.	S	Bend	trans	-62.4	-26.4	-177.4	-67.8	-176.3	177	-177.2	-0.7	113.5	N69	N69-R71 PolarHBondContact O-N 2.87Å
72	E	87.8	Confident	89.7	Confident	71 Å²	71	105.4 Å²	105.4	33%	0.332	53%	0.525	S	S	.	.			trans	-106.3	56.4	-169.4	-60.6	179.7	109.3	0	0	111.9	V70 Y74 R75	V70-E72 PolarHBondContact O-N 2.87Å; E72-Y74 HydrophobicContact CB-CD1 4.06Å; E72-Y74 HydrophobicContact CB-CE1 3.46Å; E72-Y74 VanDerWaalsContact CB-CE1 3.46Å; E72-Y74 HydrophobicContact CG-CE1 3.68Å; E72-Y74 PolarHBondContact O-N 3.47Å; E72-Y74 VanDerWaalsContact O-N 3.14Å; E72-Y74 PolarHBondContact OE1-OH 2.93Å; E72-R75 HydrophobicContact CB-CG 4.11Å; E72-R75 VanDerWaalsContact CD-CZ 3.46Å; E72-R75 WeakPolarHBondContact O-CB 3.46Å; E72-R75 WeakPolarHBondContact O-CG 3.46Å; E72-R75 PolarHBondContact O-N 3.01Å; E72-R75 VanDerWaalsContact O-N 3.11Å; E72-R75 IonicContact OE1-CZ 3.21Å; E72-R75 IonicContact OE1-NE 2.86Å; E72-R75 IonicContact OE1-NH2 2.77Å; E72-R75 PolarHBondContact OE1-NH2 2.91Å; E72-R75 IonicContact OE2-CZ 3.9Å; E72-R75 IonicContact OE2-NE 3.82Å; E72-R75 PolarHBondContact OE2-NE 3.17Å; E72-R75 VanDerWaalsContact OE2-NE 3.14Å; E72-R75 IonicContact OE2-NH1 2.77Å; E72-R75 IonicContact OE2-NH2 2.66Å; E72-R75 PolarHBondContact OE2-NH2 3.08Å
73	T	87.7	Confident	89.7	Confident	67 Å²	67	101.4 Å²	101.4	41%	0.411	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-21	179.6	55	0	0	0	0	113.5	V70 R75 Y76	V70-T73 WeakPolarHBondContact O-CG2 3.43Å; T73-R75 PolarHBondContact O-N 3.07Å; T73-R75 VanDerWaalsContact O-N 3.17Å; T73-Y76 WeakPolarHBondContact O-CD2 3.36Å; T73-Y76 PolarHBondContact O-N 3.44Å
74	Y	90.4	Very high	89.7	Confident	125 Å²	125	99.1 Å²	99.1	49%	0.49	50%	0.495	S	S	.	.	H	α-helix	trans	-60.7	-22.3	175	69.2	-93.9	0	0	0	113.1	E72 Y76 L77 T78	E72-Y74 HydrophobicContact CB-CD1 4.06Å; E72-Y74 HydrophobicContact CB-CE1 3.46Å; E72-Y74 VanDerWaalsContact CB-CE1 3.46Å; E72-Y74 HydrophobicContact CG-CE1 3.68Å; E72-Y74 PolarHBondContact O-N 3.47Å; E72-Y74 VanDerWaalsContact O-N 3.14Å; E72-Y74 PolarHBondContact OE1-OH 2.93Å; Y74-Y76 VanDerWaalsContact C-N 3.28Å; Y74-Y76 PolarHBondContact O-N 2.95Å; Y74-L77 PolarHBondContact O-N 3.36Å; Y74-L77 VanDerWaalsContact O-N 3.11Å; Y74-T78 PolarHBondContact O-N 3.01Å; Y74-T78 PolarHBondContact O-OG1 3.02Å
75	R	89.3	Confident	89.7	Confident	145 Å²	145	97.4 Å²	97.4	55%	0.547	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-34.3	177	-67.3	-177	178.4	-166.1	2.8	112.1	E72 T73 L77 T78 D79	E72-R75 HydrophobicContact CB-CG 4.11Å; E72-R75 VanDerWaalsContact CD-CZ 3.46Å; E72-R75 WeakPolarHBondContact O-CB 3.46Å; E72-R75 WeakPolarHBondContact O-CG 3.46Å; E72-R75 PolarHBondContact O-N 3.01Å; E72-R75 VanDerWaalsContact O-N 3.11Å; E72-R75 IonicContact OE1-CZ 3.21Å; E72-R75 IonicContact OE1-NE 2.86Å; E72-R75 IonicContact OE1-NH2 2.77Å; E72-R75 PolarHBondContact OE1-NH2 2.91Å; E72-R75 IonicContact OE2-CZ 3.9Å; E72-R75 IonicContact OE2-NE 3.82Å; E72-R75 PolarHBondContact OE2-NE 3.17Å; E72-R75 VanDerWaalsContact OE2-NE 3.14Å; E72-R75 IonicContact OE2-NH1 2.77Å; E72-R75 IonicContact OE2-NH2 2.66Å; E72-R75 PolarHBondContact OE2-NH2 3.08Å; T73-R75 PolarHBondContact O-N 3.07Å; T73-R75 VanDerWaalsContact O-N 3.17Å; R75-L77 VanDerWaalsContact C-N 3.28Å; R75-L77 PolarHBondContact O-N 3.04Å; R75-T78 WeakPolarHBondContact O-CB 3.39Å; R75-T78 PolarHBondContact O-N 2.94Å; R75-D79 PolarHBondContact O-N 2.9Å
76	Y	87.5	Confident	89.7	Confident	124 Å²	124	99.1 Å²	99.1	49%	0.486	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-33	174.7	-62.4	-67.9	0	0	0	112.4	T73 Y74 D79 T83	T73-Y76 WeakPolarHBondContact O-CD2 3.36Å; T73-Y76 PolarHBondContact O-N 3.44Å; Y74-Y76 VanDerWaalsContact C-N 3.28Å; Y74-Y76 PolarHBondContact O-N 2.95Å; Y76-D79 CarbonylContact O-C 3.28Å; Y76-D79 VanDerWaalsContact O-C 3.28Å; Y76-D79 VanDerWaalsContact O-O 3.12Å; Y76-T83 PolarHBondContact O-OG1 3.38Å
77	L	88.9	Confident	89.9	Confident	121 Å²	121	92 Å²	92	63%	0.634	46%	0.461	S	S	*	.	H	α-helix	trans	-80.7	-27.2	176.6	-63	177.9	0	0	0	112.6	Y74 R75 D79 I80	Y74-L77 PolarHBondContact O-N 3.36Å; Y74-L77 VanDerWaalsContact O-N 3.11Å; R75-L77 VanDerWaalsContact C-N 3.28Å; R75-L77 PolarHBondContact O-N 3.04Å; L77-D79 VanDerWaalsContact C-N 3.26Å; L77-D79 PolarHBondContact O-N 2.87Å; L77-I80 HydrophobicContact CD2-CD1 4.25Å; L77-I80 PolarHBondContact O-N 3.49Å
78	T	92.1	Very high	90.3	Very high	114 Å²	114	89.3 Å²	89.3	70%	0.699	45%	0.447	S	S	*	.	H	α-helix	trans	-64.5	-38	175.3	-51.2	0	0	0	0	110.2	Y74 R75	Y74-T78 PolarHBondContact O-N 3.01Å; Y74-T78 PolarHBondContact O-OG1 3.02Å; R75-T78 WeakPolarHBondContact O-CB 3.39Å; R75-T78 PolarHBondContact O-N 2.94Å
79	D	92.6	Very high	90.6	Very high	76 Å²	76	92 Å²	92	41%	0.406	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	64.5	169.5	-169.4	1.5	0	0	0	111.3	R75 Y76 L77 F81 T82 T83	R75-D79 PolarHBondContact O-N 2.9Å; Y76-D79 CarbonylContact O-C 3.28Å; Y76-D79 VanDerWaalsContact O-C 3.28Å; Y76-D79 VanDerWaalsContact O-O 3.12Å; L77-D79 VanDerWaalsContact C-N 3.26Å; L77-D79 PolarHBondContact O-N 2.87Å; D79-F81 PolarHBondContact O-N 3.31Å; D79-T82 VanDerWaalsContact CG-CB 3.44Å; D79-T82 WeakPolarHBondContact OD1-CB 3.39Å; D79-T82 PolarHBondContact OD1-N 3.4Å; D79-T82 VanDerWaalsContact OD1-N 3.14Å; D79-T82 PolarHBondContact OD1-OG1 3.14Å; D79-T82 WeakPolarHBondContact OD2-CB 3.37Å; D79-T82 PolarHBondContact OD2-OG1 3.38Å; D79-T83 PolarHBondContact O-N 2.95Å; D79-T83 PolarHBondContact O-OG1 3.36Å
80	I	92.4	Very high	90.9	Very high	74 Å²	74	89.4 Å²	89.4	38%	0.379	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-30.3	-179.6	-168.8	58.9	0	0	0	112.2	L77 T83 L84	L77-I80 HydrophobicContact CD2-CD1 4.25Å; L77-I80 PolarHBondContact O-N 3.49Å; I80-T83 PolarHBondContact O-N 2.99Å; I80-L84 HydrophobicContact CD1-CG 4.35Å; I80-L84 HydrophobicContact CG1-CD1 4.05Å; I80-L84 HydrophobicContact CG1-CG 4.23Å; I80-L84 WeakPolarHBondContact O-CB 3.44Å; I80-L84 VanDerWaalsContact O-CG 3.25Å; I80-L84 WeakPolarHBondContact O-CG 3.47Å; I80-L84 PolarHBondContact O-N 2.91Å
81	F	92.3	Very high	91.4	Very high	74 Å²	74	88.7 Å²	88.7	33%	0.325	41%	0.408	S	S	.	.	H	α-helix	trans	-66.2	-52.5	-178.9	-174.1	-96.2	0	0	0	110.9	D79 T83 L84 V85 F184 C188 V191	D79-F81 PolarHBondContact O-N 3.31Å; F81-T83 VanDerWaalsContact C-N 3.27Å; F81-T83 PolarHBondContact O-N 3.46Å; F81-L84 PolarHBondContact O-N 2.91Å; F81-V85 HydrophobicContact CD1-CG2 4.29Å; F81-V85 HydrophobicContact CE1-CG2 3.97Å; F81-V85 HydrophobicContact CZ-CG2 4.1Å; F81-V85 WeakPolarHBondContact O-CG2 3.5Å; F81-V85 PolarHBondContact O-N 3.18Å; F81-V85 VanDerWaalsContact O-N 3.08Å; F81-F184 AromaticContact CD2-CE2 3.92Å; F81-F184 HydrophobicContact CD2-CE2 3.92Å; F81-F184 HydrophobicContact CD2-CZ 4.44Å; F81-C188 HydrophobicContact CE2-CB 4.22Å; F81-V191 HydrophobicContact CE1-CG1 4.48Å; F81-V191 HydrophobicContact CE1-CG2 4.37Å; F81-V191 HydrophobicContact CZ-CB 4.31Å; F81-V191 HydrophobicContact CZ-CG2 3.95Å
82	T	91.4	Very high	91.8	Very high	64 Å²	64	77.3 Å²	77.3	39%	0.393	37%	0.365	S	S	.	.	H	α-helix	trans	-58.8	-42.6	176.5	-58.9	0	0	0	0	111.1	D79 L84 V85 D86	D79-T82 VanDerWaalsContact CG-CB 3.44Å; D79-T82 WeakPolarHBondContact OD1-CB 3.39Å; D79-T82 PolarHBondContact OD1-N 3.4Å; D79-T82 VanDerWaalsContact OD1-N 3.14Å; D79-T82 PolarHBondContact OD1-OG1 3.14Å; D79-T82 WeakPolarHBondContact OD2-CB 3.37Å; D79-T82 PolarHBondContact OD2-OG1 3.38Å; T82-L84 PolarHBondContact O-N 2.8Å; T82-V85 PolarHBondContact O-N 3Å; T82-D86 WeakPolarHBondContact O-CB 3.3Å; T82-D86 PolarHBondContact O-N 2.87Å
83	T	93	Very high	92.1	Very high	43 Å²	43	78.2 Å²	78.2	26%	0.264	37%	0.372	S	S	.	.	H	α-helix	trans	-59.6	-46	177.9	-59	0	0	0	0	112.1	Y76 D79 I80 F81 V85 D86 L87	Y76-T83 PolarHBondContact O-OG1 3.38Å; D79-T83 PolarHBondContact O-N 2.95Å; D79-T83 PolarHBondContact O-OG1 3.36Å; I80-T83 PolarHBondContact O-N 2.99Å; F81-T83 VanDerWaalsContact C-N 3.27Å; F81-T83 PolarHBondContact O-N 3.46Å; T83-V85 PolarHBondContact O-N 2.58Å; T83-D86 PolarHBondContact O-N 3.15Å; T83-L87 WeakPolarHBondContact O-CG 3.35Å; T83-L87 PolarHBondContact O-N 2.75Å; T83-L87 VanDerWaalsContact O-N 3.11Å
84	L	94.2	Very high	92.6	Very high	15 Å²	15	79.3 Å²	79.3	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-64.3	-40	179.3	-75.8	171.2	0	0	0	112.9	I80 F81 T82 L87 N92 I95 F184	I80-L84 HydrophobicContact CD1-CG 4.35Å; I80-L84 HydrophobicContact CG1-CD1 4.05Å; I80-L84 HydrophobicContact CG1-CG 4.23Å; I80-L84 WeakPolarHBondContact O-CB 3.44Å; I80-L84 VanDerWaalsContact O-CG 3.25Å; I80-L84 WeakPolarHBondContact O-CG 3.47Å; I80-L84 PolarHBondContact O-N 2.91Å; F81-L84 PolarHBondContact O-N 2.91Å; T82-L84 PolarHBondContact O-N 2.8Å; L84-L87 HydrophobicContact CD2-CD1 4.36Å; L84-N92 PolarHBondContact O-ND2 2.9Å; L84-I95 HydrophobicContact CD2-CD1 3.62Å; L84-I95 HydrophobicContact CD2-CG2 3.92Å; L84-F184 HydrophobicContact CD1-CE1 3.56Å; L84-F184 HydrophobicContact CD1-CZ 3.55Å
85	V	93.4	Very high	92.8	Very high	5 Å²	5	75.7 Å²	75.7	3%	0.03	36%	0.363	C	S	.	.	H	α-helix	trans	-70.1	-36.4	179.3	-177.6	0	0	0	0	110.5	F81 T82 T83 V191 K192 Q195	F81-V85 HydrophobicContact CD1-CG2 4.29Å; F81-V85 HydrophobicContact CE1-CG2 3.97Å; F81-V85 HydrophobicContact CZ-CG2 4.1Å; F81-V85 WeakPolarHBondContact O-CG2 3.5Å; F81-V85 PolarHBondContact O-N 3.18Å; F81-V85 VanDerWaalsContact O-N 3.08Å; T82-V85 PolarHBondContact O-N 3Å; T83-V85 PolarHBondContact O-N 2.58Å; V85-V191 HydrophobicContact CG1-CB 4.48Å; V85-V191 HydrophobicContact CG1-CG1 3.82Å; V85-V191 HydrophobicContact CG2-CB 4.42Å; V85-V191 HydrophobicContact CG2-CG1 4.21Å; V85-K192 HydrophobicContact CG1-CB 4.12Å; V85-K192 PolarHBondContact O-NZ 3.5Å; V85-Q195 HydrophobicContact CG1-CG 4.32Å
86	D	91.8	Very high	93.1	Very high	89 Å²	89	71.6 Å²	71.6	48%	0.476	35%	0.35	S	S	.	.	H	α-helix	trans	-79.2	-17	-180	-86.1	-15	0	0	0	114.9	T82 T83 K197	T82-D86 WeakPolarHBondContact O-CB 3.3Å; T82-D86 PolarHBondContact O-N 2.87Å; T83-D86 PolarHBondContact O-N 3.15Å; D86-K197 IonicContact OD1-NZ 3.64Å; D86-K197 PolarHBondContact OD1-NZ 3.19Å
87	L	92.3	Very high	93.5	Very high	38 Å²	38	69.7 Å²	69.7	20%	0.199	35%	0.351	C	S	.	.	S	Bend	trans	-58.1	152.4	173.8	-80.5	173.3	0	0	0	112.7	T83 L84 F91 I95 K192	T83-L87 WeakPolarHBondContact O-CG 3.35Å; T83-L87 PolarHBondContact O-N 2.75Å; T83-L87 VanDerWaalsContact O-N 3.11Å; L84-L87 HydrophobicContact CD2-CD1 4.36Å; L87-F91 HydrophobicContact CB-CB 4.27Å; L87-F91 HydrophobicContact CD1-CB 4.29Å; L87-F91 HydrophobicContact CD2-CB 4.4Å; L87-F91 HydrophobicContact CD2-CD2 4.36Å; L87-I95 HydrophobicContact CD1-CD1 3.58Å; L87-K192 WeakPolarHBondContact O-CE 3.34Å; L87-K192 PolarHBondContact O-NZ 2.8Å
88	K	94.2	Very high	93.9	Very high	96 Å²	96	68.9 Å²	68.9	42%	0.417	35%	0.345	S	S	.	.			trans	-60.8	150.9	172.9	-63.3	-178.8	178.6	177.4	0	110.7	R90 F91 N92	K88-R90 HydrophobicContact CB-CG 4.23Å; K88-R90 PolarHBondContact O-N 2.73Å; K88-R90 VanDerWaalsContact O-N 3.13Å; K88-F91 HydrophobicContact CB-CD2 3.95Å; K88-F91 HydrophobicContact CB-CE2 4.38Å; K88-F91 HydrophobicContact CD-CE2 4.42Å; K88-F91 PolarHBondContact O-N 2.98Å; K88-N92 PolarHBondContact O-N 3.17Å; K88-N92 VanDerWaalsContact O-N 3.12Å
89	W	93.1	Very high	94.1	Very high	117 Å²	117	65.4 Å²	65.4	44%	0.443	32%	0.324	S	S	.	.	H	α-helix	trans	-48.9	-42	179.2	-84.5	108.5	0	0	0	113.9	F91 N92 L93 M189 K192 I193	W89-F91 VanDerWaalsContact C-N 3.29Å; W89-F91 PolarHBondContact O-N 3.4Å; W89-N92 PolarHBondContact O-N 3.38Å; W89-L93 WeakPolarHBondContact O-CG 3.38Å; W89-L93 PolarHBondContact O-N 3.42Å; W89-M189 HydrophobicContact CH2-CE 4.26Å; W89-M189 HydrophobicContact CZ3-CE 3.69Å; W89-M189 HydrophobicContact CZ3-SD 3.99Å; W89-K192 HydrophobicContact CD2-CD 4.24Å; W89-K192 HydrophobicContact CE3-CD 4.19Å; W89-K192 HydrophobicContact CH2-CD 4.08Å; W89-K192 HydrophobicContact CH2-CG 4.11Å; W89-K192 HydrophobicContact CZ2-CD 4.13Å; W89-K192 HydrophobicContact CZ2-CG 3.92Å; W89-K192 HydrophobicContact CZ3-CD 4.11Å; W89-I193 HydrophobicContact CH2-CD1 4.44Å; W89-I193 HydrophobicContact CH2-CG1 3.67Å; W89-I193 HydrophobicContact CZ2-CG1 4.16Å
90	R	95.3	Very high	94.3	Very high	115 Å²	115	63.1 Å²	63.1	43%	0.434	31%	0.31	S	S	.	.	H	α-helix	trans	-55.3	-41.9	177.5	71.9	178.8	90.3	133.4	-20.5	113.2	D15 K88 L94	D15-R90 IonicContact OD2-CZ 3.2Å; D15-R90 IonicContact OD2-NH1 2.73Å; D15-R90 IonicContact OD2-NH2 3.57Å; D15-R90 PolarHBondContact OD2-NH2 3.37Å; K88-R90 HydrophobicContact CB-CG 4.23Å; K88-R90 PolarHBondContact O-N 2.73Å; K88-R90 VanDerWaalsContact O-N 3.13Å; R90-L94 WeakPolarHBondContact O-CB 3.48Å; R90-L94 PolarHBondContact O-N 2.86Å; R90-L94 VanDerWaalsContact O-N 3.13Å
91	F	95.2	Very high	94.5	Very high	46 Å²	46	62 Å²	62	20%	0.202	31%	0.306	C	S	.	.	H	α-helix	trans	-79.2	-36.8	-178	-62.8	-61.6	0	0	0	110.8	V11 L87 K88 W89 L94 I95	V11-F91 HydrophobicContact CG1-CE1 4.06Å; V11-F91 HydrophobicContact CG1-CZ 3.79Å; L87-F91 HydrophobicContact CB-CB 4.27Å; L87-F91 HydrophobicContact CD1-CB 4.29Å; L87-F91 HydrophobicContact CD2-CB 4.4Å; L87-F91 HydrophobicContact CD2-CD2 4.36Å; K88-F91 HydrophobicContact CB-CD2 3.95Å; K88-F91 HydrophobicContact CB-CE2 4.38Å; K88-F91 HydrophobicContact CD-CE2 4.42Å; K88-F91 PolarHBondContact O-N 2.98Å; W89-F91 VanDerWaalsContact C-N 3.29Å; W89-F91 PolarHBondContact O-N 3.4Å; F91-L94 PolarHBondContact O-N 2.91Å; F91-I95 WeakPolarHBondContact O-CB 3.28Å; F91-I95 WeakPolarHBondContact O-CG1 3.21Å; F91-I95 PolarHBondContact O-N 3.42Å
92	N	93	Very high	94.8	Very high	4 Å²	4	62.9 Å²	62.9	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-46.8	176.6	-163.8	-52.3	0	0	0	110.8	L84 K88 W89 L94 I95 F96 K192	L84-N92 PolarHBondContact O-ND2 2.9Å; K88-N92 PolarHBondContact O-N 3.17Å; K88-N92 VanDerWaalsContact O-N 3.12Å; W89-N92 PolarHBondContact O-N 3.38Å; N92-L94 PolarHBondContact O-N 2.98Å; N92-I95 PolarHBondContact O-N 2.98Å; N92-F96 WeakPolarHBondContact O-CB 3.47Å; N92-F96 PolarHBondContact O-N 2.85Å; N92-K192 HydrophobicContact CB-CD 4.26Å; N92-K192 WeakPolarHBondContact ND2-CD 3.43Å
93	L	94.9	Very high	95	Very high	91 Å²	91	60.9 Å²	60.9	48%	0.476	31%	0.305	S	S	.	.	H	α-helix	trans	-61.8	-40.4	174.6	-68.1	174.6	0	0	0	112.6	W89 F96 V97	W89-L93 WeakPolarHBondContact O-CG 3.38Å; W89-L93 PolarHBondContact O-N 3.42Å; L93-F96 WeakPolarHBondContact O-CB 3.41Å; L93-F96 PolarHBondContact O-N 3.32Å; L93-V97 WeakPolarHBondContact O-CG2 3.24Å; L93-V97 PolarHBondContact O-N 2.72Å
94	L	96.5	Very high	95.2	Very high	90 Å²	90	61.3 Å²	61.3	47%	0.471	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-47.6	175.5	-177.5	68.8	0	0	0	111.4	R90 F91 N92 F96 V97 M98	R90-L94 WeakPolarHBondContact O-CB 3.48Å; R90-L94 PolarHBondContact O-N 2.86Å; R90-L94 VanDerWaalsContact O-N 3.13Å; F91-L94 PolarHBondContact O-N 2.91Å; N92-L94 PolarHBondContact O-N 2.98Å; L94-F96 VanDerWaalsContact C-N 3.32Å; L94-F96 PolarHBondContact O-N 2.94Å; L94-V97 PolarHBondContact O-N 3.13Å; L94-M98 HydrophobicContact CD1-CE 4.16Å; L94-M98 HydrophobicContact CG-CE 4.3Å; L94-M98 HydrophobicContact CG-SD 4.15Å; L94-M98 WeakPolarHBondContact O-CB 3.21Å; L94-M98 VanDerWaalsContact O-CG 3.29Å; L94-M98 WeakPolarHBondContact O-CG 3.49Å; L94-M98 PolarHBondContact O-N 2.87Å
95	I	95.9	Very high	95.4	Very high	48 Å²	48	64.1 Å²	64.1	25%	0.246	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-41.6	178.2	-69.3	166.5	0	0	0	110.3	L84 L87 F91 N92 M98 V99 M185	L84-I95 HydrophobicContact CD2-CD1 3.62Å; L84-I95 HydrophobicContact CD2-CG2 3.92Å; L87-I95 HydrophobicContact CD1-CD1 3.58Å; F91-I95 WeakPolarHBondContact O-CB 3.28Å; F91-I95 WeakPolarHBondContact O-CG1 3.21Å; F91-I95 PolarHBondContact O-N 3.42Å; N92-I95 PolarHBondContact O-N 2.98Å; I95-M98 PolarHBondContact O-N 3.04Å; I95-V99 HydrophobicContact CG2-CG2 4.2Å; I95-V99 WeakPolarHBondContact O-CG2 3.41Å; I95-V99 PolarHBondContact O-N 2.87Å; I95-M185 HydrophobicContact CG2-CE 4.5Å
96	F	94.4	Very high	95.6	Very high	59 Å²	59	69.2 Å²	69.2	26%	0.259	34%	0.339	S	S	.	.	H	α-helix	trans	-56.5	-54.3	176.3	-170.6	-83.1	0	0	0	110.6	N92 L93 L94 M98 V99 Y100 M185 M189	N92-F96 WeakPolarHBondContact O-CB 3.47Å; N92-F96 PolarHBondContact O-N 2.85Å; L93-F96 WeakPolarHBondContact O-CB 3.41Å; L93-F96 PolarHBondContact O-N 3.32Å; L94-F96 VanDerWaalsContact C-N 3.32Å; L94-F96 PolarHBondContact O-N 2.94Å; F96-M98 VanDerWaalsContact C-N 3.32Å; F96-M98 PolarHBondContact O-N 2.74Å; F96-V99 PolarHBondContact O-N 2.92Å; F96-Y100 AromaticContact CD1-CD2 3.82Å; F96-Y100 HydrophobicContact CD1-CD2 3.82Å; F96-Y100 AromaticContact CD1-CE2 3.9Å; F96-Y100 HydrophobicContact CD1-CE2 3.9Å; F96-Y100 HydrophobicContact CD2-CE2 4.17Å; F96-Y100 AromaticContact CE1-CD2 3.64Å; F96-Y100 HydrophobicContact CE1-CD2 3.64Å; F96-Y100 AromaticContact CE1-CE2 3.41Å; F96-Y100 HydrophobicContact CE1-CE2 3.41Å; F96-Y100 VanDerWaalsContact CE1-CE2 3.41Å; F96-Y100 AromaticContact CE2-CE2 3.73Å; F96-Y100 HydrophobicContact CE2-CE2 3.73Å; F96-Y100 HydrophobicContact CG-CD2 4.36Å; F96-Y100 HydrophobicContact CG-CE2 4.25Å; F96-Y100 HydrophobicContact CZ-CD2 4.06Å; F96-Y100 AromaticContact CZ-CE2 3.32Å; F96-Y100 HydrophobicContact CZ-CE2 3.32Å; F96-Y100 VanDerWaalsContact O-CD2 3.29Å; F96-Y100 WeakPolarHBondContact O-CD2 3.45Å; F96-Y100 PolarHBondContact O-N 3.29Å; F96-M185 HydrophobicContact CD2-CB 3.94Å; F96-M185 HydrophobicContact CD2-CG 4.37Å; F96-M185 HydrophobicContact CD2-SD 4.31Å; F96-M185 HydrophobicContact CE2-CB 3.75Å; F96-M189 HydrophobicContact CD2-CG 4.1Å; F96-M189 HydrophobicContact CE2-CG 4.11Å
97	V	96.5	Very high	95.8	Very high	85 Å²	85	65.3 Å²	65.3	52%	0.515	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-40.9	177.5	174.9	0	0	0	0	111.5	L93 L94 T101	L93-V97 WeakPolarHBondContact O-CG2 3.24Å; L93-V97 PolarHBondContact O-N 2.72Å; L94-V97 PolarHBondContact O-N 3.13Å; V97-T101 HydrophobicContact CG1-CG2 4.15Å; V97-T101 WeakPolarHBondContact O-CB 3.5Å; V97-T101 VanDerWaalsContact O-CG2 3.25Å; V97-T101 WeakPolarHBondContact O-CG2 3.49Å; V97-T101 PolarHBondContact O-N 3.36Å; V97-T101 PolarHBondContact O-OG1 3.11Å
98	M	97	Very high	96.1	Very high	103 Å²	103	63.5 Å²	63.5	51%	0.507	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-41.6	180	-79.5	-174.7	161.8	0	0	112.3	L94 I95 F96 T101 V102	L94-M98 HydrophobicContact CD1-CE 4.16Å; L94-M98 HydrophobicContact CG-CE 4.3Å; L94-M98 HydrophobicContact CG-SD 4.15Å; L94-M98 WeakPolarHBondContact O-CB 3.21Å; L94-M98 VanDerWaalsContact O-CG 3.29Å; L94-M98 WeakPolarHBondContact O-CG 3.49Å; L94-M98 PolarHBondContact O-N 2.87Å; I95-M98 PolarHBondContact O-N 3.04Å; F96-M98 VanDerWaalsContact C-N 3.32Å; F96-M98 PolarHBondContact O-N 2.74Å; M98-T101 WeakPolarHBondContact CA-OG1 3.41Å; M98-T101 PolarHBondContact O-N 3.05Å; M98-T101 PolarHBondContact O-OG1 2.86Å; M98-T101 VanDerWaalsContact O-OG1 3.1Å; M98-V102 VanDerWaalsContact O-CB 3.27Å; M98-V102 WeakPolarHBondContact O-CB 3.29Å; M98-V102 WeakPolarHBondContact O-CG2 3.46Å; M98-V102 PolarHBondContact O-N 3.16Å
99	V	96.7	Very high	96.2	Very high	42 Å²	42	64.1 Å²	64.1	26%	0.255	31%	0.314	S	S	.	.	H	α-helix	trans	-67.5	-46.8	-178.6	170.2	0	0	0	0	111.2	I95 F96 T101 V102 T103 V181 M185	I95-V99 HydrophobicContact CG2-CG2 4.2Å; I95-V99 WeakPolarHBondContact O-CG2 3.41Å; I95-V99 PolarHBondContact O-N 2.87Å; F96-V99 PolarHBondContact O-N 2.92Å; V99-T101 PolarHBondContact O-N 2.89Å; V99-V102 PolarHBondContact O-N 3.11Å; V99-T103 WeakPolarHBondContact O-CG2 3.39Å; V99-T103 PolarHBondContact O-N 2.91Å; V99-T103 PolarHBondContact O-OG1 3.02Å; V99-V181 HydrophobicContact CG1-CG1 3.55Å; V99-M185 HydrophobicContact CB-CE 3.58Å; V99-M185 HydrophobicContact CG1-CE 3.59Å; V99-M185 HydrophobicContact CG2-CE 3.45Å; V99-M185 VanDerWaalsContact CG2-CE 3.45Å
100	Y	96.8	Very high	96.4	Very high	28 Å²	28	60.8 Å²	60.8	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-63.6	-41.7	176.2	-79	-76.2	0	0	0	112.6	F96 V102 T103 W104 N182 M185	F96-Y100 AromaticContact CD1-CD2 3.82Å; F96-Y100 HydrophobicContact CD1-CD2 3.82Å; F96-Y100 AromaticContact CD1-CE2 3.9Å; F96-Y100 HydrophobicContact CD1-CE2 3.9Å; F96-Y100 HydrophobicContact CD2-CE2 4.17Å; F96-Y100 AromaticContact CE1-CD2 3.64Å; F96-Y100 HydrophobicContact CE1-CD2 3.64Å; F96-Y100 AromaticContact CE1-CE2 3.41Å; F96-Y100 HydrophobicContact CE1-CE2 3.41Å; F96-Y100 VanDerWaalsContact CE1-CE2 3.41Å; F96-Y100 AromaticContact CE2-CE2 3.73Å; F96-Y100 HydrophobicContact CE2-CE2 3.73Å; F96-Y100 HydrophobicContact CG-CD2 4.36Å; F96-Y100 HydrophobicContact CG-CE2 4.25Å; F96-Y100 HydrophobicContact CZ-CD2 4.06Å; F96-Y100 AromaticContact CZ-CE2 3.32Å; F96-Y100 HydrophobicContact CZ-CE2 3.32Å; F96-Y100 VanDerWaalsContact O-CD2 3.29Å; F96-Y100 WeakPolarHBondContact O-CD2 3.45Å; F96-Y100 PolarHBondContact O-N 3.29Å; Y100-V102 PolarHBondContact O-N 3.32Å; Y100-T103 WeakPolarHBondContact CA-OG1 3.49Å; Y100-T103 PolarHBondContact O-N 3.36Å; Y100-T103 PolarHBondContact O-OG1 3.37Å; Y100-W104 AromaticContact CD1-CZ2 3.82Å; Y100-W104 HydrophobicContact CD1-CZ2 3.82Å; Y100-W104 HydrophobicContact CG-CZ2 4.18Å; Y100-W104 WeakPolarHBondContact O-CB 3.39Å; Y100-W104 PolarHBondContact O-N 3.39Å; Y100-N182 WeakPolarHBondContact OH-CA 3.41Å; Y100-N182 PolarHBondContact OH-OD1 3.12Å; Y100-M185 HydrophobicContact CE2-CB 4.17Å; Y100-M185 HydrophobicContact CE2-CG 4.21Å
101	T	96.6	Very high	96.4	Very high	51 Å²	51	55.4 Å²	55.4	31%	0.313	28%	0.284	S	S	.	.	H	α-helix	trans	-67.3	-37.7	179.1	52.2	0	0	0	0	111.9	V97 M98 V99 L105	V97-T101 HydrophobicContact CG1-CG2 4.15Å; V97-T101 WeakPolarHBondContact O-CB 3.5Å; V97-T101 VanDerWaalsContact O-CG2 3.25Å; V97-T101 WeakPolarHBondContact O-CG2 3.49Å; V97-T101 PolarHBondContact O-N 3.36Å; V97-T101 PolarHBondContact O-OG1 3.11Å; M98-T101 WeakPolarHBondContact CA-OG1 3.41Å; M98-T101 PolarHBondContact O-N 3.05Å; M98-T101 PolarHBondContact O-OG1 2.86Å; M98-T101 VanDerWaalsContact O-OG1 3.1Å; V99-T101 PolarHBondContact O-N 2.89Å; T101-L105 VanDerWaalsContact O-CB 3.29Å; T101-L105 WeakPolarHBondContact O-CB 3.21Å; T101-L105 WeakPolarHBondContact O-CG 3.32Å; T101-L105 PolarHBondContact O-N 3.43Å
102	V	97.7	Very high	96.5	Very high	92 Å²	92	57.5 Å²	57.5	56%	0.558	29%	0.29	S	S	*	.	H	α-helix	trans	-69.1	-40.4	176.3	170.7	0	0	0	0	111.8	M98 V99 Y100 L105 F106	M98-V102 VanDerWaalsContact O-CB 3.27Å; M98-V102 WeakPolarHBondContact O-CB 3.29Å; M98-V102 WeakPolarHBondContact O-CG2 3.46Å; M98-V102 PolarHBondContact O-N 3.16Å; V99-V102 PolarHBondContact O-N 3.11Å; Y100-V102 PolarHBondContact O-N 3.32Å; V102-L105 PolarHBondContact O-N 3.05Å; V102-F106 WeakPolarHBondContact O-CB 3.19Å; V102-F106 PolarHBondContact O-N 2.72Å
103	T	97	Very high	96.6	Very high	22 Å²	22	61.2 Å²	61.2	14%	0.135	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-47.3	175.4	53.3	0	0	0	0	111	V99 Y100 L105 F106 F107 E150 V181	V99-T103 WeakPolarHBondContact O-CG2 3.39Å; V99-T103 PolarHBondContact O-N 2.91Å; V99-T103 PolarHBondContact O-OG1 3.02Å; Y100-T103 WeakPolarHBondContact CA-OG1 3.49Å; Y100-T103 PolarHBondContact O-N 3.36Å; Y100-T103 PolarHBondContact O-OG1 3.37Å; T103-L105 PolarHBondContact O-N 3.1Å; T103-F106 PolarHBondContact O-N 2.99Å; T103-F107 WeakPolarHBondContact O-CD2 3.41Å; T103-F107 PolarHBondContact O-N 3.38Å; T103-E150 WeakPolarHBondContact CB-OE1 3.48Å; T103-E150 PolarHBondContact OG1-OE1 3.02Å; T103-V181 HydrophobicContact CG2-CG1 4.41Å; T103-V181 HydrophobicContact CG2-CG2 4.34Å
104	W	97.3	Very high	96.6	Very high	51 Å²	51	57.8 Å²	57.8	19%	0.193	29%	0.292	C	S	.	.	H	α-helix	trans	-61.8	-41.6	178	-61.2	-21.3	0	0	0	112.9	Y100 G108 F143 S146 I147 E150 T151	Y100-W104 AromaticContact CD1-CZ2 3.82Å; Y100-W104 HydrophobicContact CD1-CZ2 3.82Å; Y100-W104 HydrophobicContact CG-CZ2 4.18Å; Y100-W104 WeakPolarHBondContact O-CB 3.39Å; Y100-W104 PolarHBondContact O-N 3.39Å; W104-G108 WeakPolarHBondContact O-CA 3.31Å; W104-G108 PolarHBondContact O-N 3.34Å; W104-F143 HydrophobicContact CB-CD2 4.38Å; W104-F143 HydrophobicContact CB-CE2 3.69Å; W104-F143 HydrophobicContact CB-CZ 4.4Å; W104-S146 PolarHBondContact O-OG 3.35Å; W104-I147 HydrophobicContact CB-CG1 3.91Å; W104-I147 HydrophobicContact CD2-CD1 4.36Å; W104-I147 HydrophobicContact CD2-CG1 3.69Å; W104-I147 HydrophobicContact CE3-CD1 4.04Å; W104-I147 HydrophobicContact CE3-CG1 3.89Å; W104-I147 HydrophobicContact CG-CG1 3.69Å; W104-E150 VanDerWaalsContact CD1-CD 3.45Å; W104-E150 PolarHBondContact NE1-OE1 3.44Å; W104-E150 VanDerWaalsContact NE1-OE1 3.1Å; W104-T151 HydrophobicContact CZ2-CG2 3.74Å
105	L	97.5	Very high	96.5	Very high	74 Å²	74	53.7 Å²	53.7	39%	0.387	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-45.6	175.1	-76.9	171.8	0	0	0	111.3	T101 V102 T103 G108 M109 F139 F143	T101-L105 VanDerWaalsContact O-CB 3.29Å; T101-L105 WeakPolarHBondContact O-CB 3.21Å; T101-L105 WeakPolarHBondContact O-CG 3.32Å; T101-L105 PolarHBondContact O-N 3.43Å; V102-L105 PolarHBondContact O-N 3.05Å; T103-L105 PolarHBondContact O-N 3.1Å; L105-G108 PolarHBondContact O-N 3.47Å; L105-M109 VanDerWaalsContact O-CG 3.23Å; L105-M109 WeakPolarHBondContact O-CG 3.48Å; L105-M109 PolarHBondContact O-N 3Å; L105-F139 HydrophobicContact CD2-CZ 4.18Å; L105-F143 HydrophobicContact CD2-CD2 3.81Å; L105-F143 HydrophobicContact CD2-CE2 3.68Å; L105-F143 HydrophobicContact CD2-CZ 4.46Å; L105-F143 HydrophobicContact CG-CD2 4.35Å; L105-F143 HydrophobicContact CG-CE2 3.85Å
106	F	97.5	Very high	96.4	Very high	113 Å²	113	58 Å²	58	50%	0.496	29%	0.285	S	S	.	.	H	α-helix	trans	-59.1	-53.3	179.7	175.8	-105	0	0	0	111.4	V102 T103 G108 M109 I110	V102-F106 WeakPolarHBondContact O-CB 3.19Å; V102-F106 PolarHBondContact O-N 2.72Å; T103-F106 PolarHBondContact O-N 2.99Å; F106-G108 VanDerWaalsContact C-N 3.35Å; F106-G108 PolarHBondContact O-N 2.78Å; F106-M109 PolarHBondContact O-N 2.89Å; F106-I110 HydrophobicContact CD1-CD1 4.1Å; F106-I110 HydrophobicContact CE1-CD1 3.57Å; F106-I110 HydrophobicContact CE2-CD1 4.1Å; F106-I110 HydrophobicContact CZ-CD1 3.58Å; F106-I110 WeakPolarHBondContact O-CG1 3.33Å; F106-I110 PolarHBondContact O-N 3.44Å; F106-I110 VanDerWaalsContact O-N 3.14Å
107	F	97.3	Very high	96.4	Very high	6 Å²	6	60.9 Å²	60.9	3%	0.026	30%	0.302	C	S	.	.	H	α-helix	trans	-66.6	-36	176.5	-78.6	-72.8	0	0	0	112.3	T103 M109 I110 W111 S146 L170 I173 Q174 L177	T103-F107 WeakPolarHBondContact O-CD2 3.41Å; T103-F107 PolarHBondContact O-N 3.38Å; F107-M109 VanDerWaalsContact C-N 3.32Å; F107-M109 PolarHBondContact O-N 3Å; F107-I110 PolarHBondContact O-N 3.25Å; F107-I110 VanDerWaalsContact O-N 3.16Å; F107-W111 PolarHBondContact O-N 3.23Å; F107-S146 WeakPolarHBondContact CB-OG 3.45Å; F107-L170 HydrophobicContact CD1-CD1 3.86Å; F107-L170 HydrophobicContact CE1-CD1 3.94Å; F107-I173 HydrophobicContact CE1-CG2 4.38Å; F107-I173 HydrophobicContact CZ-CG2 4.49Å; F107-Q174 HydrophobicContact CB-CG 4.35Å; F107-Q174 HydrophobicContact CD1-CB 3.68Å; F107-Q174 HydrophobicContact CD1-CG 3.72Å; F107-Q174 HydrophobicContact CD2-CG 3.91Å; F107-Q174 HydrophobicContact CE1-CB 3.54Å; F107-Q174 HydrophobicContact CE1-CG 3.93Å; F107-Q174 HydrophobicContact CE2-CB 4.46Å; F107-Q174 HydrophobicContact CE2-CG 4.1Å; F107-Q174 HydrophobicContact CG-CB 4.23Å; F107-Q174 HydrophobicContact CG-CG 3.73Å; F107-Q174 HydrophobicContact CZ-CB 3.97Å; F107-Q174 HydrophobicContact CZ-CG 4.12Å; F107-L177 HydrophobicContact CZ-CB 4.28Å; F107-L177 HydrophobicContact CZ-CD2 4.24Å
108	G	97	Very high	96.2	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-38.5	174.8	0	0	0	0	0	112.9	W104 L105 F106 W112 A142 S146	W104-G108 WeakPolarHBondContact O-CA 3.31Å; W104-G108 PolarHBondContact O-N 3.34Å; L105-G108 PolarHBondContact O-N 3.47Å; F106-G108 VanDerWaalsContact C-N 3.35Å; F106-G108 PolarHBondContact O-N 2.78Å; G108-W112 WeakPolarHBondContact O-CB 3.44Å; G108-W112 PolarHBondContact O-N 2.9Å; G108-A142 WeakPolarHBondContact O-CB 3.21Å; G108-S146 PolarHBondContact N-OG 2.77Å
109	M	97	Very high	96	Very high	109 Å²	109	56.3 Å²	56.3	54%	0.537	27%	0.273	S	S	.	.	H	α-helix	trans	-65.8	-41.5	172.7	-66.8	-143.1	-71.4	0	0	111.8	L105 F106 F107 W112 L113 F139	L105-M109 VanDerWaalsContact O-CG 3.23Å; L105-M109 WeakPolarHBondContact O-CG 3.48Å; L105-M109 PolarHBondContact O-N 3Å; F106-M109 PolarHBondContact O-N 2.89Å; F107-M109 VanDerWaalsContact C-N 3.32Å; F107-M109 PolarHBondContact O-N 3Å; M109-W112 PolarHBondContact O-N 3.1Å; M109-L113 VanDerWaalsContact O-CB 3.28Å; M109-L113 WeakPolarHBondContact O-CB 3.44Å; M109-L113 PolarHBondContact O-N 3.48Å; M109-F139 HydrophobicContact CG-CE2 3.79Å; M109-F139 HydrophobicContact CG-CZ 4.19Å
110	I	96.7	Very high	95.7	Very high	48 Å²	48	54.8 Å²	54.8	25%	0.246	26%	0.263	C	S	.	.	H	α-helix	trans	-67.9	-42.6	179	-58.8	173.4	0	0	0	110.8	F106 F107 W112 L113 I114 L170	F106-I110 HydrophobicContact CD1-CD1 4.1Å; F106-I110 HydrophobicContact CE1-CD1 3.57Å; F106-I110 HydrophobicContact CE2-CD1 4.1Å; F106-I110 HydrophobicContact CZ-CD1 3.58Å; F106-I110 WeakPolarHBondContact O-CG1 3.33Å; F106-I110 PolarHBondContact O-N 3.44Å; F106-I110 VanDerWaalsContact O-N 3.14Å; F107-I110 PolarHBondContact O-N 3.25Å; F107-I110 VanDerWaalsContact O-N 3.16Å; I110-W112 VanDerWaalsContact C-N 3.34Å; I110-W112 PolarHBondContact O-N 2.92Å; I110-L113 PolarHBondContact O-N 2.86Å; I110-L113 VanDerWaalsContact O-N 3.17Å; I110-I114 HydrophobicContact CG2-CD1 4.23Å; I110-I114 HydrophobicContact CG2-CG1 4.42Å; I110-I114 WeakPolarHBondContact O-CG1 3.36Å; I110-I114 PolarHBondContact O-N 2.8Å; I110-L170 HydrophobicContact CB-CD1 4.38Å; I110-L170 HydrophobicContact CB-CD2 4.16Å; I110-L170 HydrophobicContact CG2-CD1 3.8Å; I110-L170 HydrophobicContact CG2-CD2 3.62Å; I110-L170 HydrophobicContact CG2-CG 4.36Å
111	W	96.6	Very high	95.3	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-45.5	174.2	-81.5	115.4	0	0	0	112.3	F107 L113 I114 A115 V133 A142 F145 I160 G167 L170 L171	F107-W111 PolarHBondContact O-N 3.23Å; W111-L113 VanDerWaalsContact C-N 3.33Å; W111-I114 PolarHBondContact O-N 2.78Å; W111-A115 PolarHBondContact O-N 3.23Å; W111-A115 VanDerWaalsContact O-N 3.09Å; W111-V133 HydrophobicContact CE3-CG2 3.83Å; W111-V133 HydrophobicContact CH2-CG2 4.48Å; W111-V133 HydrophobicContact CZ3-CG2 3.68Å; W111-A142 HydrophobicContact CB-CB 4.29Å; W111-F145 AromaticContact CD2-CD1 3.91Å; W111-F145 HydrophobicContact CD2-CD1 3.91Å; W111-F145 AromaticContact CD2-CE1 3.71Å; W111-F145 HydrophobicContact CD2-CE1 3.71Å; W111-F145 AromaticContact CE2-CE1 3.57Å; W111-F145 HydrophobicContact CE3-CD1 4.37Å; W111-F145 AromaticContact CE3-CE1 3.94Å; W111-F145 HydrophobicContact CE3-CE1 3.94Å; W111-F145 HydrophobicContact CG-CD1 4.06Å; W111-F145 HydrophobicContact CG-CE1 4.34Å; W111-F145 AromaticContact CH2-CE1 3.92Å; W111-F145 HydrophobicContact CH2-CE1 3.92Å; W111-F145 AromaticContact CZ2-CE1 3.7Å; W111-F145 HydrophobicContact CZ2-CE1 3.7Å; W111-F145 HydrophobicContact CZ2-CZ 4.48Å; W111-F145 HydrophobicContact CZ3-CE1 4.04Å; W111-I160 HydrophobicContact CH2-CD1 3.97Å; W111-G167 VanDerWaalsContact CH2-O 3.24Å; W111-G167 WeakPolarHBondContact CH2-O 3.31Å; W111-L170 HydrophobicContact CD2-CD2 3.53Å; W111-L170 HydrophobicContact CD2-CG 4.49Å; W111-L170 HydrophobicContact CE3-CD2 3.92Å; W111-L170 HydrophobicContact CG-CD2 3.92Å; W111-L170 HydrophobicContact CH2-CB 4.36Å; W111-L170 HydrophobicContact CH2-CD2 4.24Å; W111-L170 HydrophobicContact CH2-CG 4.48Å; W111-L170 HydrophobicContact CZ2-CB 4.27Å; W111-L170 HydrophobicContact CZ2-CD2 3.88Å; W111-L170 HydrophobicContact CZ2-CG 3.98Å; W111-L170 HydrophobicContact CZ3-CD2 4.26Å; W111-L171 HydrophobicContact CH2-CB 4.3Å; W111-L171 HydrophobicContact CZ2-CB 4.2Å
112	W	96	Very high	94.9	Very high	89 Å²	89	59 Å²	59	34%	0.337	29%	0.285	S	S	.	.	H	α-helix	trans	-63.1	-40.3	175.5	-178.7	70.7	0	0	0	111.9	G108 M109 I110 A115 Y116 F139 A142	G108-W112 WeakPolarHBondContact O-CB 3.44Å; G108-W112 PolarHBondContact O-N 2.9Å; M109-W112 PolarHBondContact O-N 3.1Å; I110-W112 VanDerWaalsContact C-N 3.34Å; I110-W112 PolarHBondContact O-N 2.92Å; W112-A115 PolarHBondContact O-N 2.75Å; W112-Y116 WeakPolarHBondContact O-CB 3.14Å; W112-Y116 PolarHBondContact O-N 3.05Å; W112-F139 HydrophobicContact CB-CD2 4.15Å; W112-F139 HydrophobicContact CD2-CD2 4.42Å; W112-F139 HydrophobicContact CG-CB 4.47Å; W112-F139 HydrophobicContact CG-CD2 4.12Å; W112-A142 HydrophobicContact CB-CB 3.77Å
113	L	95.9	Very high	94.4	Very high	83 Å²	83	58.1 Å²	58.1	44%	0.435	28%	0.275	S	S	.	.	H	α-helix	trans	-66.5	-40.8	178.5	-174.6	64	0	0	0	112.4	M109 I110 W111 Y116 I117	M109-L113 VanDerWaalsContact O-CB 3.28Å; M109-L113 WeakPolarHBondContact O-CB 3.44Å; M109-L113 PolarHBondContact O-N 3.48Å; I110-L113 PolarHBondContact O-N 2.86Å; I110-L113 VanDerWaalsContact O-N 3.17Å; W111-L113 VanDerWaalsContact C-N 3.33Å; L113-Y116 PolarHBondContact O-N 2.81Å; L113-I117 HydrophobicContact CD1-CD1 3.99Å; L113-I117 HydrophobicContact CD1-CG1 4.22Å; L113-I117 HydrophobicContact CD2-CD1 4.42Å; L113-I117 HydrophobicContact CG-CD1 3.79Å; L113-I117 HydrophobicContact CG-CG1 4.39Å; L113-I117 WeakPolarHBondContact O-CB 3.32Å; L113-I117 VanDerWaalsContact O-CG1 3.3Å; L113-I117 WeakPolarHBondContact O-CG1 3.24Å; L113-I117 PolarHBondContact O-N 2.81Å
114	I	94.9	Very high	93.9	Very high	18 Å²	18	61.6 Å²	61.6	9%	0.092	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-46.7	174.6	-69.2	177.9	0	0	0	110.2	I110 W111 Y116 I117 R118 E166 L170	I110-I114 HydrophobicContact CG2-CD1 4.23Å; I110-I114 HydrophobicContact CG2-CG1 4.42Å; I110-I114 WeakPolarHBondContact O-CG1 3.36Å; I110-I114 PolarHBondContact O-N 2.8Å; W111-I114 PolarHBondContact O-N 2.78Å; I114-Y116 VanDerWaalsContact C-N 3.27Å; I114-Y116 PolarHBondContact O-N 3.18Å; I114-I117 PolarHBondContact O-N 3.49Å; I114-R118 WeakPolarHBondContact O-CB 3.48Å; I114-R118 PolarHBondContact O-N 2.93Å; I114-E166 HydrophobicContact CD1-CB 4.42Å; I114-L170 HydrophobicContact CD1-CB 4.16Å; I114-L170 HydrophobicContact CD1-CD2 3.57Å; I114-L170 HydrophobicContact CD1-CG 4.46Å
115	A	94.3	Very high	93.2	Very high	4 Å²	4	68.1 Å²	68.1	3%	0.033	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-37.7	176.9	0	0	0	0	0	112	W111 W112 G119 D120 M121 L136	W111-A115 PolarHBondContact O-N 3.23Å; W111-A115 VanDerWaalsContact O-N 3.09Å; W112-A115 PolarHBondContact O-N 2.75Å; A115-G119 PolarHBondContact O-N 2.86Å; A115-D120 HydrophobicContact CB-CB 4.27Å; A115-D120 WeakPolarHBondContact O-CB 3.41Å; A115-D120 PolarHBondContact O-N 2.87Å; A115-M121 HydrophobicContact CB-CG 4.48Å; A115-L136 HydrophobicContact CB-CD1 4.22Å; A115-L136 HydrophobicContact CB-CD2 4.14Å
116	Y	94.3	Very high	92.7	Very high	140 Å²	140	68.2 Å²	68.2	55%	0.549	33%	0.325	S	S	.	.	H	α-helix	trans	-68.8	-49.9	176.9	-176.7	-107	0	0	0	112.7	W112 L113 I114 R118 G119	W112-Y116 WeakPolarHBondContact O-CB 3.14Å; W112-Y116 PolarHBondContact O-N 3.05Å; L113-Y116 PolarHBondContact O-N 2.81Å; I114-Y116 VanDerWaalsContact C-N 3.27Å; I114-Y116 PolarHBondContact O-N 3.18Å; Y116-R118 VanDerWaalsContact C-N 3.28Å; Y116-R118 PolarHBondContact O-N 2.71Å; Y116-G119 PolarHBondContact O-N 3.14Å; Y116-G119 VanDerWaalsContact O-N 3.1Å
117	I	94.4	Very high	92.2	Very high	119 Å²	119	69.2 Å²	69.2	61%	0.61	34%	0.343	S	S	*	.	H	α-helix	trans	-63.6	-36.7	-179.3	-69.5	169.7	0	0	0	111.3	L113 I114 G119	L113-I117 HydrophobicContact CD1-CD1 3.99Å; L113-I117 HydrophobicContact CD1-CG1 4.22Å; L113-I117 HydrophobicContact CD2-CD1 4.42Å; L113-I117 HydrophobicContact CG-CD1 3.79Å; L113-I117 HydrophobicContact CG-CG1 4.39Å; L113-I117 WeakPolarHBondContact O-CB 3.32Å; L113-I117 VanDerWaalsContact O-CG1 3.3Å; L113-I117 WeakPolarHBondContact O-CG1 3.24Å; L113-I117 PolarHBondContact O-N 2.81Å; I114-I117 PolarHBondContact O-N 3.49Å; I117-G119 PolarHBondContact O-N 3.37Å
118	R	91.5	Very high	91.8	Very high	82 Å²	82	74.2 Å²	74.2	31%	0.309	38%	0.379	S	S	.	.	H	α-helix	trans	-71.7	-19.2	178.1	-174.8	174.5	167.4	88.3	5	113.1	I114 Y116 D120 W129 K163	I114-R118 WeakPolarHBondContact O-CB 3.48Å; I114-R118 PolarHBondContact O-N 2.93Å; Y116-R118 VanDerWaalsContact C-N 3.28Å; Y116-R118 PolarHBondContact O-N 2.71Å; R118-D120 WeakPolarHBondContact CD-OD1 3.39Å; R118-D120 WeakPolarHBondContact CG-OD1 3.48Å; R118-D120 IonicContact NE-OD1 3.17Å; R118-D120 PolarHBondContact NE-OD1 2.87Å; R118-D120 IonicContact NE-OD2 3.76Å; R118-W129 HydrophobicContact CG-CZ2 4.13Å; R118-K163 PolarHBondContact NH1-O 2.85Å; R118-K163 PolarHBondContact NH2-O 2.92Å
119	G	92.3	Very high	91.5	Very high	10 Å²	10	78.4 Å²	78.4	10%	0.103	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	81	17.3	-174.5	0	0	0	0	0	113.7	A115 Y116 I117 M121 D122 H123	A115-G119 PolarHBondContact O-N 2.86Å; Y116-G119 PolarHBondContact O-N 3.14Å; Y116-G119 VanDerWaalsContact O-N 3.1Å; I117-G119 PolarHBondContact O-N 3.37Å; G119-M121 PolarHBondContact O-N 3.42Å; G119-D122 PolarHBondContact O-N 3.35Å; G119-H123 PolarHBondContact O-ND1 3.5Å
120	D	91.4	Very high	91.3	Very high	10 Å²	10	76.3 Å²	76.3	5%	0.053	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-29.9	177.7	-69.7	-17.8	0	0	0	111.5	A115 R118 D122 W129 P131 C132	A115-D120 HydrophobicContact CB-CB 4.27Å; A115-D120 WeakPolarHBondContact O-CB 3.41Å; A115-D120 PolarHBondContact O-N 2.87Å; R118-D120 WeakPolarHBondContact CD-OD1 3.39Å; R118-D120 WeakPolarHBondContact CG-OD1 3.48Å; R118-D120 IonicContact NE-OD1 3.17Å; R118-D120 PolarHBondContact NE-OD1 2.87Å; R118-D120 IonicContact NE-OD2 3.76Å; D120-D122 VanDerWaalsContact C-N 3.31Å; D120-D122 PolarHBondContact O-N 3.27Å; D120-W129 PolarHBondContact OD1-NE1 3.41Å; D120-P131 HydrophobicContact CB-CB 3.91Å; D120-P131 WeakPolarHBondContact OD1-CA 3.37Å; D120-C132 WeakPolarHBondContact OD2-CB 3.26Å; D120-C132 PolarHBondContact OD2-N 3.19Å
121	M	87.4	Confident	91.1	Very high	41 Å²	41	75.7 Å²	75.7	20%	0.202	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-23.7	178.7	-63.7	-67.9	-57.8	0	0	113.3	A115 G119 I124 L136 N137	A115-M121 HydrophobicContact CB-CG 4.48Å; G119-M121 PolarHBondContact O-N 3.42Å; M121-I124 WeakPolarHBondContact O-CD1 3.47Å; M121-I124 WeakPolarHBondContact O-CG1 3.43Å; M121-L136 HydrophobicContact SD-CD2 4.14Å; M121-N137 WeakPolarHBondContact CE-O 3.29Å
122	D	89.3	Confident	91	Very high	127 Å²	127	75.7 Å²	75.7	68%	0.679	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-20.9	-178.5	-63.1	-34	0	0	0	112.1	G119 D120	G119-D122 PolarHBondContact O-N 3.35Å; D120-D122 VanDerWaalsContact C-N 3.31Å; D120-D122 PolarHBondContact O-N 3.27Å
123	H	87.8	Confident	90.9	Very high	73 Å²	73	71.6 Å²	71.6	34%	0.338	37%	0.372	S	S	.	.			trans	-115.9	34.8	-172	-56.9	88.7	0	0	0	112.5	G119 E125 D126 W129	G119-H123 PolarHBondContact O-ND1 3.5Å; H123-E125 VanDerWaalsContact C-N 3.34Å; H123-E125 PolarHBondContact O-N 2.93Å; H123-D126 HydrophobicContact CB-CB 4.17Å; H123-D126 IonicContact CD2-OD2 3.23Å; H123-D126 PolarHBondContact CD2-OD2 3.16Å; H123-D126 VanDerWaalsContact CD2-OD2 3.23Å; H123-D126 IonicContact CG-OD2 3.78Å; H123-D126 PolarHBondContact O-N 3.35Å; H123-W129 HydrophobicContact CB-CB 3.89Å; H123-W129 HydrophobicContact CB-CD2 4.31Å; H123-W129 HydrophobicContact CB-CG 3.77Å
124	I	85.2	Confident	90.8	Very high	95 Å²	95	69.7 Å²	69.7	49%	0.487	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-37.2	-173.7	-64.3	171.8	0	0	0	112.5	M121	M121-I124 WeakPolarHBondContact O-CD1 3.47Å; M121-I124 WeakPolarHBondContact O-CG1 3.43Å
125	E	82.6	Confident	90.7	Very high	188 Å²	188	72 Å²	72	88%	0.879	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-1.2	-178.1	-63.9	-174.8	174.8	0	0	113.1	H123 P127	H123-E125 VanDerWaalsContact C-N 3.34Å; H123-E125 PolarHBondContact O-N 2.93Å; E125-P127 VanDerWaalsContact O-CD 3.25Å; E125-P127 WeakPolarHBondContact O-CD 3.49Å
126	D	87.7	Confident	90.6	Very high	76 Å²	76	72.5 Å²	72.5	41%	0.406	38%	0.379	S	S	.	.			trans	-84.2	111.5	-175.4	-79.8	-40.6	0	0	0	111.7	H123 S128 W129	H123-D126 HydrophobicContact CB-CB 4.17Å; H123-D126 IonicContact CD2-OD2 3.23Å; H123-D126 PolarHBondContact CD2-OD2 3.16Å; H123-D126 VanDerWaalsContact CD2-OD2 3.23Å; H123-D126 IonicContact CG-OD2 3.78Å; H123-D126 PolarHBondContact O-N 3.35Å; D126-S128 PolarHBondContact O-N 2.81Å; D126-S128 VanDerWaalsContact O-N 3.09Å; D126-W129 HydrophobicContact CB-CB 4.18Å; D126-W129 PolarHBondContact O-N 3.49Å; D126-W129 VanDerWaalsContact O-N 3.13Å
127	P	85.9	Confident	90.4	Very high	133 Å²	133	70.8 Å²	70.8	86%	0.864	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-13.9	-178.2	29.2	-36.2	0	0	0	113.3	E125	E125-P127 VanDerWaalsContact O-CD 3.25Å; E125-P127 WeakPolarHBondContact O-CD 3.49Å
128	S	89.4	Confident	90.2	Very high	112 Å²	112	66 Å²	66	78%	0.783	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-20.3	177.8	70	0	0	0	0	113.2	D126	D126-S128 PolarHBondContact O-N 2.81Å; D126-S128 VanDerWaalsContact O-N 3.09Å
129	W	91.6	Very high	90.4	Very high	87 Å²	87	65.9 Å²	65.9	33%	0.33	36%	0.361	S	S	.	.			trans	-92.7	134.4	-179.4	-171.4	-95.6	0	0	0	110.5	R118 D120 H123 D126	R118-W129 HydrophobicContact CG-CZ2 4.13Å; D120-W129 PolarHBondContact OD1-NE1 3.41Å; H123-W129 HydrophobicContact CB-CB 3.89Å; H123-W129 HydrophobicContact CB-CD2 4.31Å; H123-W129 HydrophobicContact CB-CG 3.77Å; D126-W129 HydrophobicContact CB-CB 4.18Å; D126-W129 PolarHBondContact O-N 3.49Å; D126-W129 VanDerWaalsContact O-N 3.13Å
130	T	92.1	Very high	90.6	Very high	66 Å²	66	70.3 Å²	70.3	41%	0.405	39%	0.385	S	S	.	.			trans	-113.9	110.4	175.6	33.8	0	0	0	0	108.2	K163	T130-K163 WeakPolarHBondContact OG1-CE 3.42Å; T130-K163 WeakPolarHBondContact OG1-CG 3.43Å
131	P	93.2	Very high	90.7	Very high	35 Å²	35	70.5 Å²	70.5	23%	0.227	39%	0.388	C	S	.	.			trans	-71.1	164	-177.2	31.4	-36.6	0	0	0	110.9	D120 V133 T161	D120-P131 HydrophobicContact CB-CB 3.91Å; D120-P131 WeakPolarHBondContact OD1-CA 3.37Å; P131-V133 VanDerWaalsContact C-N 3.27Å; P131-V133 PolarHBondContact O-N 2.78Å; P131-T161 WeakPolarHBondContact O-CG2 3.2Å; P131-T161 PolarHBondContact O-OG1 2.86Å
132	C	92.8	Very high	91.2	Very high	2 Å²	2	68.6 Å²	68.6	1%	0.014	38%	0.378	C	S	.	.	S	Bend	trans	-60.7	-39.8	175.3	-173.9	0	0	0	0	112	D120 I160 T161 C164	D120-C132 WeakPolarHBondContact OD2-CB 3.26Å; D120-C132 PolarHBondContact OD2-N 3.19Å; C132-I160 WeakPolarHBondContact O-CA 3.41Å; C132-T161 PolarHBondContact O-N 3.14Å; C132-T161 PolarHBondContact O-OG1 3.13Å; C132-C164 WeakPolarHBondContact CA-SG 3.44Å; C132-C164 HydrophobicContact CB-CB 3.6Å; C132-C164 WeakPolarHBondContact CB-SG 3.4Å; C132-C164 WeakPolarHBondContact SG-CB 3.48Å; C132-C164 CovalentContact SG-SG 2.02Å; C132-C164 PolarHBondContact SG-SG 2.82Å
133	V	95	Very high	91.5	Very high	2 Å²	2	65 Å²	65	1%	0.012	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-130.4	125.6	174.1	-178.9	0	0	0	0	108.5	W111 P131 L136 F145 R158 V159	W111-V133 HydrophobicContact CE3-CG2 3.83Å; W111-V133 HydrophobicContact CH2-CG2 4.48Å; W111-V133 HydrophobicContact CZ3-CG2 3.68Å; P131-V133 VanDerWaalsContact C-N 3.27Å; P131-V133 PolarHBondContact O-N 2.78Å; V133-L136 HydrophobicContact CB-CB 4.46Å; V133-L136 HydrophobicContact CB-CD1 4.02Å; V133-L136 HydrophobicContact CG1-CD1 4.44Å; V133-L136 HydrophobicContact CG2-CD1 4.49Å; V133-F145 HydrophobicContact CB-CE1 4.39Å; V133-F145 HydrophobicContact CG1-CD1 3.99Å; V133-F145 HydrophobicContact CG1-CD2 3.89Å; V133-F145 HydrophobicContact CG1-CE1 3.95Å; V133-F145 HydrophobicContact CG1-CE2 3.83Å; V133-F145 HydrophobicContact CG1-CG 3.95Å; V133-F145 HydrophobicContact CG1-CZ 3.86Å; V133-F145 HydrophobicContact CG2-CD1 4.08Å; V133-F145 HydrophobicContact CG2-CE1 3.53Å; V133-F145 HydrophobicContact CG2-CZ 3.84Å; V133-R158 HydrophobicContact CG1-CB 3.91Å; V133-V159 WeakPolarHBondContact CA-O 3.15Å
134	T	93.6	Very high	92	Very high	43 Å²	43	64.8 Å²	64.8	26%	0.264	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	144.3	178.5	60.6	0	0	0	0	111.3	L136 Y157 R158 V159 T161	T134-L136 VanDerWaalsContact C-N 3.35Å; T134-L136 PolarHBondContact O-N 3.08Å; T134-Y157 PolarHBondContact OG1-O 2.72Å; T134-R158 WeakPolarHBondContact O-CA 3.33Å; T134-V159 PolarHBondContact N-O 2.74Å; T134-V159 PolarHBondContact OG1-N 3.09Å; T134-V159 PolarHBondContact OG1-O 3.25Å; T134-T161 HydrophobicContact CG2-CG2 4.07Å
135	N	92.1	Very high	92.5	Very high	67 Å²	67	60.8 Å²	60.8	36%	0.358	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	36.1	176.2	-56.7	-54.1	0	0	0	115.3	N137 Y157	N135-N137 PolarHBondContact O-N 3.25Å; N135-Y157 HydrophobicContact CB-CD1 3.83Å; N135-Y157 HydrophobicContact CB-CE1 3.43Å; N135-Y157 VanDerWaalsContact CB-CE1 3.43Å; N135-Y157 PolarHBondContact ND2-O 3.14Å
136	L	92.9	Very high	93.2	Very high	15 Å²	15	51.8 Å²	51.8	8%	0.079	30%	0.295	C	S	.	.			trans	-96.6	80.5	173.1	-158.9	166.9	0	0	0	109.6	A115 M121 V133 T134 A142	A115-L136 HydrophobicContact CB-CD1 4.22Å; A115-L136 HydrophobicContact CB-CD2 4.14Å; M121-L136 HydrophobicContact SD-CD2 4.14Å; V133-L136 HydrophobicContact CB-CB 4.46Å; V133-L136 HydrophobicContact CB-CD1 4.02Å; V133-L136 HydrophobicContact CG1-CD1 4.44Å; V133-L136 HydrophobicContact CG2-CD1 4.49Å; T134-L136 VanDerWaalsContact C-N 3.35Å; T134-L136 PolarHBondContact O-N 3.08Å; L136-A142 HydrophobicContact CD1-CB 4.16Å; L136-A142 HydrophobicContact CD2-CB 3.97Å; L136-A142 HydrophobicContact CG-CB 4.16Å
137	N	89.7	Confident	93.7	Very high	103 Å²	103	49.9 Å²	49.9	55%	0.551	28%	0.284	S	S	*	.			trans	-82.8	-12.7	-172.3	-58.6	0.9	0	0	0	114.1	M121 N135 S141	M121-N137 WeakPolarHBondContact CE-O 3.29Å; N135-N137 PolarHBondContact O-N 3.25Å; N137-S141 PolarHBondContact N-OG 2.77Å
138	G	91.7	Very high	94.2	Very high	19 Å²	19	43.9 Å²	43.9	20%	0.196	25%	0.245	C	C	.	.	S	Bend	trans	179.9	-174.1	-174.3	0	0	0	0	0	113.5	V140 S141 A142	G138-V140 PolarHBondContact O-N 3.05Å; G138-S141 PolarHBondContact N-OG 2.89Å; G138-S141 PolarHBondContact O-N 3.27Å; G138-S141 PolarHBondContact O-OG 3.27Å; G138-A142 PolarHBondContact O-N 2.93Å; G138-A142 VanDerWaalsContact O-N 3.15Å
139	F	94.1	Very high	94.5	Very high	80 Å²	80	39.6 Å²	39.6	35%	0.351	21%	0.214	S	C	.	.	H	α-helix	trans	-60.5	-42.4	-178.5	178.7	-108	0	0	0	112.7	L105 M109 W112 S141 A142 F143	L105-F139 HydrophobicContact CD2-CZ 4.18Å; M109-F139 HydrophobicContact CG-CE2 3.79Å; M109-F139 HydrophobicContact CG-CZ 4.19Å; W112-F139 HydrophobicContact CB-CD2 4.15Å; W112-F139 HydrophobicContact CD2-CD2 4.42Å; W112-F139 HydrophobicContact CG-CB 4.47Å; W112-F139 HydrophobicContact CG-CD2 4.12Å; F139-S141 VanDerWaalsContact C-N 3.33Å; F139-S141 PolarHBondContact O-N 2.78Å; F139-A142 WeakPolarHBondContact O-CB 3.41Å; F139-A142 PolarHBondContact O-N 2.73Å; F139-A142 VanDerWaalsContact O-N 3.13Å; F139-F143 PolarHBondContact O-N 3.35Å
140	V	96.3	Very high	94.8	Very high	102 Å²	102	36.6 Å²	36.6	62%	0.618	20%	0.203	S	C	*	.	H	α-helix	trans	-64.4	-37.8	-178.7	-179.1	0	0	0	0	111.6	G138 F143 L144	G138-V140 PolarHBondContact O-N 3.05Å; V140-F143 PolarHBondContact O-N 2.87Å; V140-L144 HydrophobicContact CG1-CD1 4.48Å; V140-L144 WeakPolarHBondContact O-CG 3.48Å; V140-L144 PolarHBondContact O-N 3.43Å
141	S	95.3	Very high	95	Very high	15 Å²	15	35.8 Å²	35.8	11%	0.105	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-34.9	174.1	44.1	0	0	0	0	112.7	N137 G138 F139 L144 F145	N137-S141 PolarHBondContact N-OG 2.77Å; G138-S141 PolarHBondContact N-OG 2.89Å; G138-S141 PolarHBondContact O-N 3.27Å; G138-S141 PolarHBondContact O-OG 3.27Å; F139-S141 VanDerWaalsContact C-N 3.33Å; F139-S141 PolarHBondContact O-N 2.78Å; S141-L144 PolarHBondContact O-N 2.9Å; S141-F145 WeakPolarHBondContact O-CB 3.34Å; S141-F145 PolarHBondContact O-N 3.15Å
142	A	96	Very high	95.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-39.8	173.2	0	0	0	0	0	111.6	G108 W111 W112 L136 G138 F139 F145 S146	G108-A142 WeakPolarHBondContact O-CB 3.21Å; W111-A142 HydrophobicContact CB-CB 4.29Å; W112-A142 HydrophobicContact CB-CB 3.77Å; L136-A142 HydrophobicContact CD1-CB 4.16Å; L136-A142 HydrophobicContact CD2-CB 3.97Å; L136-A142 HydrophobicContact CG-CB 4.16Å; G138-A142 PolarHBondContact O-N 2.93Å; G138-A142 VanDerWaalsContact O-N 3.15Å; F139-A142 WeakPolarHBondContact O-CB 3.41Å; F139-A142 PolarHBondContact O-N 2.73Å; F139-A142 VanDerWaalsContact O-N 3.13Å; A142-F145 PolarHBondContact O-N 2.95Å; A142-S146 WeakPolarHBondContact O-CB 3.44Å; A142-S146 PolarHBondContact O-N 2.81Å
143	F	97	Very high	95.3	Very high	51 Å²	51	44 Å²	44	22%	0.224	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-44.4	174.4	178.9	-110.8	0	0	0	112.1	W104 L105 F139 V140 S146 I147	W104-F143 HydrophobicContact CB-CD2 4.38Å; W104-F143 HydrophobicContact CB-CE2 3.69Å; W104-F143 HydrophobicContact CB-CZ 4.4Å; L105-F143 HydrophobicContact CD2-CD2 3.81Å; L105-F143 HydrophobicContact CD2-CE2 3.68Å; L105-F143 HydrophobicContact CD2-CZ 4.46Å; L105-F143 HydrophobicContact CG-CD2 4.35Å; L105-F143 HydrophobicContact CG-CE2 3.85Å; F139-F143 PolarHBondContact O-N 3.35Å; V140-F143 PolarHBondContact O-N 2.87Å; F143-S146 WeakPolarHBondContact O-CB 3.28Å; F143-S146 PolarHBondContact O-N 2.74Å; F143-I147 HydrophobicContact CD1-CD1 4.01Å; F143-I147 HydrophobicContact CE1-CD1 3.48Å; F143-I147 VanDerWaalsContact CE1-CD1 3.48Å; F143-I147 HydrophobicContact CE2-CD1 4.2Å; F143-I147 HydrophobicContact CE2-CG1 4.48Å; F143-I147 HydrophobicContact CZ-CD1 3.6Å; F143-I147 HydrophobicContact CZ-CG1 4.33Å; F143-I147 WeakPolarHBondContact O-CG1 3.27Å; F143-I147 PolarHBondContact O-N 2.97Å
144	L	96.9	Very high	95.2	Very high	69 Å²	69	46.2 Å²	46.2	36%	0.361	27%	0.267	S	S	.	.	H	α-helix	trans	-60.8	-45.6	174	-72.5	170.8	0	0	0	111.6	V140 S141 S146 I147 E148	V140-L144 HydrophobicContact CG1-CD1 4.48Å; V140-L144 WeakPolarHBondContact O-CG 3.48Å; V140-L144 PolarHBondContact O-N 3.43Å; S141-L144 PolarHBondContact O-N 2.9Å; L144-S146 VanDerWaalsContact C-N 3.31Å; L144-S146 PolarHBondContact O-N 3.05Å; L144-I147 PolarHBondContact O-N 2.9Å; L144-E148 WeakPolarHBondContact O-CB 3.28Å; L144-E148 VanDerWaalsContact O-CG 3.29Å; L144-E148 WeakPolarHBondContact O-CG 3.29Å; L144-E148 PolarHBondContact O-N 2.9Å
145	F	96.7	Very high	95.3	Very high	11 Å²	11	52.2 Å²	52.2	5%	0.048	29%	0.286	C	S	.	.	H	α-helix	trans	-61.7	-38.8	176.4	-179.8	-113.1	0	0	0	112.5	W111 V133 S141 A142 E148 T149 R158	W111-F145 AromaticContact CD2-CD1 3.91Å; W111-F145 HydrophobicContact CD2-CD1 3.91Å; W111-F145 AromaticContact CD2-CE1 3.71Å; W111-F145 HydrophobicContact CD2-CE1 3.71Å; W111-F145 AromaticContact CE2-CE1 3.57Å; W111-F145 HydrophobicContact CE3-CD1 4.37Å; W111-F145 AromaticContact CE3-CE1 3.94Å; W111-F145 HydrophobicContact CE3-CE1 3.94Å; W111-F145 HydrophobicContact CG-CD1 4.06Å; W111-F145 HydrophobicContact CG-CE1 4.34Å; W111-F145 AromaticContact CH2-CE1 3.92Å; W111-F145 HydrophobicContact CH2-CE1 3.92Å; W111-F145 AromaticContact CZ2-CE1 3.7Å; W111-F145 HydrophobicContact CZ2-CE1 3.7Å; W111-F145 HydrophobicContact CZ2-CZ 4.48Å; W111-F145 HydrophobicContact CZ3-CE1 4.04Å; V133-F145 HydrophobicContact CB-CE1 4.39Å; V133-F145 HydrophobicContact CG1-CD1 3.99Å; V133-F145 HydrophobicContact CG1-CD2 3.89Å; V133-F145 HydrophobicContact CG1-CE1 3.95Å; V133-F145 HydrophobicContact CG1-CE2 3.83Å; V133-F145 HydrophobicContact CG1-CG 3.95Å; V133-F145 HydrophobicContact CG1-CZ 3.86Å; V133-F145 HydrophobicContact CG2-CD1 4.08Å; V133-F145 HydrophobicContact CG2-CE1 3.53Å; V133-F145 HydrophobicContact CG2-CZ 3.84Å; S141-F145 WeakPolarHBondContact O-CB 3.34Å; S141-F145 PolarHBondContact O-N 3.15Å; A142-F145 PolarHBondContact O-N 2.95Å; F145-E148 PolarHBondContact O-N 2.92Å; F145-T149 VanDerWaalsContact O-CB 3.31Å; F145-T149 WeakPolarHBondContact O-CB 3.3Å; F145-T149 PolarHBondContact O-N 2.9Å; F145-T149 PolarHBondContact O-OG1 2.79Å; F145-R158 HydrophobicContact CB-CB 4.25Å; F145-R158 HydrophobicContact CB-CG 4.48Å; F145-R158 HydrophobicContact CD2-CB 3.48Å; F145-R158 VanDerWaalsContact CD2-CB 3.48Å; F145-R158 HydrophobicContact CE2-CB 4.17Å; F145-R158 WeakPolarHBondContact CE2-O 3.35Å; F145-R158 HydrophobicContact CG-CB 4.16Å
146	S	97.3	Very high	95.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.1	-46.5	174.2	-179.3	0	0	0	0	111.6	W104 F107 G108 A142 F143 L144 T149 E150 Q174	W104-S146 PolarHBondContact O-OG 3.35Å; F107-S146 WeakPolarHBondContact CB-OG 3.45Å; G108-S146 PolarHBondContact N-OG 2.77Å; A142-S146 WeakPolarHBondContact O-CB 3.44Å; A142-S146 PolarHBondContact O-N 2.81Å; F143-S146 WeakPolarHBondContact O-CB 3.28Å; F143-S146 PolarHBondContact O-N 2.74Å; L144-S146 VanDerWaalsContact C-N 3.31Å; L144-S146 PolarHBondContact O-N 3.05Å; S146-T149 PolarHBondContact O-N 3.16Å; S146-E150 WeakPolarHBondContact O-CB 3.35Å; S146-E150 PolarHBondContact O-N 3.02Å; S146-Q174 PolarHBondContact O-NE2 2.86Å
147	I	97.4	Very high	95.4	Very high	36 Å²	36	57.1 Å²	57.1	19%	0.185	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-50.3	175	-64.4	169.8	0	0	0	110.5	W104 F143 L144 T149 E150 T151	W104-I147 HydrophobicContact CB-CG1 3.91Å; W104-I147 HydrophobicContact CD2-CD1 4.36Å; W104-I147 HydrophobicContact CD2-CG1 3.69Å; W104-I147 HydrophobicContact CE3-CD1 4.04Å; W104-I147 HydrophobicContact CE3-CG1 3.89Å; W104-I147 HydrophobicContact CG-CG1 3.69Å; F143-I147 HydrophobicContact CD1-CD1 4.01Å; F143-I147 HydrophobicContact CE1-CD1 3.48Å; F143-I147 VanDerWaalsContact CE1-CD1 3.48Å; F143-I147 HydrophobicContact CE2-CD1 4.2Å; F143-I147 HydrophobicContact CE2-CG1 4.48Å; F143-I147 HydrophobicContact CZ-CD1 3.6Å; F143-I147 HydrophobicContact CZ-CG1 4.33Å; F143-I147 WeakPolarHBondContact O-CG1 3.27Å; F143-I147 PolarHBondContact O-N 2.97Å; L144-I147 PolarHBondContact O-N 2.9Å; I147-T149 PolarHBondContact O-N 2.72Å; I147-E150 PolarHBondContact O-N 2.73Å; I147-T151 HydrophobicContact CG2-CG2 4.13Å; I147-T151 WeakPolarHBondContact O-CB 3.32Å; I147-T151 PolarHBondContact O-N 2.79Å; I147-T151 PolarHBondContact O-OG1 2.79Å
148	E	97	Very high	95.7	Very high	6 Å²	6	54.8 Å²	54.8	3%	0.028	30%	0.299	C	S	.	.	H	α-helix	trans	-54.2	-37.9	-179.7	-74.7	176.2	-137	0	0	112	L144 F145 T152 I153 G154 Y155 R158	L144-E148 WeakPolarHBondContact O-CB 3.28Å; L144-E148 VanDerWaalsContact O-CG 3.29Å; L144-E148 WeakPolarHBondContact O-CG 3.29Å; L144-E148 PolarHBondContact O-N 2.9Å; F145-E148 PolarHBondContact O-N 2.92Å; E148-T152 CarbonylContact O-C 3.56Å; E148-T152 PolarHBondContact O-N 2.73Å; E148-I153 PolarHBondContact O-N 2.83Å; E148-G154 PolarHBondContact O-N 2.8Å; E148-Y155 VanDerWaalsContact CD-CD2 3.43Å; E148-Y155 HydrophobicContact CG-CD2 3.53Å; E148-Y155 HydrophobicContact CG-CE2 3.96Å; E148-Y155 HydrophobicContact CG-CG 4.5Å; E148-Y155 PolarHBondContact OE2-N 3.15Å; E148-R158 WeakPolarHBondContact OE1-CD 3.47Å; E148-R158 IonicContact OE1-CZ 3.99Å; E148-R158 IonicContact OE1-NE 3.27Å; E148-R158 IonicContact OE1-NH1 3.9Å; E148-R158 PolarHBondContact OE1-NH1 3.32Å
149	T	96.5	Very high	95.8	Very high	22 Å²	22	57.1 Å²	57.1	14%	0.135	31%	0.31	C	S	.	.	H	α-helix	trans	-77.2	-51	-179.6	-57.8	0	0	0	0	112	F145 S146 I147 T152 L171	F145-T149 VanDerWaalsContact O-CB 3.31Å; F145-T149 WeakPolarHBondContact O-CB 3.3Å; F145-T149 PolarHBondContact O-N 2.9Å; F145-T149 PolarHBondContact O-OG1 2.79Å; S146-T149 PolarHBondContact O-N 3.16Å; I147-T149 PolarHBondContact O-N 2.72Å; T149-T152 PolarHBondContact O-N 3.21Å; T149-L171 HydrophobicContact CG2-CD1 3.23Å
150	E	96.5	Very high	95.9	Very high	24 Å²	24	55.7 Å²	55.7	11%	0.112	31%	0.305	C	S	.	.	H	α-helix	trans	-68.7	-39.6	-175.8	-166.8	170.6	115.5	0	0	112.5	T103 W104 S146 I147 T152	T103-E150 WeakPolarHBondContact CB-OE1 3.48Å; T103-E150 PolarHBondContact OG1-OE1 3.02Å; W104-E150 VanDerWaalsContact CD1-CD 3.45Å; W104-E150 PolarHBondContact NE1-OE1 3.44Å; W104-E150 VanDerWaalsContact NE1-OE1 3.1Å; S146-E150 WeakPolarHBondContact O-CB 3.35Å; S146-E150 PolarHBondContact O-N 3.02Å; I147-E150 PolarHBondContact O-N 2.73Å; E150-T152 PolarHBondContact O-N 2.66Å
151	T	96.3	Very high	95.7	Very high	49 Å²	49	52.2 Å²	52.2	30%	0.301	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.5	176.4	60.9	0	0	0	0	112.9	W104 I147 I153	W104-T151 HydrophobicContact CZ2-CG2 3.74Å; I147-T151 HydrophobicContact CG2-CG2 4.13Å; I147-T151 WeakPolarHBondContact O-CB 3.32Å; I147-T151 PolarHBondContact O-N 2.79Å; I147-T151 PolarHBondContact O-OG1 2.79Å; T151-I153 PolarHBondContact O-N 3.26Å; T151-I153 VanDerWaalsContact OG1-CD1 3.25Å; T151-I153 WeakPolarHBondContact OG1-CD1 3.24Å; T151-I153 VanDerWaalsContact OG1-CG1 3.29Å; T151-I153 WeakPolarHBondContact OG1-CG1 3.23Å
152	T	96.5	Very high	95.6	Very high	123 Å²	123	57.2 Å²	57.2	76%	0.755	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	25.6	-178.8	68.5	0	0	0	0	114.2	E148 T149 E150	E148-T152 CarbonylContact O-C 3.56Å; E148-T152 PolarHBondContact O-N 2.73Å; T149-T152 PolarHBondContact O-N 3.21Å; E150-T152 PolarHBondContact O-N 2.66Å
153	I	96.6	Very high	95.4	Very high	88 Å²	88	61.5 Å²	61.5	45%	0.451	33%	0.328	S	S	.	.			trans	-71.9	-48.2	174.7	-64.1	169.5	0	0	0	110.4	E148 T151 Y155	E148-I153 PolarHBondContact O-N 2.83Å; T151-I153 PolarHBondContact O-N 3.26Å; T151-I153 VanDerWaalsContact OG1-CD1 3.25Å; T151-I153 WeakPolarHBondContact OG1-CD1 3.24Å; T151-I153 VanDerWaalsContact OG1-CG1 3.29Å; T151-I153 WeakPolarHBondContact OG1-CG1 3.23Å; I153-Y155 HydrophobicContact CG2-CD1 3.87Å; I153-Y155 HydrophobicContact CG2-CD2 4.25Å; I153-Y155 HydrophobicContact CG2-CE1 3.52Å; I153-Y155 HydrophobicContact CG2-CE2 3.91Å; I153-Y155 HydrophobicContact CG2-CG 4.21Å
154	G	93.3	Very high	95.1	Very high	48 Å²	48	59.1 Å²	59.1	50%	0.495	32%	0.318	S	S	.	.			trans	48	69.6	175.5	0	0	0	0	0	115	E148 G156	E148-G154 PolarHBondContact O-N 2.8Å; G154-G156 PolarHBondContact O-N 2.89Å
155	Y	95.6	Very high	94.9	Very high	168 Å²	168	60 Å²	60	66%	0.659	33%	0.327	S	S	*	.			trans	-60.5	-18.1	-175.8	-67.9	-63.7	0	0	0	114.2	E148 I153 Y157	E148-Y155 VanDerWaalsContact CD-CD2 3.43Å; E148-Y155 HydrophobicContact CG-CD2 3.53Å; E148-Y155 HydrophobicContact CG-CE2 3.96Å; E148-Y155 HydrophobicContact CG-CG 4.5Å; E148-Y155 PolarHBondContact OE2-N 3.15Å; I153-Y155 HydrophobicContact CG2-CD1 3.87Å; I153-Y155 HydrophobicContact CG2-CD2 4.25Å; I153-Y155 HydrophobicContact CG2-CE1 3.52Å; I153-Y155 HydrophobicContact CG2-CE2 3.91Å; I153-Y155 HydrophobicContact CG2-CG 4.21Å; Y155-Y157 VanDerWaalsContact C-N 3.31Å; Y155-Y157 PolarHBondContact O-N 2.93Å
156	G	93.3	Very high	94.8	Very high	51 Å²	51	64.9 Å²	64.9	53%	0.526	35%	0.351	S	S	.	.	S	Bend	trans	83.1	3.2	177.2	0	0	0	0	0	114.5	G154 V159	G154-G156 PolarHBondContact O-N 2.89Å; G156-V159 VanDerWaalsContact O-CG2 3.23Å; G156-V159 WeakPolarHBondContact O-CG2 3.42Å
157	Y	94.7	Very high	94.7	Very high	134 Å²	134	64.9 Å²	64.9	53%	0.525	35%	0.351	S	S	.	.	S	Bend	trans	-79.1	-34.9	170.1	-170.2	-94.9	0	0	0	111.8	T134 N135 Y155	T134-Y157 PolarHBondContact OG1-O 2.72Å; N135-Y157 HydrophobicContact CB-CD1 3.83Å; N135-Y157 HydrophobicContact CB-CE1 3.43Å; N135-Y157 VanDerWaalsContact CB-CE1 3.43Å; N135-Y157 PolarHBondContact ND2-O 3.14Å; Y155-Y157 VanDerWaalsContact C-N 3.31Å; Y155-Y157 PolarHBondContact O-N 2.93Å
158	R	94.7	Very high	94.6	Very high	54 Å²	54	67.4 Å²	67.4	20%	0.204	36%	0.363	C	S	.	.	S	Bend	trans	-108.5	113.9	172	-61.8	98.4	-176.7	177	5.2	108.4	V133 T134 F145 E148	V133-R158 HydrophobicContact CG1-CB 3.91Å; T134-R158 WeakPolarHBondContact O-CA 3.33Å; F145-R158 HydrophobicContact CB-CB 4.25Å; F145-R158 HydrophobicContact CB-CG 4.48Å; F145-R158 HydrophobicContact CD2-CB 3.48Å; F145-R158 VanDerWaalsContact CD2-CB 3.48Å; F145-R158 HydrophobicContact CE2-CB 4.17Å; F145-R158 WeakPolarHBondContact CE2-O 3.35Å; F145-R158 HydrophobicContact CG-CB 4.16Å; E148-R158 WeakPolarHBondContact OE1-CD 3.47Å; E148-R158 IonicContact OE1-CZ 3.99Å; E148-R158 IonicContact OE1-NE 3.27Å; E148-R158 IonicContact OE1-NH1 3.9Å; E148-R158 PolarHBondContact OE1-NH1 3.32Å
159	V	95.1	Very high	94.6	Very high	69 Å²	69	71.9 Å²	71.9	42%	0.418	39%	0.387	S	S	.	.			trans	-128	134.4	-173.3	-174.2	0	0	0	0	109.1	V133 T134 G156	V133-V159 WeakPolarHBondContact CA-O 3.15Å; T134-V159 PolarHBondContact N-O 2.74Å; T134-V159 PolarHBondContact OG1-N 3.09Å; T134-V159 PolarHBondContact OG1-O 3.25Å; G156-V159 VanDerWaalsContact O-CG2 3.23Å; G156-V159 WeakPolarHBondContact O-CG2 3.42Å
160	I	94.8	Very high	94.6	Very high	50 Å²	50	71.5 Å²	71.5	26%	0.256	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-71.2	141.8	174.6	-167.5	172.5	0	0	0	110.8	W111 C132 I168 L171	W111-I160 HydrophobicContact CH2-CD1 3.97Å; C132-I160 WeakPolarHBondContact O-CA 3.41Å; I160-I168 HydrophobicContact CD1-CG1 4.25Å; I160-L171 HydrophobicContact CD1-CB 4.18Å; I160-L171 HydrophobicContact CD1-CD2 3.94Å; I160-L171 HydrophobicContact CG2-CD2 4.23Å
161	T	93.5	Very high	94.6	Very high	29 Å²	29	72.7 Å²	72.7	18%	0.178	39%	0.39	C	S	.	.			trans	-109.8	168.3	178.8	70.7	0	0	0	0	112.4	P131 C132 T134 K163	P131-T161 WeakPolarHBondContact O-CG2 3.2Å; P131-T161 PolarHBondContact O-OG1 2.86Å; C132-T161 PolarHBondContact O-N 3.14Å; C132-T161 PolarHBondContact O-OG1 3.13Å; T134-T161 HydrophobicContact CG2-CG2 4.07Å; T161-K163 PolarHBondContact O-N 2.84Å
162	D	92.8	Very high	94.6	Very high	120 Å²	120	75.9 Å²	75.9	64%	0.642	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-6.5	177.8	62.8	-45.5	0	0	0	113.8
163	K	91	Very high	94.6	Very high	89 Å²	89	73.8 Å²	73.8	39%	0.387	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-17.1	-167.2	-55.8	-59.1	178.9	-148.9	0	115.1	R118 T130 T161	R118-K163 PolarHBondContact NH1-O 2.85Å; R118-K163 PolarHBondContact NH2-O 2.92Å; T130-K163 WeakPolarHBondContact OG1-CE 3.42Å; T130-K163 WeakPolarHBondContact OG1-CG 3.43Å; T161-K163 PolarHBondContact O-N 2.84Å
164	C	90.7	Very high	94.7	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.014	37%	0.367	C	S	.	.			trans	-124.2	99.7	-174.6	58.6	0	0	0	0	111	C132 E166 G167 I168	C132-C164 WeakPolarHBondContact CA-SG 3.44Å; C132-C164 HydrophobicContact CB-CB 3.6Å; C132-C164 WeakPolarHBondContact CB-SG 3.4Å; C132-C164 WeakPolarHBondContact SG-CB 3.48Å; C132-C164 CovalentContact SG-SG 2.02Å; C132-C164 PolarHBondContact SG-SG 2.82Å; C164-E166 PolarHBondContact O-N 3.18Å; C164-G167 PolarHBondContact O-N 3.13Å; C164-I168 PolarHBondContact O-N 2.79Å
165	P	94	Very high	94.9	Very high	86 Å²	86	69.8 Å²	69.8	56%	0.558	36%	0.361	S	S	*	.	H	α-helix	trans	-61.4	-30.6	173.5	25.1	-33.5	0	0	0	112	G167 I168 I169	P165-G167 PolarHBondContact O-N 2.8Å; P165-I168 PolarHBondContact O-N 2.82Å; P165-I169 WeakPolarHBondContact O-CG1 3.47Å; P165-I169 PolarHBondContact O-N 3.11Å
166	E	94.1	Very high	94.9	Very high	115 Å²	115	65.5 Å²	65.5	54%	0.537	35%	0.352	S	S	.	.	H	α-helix	trans	-59.7	-43	175.4	-64.9	173.5	-140.2	0	0	112.4	I114 C164 I169 L170	I114-E166 HydrophobicContact CD1-CB 4.42Å; C164-E166 PolarHBondContact O-N 3.18Å; E166-I169 PolarHBondContact O-N 3.26Å; E166-L170 WeakPolarHBondContact O-CB 3.3Å; E166-L170 PolarHBondContact O-N 2.88Å
167	G	94.6	Very high	95.1	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-65.1	-39.2	176.2	0	0	0	0	0	112.3	W111 C164 P165 L170 L171	W111-G167 VanDerWaalsContact CH2-O 3.24Å; W111-G167 WeakPolarHBondContact CH2-O 3.31Å; C164-G167 PolarHBondContact O-N 3.13Å; P165-G167 PolarHBondContact O-N 2.8Å; G167-L170 PolarHBondContact O-N 2.88Å; G167-L171 WeakPolarHBondContact O-CB 3.47Å; G167-L171 PolarHBondContact O-N 3Å
168	I	95.3	Very high	95.2	Very high	88 Å²	88	60.8 Å²	60.8	45%	0.451	33%	0.325	S	S	.	.	H	α-helix	trans	-64	-43.1	178.1	-62.4	172.4	0	0	0	110.8	I160 C164 P165 L171 L172	I160-I168 HydrophobicContact CD1-CG1 4.25Å; C164-I168 PolarHBondContact O-N 2.79Å; P165-I168 PolarHBondContact O-N 2.82Å; I168-L171 PolarHBondContact O-N 3.14Å; I168-L172 PolarHBondContact O-N 3.03Å
169	I	96.3	Very high	95.4	Very high	100 Å²	100	62 Å²	62	51%	0.513	34%	0.342	S	S	.	.	H	α-helix	trans	-65.5	-42.7	176.7	-65.1	166.3	0	0	0	110.4	P165 E166 L172 I173	P165-I169 WeakPolarHBondContact O-CG1 3.47Å; P165-I169 PolarHBondContact O-N 3.11Å; E166-I169 PolarHBondContact O-N 3.26Å; I169-L172 PolarHBondContact O-N 3.29Å; I169-I173 HydrophobicContact CG2-CD1 3.86Å; I169-I173 HydrophobicContact CG2-CG1 4.46Å; I169-I173 WeakPolarHBondContact O-CG1 3.16Å; I169-I173 PolarHBondContact O-N 3.39Å
170	L	96.5	Very high	95.5	Very high	14 Å²	14	63.8 Å²	63.8	7%	0.073	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-45.3	177	-179.2	62.4	0	0	0	111.8	F107 I110 W111 I114 E166 G167 L172 I173 Q174	F107-L170 HydrophobicContact CD1-CD1 3.86Å; F107-L170 HydrophobicContact CE1-CD1 3.94Å; I110-L170 HydrophobicContact CB-CD1 4.38Å; I110-L170 HydrophobicContact CB-CD2 4.16Å; I110-L170 HydrophobicContact CG2-CD1 3.8Å; I110-L170 HydrophobicContact CG2-CD2 3.62Å; I110-L170 HydrophobicContact CG2-CG 4.36Å; W111-L170 HydrophobicContact CD2-CD2 3.53Å; W111-L170 HydrophobicContact CD2-CG 4.49Å; W111-L170 HydrophobicContact CE3-CD2 3.92Å; W111-L170 HydrophobicContact CG-CD2 3.92Å; W111-L170 HydrophobicContact CH2-CB 4.36Å; W111-L170 HydrophobicContact CH2-CD2 4.24Å; W111-L170 HydrophobicContact CH2-CG 4.48Å; W111-L170 HydrophobicContact CZ2-CB 4.27Å; W111-L170 HydrophobicContact CZ2-CD2 3.88Å; W111-L170 HydrophobicContact CZ2-CG 3.98Å; W111-L170 HydrophobicContact CZ3-CD2 4.26Å; I114-L170 HydrophobicContact CD1-CB 4.16Å; I114-L170 HydrophobicContact CD1-CD2 3.57Å; I114-L170 HydrophobicContact CD1-CG 4.46Å; E166-L170 WeakPolarHBondContact O-CB 3.3Å; E166-L170 PolarHBondContact O-N 2.88Å; G167-L170 PolarHBondContact O-N 2.88Å; L170-L172 VanDerWaalsContact C-N 3.3Å; L170-L172 PolarHBondContact O-N 2.99Å; L170-I173 PolarHBondContact O-N 2.77Å; L170-Q174 VanDerWaalsContact O-CB 3.3Å; L170-Q174 WeakPolarHBondContact O-CB 3.15Å; L170-Q174 PolarHBondContact O-N 3.25Å
171	L	96.4	Very high	95.5	Very high	49 Å²	49	63 Å²	63	26%	0.257	35%	0.345	S	S	.	.	H	α-helix	trans	-55.2	-47	175.2	176.5	64.3	0	0	0	110.8	W111 T149 I160 G167 I168 Q174 S175	W111-L171 HydrophobicContact CH2-CB 4.3Å; W111-L171 HydrophobicContact CZ2-CB 4.2Å; T149-L171 HydrophobicContact CG2-CD1 3.23Å; I160-L171 HydrophobicContact CD1-CB 4.18Å; I160-L171 HydrophobicContact CD1-CD2 3.94Å; I160-L171 HydrophobicContact CG2-CD2 4.23Å; G167-L171 WeakPolarHBondContact O-CB 3.47Å; G167-L171 PolarHBondContact O-N 3Å; I168-L171 PolarHBondContact O-N 3.14Å; L171-Q174 PolarHBondContact O-N 3.07Å; L171-S175 WeakPolarHBondContact O-CB 3.22Å; L171-S175 PolarHBondContact O-N 2.73Å; L171-S175 PolarHBondContact O-OG 3.24Å; L171-S175 VanDerWaalsContact O-OG 3.05Å
172	L	96.8	Very high	95.7	Very high	116 Å²	116	65.3 Å²	65.3	61%	0.607	36%	0.357	S	S	*	.	H	α-helix	trans	-60.7	-47.9	177.9	-177.5	66.6	0	0	0	112	I168 I169 L170 Q174 S175 V176	I168-L172 PolarHBondContact O-N 3.03Å; I169-L172 PolarHBondContact O-N 3.29Å; L170-L172 VanDerWaalsContact C-N 3.3Å; L170-L172 PolarHBondContact O-N 2.99Å; L172-Q174 VanDerWaalsContact C-N 3.35Å; L172-Q174 PolarHBondContact O-N 3.4Å; L172-S175 PolarHBondContact O-N 2.87Å; L172-V176 WeakPolarHBondContact O-CG2 3.34Å; L172-V176 PolarHBondContact O-N 2.75Å; L172-V176 VanDerWaalsContact O-N 3.11Å
173	I	97.5	Very high	95.8	Very high	79 Å²	79	62.7 Å²	62.7	41%	0.405	35%	0.351	S	S	.	.	H	α-helix	trans	-61.3	-45.5	177.9	-69	171	0	0	0	110.3	F107 I169 L170 V176 L177	F107-I173 HydrophobicContact CE1-CG2 4.38Å; F107-I173 HydrophobicContact CZ-CG2 4.49Å; I169-I173 HydrophobicContact CG2-CD1 3.86Å; I169-I173 HydrophobicContact CG2-CG1 4.46Å; I169-I173 WeakPolarHBondContact O-CG1 3.16Å; I169-I173 PolarHBondContact O-N 3.39Å; L170-I173 PolarHBondContact O-N 2.77Å; I173-V176 PolarHBondContact O-N 3.31Å; I173-L177 HydrophobicContact CG2-CD1 3.97Å; I173-L177 WeakPolarHBondContact O-CB 3.43Å; I173-L177 WeakPolarHBondContact O-CD1 3.26Å; I173-L177 PolarHBondContact O-N 2.67Å
174	Q	97.6	Very high	96.1	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-44.8	179.8	-175.4	173.1	-12.4	0	0	111.8	F107 S146 L170 L171 L172 V176 G178	F107-Q174 HydrophobicContact CB-CG 4.35Å; F107-Q174 HydrophobicContact CD1-CB 3.68Å; F107-Q174 HydrophobicContact CD1-CG 3.72Å; F107-Q174 HydrophobicContact CD2-CG 3.91Å; F107-Q174 HydrophobicContact CE1-CB 3.54Å; F107-Q174 HydrophobicContact CE1-CG 3.93Å; F107-Q174 HydrophobicContact CE2-CB 4.46Å; F107-Q174 HydrophobicContact CE2-CG 4.1Å; F107-Q174 HydrophobicContact CG-CB 4.23Å; F107-Q174 HydrophobicContact CG-CG 3.73Å; F107-Q174 HydrophobicContact CZ-CB 3.97Å; F107-Q174 HydrophobicContact CZ-CG 4.12Å; S146-Q174 PolarHBondContact O-NE2 2.86Å; L170-Q174 VanDerWaalsContact O-CB 3.3Å; L170-Q174 WeakPolarHBondContact O-CB 3.15Å; L170-Q174 PolarHBondContact O-N 3.25Å; L171-Q174 PolarHBondContact O-N 3.07Å; L172-Q174 VanDerWaalsContact C-N 3.35Å; L172-Q174 PolarHBondContact O-N 3.4Å; Q174-V176 VanDerWaalsContact C-N 3.34Å; Q174-V176 PolarHBondContact O-N 2.83Å; Q174-G178 WeakPolarHBondContact O-CA 3.46Å; Q174-G178 PolarHBondContact O-N 2.67Å
175	S	96.8	Very high	96.2	Very high	52 Å²	52	62.4 Å²	62.4	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-62.7	-40	177.6	-61.3	0	0	0	0	112.3	L171 L172 S179	L171-S175 WeakPolarHBondContact O-CB 3.22Å; L171-S175 PolarHBondContact O-N 2.73Å; L171-S175 PolarHBondContact O-OG 3.24Å; L171-S175 VanDerWaalsContact O-OG 3.05Å; L172-S175 PolarHBondContact O-N 2.87Å; S175-S179 WeakPolarHBondContact O-CB 3.3Å; S175-S179 PolarHBondContact O-N 2.93Å; S175-S179 VanDerWaalsContact O-N 3.16Å; S175-S179 PolarHBondContact O-OG 3.12Å
176	V	97.6	Very high	96.3	Very high	78 Å²	78	62 Å²	62	47%	0.473	35%	0.346	S	S	.	.	H	α-helix	trans	-68.3	-51.5	177.8	173.1	0	0	0	0	111.1	L172 I173 Q174 S179 I180	L172-V176 WeakPolarHBondContact O-CG2 3.34Å; L172-V176 PolarHBondContact O-N 2.75Å; L172-V176 VanDerWaalsContact O-N 3.11Å; I173-V176 PolarHBondContact O-N 3.31Å; Q174-V176 VanDerWaalsContact C-N 3.34Å; Q174-V176 PolarHBondContact O-N 2.83Å; V176-S179 PolarHBondContact O-N 3.32Å; V176-I180 HydrophobicContact CG1-CD1 4.06Å; V176-I180 WeakPolarHBondContact O-CG1 3.26Å; V176-I180 PolarHBondContact O-N 3.03Å; V176-I180 VanDerWaalsContact O-N 3.13Å
177	L	97.3	Very high	96.4	Very high	79 Å²	79	57.9 Å²	57.9	41%	0.414	33%	0.334	S	S	.	.	H	α-helix	trans	-66.6	-39.6	-179	-90	69.3	0	0	0	112	F107 I173 S179 I180 V181	F107-L177 HydrophobicContact CZ-CB 4.28Å; F107-L177 HydrophobicContact CZ-CD2 4.24Å; I173-L177 HydrophobicContact CG2-CD1 3.97Å; I173-L177 WeakPolarHBondContact O-CB 3.43Å; I173-L177 WeakPolarHBondContact O-CD1 3.26Å; I173-L177 PolarHBondContact O-N 2.67Å; L177-S179 VanDerWaalsContact C-N 3.3Å; L177-S179 PolarHBondContact O-N 3.34Å; L177-I180 PolarHBondContact O-N 3.03Å; L177-V181 WeakPolarHBondContact O-CG2 3.46Å; L177-V181 PolarHBondContact O-N 3.03Å
178	G	96.8	Very high	96.4	Very high	7 Å²	7	58 Å²	58	7%	0.072	34%	0.335	C	S	.	.	H	α-helix	trans	-58.7	-42	175.1	0	0	0	0	0	111.9	Q174 V181 N182	Q174-G178 WeakPolarHBondContact O-CA 3.46Å; Q174-G178 PolarHBondContact O-N 2.67Å; G178-V181 PolarHBondContact O-N 3.18Å; G178-N182 VanDerWaalsContact O-CB 3.23Å; G178-N182 WeakPolarHBondContact O-CB 3.34Å; G178-N182 PolarHBondContact O-N 3.43Å
179	S	97	Very high	96.3	Very high	80 Å²	80	55.6 Å²	55.6	56%	0.559	32%	0.322	S	S	*	.	H	α-helix	trans	-64.1	-40.9	175.1	-60.4	0	0	0	0	112.5	S175 V176 L177 A183	S175-S179 WeakPolarHBondContact O-CB 3.3Å; S175-S179 PolarHBondContact O-N 2.93Å; S175-S179 VanDerWaalsContact O-N 3.16Å; S175-S179 PolarHBondContact O-OG 3.12Å; V176-S179 PolarHBondContact O-N 3.32Å; L177-S179 VanDerWaalsContact C-N 3.3Å; L177-S179 PolarHBondContact O-N 3.34Å; S179-A183 VanDerWaalsContact O-CB 3.27Å; S179-A183 WeakPolarHBondContact O-CB 3.43Å; S179-A183 PolarHBondContact O-N 3.37Å
180	I	97.2	Very high	96.2	Very high	107 Å²	107	57.6 Å²	57.6	55%	0.549	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-47.7	177.8	-66.8	166	0	0	0	110.9	V176 L177 A183 F184	V176-I180 HydrophobicContact CG1-CD1 4.06Å; V176-I180 WeakPolarHBondContact O-CG1 3.26Å; V176-I180 PolarHBondContact O-N 3.03Å; V176-I180 VanDerWaalsContact O-N 3.13Å; L177-I180 PolarHBondContact O-N 3.03Å; I180-A183 PolarHBondContact O-N 2.55Å; I180-F184 WeakPolarHBondContact O-CB 3.44Å; I180-F184 PolarHBondContact O-N 2.75Å
181	V	96.4	Very high	96.1	Very high	33 Å²	33	59.4 Å²	59.4	20%	0.2	34%	0.339	C	S	.	.	H	α-helix	trans	-63.9	-44.5	179.3	171.2	0	0	0	0	110.9	V99 T103 L177 G178 F184 M185	V99-V181 HydrophobicContact CG1-CG1 3.55Å; T103-V181 HydrophobicContact CG2-CG1 4.41Å; T103-V181 HydrophobicContact CG2-CG2 4.34Å; L177-V181 WeakPolarHBondContact O-CG2 3.46Å; L177-V181 PolarHBondContact O-N 3.03Å; G178-V181 PolarHBondContact O-N 3.18Å; V181-F184 PolarHBondContact O-N 3.28Å; V181-M185 HydrophobicContact CG1-CG 4.44Å; V181-M185 WeakPolarHBondContact O-CB 3.35Å; V181-M185 WeakPolarHBondContact O-CG 3.49Å; V181-M185 PolarHBondContact O-N 2.6Å
182	N	96.3	Very high	95.9	Very high	78 Å²	78	58 Å²	58	42%	0.417	33%	0.331	S	S	.	.	H	α-helix	trans	-60.6	-47.9	176.4	179.8	50.3	0	0	0	111.6	Y100 G178 F184 M185 V186	Y100-N182 WeakPolarHBondContact OH-CA 3.41Å; Y100-N182 PolarHBondContact OH-OD1 3.12Å; G178-N182 VanDerWaalsContact O-CB 3.23Å; G178-N182 WeakPolarHBondContact O-CB 3.34Å; G178-N182 PolarHBondContact O-N 3.43Å; N182-F184 VanDerWaalsContact C-N 3.33Å; N182-F184 PolarHBondContact O-N 3.09Å; N182-M185 PolarHBondContact O-N 2.87Å; N182-V186 WeakPolarHBondContact O-CB 3.47Å; N182-V186 WeakPolarHBondContact O-CG2 3.38Å; N182-V186 PolarHBondContact O-N 3.13Å; N182-V186 WeakPolarHBondContact OD1-CG2 3.46Å
183	A	96.5	Very high	95.7	Very high	64 Å²	64	58.2 Å²	58.2	53%	0.529	33%	0.332	S	S	.	.	H	α-helix	trans	-59.9	-42.5	177.3	0	0	0	0	0	112.2	S179 I180 G187	S179-A183 VanDerWaalsContact O-CB 3.27Å; S179-A183 WeakPolarHBondContact O-CB 3.43Å; S179-A183 PolarHBondContact O-N 3.37Å; I180-A183 PolarHBondContact O-N 2.55Å; A183-G187 PolarHBondContact O-N 2.89Å
184	F	95.4	Very high	95.4	Very high	76 Å²	76	55.5 Å²	55.5	33%	0.333	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-47.1	176.7	-179.9	-99.2	0	0	0	112.1	F81 L84 I180 V181 N182 C188	F81-F184 AromaticContact CD2-CE2 3.92Å; F81-F184 HydrophobicContact CD2-CE2 3.92Å; F81-F184 HydrophobicContact CD2-CZ 4.44Å; L84-F184 HydrophobicContact CD1-CE1 3.56Å; L84-F184 HydrophobicContact CD1-CZ 3.55Å; I180-F184 WeakPolarHBondContact O-CB 3.44Å; I180-F184 PolarHBondContact O-N 2.75Å; V181-F184 PolarHBondContact O-N 3.28Å; N182-F184 VanDerWaalsContact C-N 3.33Å; N182-F184 PolarHBondContact O-N 3.09Å; F184-C188 WeakPolarHBondContact O-CB 3.41Å; F184-C188 PolarHBondContact O-N 3Å
185	M	94.7	Very high	95	Very high	10 Å²	10	57.6 Å²	57.6	5%	0.049	33%	0.329	C	S	.	.	H	α-helix	trans	-69.8	-45	-177.6	-72.7	-58.4	169	0	0	112.9	I95 F96 V99 Y100 V181 N182 G187 C188 M189	I95-M185 HydrophobicContact CG2-CE 4.5Å; F96-M185 HydrophobicContact CD2-CB 3.94Å; F96-M185 HydrophobicContact CD2-CG 4.37Å; F96-M185 HydrophobicContact CD2-SD 4.31Å; F96-M185 HydrophobicContact CE2-CB 3.75Å; V99-M185 HydrophobicContact CB-CE 3.58Å; V99-M185 HydrophobicContact CG1-CE 3.59Å; V99-M185 HydrophobicContact CG2-CE 3.45Å; V99-M185 VanDerWaalsContact CG2-CE 3.45Å; Y100-M185 HydrophobicContact CE2-CB 4.17Å; Y100-M185 HydrophobicContact CE2-CG 4.21Å; V181-M185 HydrophobicContact CG1-CG 4.44Å; V181-M185 WeakPolarHBondContact O-CB 3.35Å; V181-M185 WeakPolarHBondContact O-CG 3.49Å; V181-M185 PolarHBondContact O-N 2.6Å; N182-M185 PolarHBondContact O-N 2.87Å; M185-G187 VanDerWaalsContact C-N 3.34Å; M185-C188 PolarHBondContact O-N 3.14Å; M185-M189 WeakPolarHBondContact O-CB 3.36Å; M185-M189 WeakPolarHBondContact O-CG 3.45Å; M185-M189 PolarHBondContact O-N 2.65Å
186	V	95.9	Very high	94.5	Very high	77 Å²	77	56.2 Å²	56.2	47%	0.467	32%	0.319	S	S	.	.	H	α-helix	trans	-64.3	-41.6	175.7	173.9	0	0	0	0	110.5	N182 M189 F190	N182-V186 WeakPolarHBondContact O-CB 3.47Å; N182-V186 WeakPolarHBondContact O-CG2 3.38Å; N182-V186 PolarHBondContact O-N 3.13Å; N182-V186 WeakPolarHBondContact OD1-CG2 3.46Å; V186-M189 PolarHBondContact O-N 2.85Å; V186-F190 WeakPolarHBondContact O-CB 3.45Å; V186-F190 PolarHBondContact O-N 3.34Å
187	G	95.2	Very high	93.8	Very high	28 Å²	28	58.3 Å²	58.3	29%	0.289	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-45.9	174.9	0	0	0	0	0	112.7	A183 M185 M189 F190 V191	A183-G187 PolarHBondContact O-N 2.89Å; M185-G187 VanDerWaalsContact C-N 3.34Å; G187-M189 PolarHBondContact O-N 3.29Å; G187-F190 PolarHBondContact O-N 3.31Å; G187-V191 WeakPolarHBondContact O-CG2 3.49Å; G187-V191 PolarHBondContact O-N 3.49Å
188	C	94.7	Very high	93.1	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.014	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-45.5	175.5	-176.7	0	0	0	0	111.8	F81 F184 M185 K192	F81-C188 HydrophobicContact CE2-CB 4.22Å; F184-C188 WeakPolarHBondContact O-CB 3.41Å; F184-C188 PolarHBondContact O-N 3Å; M185-C188 PolarHBondContact O-N 3.14Å; C188-K192 WeakPolarHBondContact O-CB 3.46Å; C188-K192 PolarHBondContact O-N 2.8Å
189	M	93.8	Very high	92.5	Very high	38 Å²	38	60.6 Å²	60.6	19%	0.187	33%	0.326	C	S	.	.	H	α-helix	trans	-64.2	-44.3	177.6	-74.7	-69.4	-68.9	0	0	112.2	W89 F96 M185 V186 G187 K192 I193	W89-M189 HydrophobicContact CH2-CE 4.26Å; W89-M189 HydrophobicContact CZ3-CE 3.69Å; W89-M189 HydrophobicContact CZ3-SD 3.99Å; F96-M189 HydrophobicContact CD2-CG 4.1Å; F96-M189 HydrophobicContact CE2-CG 4.11Å; M185-M189 WeakPolarHBondContact O-CB 3.36Å; M185-M189 WeakPolarHBondContact O-CG 3.45Å; M185-M189 PolarHBondContact O-N 2.65Å; V186-M189 PolarHBondContact O-N 2.85Å; G187-M189 PolarHBondContact O-N 3.29Å; M189-K192 PolarHBondContact O-N 3.01Å; M189-I193 VanDerWaalsContact O-CG1 3.28Å; M189-I193 WeakPolarHBondContact O-CG1 3.45Å; M189-I193 PolarHBondContact O-N 3.28Å
190	F	94.1	Very high	92	Very high	142 Å²	142	57.9 Å²	57.9	62%	0.623	31%	0.309	S	S	*	.	H	α-helix	trans	-59.5	-50.3	177	175.9	-99.4	0	0	0	111.3	V186 G187 K192 I193 S194	V186-F190 WeakPolarHBondContact O-CB 3.45Å; V186-F190 PolarHBondContact O-N 3.34Å; G187-F190 PolarHBondContact O-N 3.31Å; F190-K192 VanDerWaalsContact C-N 3.3Å; F190-K192 PolarHBondContact O-N 3.41Å; F190-I193 PolarHBondContact O-N 3.41Å; F190-S194 WeakPolarHBondContact O-CB 3.36Å; F190-S194 PolarHBondContact O-N 2.93Å; F190-S194 PolarHBondContact O-OG 3.39Å; F190-S194 VanDerWaalsContact O-OG 3.06Å
191	V	93.2	Very high	91.6	Very high	52 Å²	52	59 Å²	59	32%	0.315	31%	0.312	S	S	.	.	H	α-helix	trans	-58.6	-45.4	177.3	174.3	0	0	0	0	110.2	F81 V85 G187 I193 S194 Q195	F81-V191 HydrophobicContact CE1-CG1 4.48Å; F81-V191 HydrophobicContact CE1-CG2 4.37Å; F81-V191 HydrophobicContact CZ-CB 4.31Å; F81-V191 HydrophobicContact CZ-CG2 3.95Å; V85-V191 HydrophobicContact CG1-CB 4.48Å; V85-V191 HydrophobicContact CG1-CG1 3.82Å; V85-V191 HydrophobicContact CG2-CB 4.42Å; V85-V191 HydrophobicContact CG2-CG1 4.21Å; G187-V191 WeakPolarHBondContact O-CG2 3.49Å; G187-V191 PolarHBondContact O-N 3.49Å; V191-I193 PolarHBondContact O-N 3.21Å; V191-S194 WeakPolarHBondContact CA-OG 3.47Å; V191-S194 PolarHBondContact O-N 3.21Å; V191-S194 PolarHBondContact O-OG 3.48Å; V191-Q195 VanDerWaalsContact O-CG 3.3Å; V191-Q195 WeakPolarHBondContact O-CG 3.41Å; V191-Q195 PolarHBondContact O-N 2.9Å; V191-Q195 VanDerWaalsContact O-N 3.11Å
192	K	93.6	Very high	91.4	Very high	20 Å²	20	58.4 Å²	58.4	9%	0.087	31%	0.308	C	S	.	.	H	α-helix	trans	-60.1	-41.8	179.2	-171.7	170.7	-170.5	59.2	0	113.6	V85 L87 W89 N92 C188 M189 F190	V85-K192 HydrophobicContact CG1-CB 4.12Å; V85-K192 PolarHBondContact O-NZ 3.5Å; L87-K192 WeakPolarHBondContact O-CE 3.34Å; L87-K192 PolarHBondContact O-NZ 2.8Å; W89-K192 HydrophobicContact CD2-CD 4.24Å; W89-K192 HydrophobicContact CE3-CD 4.19Å; W89-K192 HydrophobicContact CH2-CD 4.08Å; W89-K192 HydrophobicContact CH2-CG 4.11Å; W89-K192 HydrophobicContact CZ2-CD 4.13Å; W89-K192 HydrophobicContact CZ2-CG 3.92Å; W89-K192 HydrophobicContact CZ3-CD 4.11Å; N92-K192 HydrophobicContact CB-CD 4.26Å; N92-K192 WeakPolarHBondContact ND2-CD 3.43Å; C188-K192 WeakPolarHBondContact O-CB 3.46Å; C188-K192 PolarHBondContact O-N 2.8Å; M189-K192 PolarHBondContact O-N 3.01Å; F190-K192 VanDerWaalsContact C-N 3.3Å; F190-K192 PolarHBondContact O-N 3.41Å
193	I	92.8	Very high	91.4	Very high	121 Å²	121	55.2 Å²	55.2	62%	0.621	29%	0.291	S	S	*	.	H	α-helix	trans	-68.3	-40.2	177.6	-68.1	168.4	0	0	0	110.6	W89 M189 F190 V191 Q195	W89-I193 HydrophobicContact CH2-CD1 4.44Å; W89-I193 HydrophobicContact CH2-CG1 3.67Å; W89-I193 HydrophobicContact CZ2-CG1 4.16Å; M189-I193 VanDerWaalsContact O-CG1 3.28Å; M189-I193 WeakPolarHBondContact O-CG1 3.45Å; M189-I193 PolarHBondContact O-N 3.28Å; F190-I193 PolarHBondContact O-N 3.41Å; V191-I193 PolarHBondContact O-N 3.21Å; I193-Q195 VanDerWaalsContact C-N 3.28Å; I193-Q195 PolarHBondContact O-N 3.19Å
194	S	90.5	Very high	91.4	Very high	22 Å²	22	53.6 Å²	53.6	15%	0.154	28%	0.275	C	S	.	.	H	α-helix	trans	-77.9	-7.2	-176.6	70	0	0	0	0	114.7	F190 V191 M317	F190-S194 WeakPolarHBondContact O-CB 3.36Å; F190-S194 PolarHBondContact O-N 2.93Å; F190-S194 PolarHBondContact O-OG 3.39Å; F190-S194 VanDerWaalsContact O-OG 3.06Å; V191-S194 WeakPolarHBondContact CA-OG 3.47Å; V191-S194 PolarHBondContact O-N 3.21Å; V191-S194 PolarHBondContact O-OG 3.48Å; S194-M317 VanDerWaalsContact OG-CE 3.27Å; S194-M317 WeakPolarHBondContact OG-CE 3.4Å
195	Q	88.5	Confident	91.5	Very high	43 Å²	43	51 Å²	51	20%	0.201	26%	0.263	C	S	.	.			trans	-56.6	130.8	-176.4	-74.4	-164.6	-25.2	0	0	112.2	V85 V191 I193 K197	V85-Q195 HydrophobicContact CG1-CG 4.32Å; V191-Q195 VanDerWaalsContact O-CG 3.3Å; V191-Q195 WeakPolarHBondContact O-CG 3.41Å; V191-Q195 PolarHBondContact O-N 2.9Å; V191-Q195 VanDerWaalsContact O-N 3.11Å; I193-Q195 VanDerWaalsContact C-N 3.28Å; I193-Q195 PolarHBondContact O-N 3.19Å; Q195-K197 PolarHBondContact O-N 2.91Å; Q195-K197 VanDerWaalsContact O-N 3.09Å
196	P	87.4	Confident	91.6	Very high	24 Å²	24	50.6 Å²	50.6	16%	0.156	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-1	-175.8	32.1	-37.3	0	0	0	113.5	K198 R199 V312 M317 T318 C319	P196-K198 PolarHBondContact O-N 3.49Å; P196-K198 VanDerWaalsContact O-N 3.13Å; P196-R199 WeakPolarHBondContact O-CA 3.32Å; P196-R199 VanDerWaalsContact O-CB 3.23Å; P196-R199 WeakPolarHBondContact O-CB 3.32Å; P196-R199 PolarHBondContact O-N 3.06Å; P196-V312 HydrophobicContact CB-CG2 3.68Å; P196-M317 HydrophobicContact CB-CB 4.17Å; P196-M317 HydrophobicContact CG-CB 3.81Å; P196-T318 WeakPolarHBondContact CG-O 3.48Å; P196-C319 HydrophobicContact CB-CB 3.89Å
197	K	82.4	Confident	91.7	Very high	121 Å²	121	49.7 Å²	49.7	53%	0.526	26%	0.256	S	S	.	.	H	α-helix	trans	-55.9	-32	179.3	-66.1	179.1	-176.1	170.1	0	112	D86 Q195 R199 A200	D86-K197 IonicContact OD1-NZ 3.64Å; D86-K197 PolarHBondContact OD1-NZ 3.19Å; Q195-K197 PolarHBondContact O-N 2.91Å; Q195-K197 VanDerWaalsContact O-N 3.09Å; K197-R199 VanDerWaalsContact C-N 3.33Å; K197-A200 WeakPolarHBondContact O-CB 3.49Å; K197-A200 PolarHBondContact O-N 3.37Å
198	K	82	Confident	91.8	Very high	127 Å²	127	51.4 Å²	51.4	55%	0.552	26%	0.257	S	S	*	.	H	α-helix	trans	-72.2	-23	175.4	-70.1	-59.1	-169	177.7	0	114.2	P196 A200 E201	P196-K198 PolarHBondContact O-N 3.49Å; P196-K198 VanDerWaalsContact O-N 3.13Å; K198-A200 VanDerWaalsContact C-N 3.32Å; K198-E201 VanDerWaalsContact CD-OE2 3.31Å; K198-E201 WeakPolarHBondContact CD-OE2 3.13Å; K198-E201 VanDerWaalsContact NZ-CD 3.28Å; K198-E201 IonicContact NZ-OE1 3.35Å; K198-E201 PolarHBondContact NZ-OE1 3.21Å; K198-E201 IonicContact NZ-OE2 3.89Å; K198-E201 PolarHBondContact NZ-OE2 3.26Å; K198-E201 PolarHBondContact O-N 3.38Å
199	R	86.1	Confident	92	Very high	7 Å²	7	51.3 Å²	51.3	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-68.7	-33.4	171.1	-168.8	69.1	165.2	102.6	8.7	111.4	P196 K197 E201 T202 D226 R228 S230 I232 V312 C319	P196-R199 WeakPolarHBondContact O-CA 3.32Å; P196-R199 VanDerWaalsContact O-CB 3.23Å; P196-R199 WeakPolarHBondContact O-CB 3.32Å; P196-R199 PolarHBondContact O-N 3.06Å; K197-R199 VanDerWaalsContact C-N 3.33Å; R199-E201 PolarHBondContact O-N 3.06Å; R199-T202 PolarHBondContact NH1-OG1 2.98Å; R199-T202 PolarHBondContact O-N 2.88Å; R199-T202 PolarHBondContact O-OG1 3.39Å; R199-D226 IonicContact CZ-OD1 2.8Å; R199-D226 IonicContact CZ-OD2 2.55Å; R199-D226 IonicContact NH1-OD1 2.72Å; R199-D226 PolarHBondContact NH1-OD1 3.29Å; R199-D226 IonicContact NH1-OD2 3.21Å; R199-D226 PolarHBondContact NH1-OD2 2.98Å; R199-D226 IonicContact NH2-OD1 3.01Å; R199-D226 IonicContact NH2-OD2 3.46Å; R199-D226 PolarHBondContact NH2-OD2 3.38Å; R199-R228 VanDerWaalsContact CD-NH1 3.27Å; R199-R228 VanDerWaalsContact NH1-CB 3.32Å; R199-R228 VanDerWaalsContact NH1-CD 3.25Å; R199-S230 PolarHBondContact NH2-O 2.92Å; R199-S230 PolarHBondContact NH2-OG 3.37Å; R199-I232 HydrophobicContact CG-CD1 3.92Å; R199-V312 HydrophobicContact CB-CG2 3.81Å; R199-V312 HydrophobicContact CG-CG1 4.25Å; R199-V312 HydrophobicContact CG-CG2 3.75Å; R199-C319 HydrophobicContact CB-CB 4.49Å
200	A	86.5	Confident	92.2	Very high	23 Å²	23	49.5 Å²	49.5	19%	0.19	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-24.7	176.9	0	0	0	0	0	113.1	K197 K198 T202 L203 A321	K197-A200 WeakPolarHBondContact O-CB 3.49Å; K197-A200 PolarHBondContact O-N 3.37Å; K198-A200 VanDerWaalsContact C-N 3.32Å; A200-T202 PolarHBondContact O-N 2.95Å; A200-L203 PolarHBondContact O-N 3.22Å; A200-A321 HydrophobicContact CB-CB 4.09Å
201	E	88.7	Confident	92.3	Very high	130 Å²	130	42.8 Å²	42.8	61%	0.607	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-22.4	174.8	-64.8	178.3	176	0	0	112.5	K198 R199	K198-E201 VanDerWaalsContact CD-OE2 3.31Å; K198-E201 WeakPolarHBondContact CD-OE2 3.13Å; K198-E201 VanDerWaalsContact NZ-CD 3.28Å; K198-E201 IonicContact NZ-OE1 3.35Å; K198-E201 PolarHBondContact NZ-OE1 3.21Å; K198-E201 IonicContact NZ-OE2 3.89Å; K198-E201 PolarHBondContact NZ-OE2 3.26Å; K198-E201 PolarHBondContact O-N 3.38Å; R199-E201 PolarHBondContact O-N 3.06Å
202	T	92.3	Very high	92.5	Very high	22 Å²	22	40.3 Å²	40.3	14%	0.135	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	0.4	176.9	66	0	0	0	0	113.4	R199 A200 L227 R228	R199-T202 PolarHBondContact NH1-OG1 2.98Å; R199-T202 PolarHBondContact O-N 2.88Å; R199-T202 PolarHBondContact O-OG1 3.39Å; A200-T202 PolarHBondContact O-N 2.95Å; T202-L227 WeakPolarHBondContact O-CB 3.45Å; T202-L227 WeakPolarHBondContact O-CG 2.84Å; T202-L227 PolarHBondContact O-N 3.11Å; T202-R228 HydrophobicContact CG2-CG 4.18Å
203	L	95.2	Very high	92.7	Very high	10 Å²	10	41.2 Å²	41.2	5%	0.052	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	115.4	175.3	-70.2	167.9	0	0	0	108.2	A200 D226 I232 L273 L308 A321	A200-L203 PolarHBondContact O-N 3.22Å; L203-D226 HydrophobicContact CD2-CB 3.98Å; L203-I232 HydrophobicContact CD1-CD1 4.31Å; L203-I232 HydrophobicContact CD1-CG1 4.46Å; L203-I232 HydrophobicContact CD2-CD1 4.47Å; L203-I232 HydrophobicContact CD2-CG1 4.01Å; L203-L273 HydrophobicContact CD2-CD2 4.32Å; L203-L308 HydrophobicContact CD1-CD2 3.78Å; L203-L308 HydrophobicContact CD2-CD2 4.36Å; L203-A321 HydrophobicContact CB-CB 3.79Å; L203-A321 HydrophobicContact CD1-CB 3.85Å; L203-A321 HydrophobicContact CG-CB 4.49Å
204	V	96.1	Very high	92.8	Very high	31 Å²	31	41.1 Å²	41.1	19%	0.188	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	142.2	-172.6	-68.7	0	0	0	0	111	V224 G225 L227 F354	V204-V224 CarbonylContact O-C 3.57Å; V204-V224 WeakPolarHBondContact O-CA 3.37Å; V204-G225 WeakPolarHBondContact CG2-O 3.35Å; V204-G225 PolarHBondContact N-O 2.96Å; V204-G225 PolarHBondContact O-N 3.31Å; V204-L227 HydrophobicContact CG1-CD1 3.76Å; V204-L227 HydrophobicContact CG1-CD2 4.39Å; V204-L227 HydrophobicContact CG1-CG 4.03Å; V204-L227 HydrophobicContact CG2-CD2 4.04Å; V204-L227 HydrophobicContact CG2-CG 4.21Å; V204-F354 HydrophobicContact CB-CE1 4.26Å; V204-F354 HydrophobicContact CB-CZ 4.26Å; V204-F354 HydrophobicContact CG2-CE1 3.95Å; V204-F354 HydrophobicContact CG2-CE2 3.98Å; V204-F354 HydrophobicContact CG2-CZ 3.59Å
205	F	97.7	Very high	92.9	Very high	21 Å²	21	47.5 Å²	47.5	9%	0.092	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	149.7	172.4	-62.7	-85.4	0	0	0	109.2	R223 V224 I237 V306 L308 A321 H355	F205-R223 CarbonylContact C-O 3.56Å; F205-R223 WeakPolarHBondContact CA-O 3.49Å; F205-V224 HydrophobicContact CD1-CB 4.35Å; F205-V224 HydrophobicContact CD1-CG2 3.99Å; F205-V224 HydrophobicContact CE1-CG2 3.85Å; F205-I237 HydrophobicContact CE1-CD1 4.29Å; F205-V306 HydrophobicContact CD1-CG1 3.99Å; F205-V306 HydrophobicContact CE1-CB 4.43Å; F205-V306 HydrophobicContact CE1-CG1 3.57Å; F205-V306 HydrophobicContact CZ-CG1 4.4Å; F205-L308 HydrophobicContact CE1-CB 4.18Å; F205-L308 HydrophobicContact CZ-CB 3.78Å; F205-A321 HydrophobicContact CE2-CB 3.86Å; F205-A321 HydrophobicContact CZ-CB 4.14Å; F205-H355 PolarHBondContact O-CE1 3.4Å
206	S	97.6	Very high	93.1	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.007	26%	0.255	C	S	.	.			trans	-59.6	150.1	174.9	57.5	0	0	0	0	111	H208 R223 Y325 F336	S206-H208 VanDerWaalsContact C-N 3.28Å; S206-H208 WeakPolarHBondContact CB-O 3.22Å; S206-H208 PolarHBondContact O-N 2.83Å; S206-H208 PolarHBondContact OG-O 2.96Å; S206-R223 PolarHBondContact N-O 2.84Å; S206-R223 PolarHBondContact OG-N 2.91Å; S206-Y325 WeakPolarHBondContact O-CE1 3.39Å; S206-Y325 PolarHBondContact O-OH 3.5Å; S206-Y325 PolarHBondContact OG-OH 3.28Å; S206-F336 WeakPolarHBondContact OG-CZ 3.48Å
207	T	97	Very high	93.4	Very high	59 Å²	59	52.1 Å²	52.1	36%	0.362	27%	0.268	S	S	.	.	S	Bend	trans	-69.7	-34.5	-178.7	-40.3	0	0	0	0	110.8	K59 H355	K59-T207 WeakPolarHBondContact CE-O 3.35Å; K59-T207 PolarHBondContact NZ-O 2.86Å; T207-H355 PolarHBondContact N-ND1 2.76Å; T207-H355 PolarHBondContact OG1-ND1 2.97Å
208	H	97.9	Very high	94.1	Very high	63 Å²	63	46.7 Å²	46.7	29%	0.292	24%	0.244	S	C	.	.	S	Bend	trans	-118	151.6	180	-56.5	100	0	0	0	110.6	S206 Y325 E329 L331 F336	S206-H208 VanDerWaalsContact C-N 3.28Å; S206-H208 WeakPolarHBondContact CB-O 3.22Å; S206-H208 PolarHBondContact O-N 2.83Å; S206-H208 PolarHBondContact OG-O 2.96Å; H208-Y325 VanDerWaalsContact C-CE1 3.43Å; H208-E329 WeakPolarHBondContact CA-O 3.45Å; H208-L331 HydrophobicContact CB-CD1 3.83Å; H208-L331 HydrophobicContact CB-CG 4.07Å; H208-F336 WeakPolarHBondContact O-CZ 3.33Å
209	A	98	Very high	94.9	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	150.3	160.8	0	0	0	0	0	107.8	M221 F222 Y325 E329 I330 L331	A209-M221 CarbonylContact C-O 3.59Å; A209-M221 VanDerWaalsContact CA-O 3.24Å; A209-M221 WeakPolarHBondContact CA-O 3.07Å; A209-F222 HydrophobicContact CB-CB 4.38Å; A209-Y325 HydrophobicContact CB-CD1 3.84Å; A209-Y325 HydrophobicContact CB-CD2 4.27Å; A209-Y325 HydrophobicContact CB-CE1 4.22Å; A209-Y325 HydrophobicContact CB-CG 3.88Å; A209-E329 PolarHBondContact N-O 2.71Å; A209-I330 HydrophobicContact CB-CG1 4.36Å; A209-I330 CarbonylContact O-C 3.55Å; A209-I330 WeakPolarHBondContact O-CA 3.41Å; A209-L331 PolarHBondContact O-N 3Å
210	V	98	Very high	95.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144.9	-178.5	-55.9	0	0	0	0	110.5	M221 L331 Y334 F336 T357	V210-M221 HydrophobicContact CG2-CB 3.87Å; V210-M221 HydrophobicContact CG2-CE 4.19Å; V210-M221 PolarHBondContact N-O 3.37Å; V210-M221 PolarHBondContact O-N 3.14Å; V210-L331 CarbonylContact C-O 3.54Å; V210-L331 VanDerWaalsContact CA-O 3.31Å; V210-L331 WeakPolarHBondContact CA-O 3.29Å; V210-L331 HydrophobicContact CG1-CB 4.35Å; V210-Y334 WeakPolarHBondContact CB-O 3.36Å; V210-Y334 WeakPolarHBondContact CG2-O 3.44Å; V210-F336 HydrophobicContact CG1-CE1 4.49Å; V210-F336 HydrophobicContact CG1-CE2 4.36Å; V210-F336 HydrophobicContact CG1-CZ 4.18Å; V210-F336 HydrophobicContact CG2-CD2 3.84Å; V210-F336 HydrophobicContact CG2-CE2 3.57Å; V210-F336 HydrophobicContact CG2-CZ 4.19Å; V210-T357 HydrophobicContact CG1-CG2 3.6Å
211	I	97.9	Very high	96	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122	171.4	-65	174.5	0	0	0	108	L218 C219 L220 I283 L297 I330 L331 W332 G333 Y334	I211-L218 HydrophobicContact CG2-CD1 3.83Å; I211-L218 HydrophobicContact CG2-CD2 4.02Å; I211-L218 HydrophobicContact CG2-CG 3.77Å; I211-C219 WeakPolarHBondContact CA-O 3.5Å; I211-L220 HydrophobicContact CD1-CD1 4.33Å; I211-L220 HydrophobicContact CG1-CB 4.22Å; I211-L220 HydrophobicContact CG1-CD1 4.33Å; I211-L220 HydrophobicContact CG1-CG 4.26Å; I211-I283 HydrophobicContact CG2-CD1 4.25Å; I211-L297 HydrophobicContact CD1-CD2 4.41Å; I211-I330 HydrophobicContact CD1-CG2 3.69Å; I211-I330 HydrophobicContact CG1-CG2 3.91Å; I211-L331 PolarHBondContact N-O 2.89Å; I211-W332 HydrophobicContact CB-CD2 4.39Å; I211-W332 HydrophobicContact CB-CE3 4.24Å; I211-W332 HydrophobicContact CD1-CE3 3.82Å; I211-W332 HydrophobicContact CD1-CZ3 3.97Å; I211-W332 HydrophobicContact CG2-CD2 4.11Å; I211-W332 HydrophobicContact CG2-CE3 4.01Å; I211-W332 HydrophobicContact CG2-CH2 4.34Å; I211-W332 HydrophobicContact CG2-CZ2 4.42Å; I211-W332 HydrophobicContact CG2-CZ3 4.13Å; I211-G333 WeakPolarHBondContact O-CA 3.49Å; I211-G333 PolarHBondContact O-N 2.81Å; I211-Y334 PolarHBondContact O-N 3.42Å
212	S	97.1	Very high	96.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	169.4	172.4	54	0	0	0	0	112.1	C219 M221 Y334 R335	S212-C219 PolarHBondContact N-O 2.72Å; S212-C219 PolarHBondContact O-N 2.74Å; S212-M221 WeakPolarHBondContact OG-CE 3.45Å; S212-Y334 VanDerWaalsContact CB-O 3.24Å; S212-Y334 WeakPolarHBondContact CB-O 3.14Å; S212-Y334 PolarHBondContact OG-O 3.27Å; S212-R335 WeakPolarHBondContact OG-CG 2.91Å
213	M	96.5	Very high	96.7	Very high	39 Å²	39	33.3 Å²	33.3	19%	0.192	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	134.4	177.3	-66.6	-64.1	-73.7	0	0	110.9	G216 K217 L218 R335 T362 P363 L370	M213-G216 VanDerWaalsContact CE-C 3.46Å; M213-G216 WeakPolarHBondContact CE-O 3.45Å; M213-K217 WeakPolarHBondContact CA-O 3.16Å; M213-L218 HydrophobicContact CG-CD1 4.35Å; M213-L218 HydrophobicContact SD-CB 4.11Å; M213-L218 HydrophobicContact SD-CD1 3.7Å; M213-R335 PolarHBondContact O-NH2 3.41Å; M213-T362 HydrophobicContact CG-CG2 4.23Å; M213-P363 VanDerWaalsContact CG-CD 3.45Å; M213-P363 HydrophobicContact CG-CG 4.16Å; M213-P363 HydrophobicContact SD-CG 4.4Å; M213-L370 HydrophobicContact SD-CD1 4.03Å
214	R	95.3	Very high	96.8	Very high	119 Å²	119	32.9 Å²	32.9	45%	0.449	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	121.9	172.1	-165.6	171.6	-174.5	168.6	-0.4	108.7	G216 K217	R214-G216 VanDerWaalsContact C-N 3.26Å; R214-G216 PolarHBondContact O-N 2.95Å; R214-K217 PolarHBondContact N-O 2.99Å; R214-K217 PolarHBondContact O-N 3.11Å; R214-K217 VanDerWaalsContact O-O 3.11Å
215	D	93.8	Very high	96.8	Very high	156 Å²	156	31.4 Å²	31.4	83%	0.834	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.8	44.5	-179.6	-54.5	-42.5	0	0	0	114	K217	D215-K217 PolarHBondContact O-N 3.34Å
216	G	91.8	Very high	96.7	Very high	66 Å²	66	30.5 Å²	30.5	68%	0.68	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.2	-3.3	179.7	0	0	0	0	0	115.3	M213 R214	M213-G216 VanDerWaalsContact CE-C 3.46Å; M213-G216 WeakPolarHBondContact CE-O 3.45Å; R214-G216 VanDerWaalsContact C-N 3.26Å; R214-G216 PolarHBondContact O-N 2.95Å
217	K	94.6	Very high	96.5	Very high	99 Å²	99	34.6 Å²	34.6	43%	0.43	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	144.2	-178.9	-52.6	-167.3	-174.8	-175.9	0	112	M213 R214 D215 E282	M213-K217 WeakPolarHBondContact CA-O 3.16Å; R214-K217 PolarHBondContact N-O 2.99Å; R214-K217 PolarHBondContact O-N 3.11Å; R214-K217 VanDerWaalsContact O-O 3.11Å; D215-K217 PolarHBondContact O-N 3.34Å; K217-E282 HydrophobicContact CB-CG 4.34Å; K217-E282 HydrophobicContact CD-CG 3.76Å; K217-E282 WeakPolarHBondContact CD-OE1 3.04Å; K217-E282 VanDerWaalsContact CD-OE2 3.31Å; K217-E282 WeakPolarHBondContact CD-OE2 3.41Å; K217-E282 WeakPolarHBondContact CE-OE1 3.31Å; K217-E282 IonicContact NZ-OE1 2.75Å; K217-E282 PolarHBondContact NZ-OE1 2.83Å; K217-E282 IonicContact NZ-OE2 2.67Å; K217-E282 PolarHBondContact NZ-OE2 2.85Å
218	L	96.5	Very high	96.3	Very high	6 Å²	6	37.8 Å²	37.8	3%	0.031	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	125.6	174.1	-162.6	72.1	0	0	0	109.1	I211 M213 I283 W332 T362 A367	I211-L218 HydrophobicContact CG2-CD1 3.83Å; I211-L218 HydrophobicContact CG2-CD2 4.02Å; I211-L218 HydrophobicContact CG2-CG 3.77Å; M213-L218 HydrophobicContact CG-CD1 4.35Å; M213-L218 HydrophobicContact SD-CB 4.11Å; M213-L218 HydrophobicContact SD-CD1 3.7Å; L218-I283 HydrophobicContact CB-CB 4.45Å; L218-I283 HydrophobicContact CB-CD1 4.47Å; L218-I283 HydrophobicContact CD2-CD1 3.94Å; L218-I283 HydrophobicContact CG-CD1 4.02Å; L218-I283 VanDerWaalsContact O-CB 3.28Å; L218-I283 WeakPolarHBondContact O-CB 3.34Å; L218-I283 WeakPolarHBondContact O-CG1 3.4Å; L218-I283 PolarHBondContact O-N 2.86Å; L218-W332 HydrophobicContact CD1-CZ2 4.39Å; L218-W332 HydrophobicContact CD2-CH2 3.64Å; L218-W332 HydrophobicContact CD2-CZ2 3.81Å; L218-T362 HydrophobicContact CD1-CG2 4.16Å; L218-A367 HydrophobicContact CB-CB 4.35Å; L218-A367 HydrophobicContact CD2-CB 4.14Å
219	C	97.5	Very high	96	Very high	9 Å²	9	42.4 Å²	42.4	6%	0.061	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.4	-175.1	-63.2	0	0	0	0	111.4	I211 S212 M221 H281	I211-C219 WeakPolarHBondContact CA-O 3.5Å; S212-C219 PolarHBondContact N-O 2.72Å; S212-C219 PolarHBondContact O-N 2.74Å; C219-M221 HydrophobicContact CB-CE 4.31Å; C219-M221 HydrophobicContact CB-CG 4.34Å; C219-H281 CarbonylContact C-O 3.57Å; C219-H281 VanDerWaalsContact CA-O 3.29Å; C219-H281 WeakPolarHBondContact CA-O 3.22Å
220	L	97.7	Very high	95.7	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.7	167.3	-176.3	149.8	0	0	0	109	I211 F222 H281 I283 F289 I304	I211-L220 HydrophobicContact CD1-CD1 4.33Å; I211-L220 HydrophobicContact CG1-CB 4.22Å; I211-L220 HydrophobicContact CG1-CD1 4.33Å; I211-L220 HydrophobicContact CG1-CG 4.26Å; L220-F222 HydrophobicContact CD2-CD1 4.34Å; L220-H281 HydrophobicContact CB-CB 4.31Å; L220-H281 PolarHBondContact N-O 2.93Å; L220-H281 PolarHBondContact O-N 3.23Å; L220-I283 HydrophobicContact CB-CD1 4.37Å; L220-F289 HydrophobicContact CD1-CD1 4.45Å; L220-F289 HydrophobicContact CD1-CD2 4.35Å; L220-F289 HydrophobicContact CD1-CE1 4.12Å; L220-F289 HydrophobicContact CD1-CE2 4.01Å; L220-F289 HydrophobicContact CD1-CZ 3.91Å; L220-I304 HydrophobicContact CD1-CD1 3.45Å; L220-I304 VanDerWaalsContact CD1-CD1 3.45Å; L220-I304 HydrophobicContact CD2-CD1 4.09Å; L220-I304 HydrophobicContact CG-CD1 4.42Å
221	M	98.2	Very high	95.5	Very high	10 Å²	10	48.1 Å²	48.1	5%	0.049	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	140	-171.5	-70.5	172.1	-75.6	0	0	112.1	A209 V210 S212 C219 I278 I279 F336	A209-M221 CarbonylContact C-O 3.59Å; A209-M221 VanDerWaalsContact CA-O 3.24Å; A209-M221 WeakPolarHBondContact CA-O 3.07Å; V210-M221 HydrophobicContact CG2-CB 3.87Å; V210-M221 HydrophobicContact CG2-CE 4.19Å; V210-M221 PolarHBondContact N-O 3.37Å; V210-M221 PolarHBondContact O-N 3.14Å; S212-M221 WeakPolarHBondContact OG-CE 3.45Å; C219-M221 HydrophobicContact CB-CE 4.31Å; C219-M221 HydrophobicContact CB-CG 4.34Å; M221-I278 HydrophobicContact CB-CG2 3.76Å; M221-I278 HydrophobicContact CG-CG2 3.93Å; M221-I278 HydrophobicContact SD-CG2 4.05Å; M221-I279 VanDerWaalsContact CA-O 3.23Å; M221-I279 WeakPolarHBondContact CA-O 3.28Å; M221-F336 HydrophobicContact CB-CE2 4.1Å
222	F	98.1	Very high	95.3	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.009	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	151.3	167.1	59.4	-91.3	0	0	0	109.3	A209 L220 I237 I279 V306 Y325	A209-F222 HydrophobicContact CB-CB 4.38Å; L220-F222 HydrophobicContact CD2-CD1 4.34Å; F222-I237 HydrophobicContact CE2-CD1 4.18Å; F222-I237 HydrophobicContact CE2-CG1 4.18Å; F222-I237 HydrophobicContact CZ-CD1 4.4Å; F222-I237 HydrophobicContact CZ-CG1 4.06Å; F222-I279 HydrophobicContact CD1-CB 4.48Å; F222-I279 HydrophobicContact CD2-CB 4.04Å; F222-I279 HydrophobicContact CD2-CG1 4.16Å; F222-I279 HydrophobicContact CE1-CB 4.05Å; F222-I279 HydrophobicContact CE1-CG2 3.95Å; F222-I279 HydrophobicContact CE2-CB 3.54Å; F222-I279 HydrophobicContact CE2-CG1 3.57Å; F222-I279 HydrophobicContact CE2-CG2 3.97Å; F222-I279 HydrophobicContact CG-CB 4.48Å; F222-I279 HydrophobicContact CZ-CB 3.56Å; F222-I279 HydrophobicContact CZ-CG1 4.02Å; F222-I279 HydrophobicContact CZ-CG2 3.47Å; F222-I279 VanDerWaalsContact CZ-CG2 3.47Å; F222-I279 PolarHBondContact N-O 3.13Å; F222-I279 VanDerWaalsContact N-O 3.1Å; F222-I279 PolarHBondContact O-N 2.97Å; F222-V306 HydrophobicContact CD1-CG2 4.14Å; F222-V306 HydrophobicContact CD2-CG1 4.1Å; F222-V306 HydrophobicContact CD2-CG2 4.34Å; F222-V306 HydrophobicContact CE1-CG1 4.4Å; F222-V306 HydrophobicContact CE1-CG2 3.82Å; F222-V306 HydrophobicContact CE2-CB 4.33Å; F222-V306 HydrophobicContact CE2-CG1 3.34Å; F222-V306 HydrophobicContact CE2-CG2 4.06Å; F222-V306 HydrophobicContact CG-CG2 4.38Å; F222-V306 HydrophobicContact CZ-CB 4.32Å; F222-V306 HydrophobicContact CZ-CG1 3.51Å; F222-V306 HydrophobicContact CZ-CG2 3.77Å; F222-Y325 HydrophobicContact CB-CE2 3.85Å; F222-Y325 HydrophobicContact CG-CE2 4.08Å
223	R	98	Very high	95.1	Very high	6 Å²	6	51.6 Å²	51.6	2%	0.023	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	141.9	-178.9	176.2	-175.7	-73.5	164.9	-14.1	110.4	F205 S206 P276 L277 I278 F336 T337 V339 S353 F354	F205-R223 CarbonylContact C-O 3.56Å; F205-R223 WeakPolarHBondContact CA-O 3.49Å; S206-R223 PolarHBondContact N-O 2.84Å; S206-R223 PolarHBondContact OG-N 2.91Å; R223-P276 HydrophobicContact CG-CB 4.09Å; R223-L277 CarbonylContact C-O 3.54Å; R223-L277 VanDerWaalsContact CA-O 3.32Å; R223-L277 WeakPolarHBondContact CA-O 3.28Å; R223-I278 HydrophobicContact CB-CG1 4.44Å; R223-F336 HydrophobicContact CB-CD1 4.38Å; R223-F336 HydrophobicContact CB-CE1 4.25Å; R223-F336 HydrophobicContact CB-CE2 4.41Å; R223-F336 HydrophobicContact CB-CZ 4.28Å; R223-T337 PolarHBondContact NH1-O 2.94Å; R223-T337 VanDerWaalsContact NH1-O 3.13Å; R223-T337 PolarHBondContact NH2-O 3.34Å; R223-V339 VanDerWaalsContact NH1-CG1 3.25Å; R223-S353 PolarHBondContact NH1-O 3.17Å; R223-S353 VanDerWaalsContact NH1-O 3.14Å; R223-F354 WeakPolarHBondContact CD-O 3.36Å; R223-F354 HydrophobicContact CG-CD2 4.27Å; R223-F354 HydrophobicContact CG-CE2 3.73Å; R223-F354 HydrophobicContact CG-CZ 3.91Å; R223-F354 PolarHBondContact NH1-O 3.41Å
224	V	97.3	Very high	95	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	147.7	175.3	67.7	0	0	0	0	109.9	V204 F205 L271 L273 P276 L277 I279 L308	V204-V224 CarbonylContact O-C 3.57Å; V204-V224 WeakPolarHBondContact O-CA 3.37Å; F205-V224 HydrophobicContact CD1-CB 4.35Å; F205-V224 HydrophobicContact CD1-CG2 3.99Å; F205-V224 HydrophobicContact CE1-CG2 3.85Å; V224-L271 HydrophobicContact CG1-CD1 4.2Å; V224-L273 HydrophobicContact CG1-CD1 4.03Å; V224-L273 HydrophobicContact CG2-CD2 4.38Å; V224-P276 CarbonylContact O-C 3.56Å; V224-P276 WeakPolarHBondContact O-CA 3.18Å; V224-L277 HydrophobicContact CG1-CB 4.32Å; V224-L277 PolarHBondContact N-O 3.12Å; V224-L277 PolarHBondContact O-N 3.24Å; V224-I279 HydrophobicContact CG1-CD1 3.91Å; V224-I279 HydrophobicContact CG1-CG1 3.88Å; V224-L308 HydrophobicContact CG2-CD1 3.5Å; V224-L308 VanDerWaalsContact CG2-CD1 3.5Å
225	G	95.7	Very high	95.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	150.8	178.5	0	0	0	0	0	112.7	V204	V204-G225 WeakPolarHBondContact CG2-O 3.35Å; V204-G225 PolarHBondContact N-O 2.96Å; V204-G225 PolarHBondContact O-N 3.31Å
226	D	95.7	Very high	95.2	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.016	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.8	164.6	-170.5	-5.5	0	0	0	108.1	R199 L203 R228 S230 L273 Y351	R199-D226 IonicContact CZ-OD1 2.8Å; R199-D226 IonicContact CZ-OD2 2.55Å; R199-D226 IonicContact NH1-OD1 2.72Å; R199-D226 PolarHBondContact NH1-OD1 3.29Å; R199-D226 IonicContact NH1-OD2 3.21Å; R199-D226 PolarHBondContact NH1-OD2 2.98Å; R199-D226 IonicContact NH2-OD1 3.01Å; R199-D226 IonicContact NH2-OD2 3.46Å; R199-D226 PolarHBondContact NH2-OD2 3.38Å; L203-D226 HydrophobicContact CD2-CB 3.98Å; D226-R228 PolarHBondContact OD1-N 3.48Å; D226-S230 VanDerWaalsContact OD2-O 3.13Å; D226-L273 HydrophobicContact CB-CD2 4.24Å; D226-L273 HydrophobicContact CB-CG 4.42Å; D226-Y351 PolarHBondContact O-OH 3.49Å
227	L	93.7	Very high	95.5	Very high	87 Å²	87	42.8 Å²	42.8	46%	0.455	22%	0.215	S	C	.	.			trans	-85.9	-10.3	177.6	-61.8	178.7	0	0	0	113	T202 V204 Y351	T202-L227 WeakPolarHBondContact O-CB 3.45Å; T202-L227 WeakPolarHBondContact O-CG 2.84Å; T202-L227 PolarHBondContact O-N 3.11Å; V204-L227 HydrophobicContact CG1-CD1 3.76Å; V204-L227 HydrophobicContact CG1-CD2 4.39Å; V204-L227 HydrophobicContact CG1-CG 4.03Å; V204-L227 HydrophobicContact CG2-CD2 4.04Å; V204-L227 HydrophobicContact CG2-CG 4.21Å; L227-Y351 HydrophobicContact CD2-CD1 3.64Å; L227-Y351 HydrophobicContact CD2-CE1 3.39Å; L227-Y351 HydrophobicContact CD2-CG 4.31Å
228	R	92.8	Very high	95.6	Very high	125 Å²	125	42.2 Å²	42.2	47%	0.472	21%	0.21	S	C	.	.	S	Bend	trans	-102.1	156.1	179	-66	-173.7	166.8	152.5	4.1	111.2	R199 T202 D226 S230	R199-R228 VanDerWaalsContact CD-NH1 3.27Å; R199-R228 VanDerWaalsContact NH1-CB 3.32Å; R199-R228 VanDerWaalsContact NH1-CD 3.25Å; T202-R228 HydrophobicContact CG2-CG 4.18Å; D226-R228 PolarHBondContact OD1-N 3.48Å; R228-S230 VanDerWaalsContact C-N 3.34Å
229	N	91.1	Very high	95.7	Very high	161 Å²	161	42 Å²	42	86%	0.861	21%	0.209	S	C	*	.	S	Bend	trans	-73.5	-24.9	172.7	-63	-19.7	0	0	0	113.2
230	S	93	Very high	95.7	Very high	42 Å²	42	44.3 Å²	44.3	29%	0.294	22%	0.218	S	C	.	.	S	Bend	trans	-67.2	150.8	174.2	55.4	0	0	0	0	110.5	R199 D226 R228	R199-S230 PolarHBondContact NH2-O 2.92Å; R199-S230 PolarHBondContact NH2-OG 3.37Å; D226-S230 VanDerWaalsContact OD2-O 3.13Å; R228-S230 VanDerWaalsContact C-N 3.34Å
231	H	93	Very high	95.6	Very high	77 Å²	77	44.7 Å²	44.7	36%	0.356	22%	0.22	S	C	.	.			trans	-88.7	161.1	-176.7	-61.3	-57.3	0	0	0	112.9	E313	H231-E313 PolarHBondContact N-OE2 3.29Å
232	I	93.8	Very high	95.5	Very high	12 Å²	12	44.6 Å²	44.6	6%	0.062	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.3	160.9	-58.1	-61.5	0	0	0	106.6	R199 L203 A235	R199-I232 HydrophobicContact CG-CD1 3.92Å; L203-I232 HydrophobicContact CD1-CD1 4.31Å; L203-I232 HydrophobicContact CD1-CG1 4.46Å; L203-I232 HydrophobicContact CD2-CD1 4.47Å; L203-I232 HydrophobicContact CD2-CG1 4.01Å; I232-A235 HydrophobicContact CB-CB 4.18Å; I232-A235 HydrophobicContact CG2-CB 3.84Å
233	V	94	Very high	95.3	Very high	63 Å²	63	48 Å²	48	38%	0.382	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	139	-178.3	-178.6	0	0	0	0	108.8	A235 G310 M311 E313	V233-A235 PolarHBondContact O-N 3.09Å; V233-G310 CarbonylContact O-C 3.54Å; V233-M311 HydrophobicContact CB-CB 4.28Å; V233-M311 HydrophobicContact CG1-CE 4.12Å; V233-M311 PolarHBondContact N-O 2.71Å; V233-M311 PolarHBondContact O-N 2.76Å; V233-E313 HydrophobicContact CG2-CB 4.32Å
234	E	94.3	Very high	95	Very high	153 Å²	153	50.3 Å²	50.3	72%	0.715	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.5	40.6	-175.5	-64.6	-179.6	178.5	0	0	112.7	S236 M311	E234-S236 PolarHBondContact O-N 3.36Å; E234-M311 HydrophobicContact CB-CE 4.15Å; E234-M311 VanDerWaalsContact CD-CE 3.5Å; E234-M311 HydrophobicContact CG-CE 3.97Å; E234-M311 VanDerWaalsContact OE2-CE 3.26Å; E234-M311 WeakPolarHBondContact OE2-CE 3.37Å
235	A	96.1	Very high	94.8	Very high	2 Å²	2	55 Å²	55	2%	0.017	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	126.9	176	0	0	0	0	0	109.9	I232 V233 R270 L271 E309	I232-A235 HydrophobicContact CB-CB 4.18Å; I232-A235 HydrophobicContact CG2-CB 3.84Å; V233-A235 PolarHBondContact O-N 3.09Å; A235-R270 CarbonylContact O-C 3.52Å; A235-R270 WeakPolarHBondContact O-CA 3.46Å; A235-L271 HydrophobicContact CB-CB 4.07Å; A235-L271 PolarHBondContact O-N 3Å; A235-E309 CarbonylContact C-O 3.52Å; A235-E309 VanDerWaalsContact CA-O 3.3Å; A235-E309 WeakPolarHBondContact CA-O 3.33Å
236	S	96.9	Very high	94.7	Very high	36 Å²	36	61.6 Å²	61.6	25%	0.252	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.5	177.1	57.5	0	0	0	0	110.4	E234 D269 L308 E309	E234-S236 PolarHBondContact O-N 3.36Å; S236-D269 CarbonylContact C-O 3.48Å; S236-D269 VanDerWaalsContact CA-O 3.28Å; S236-D269 WeakPolarHBondContact CA-O 3.42Å; S236-L308 WeakPolarHBondContact O-CA 3.45Å; S236-E309 PolarHBondContact N-O 3.48Å; S236-E309 PolarHBondContact O-N 2.65Å
237	I	97.4	Very high	94.7	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.015	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.6	178.7	-168.6	65.9	0	0	0	110.3	F205 F222 V262 D269 L271 I279 V306 I307 L308	F205-I237 HydrophobicContact CE1-CD1 4.29Å; F222-I237 HydrophobicContact CE2-CD1 4.18Å; F222-I237 HydrophobicContact CE2-CG1 4.18Å; F222-I237 HydrophobicContact CZ-CD1 4.4Å; F222-I237 HydrophobicContact CZ-CG1 4.06Å; I237-V262 HydrophobicContact CG2-CG2 4Å; I237-V262 WeakPolarHBondContact O-CG2 3.4Å; I237-D269 HydrophobicContact CG2-CB 4.41Å; I237-D269 PolarHBondContact N-O 2.94Å; I237-L271 HydrophobicContact CB-CD1 3.93Å; I237-L271 HydrophobicContact CB-CG 4.34Å; I237-L271 HydrophobicContact CG2-CD1 4.13Å; I237-L271 HydrophobicContact CG2-CD2 3.96Å; I237-L271 HydrophobicContact CG2-CG 4.12Å; I237-I279 HydrophobicContact CG1-CG1 4.3Å; I237-I279 HydrophobicContact CG1-CG2 4.3Å; I237-I279 HydrophobicContact CG2-CD1 4.27Å; I237-I279 HydrophobicContact CG2-CG2 4.13Å; I237-V306 HydrophobicContact CD1-CG1 3.52Å; I237-V306 HydrophobicContact CG1-CG1 4.34Å; I237-I307 WeakPolarHBondContact CD1-O 3.18Å; I237-L308 HydrophobicContact CD1-CB 3.89Å; I237-L308 HydrophobicContact CD1-CD1 4.4Å; I237-L308 HydrophobicContact CD1-CG 4.47Å
238	R	97	Very high	94.8	Very high	88 Å²	88	64.2 Å²	64.2	33%	0.332	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	149.4	172.1	66.1	-174.2	-170.6	-150.7	-7.4	110.4	I307 E309 Q320	R238-I307 HydrophobicContact CG-CB 3.74Å; R238-I307 HydrophobicContact CG-CD1 4.37Å; R238-I307 HydrophobicContact CG-CG1 4.43Å; R238-I307 HydrophobicContact CG-CG2 4.41Å; R238-I307 PolarHBondContact N-O 3.46Å; R238-I307 PolarHBondContact O-N 3.25Å; R238-E309 IonicContact CZ-OE1 2.92Å; R238-E309 IonicContact CZ-OE2 3.14Å; R238-E309 IonicContact NE-OE2 3.55Å; R238-E309 VanDerWaalsContact NH1-CD 3.3Å; R238-E309 IonicContact NH1-OE1 2.78Å; R238-E309 PolarHBondContact NH1-OE1 2.82Å; R238-E309 IonicContact NH1-OE2 3.53Å; R238-E309 PolarHBondContact NH1-OE2 3.25Å; R238-E309 VanDerWaalsContact NH2-CD 3.33Å; R238-E309 IonicContact NH2-OE1 3.14Å; R238-E309 PolarHBondContact NH2-OE1 3.4Å; R238-E309 IonicContact NH2-OE2 2.76Å; R238-Q320 VanDerWaalsContact NH2-NE2 3.18Å
239	A	97.7	Very high	95	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.008	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.7	178.4	0	0	0	0	0	110.3	I260 V262 I304 V305 V306	A239-I260 HydrophobicContact CB-CB 4.01Å; A239-I260 HydrophobicContact CB-CD1 4.38Å; A239-I260 PolarHBondContact O-N 2.84Å; A239-V262 HydrophobicContact CB-CG1 4.05Å; A239-I304 HydrophobicContact CB-CG2 4.48Å; A239-V305 CarbonylContact C-O 3.58Å; A239-V305 WeakPolarHBondContact CA-O 3.39Å; A239-V306 HydrophobicContact CB-CG2 4.41Å
240	K	97.4	Very high	95.2	Very high	58 Å²	58	59.9 Å²	59.9	25%	0.252	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.6	175.5	-61.1	-59.8	-169.9	-164.4	0	109.1	T258 D259 I304 V305	K240-T258 CarbonylContact C-O 3.47Å; K240-T258 WeakPolarHBondContact CA-O 3.11Å; K240-D259 HydrophobicContact CD-CB 4.29Å; K240-D259 WeakPolarHBondContact CD-OD1 3.39Å; K240-D259 WeakPolarHBondContact CE-OD1 3.16Å; K240-D259 IonicContact NZ-OD1 2.85Å; K240-D259 PolarHBondContact NZ-OD1 3.22Å; K240-I304 CarbonylContact O-C 3.43Å; K240-I304 WeakPolarHBondContact O-CA 3.38Å; K240-V305 PolarHBondContact N-O 3.34Å; K240-V305 PolarHBondContact O-N 3.21Å
241	L	96.8	Very high	95.3	Very high	10 Å²	10	63.9 Å²	63.9	5%	0.052	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	128.2	163.2	179.4	68	0	0	0	108.6	Q257 T258 I260 P288 F289 L302 I304	L241-Q257 WeakPolarHBondContact O-CA 3.31Å; L241-T258 WeakPolarHBondContact CB-OG1 3.28Å; L241-T258 PolarHBondContact N-O 3.08Å; L241-T258 PolarHBondContact O-N 2.96Å; L241-I260 HydrophobicContact CB-CD1 3.93Å; L241-I260 HydrophobicContact CB-CG1 4.01Å; L241-P288 HydrophobicContact CD2-CB 3.27Å; L241-P288 HydrophobicContact CD2-CG 3.75Å; L241-F289 HydrophobicContact CD1-CE2 4.5Å; L241-F289 HydrophobicContact CD1-CZ 4.01Å; L241-L302 HydrophobicContact CD1-CB 3.91Å; L241-L302 HydrophobicContact CD1-CD1 4.42Å; L241-I304 HydrophobicContact CD1-CG1 4.29Å
242	I	96	Very high	95.4	Very high	7 Å²	7	66.2 Å²	66.2	4%	0.036	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	113.9	174.3	-54.3	-169.3	0	0	0	107.9	Y56 L255 N256 Q257 E303 V305	Y56-I242 HydrophobicContact CD1-CD1 3.35Å; Y56-I242 HydrophobicContact CE1-CD1 3.95Å; Y56-I242 HydrophobicContact CG-CD1 4.06Å; I242-L255 HydrophobicContact CG2-CB 3.72Å; I242-L255 HydrophobicContact CG2-CD2 3.63Å; I242-L255 HydrophobicContact CG2-CG 4.25Å; I242-N256 WeakPolarHBondContact CA-O 3.41Å; I242-Q257 HydrophobicContact CG1-CG 4.3Å; I242-E303 HydrophobicContact CB-CB 4.43Å; I242-E303 PolarHBondContact N-O 3.16Å; I242-E303 PolarHBondContact O-N 3.05Å; I242-V305 HydrophobicContact CD1-CB 4.26Å; I242-V305 HydrophobicContact CD1-CG2 3.41Å; I242-V305 VanDerWaalsContact CD1-CG2 3.41Å; I242-V305 HydrophobicContact CG1-CG2 4.06Å
243	K	93.3	Very high	95.4	Very high	75 Å²	75	67.8 Å²	67.8	33%	0.326	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	138.1	177.6	179.4	179.2	-179.9	-169.9	0	109.4	N256 E300	K243-N256 PolarHBondContact N-O 3.32Å; K243-N256 VanDerWaalsContact N-O 3.12Å; K243-N256 VanDerWaalsContact O-CB 3.28Å; K243-N256 WeakPolarHBondContact O-CB 3.26Å; K243-N256 PolarHBondContact O-N 2.8Å; K243-E300 WeakPolarHBondContact CE-OE1 3.27Å; K243-E300 IonicContact NZ-OE1 2.74Å; K243-E300 PolarHBondContact NZ-OE1 2.92Å
244	S	92.7	Very high	95.3	Very high	54 Å²	54	69 Å²	69	38%	0.378	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	135	173	-60.4	0	0	0	0	110.3	L255	S244-L255 PolarHBondContact OG-N 3.46Å
245	K	92.4	Very high	95.1	Very high	97 Å²	97	65.4 Å²	65.4	42%	0.422	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	156	177.7	67.7	174.6	-77.2	-173.1	0	111.1	I253 N256	K245-I253 HydrophobicContact CD-CD1 4.34Å; K245-I253 HydrophobicContact CG-CB 4.05Å; K245-I253 HydrophobicContact CG-CD1 4.38Å; K245-I253 PolarHBondContact N-O 3.34Å; K245-I253 PolarHBondContact O-N 2.95Å; K245-N256 HydrophobicContact CD-CB 3.93Å; K245-N256 VanDerWaalsContact CD-CG 3.47Å; K245-N256 WeakPolarHBondContact CD-ND2 3.2Å; K245-N256 HydrophobicContact CG-CB 3.73Å
246	Q	94.5	Very high	95.1	Very high	140 Å²	140	67.1 Å²	67.1	65%	0.654	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.8	167.3	-168.9	171.3	13.7	0	0	108.4	E251	Q246-E251 CarbonylContact C-O 3.58Å; Q246-E251 WeakPolarHBondContact CA-O 3.48Å
247	T	95.8	Very high	95	Very high	28 Å²	28	70.5 Å²	70.5	17%	0.172	37%	0.365	C	S	.	.			trans	-80.3	166.1	177.1	76.4	0	0	0	0	111.3	E249 G250 E251 I253	T247-E249 WeakPolarHBondContact CB-OE2 3.23Å; T247-E249 PolarHBondContact O-N 3.12Å; T247-E249 PolarHBondContact OG1-N 3.46Å; T247-E249 PolarHBondContact OG1-OE2 2.67Å; T247-G250 PolarHBondContact O-N 3.14Å; T247-G250 PolarHBondContact OG1-N 2.8Å; T247-E251 HydrophobicContact CG2-CB 4.12Å; T247-E251 PolarHBondContact N-O 3.41Å; T247-E251 PolarHBondContact OG1-N 2.99Å; T247-I253 HydrophobicContact CG2-CD1 4.09Å
248	S	95.8	Very high	94.9	Very high	116 Å²	116	72.8 Å²	72.8	81%	0.811	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.9	174	26.7	0	0	0	0	112.8	G250	S248-G250 VanDerWaalsContact C-N 3.26Å; S248-G250 PolarHBondContact O-N 2.83Å
249	E	96.2	Very high	94.9	Very high	154 Å²	154	72.4 Å²	72.4	72%	0.72	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-7.6	180	-52.7	68.9	-143.2	0	0	112.2	T247	T247-E249 WeakPolarHBondContact CB-OE2 3.23Å; T247-E249 PolarHBondContact O-N 3.12Å; T247-E249 PolarHBondContact OG1-N 3.46Å; T247-E249 PolarHBondContact OG1-OE2 2.67Å
250	G	94.5	Very high	94.8	Very high	42 Å²	42	72.5 Å²	72.5	43%	0.433	38%	0.384	S	S	.	.			trans	97.4	2	177.2	0	0	0	0	0	115.4	T247 S248 F252	T247-G250 PolarHBondContact O-N 3.14Å; T247-G250 PolarHBondContact OG1-N 2.8Å; S248-G250 VanDerWaalsContact C-N 3.26Å; S248-G250 PolarHBondContact O-N 2.83Å; G250-F252 PolarHBondContact O-N 2.99Å
251	E	95.6	Very high	94.8	Very high	126 Å²	126	72 Å²	72	59%	0.589	38%	0.384	S	S	*	.			trans	-69.3	123.3	177.1	-173.6	-178.1	-165.5	0	0	110.4	Q246 T247 I253	Q246-E251 CarbonylContact C-O 3.58Å; Q246-E251 WeakPolarHBondContact CA-O 3.48Å; T247-E251 HydrophobicContact CG2-CB 4.12Å; T247-E251 PolarHBondContact N-O 3.41Å; T247-E251 PolarHBondContact OG1-N 2.99Å; E251-I253 HydrophobicContact CG-CG1 4.21Å
252	F	95.1	Very high	94.7	Very high	125 Å²	125	72.2 Å²	72.2	55%	0.548	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	119.2	172.4	178.7	-103	0	0	0	109.7	G250 P254	G250-F252 PolarHBondContact O-N 2.99Å; F252-P254 HydrophobicContact CD1-CG 4.01Å; F252-P254 HydrophobicContact CE1-CB 4.13Å; F252-P254 HydrophobicContact CE1-CG 3.8Å; F252-P254 WeakPolarHBondContact O-CD 3.08Å
253	I	94.5	Very high	94.6	Very high	46 Å²	46	72.4 Å²	72.4	24%	0.236	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	105	178.2	-55.4	175.3	0	0	0	107.9	K245 T247 E251 N256	K245-I253 HydrophobicContact CD-CD1 4.34Å; K245-I253 HydrophobicContact CG-CB 4.05Å; K245-I253 HydrophobicContact CG-CD1 4.38Å; K245-I253 PolarHBondContact N-O 3.34Å; K245-I253 PolarHBondContact O-N 2.95Å; T247-I253 HydrophobicContact CG2-CD1 4.09Å; E251-I253 HydrophobicContact CG-CG1 4.21Å; I253-N256 HydrophobicContact CB-CB 4.34Å; I253-N256 HydrophobicContact CG2-CB 3.84Å
254	P	91.4	Very high	94.6	Very high	87 Å²	87	76.5 Å²	76.5	57%	0.565	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	137.6	175.2	-14.7	27.6	0	0	0	110.5	F252 N256	F252-P254 HydrophobicContact CD1-CG 4.01Å; F252-P254 HydrophobicContact CE1-CB 4.13Å; F252-P254 HydrophobicContact CE1-CG 3.8Å; F252-P254 WeakPolarHBondContact O-CD 3.08Å; P254-N256 VanDerWaalsContact C-N 3.27Å; P254-N256 PolarHBondContact O-N 3.23Å
255	L	91.1	Very high	94.6	Very high	79 Å²	79	83.1 Å²	83.1	41%	0.414	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.8	46.5	172.3	-59.6	174.1	0	0	0	113.3	Y56 I242 S244 Q257	Y56-L255 HydrophobicContact CD2-CD1 3.69Å; Y56-L255 HydrophobicContact CE2-CD1 4.05Å; I242-L255 HydrophobicContact CG2-CB 3.72Å; I242-L255 HydrophobicContact CG2-CD2 3.63Å; I242-L255 HydrophobicContact CG2-CG 4.25Å; S244-L255 PolarHBondContact OG-N 3.46Å; L255-Q257 PolarHBondContact O-N 3.44Å
256	N	95.2	Very high	94.7	Very high	37 Å²	37	83 Å²	83	20%	0.198	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	130.6	179.3	179.7	73.5	0	0	0	110.4	I242 K243 K245 I253 P254 T258	I242-N256 WeakPolarHBondContact CA-O 3.41Å; K243-N256 PolarHBondContact N-O 3.32Å; K243-N256 VanDerWaalsContact N-O 3.12Å; K243-N256 VanDerWaalsContact O-CB 3.28Å; K243-N256 WeakPolarHBondContact O-CB 3.26Å; K243-N256 PolarHBondContact O-N 2.8Å; K245-N256 HydrophobicContact CD-CB 3.93Å; K245-N256 VanDerWaalsContact CD-CG 3.47Å; K245-N256 WeakPolarHBondContact CD-ND2 3.2Å; K245-N256 HydrophobicContact CG-CB 3.73Å; I253-N256 HydrophobicContact CB-CB 4.34Å; I253-N256 HydrophobicContact CG2-CB 3.84Å; P254-N256 VanDerWaalsContact C-N 3.27Å; P254-N256 PolarHBondContact O-N 3.23Å; N256-T258 WeakPolarHBondContact ND2-CG2 3.35Å
257	Q	95.3	Very high	94.6	Very high	107 Å²	107	77.1 Å²	77.1	50%	0.5	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.5	-176.4	-56.6	-176.1	13.7	0	0	109.7	L241 I242 L255	L241-Q257 WeakPolarHBondContact O-CA 3.31Å; I242-Q257 HydrophobicContact CG1-CG 4.3Å; L255-Q257 PolarHBondContact O-N 3.44Å
258	T	95.3	Very high	94.6	Very high	52 Å²	52	81.2 Å²	81.2	32%	0.319	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.1	172.7	57.2	0	0	0	0	109.8	K240 L241 N256	K240-T258 CarbonylContact C-O 3.47Å; K240-T258 WeakPolarHBondContact CA-O 3.11Å; L241-T258 WeakPolarHBondContact CB-OG1 3.28Å; L241-T258 PolarHBondContact N-O 3.08Å; L241-T258 PolarHBondContact O-N 2.96Å; N256-T258 WeakPolarHBondContact ND2-CG2 3.35Å
259	D	96.3	Very high	94.6	Very high	80 Å²	80	77 Å²	77	43%	0.428	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	137.9	178.3	-162.1	67.2	0	0	0	111.8	K240	K240-D259 HydrophobicContact CD-CB 4.29Å; K240-D259 WeakPolarHBondContact CD-OD1 3.39Å; K240-D259 WeakPolarHBondContact CE-OD1 3.16Å; K240-D259 IonicContact NZ-OD1 2.85Å; K240-D259 PolarHBondContact NZ-OD1 3.22Å
260	I	96.2	Very high	94.5	Very high	3 Å²	3	78.2 Å²	78.2	2%	0.015	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.2	174	-61.8	172	0	0	0	107.2	A239 L241 V262 H281 F289 I304	A239-I260 HydrophobicContact CB-CB 4.01Å; A239-I260 HydrophobicContact CB-CD1 4.38Å; A239-I260 PolarHBondContact O-N 2.84Å; L241-I260 HydrophobicContact CB-CD1 3.93Å; L241-I260 HydrophobicContact CB-CG1 4.01Å; I260-V262 HydrophobicContact CG2-CG1 4.46Å; I260-V262 PolarHBondContact O-N 3.33Å; I260-H281 HydrophobicContact CG2-CB 3.94Å; I260-H281 WeakPolarHBondContact CG2-ND1 3.45Å; I260-F289 HydrophobicContact CD1-CE2 4.03Å; I260-I304 HydrophobicContact CD1-CG1 4.21Å; I260-I304 HydrophobicContact CD1-CG2 3.87Å
261	N	96.4	Very high	94.6	Very high	48 Å²	48	77.3 Å²	77.3	26%	0.257	38%	0.379	S	S	.	.			trans	-69	114.2	179.8	-180	14.5	0	0	0	111.7	G263 Y264 Y265 H281	N261-G263 PolarHBondContact OD1-N 2.92Å; N261-Y264 PolarHBondContact OD1-N 3.03Å; N261-Y264 VanDerWaalsContact OD1-N 3.1Å; N261-Y265 VanDerWaalsContact ND2-CD2 3.26Å; N261-Y265 WeakPolarHBondContact ND2-CD2 3.37Å; N261-Y265 WeakPolarHBondContact ND2-CE2 3.38Å; N261-H281 PolarHBondContact O-ND1 3.3Å
262	V	95.8	Very high	94.6	Very high	13 Å²	13	79.1 Å²	79.1	8%	0.079	39%	0.385	C	S	.	.	S	Bend	trans	-115.2	21.5	177.3	-69	0	0	0	0	112.6	I237 A239 I260 I279 H281	I237-V262 HydrophobicContact CG2-CG2 4Å; I237-V262 WeakPolarHBondContact O-CG2 3.4Å; A239-V262 HydrophobicContact CB-CG1 4.05Å; I260-V262 HydrophobicContact CG2-CG1 4.46Å; I260-V262 PolarHBondContact O-N 3.33Å; V262-I279 HydrophobicContact CB-CG2 3.9Å; V262-I279 HydrophobicContact CG1-CG2 4.03Å; V262-H281 HydrophobicContact CG1-CB 4.34Å
263	G	93	Very high	94.6	Very high	12 Å²	12	73.5 Å²	73.5	12%	0.124	36%	0.361	C	S	.	.	S	Bend	trans	123.5	11.6	-178.2	0	0	0	0	0	115	N261 Y265 T266 G267 D268 D269	N261-G263 PolarHBondContact OD1-N 2.92Å; G263-Y265 VanDerWaalsContact C-N 3.35Å; G263-Y265 PolarHBondContact O-N 2.86Å; G263-T266 PolarHBondContact O-N 3.28Å; G263-T266 PolarHBondContact O-OG1 2.8Å; G263-G267 WeakPolarHBondContact O-CA 3.38Å; G263-G267 PolarHBondContact O-N 2.88Å; G263-D268 PolarHBondContact O-N 3.29Å; G263-D269 PolarHBondContact O-N 2.91Å
264	Y	92.7	Very high	94.6	Very high	161 Å²	161	74.7 Å²	74.7	63%	0.631	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-40.5	-172.8	-178.6	-106.7	0	0	0	113.4	N261	N261-Y264 PolarHBondContact OD1-N 3.03Å; N261-Y264 VanDerWaalsContact OD1-N 3.1Å
265	Y	93.8	Very high	94.7	Very high	192 Å²	192	72.2 Å²	72.2	75%	0.753	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-27.3	-177.2	-57.6	-62	0	0	0	113.8	N261 G263	N261-Y265 VanDerWaalsContact ND2-CD2 3.26Å; N261-Y265 WeakPolarHBondContact ND2-CD2 3.37Å; N261-Y265 WeakPolarHBondContact ND2-CE2 3.38Å; G263-Y265 VanDerWaalsContact C-N 3.35Å; G263-Y265 PolarHBondContact O-N 2.86Å
266	T	93.9	Very high	95	Very high	96 Å²	96	69 Å²	69	59%	0.589	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-17.3	179.7	51.3	0	0	0	0	112	G263 D268	G263-T266 PolarHBondContact O-N 3.28Å; G263-T266 PolarHBondContact O-OG1 2.8Å; T266-D268 VanDerWaalsContact C-N 3.31Å; T266-D268 WeakPolarHBondContact CB-OD2 3.34Å; T266-D268 VanDerWaalsContact OG1-CG 3.29Å; T266-D268 PolarHBondContact OG1-N 2.93Å; T266-D268 PolarHBondContact OG1-OD2 3.4Å
267	G	93.4	Very high	95.1	Very high	15 Å²	15	69.8 Å²	69.8	16%	0.155	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	16.2	-171.6	0	0	0	0	0	113.4	G263 D269 R270	G263-G267 WeakPolarHBondContact O-CA 3.38Å; G263-G267 PolarHBondContact O-N 2.88Å; G267-D269 VanDerWaalsContact C-OD1 3.29Å; G267-D269 VanDerWaalsContact CA-OD1 3.29Å; G267-D269 WeakPolarHBondContact CA-OD1 3.3Å; G267-R270 WeakPolarHBondContact O-CB 3.31Å; G267-R270 PolarHBondContact O-N 3.34Å; G267-R270 PolarHBondContact O-NE 2.96Å; G267-R270 PolarHBondContact O-NH2 3.11Å
268	D	94.5	Very high	95.3	Very high	115 Å²	115	67.7 Å²	67.7	62%	0.615	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-10.4	173.3	-70.1	-51	0	0	0	112.3	G263 T266 R270	G263-D268 PolarHBondContact O-N 3.29Å; T266-D268 VanDerWaalsContact C-N 3.31Å; T266-D268 WeakPolarHBondContact CB-OD2 3.34Å; T266-D268 VanDerWaalsContact OG1-CG 3.29Å; T266-D268 PolarHBondContact OG1-N 2.93Å; T266-D268 PolarHBondContact OG1-OD2 3.4Å; D268-R270 PolarHBondContact O-N 3.48Å
269	D	95.4	Very high	95.4	Very high	27 Å²	27	65.7 Å²	65.7	14%	0.144	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-18.1	168.1	65.7	-34.7	0	0	0	112.3	S236 I237 G263 G267 L271	S236-D269 CarbonylContact C-O 3.48Å; S236-D269 VanDerWaalsContact CA-O 3.28Å; S236-D269 WeakPolarHBondContact CA-O 3.42Å; I237-D269 HydrophobicContact CG2-CB 4.41Å; I237-D269 PolarHBondContact N-O 2.94Å; G263-D269 PolarHBondContact O-N 2.91Å; G267-D269 VanDerWaalsContact C-OD1 3.29Å; G267-D269 VanDerWaalsContact CA-OD1 3.29Å; G267-D269 WeakPolarHBondContact CA-OD1 3.3Å; D269-L271 PolarHBondContact O-N 2.85Å
270	R	96	Very high	95.4	Very high	179 Å²	179	63.8 Å²	63.8	68%	0.675	31%	0.314	S	S	*	.	B	Isolated β-bridge	trans	-84.5	108	172.4	-59.7	172.4	-62.3	175.5	2.1	109.5	A235 G267 D268	A235-R270 CarbonylContact O-C 3.52Å; A235-R270 WeakPolarHBondContact O-CA 3.46Å; G267-R270 WeakPolarHBondContact O-CB 3.31Å; G267-R270 PolarHBondContact O-N 3.34Å; G267-R270 PolarHBondContact O-NE 2.96Å; G267-R270 PolarHBondContact O-NH2 3.11Å; D268-R270 PolarHBondContact O-N 3.48Å
271	L	96	Very high	95.5	Very high	23 Å²	23	63.9 Å²	63.9	12%	0.12	32%	0.315	C	S	.	.			trans	-89.4	138.6	-171.3	-54.7	-177.3	0	0	0	111.7	V224 A235 I237 D269 L273 L277 I279 L308	V224-L271 HydrophobicContact CG1-CD1 4.2Å; A235-L271 HydrophobicContact CB-CB 4.07Å; A235-L271 PolarHBondContact O-N 3Å; I237-L271 HydrophobicContact CB-CD1 3.93Å; I237-L271 HydrophobicContact CB-CG 4.34Å; I237-L271 HydrophobicContact CG2-CD1 4.13Å; I237-L271 HydrophobicContact CG2-CD2 3.96Å; I237-L271 HydrophobicContact CG2-CG 4.12Å; D269-L271 PolarHBondContact O-N 2.85Å; L271-L273 HydrophobicContact CB-CB 4.38Å; L271-L277 HydrophobicContact CB-CD1 4.38Å; L271-L277 HydrophobicContact CD2-CD1 4.3Å; L271-I279 HydrophobicContact CD1-CD1 3.99Å; L271-I279 HydrophobicContact CD2-CD1 3.69Å; L271-L308 HydrophobicContact CD1-CD1 3.98Å
272	F	95.5	Very high	95.5	Very high	164 Å²	164	65 Å²	65	72%	0.719	32%	0.319	S	S	*	.			trans	-98.5	84.9	156	179.1	-113.7	0	0	0	108.2	V274	F272-V274 HydrophobicContact CD1-CG2 4.29Å; F272-V274 HydrophobicContact CE1-CG2 3.68Å; F272-V274 HydrophobicContact CE2-CG2 3.92Å; F272-V274 HydrophobicContact CZ-CG2 3.47Å; F272-V274 VanDerWaalsContact CZ-CG2 3.47Å; F272-V274 PolarHBondContact O-N 3.27Å
273	L	94.3	Very high	95.5	Very high	7 Å²	7	64.8 Å²	64.8	4%	0.037	32%	0.317	C	S	.	.			trans	-91.6	97.8	-171.8	-172.6	65.7	0	0	0	110.9	L203 V224 D226 L271 L277 L308	L203-L273 HydrophobicContact CD2-CD2 4.32Å; V224-L273 HydrophobicContact CG1-CD1 4.03Å; V224-L273 HydrophobicContact CG2-CD2 4.38Å; D226-L273 HydrophobicContact CB-CD2 4.24Å; D226-L273 HydrophobicContact CB-CG 4.42Å; L271-L273 HydrophobicContact CB-CB 4.38Å; L273-L277 HydrophobicContact CD1-CB 4.25Å; L273-L277 HydrophobicContact CD1-CD1 4.05Å; L273-L277 HydrophobicContact CD1-CG 3.91Å; L273-L308 HydrophobicContact CD2-CD1 4.04Å
274	V	94.3	Very high	95.6	Very high	72 Å²	72	66.1 Å²	66.1	44%	0.436	32%	0.321	S	S	.	.	S	Bend	trans	-114.9	-66.7	170.6	-178.8	0	0	0	0	109.1	F272	F272-V274 HydrophobicContact CD1-CG2 4.29Å; F272-V274 HydrophobicContact CE1-CG2 3.68Å; F272-V274 HydrophobicContact CE2-CG2 3.92Å; F272-V274 HydrophobicContact CZ-CG2 3.47Å; F272-V274 VanDerWaalsContact CZ-CG2 3.47Å; F272-V274 PolarHBondContact O-N 3.27Å
275	S	95.1	Very high	95.7	Very high	35 Å²	35	65.2 Å²	65.2	25%	0.245	32%	0.323	C	S	.	.	S	Bend	trans	-83.7	157.3	166.5	59	0	0	0	0	110.8	L277	S275-L277 PolarHBondContact O-N 3.42Å
276	P	97	Very high	95.7	Very high	10 Å²	10	63 Å²	63	7%	0.065	32%	0.319	C	S	.	.			trans	-51.2	132.6	174	-30.4	37.2	0	0	0	113.8	R223 V224 V339 V349 Y351 F354	R223-P276 HydrophobicContact CG-CB 4.09Å; V224-P276 CarbonylContact O-C 3.56Å; V224-P276 WeakPolarHBondContact O-CA 3.18Å; P276-V339 HydrophobicContact CB-CG2 4.15Å; P276-V339 HydrophobicContact CG-CG2 4.21Å; P276-V349 HydrophobicContact CG-CG1 3.66Å; P276-Y351 HydrophobicContact CG-CE1 4.15Å; P276-F354 HydrophobicContact CB-CD2 4.02Å; P276-F354 HydrophobicContact CB-CE2 3.79Å; P276-F354 HydrophobicContact CG-CD2 3.88Å; P276-F354 HydrophobicContact CG-CE2 3.92Å
277	L	97.4	Very high	95.8	Very high	55 Å²	55	58.7 Å²	58.7	29%	0.288	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	141.7	178.8	-63.5	179.6	0	0	0	110.6	R223 V224 L271 L273 S275 I279	R223-L277 CarbonylContact C-O 3.54Å; R223-L277 VanDerWaalsContact CA-O 3.32Å; R223-L277 WeakPolarHBondContact CA-O 3.28Å; V224-L277 HydrophobicContact CG1-CB 4.32Å; V224-L277 PolarHBondContact N-O 3.12Å; V224-L277 PolarHBondContact O-N 3.24Å; L271-L277 HydrophobicContact CB-CD1 4.38Å; L271-L277 HydrophobicContact CD2-CD1 4.3Å; L273-L277 HydrophobicContact CD1-CB 4.25Å; L273-L277 HydrophobicContact CD1-CD1 4.05Å; L273-L277 HydrophobicContact CD1-CG 3.91Å; S275-L277 PolarHBondContact O-N 3.42Å; L277-I279 HydrophobicContact CB-CD1 4.32Å
278	I	97.9	Very high	95.7	Very high	63 Å²	63	60.5 Å²	60.5	32%	0.323	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	108.7	170.4	-60.4	171.5	0	0	0	107.3	M221 R223 F336	M221-I278 HydrophobicContact CB-CG2 3.76Å; M221-I278 HydrophobicContact CG-CG2 3.93Å; M221-I278 HydrophobicContact SD-CG2 4.05Å; R223-I278 HydrophobicContact CB-CG1 4.44Å; I278-F336 HydrophobicContact CD1-CB 3.96Å; I278-F336 HydrophobicContact CD1-CD2 4.13Å; I278-F336 HydrophobicContact CD1-CG 4.42Å; I278-F336 HydrophobicContact CG1-CD2 4.17Å; I278-F336 HydrophobicContact CG2-CD2 4.07Å; I278-F336 HydrophobicContact CG2-CE2 4.35Å
279	I	97.7	Very high	95.8	Very high	9 Å²	9	55.1 Å²	55.1	5%	0.046	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	128.3	174.7	-49.9	-53.3	0	0	0	107.8	M221 F222 V224 I237 V262 L271 L277	M221-I279 VanDerWaalsContact CA-O 3.23Å; M221-I279 WeakPolarHBondContact CA-O 3.28Å; F222-I279 HydrophobicContact CD1-CB 4.48Å; F222-I279 HydrophobicContact CD2-CB 4.04Å; F222-I279 HydrophobicContact CD2-CG1 4.16Å; F222-I279 HydrophobicContact CE1-CB 4.05Å; F222-I279 HydrophobicContact CE1-CG2 3.95Å; F222-I279 HydrophobicContact CE2-CB 3.54Å; F222-I279 HydrophobicContact CE2-CG1 3.57Å; F222-I279 HydrophobicContact CE2-CG2 3.97Å; F222-I279 HydrophobicContact CG-CB 4.48Å; F222-I279 HydrophobicContact CZ-CB 3.56Å; F222-I279 HydrophobicContact CZ-CG1 4.02Å; F222-I279 HydrophobicContact CZ-CG2 3.47Å; F222-I279 VanDerWaalsContact CZ-CG2 3.47Å; F222-I279 PolarHBondContact N-O 3.13Å; F222-I279 VanDerWaalsContact N-O 3.1Å; F222-I279 PolarHBondContact O-N 2.97Å; V224-I279 HydrophobicContact CG1-CD1 3.91Å; V224-I279 HydrophobicContact CG1-CG1 3.88Å; I237-I279 HydrophobicContact CG1-CG1 4.3Å; I237-I279 HydrophobicContact CG1-CG2 4.3Å; I237-I279 HydrophobicContact CG2-CD1 4.27Å; I237-I279 HydrophobicContact CG2-CG2 4.13Å; V262-I279 HydrophobicContact CB-CG2 3.9Å; V262-I279 HydrophobicContact CG1-CG2 4.03Å; L271-I279 HydrophobicContact CD1-CD1 3.99Å; L271-I279 HydrophobicContact CD2-CD1 3.69Å; L277-I279 HydrophobicContact CB-CD1 4.32Å
280	S	97.5	Very high	95.8	Very high	41 Å²	41	56.3 Å²	56.3	29%	0.287	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120	-173	-172.5	0	0	0	0	110.5
281	H	97.5	Very high	95.7	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.019	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	116.2	168.2	168.5	58.6	0	0	0	109.3	C219 L220 I260 N261 V262 I283 S287	C219-H281 CarbonylContact C-O 3.57Å; C219-H281 VanDerWaalsContact CA-O 3.29Å; C219-H281 WeakPolarHBondContact CA-O 3.22Å; L220-H281 HydrophobicContact CB-CB 4.31Å; L220-H281 PolarHBondContact N-O 2.93Å; L220-H281 PolarHBondContact O-N 3.23Å; I260-H281 HydrophobicContact CG2-CB 3.94Å; I260-H281 WeakPolarHBondContact CG2-ND1 3.45Å; N261-H281 PolarHBondContact O-ND1 3.3Å; V262-H281 HydrophobicContact CG1-CB 4.34Å; H281-I283 PolarHBondContact O-N 3.42Å; H281-S287 WeakPolarHBondContact NE2-CB 3.14Å; H281-S287 PolarHBondContact NE2-OG 3.23Å
282	E	96.9	Very high	95.7	Very high	73 Å²	73	53 Å²	53	34%	0.341	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	122.1	172.3	-176.9	-177.1	139.8	0	0	110.3	K217 N284	K217-E282 HydrophobicContact CB-CG 4.34Å; K217-E282 HydrophobicContact CD-CG 3.76Å; K217-E282 WeakPolarHBondContact CD-OE1 3.04Å; K217-E282 VanDerWaalsContact CD-OE2 3.31Å; K217-E282 WeakPolarHBondContact CD-OE2 3.41Å; K217-E282 WeakPolarHBondContact CE-OE1 3.31Å; K217-E282 IonicContact NZ-OE1 2.75Å; K217-E282 PolarHBondContact NZ-OE1 2.83Å; K217-E282 IonicContact NZ-OE2 2.67Å; K217-E282 PolarHBondContact NZ-OE2 2.85Å; E282-N284 VanDerWaalsContact C-N 3.31Å; E282-N284 HydrophobicContact CG-CB 4.44Å; E282-N284 PolarHBondContact O-N 3.45Å
283	I	96.8	Very high	95.7	Very high	8 Å²	8	45.8 Å²	45.8	4%	0.041	24%	0.238	C	C	.	.			trans	-81.6	82.8	176.8	-54.5	175	0	0	0	108.4	I211 L218 L220 H281 F289 W290 A367	I211-I283 HydrophobicContact CG2-CD1 4.25Å; L218-I283 HydrophobicContact CB-CB 4.45Å; L218-I283 HydrophobicContact CB-CD1 4.47Å; L218-I283 HydrophobicContact CD2-CD1 3.94Å; L218-I283 HydrophobicContact CG-CD1 4.02Å; L218-I283 VanDerWaalsContact O-CB 3.28Å; L218-I283 WeakPolarHBondContact O-CB 3.34Å; L218-I283 WeakPolarHBondContact O-CG1 3.4Å; L218-I283 PolarHBondContact O-N 2.86Å; L220-I283 HydrophobicContact CB-CD1 4.37Å; H281-I283 PolarHBondContact O-N 3.42Å; I283-F289 HydrophobicContact CD1-CB 4.01Å; I283-F289 HydrophobicContact CG1-CB 4.17Å; I283-F289 HydrophobicContact CG2-CB 3.78Å; I283-W290 WeakPolarHBondContact O-CZ3 3.49Å; I283-A367 HydrophobicContact CB-CB 4.18Å; I283-A367 HydrophobicContact CG2-CB 3.53Å
284	N	94.6	Very high	95.7	Very high	40 Å²	40	49.3 Å²	49.3	21%	0.214	25%	0.253	C	S	.	.			trans	-98	-175.6	175.5	66	14	0	0	0	111.8	E282 Q286 S287	E282-N284 VanDerWaalsContact C-N 3.31Å; E282-N284 HydrophobicContact CG-CB 4.44Å; E282-N284 PolarHBondContact O-N 3.45Å; N284-Q286 PolarHBondContact ND2-OE1 2.75Å; N284-Q286 PolarHBondContact O-N 3.14Å; N284-Q286 VanDerWaalsContact O-N 3.16Å; N284-Q286 PolarHBondContact OD1-N 2.75Å; N284-Q286 VanDerWaalsContact OD1-N 3.11Å; N284-Q286 PolarHBondContact OD1-OE1 3.49Å; N284-S287 WeakPolarHBondContact O-CB 3.41Å; N284-S287 PolarHBondContact O-N 2.95Å; N284-S287 PolarHBondContact OD1-N 2.92Å; N284-S287 VanDerWaalsContact OD1-N 3.11Å
285	Q	95.2	Very high	95.7	Very high	142 Å²	142	49.2 Å²	49.2	66%	0.664	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.1	-179.2	-171	-179.7	5.2	0	0	113.7	S287 W290	Q285-S287 VanDerWaalsContact C-N 3.35Å; Q285-W290 HydrophobicContact CB-CZ2 4.39Å
286	Q	93.6	Very high	95.7	Very high	144 Å²	144	51.4 Å²	51.4	67%	0.673	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-11.1	176.8	-63	75.5	29.7	0	0	112.6	N284	N284-Q286 PolarHBondContact ND2-OE1 2.75Å; N284-Q286 PolarHBondContact O-N 3.14Å; N284-Q286 VanDerWaalsContact O-N 3.16Å; N284-Q286 PolarHBondContact OD1-N 2.75Å; N284-Q286 VanDerWaalsContact OD1-N 3.11Å; N284-Q286 PolarHBondContact OD1-OE1 3.49Å
287	S	94.4	Very high	95.5	Very high	7 Å²	7	51.2 Å²	51.2	5%	0.049	26%	0.264	C	S	.	.	S	Bend	trans	-70.6	136.5	-179.7	-179	0	0	0	0	111.2	H281 N284 Q285 F289 W290	H281-S287 WeakPolarHBondContact NE2-CB 3.14Å; H281-S287 PolarHBondContact NE2-OG 3.23Å; N284-S287 WeakPolarHBondContact O-CB 3.41Å; N284-S287 PolarHBondContact O-N 2.95Å; N284-S287 PolarHBondContact OD1-N 2.92Å; N284-S287 VanDerWaalsContact OD1-N 3.11Å; Q285-S287 VanDerWaalsContact C-N 3.35Å; S287-F289 PolarHBondContact O-N 3.02Å; S287-F289 VanDerWaalsContact O-N 3.08Å; S287-F289 PolarHBondContact OG-N 3.4Å; S287-F289 VanDerWaalsContact OG-N 3.13Å; S287-W290 VanDerWaalsContact O-CB 3.26Å; S287-W290 WeakPolarHBondContact O-CB 3.4Å; S287-W290 PolarHBondContact O-N 3.24Å; S287-W290 VanDerWaalsContact O-N 3.09Å
288	P	93.3	Very high	95.2	Very high	52 Å²	52	53.4 Å²	53.4	34%	0.338	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-17	168.7	-23.8	34.4	0	0	0	114.3	L241	L241-P288 HydrophobicContact CD2-CB 3.27Å; L241-P288 HydrophobicContact CD2-CG 3.75Å
289	F	94.9	Very high	94.9	Very high	3 Å²	3	58.2 Å²	58.2	1%	0.013	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	2.6	179.5	-62.2	-87	0	0	0	113.2	L220 L241 I260 I283 S287 E291 I292 L302 I304	L220-F289 HydrophobicContact CD1-CD1 4.45Å; L220-F289 HydrophobicContact CD1-CD2 4.35Å; L220-F289 HydrophobicContact CD1-CE1 4.12Å; L220-F289 HydrophobicContact CD1-CE2 4.01Å; L220-F289 HydrophobicContact CD1-CZ 3.91Å; L241-F289 HydrophobicContact CD1-CE2 4.5Å; L241-F289 HydrophobicContact CD1-CZ 4.01Å; I260-F289 HydrophobicContact CD1-CE2 4.03Å; I283-F289 HydrophobicContact CD1-CB 4.01Å; I283-F289 HydrophobicContact CG1-CB 4.17Å; I283-F289 HydrophobicContact CG2-CB 3.78Å; S287-F289 PolarHBondContact O-N 3.02Å; S287-F289 VanDerWaalsContact O-N 3.08Å; S287-F289 PolarHBondContact OG-N 3.4Å; S287-F289 VanDerWaalsContact OG-N 3.13Å; F289-E291 VanDerWaalsContact C-N 3.32Å; F289-E291 PolarHBondContact O-N 3.39Å; F289-I292 HydrophobicContact CD1-CD1 3.83Å; F289-I292 HydrophobicContact CE1-CD1 4.41Å; F289-I292 PolarHBondContact O-N 3.39Å; F289-I292 VanDerWaalsContact O-N 3.14Å; F289-L302 HydrophobicContact CE1-CD1 4.18Å; F289-L302 HydrophobicContact CE1-CD2 3.78Å; F289-L302 HydrophobicContact CZ-CD1 4.42Å; F289-L302 HydrophobicContact CZ-CD2 4.41Å; F289-I304 HydrophobicContact CE1-CD1 4.37Å; F289-I304 HydrophobicContact CE2-CD1 4.19Å; F289-I304 HydrophobicContact CZ-CD1 3.56Å; F289-I304 HydrophobicContact CZ-CG1 3.91Å
290	W	96	Very high	94.6	Very high	51 Å²	51	60.4 Å²	60.4	19%	0.193	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-42.3	-173.6	-176.6	-121.6	0	0	0	114.1	I283 Q285 S287 A367 K368 A371	I283-W290 WeakPolarHBondContact O-CZ3 3.49Å; Q285-W290 HydrophobicContact CB-CZ2 4.39Å; S287-W290 VanDerWaalsContact O-CB 3.26Å; S287-W290 WeakPolarHBondContact O-CB 3.4Å; S287-W290 PolarHBondContact O-N 3.24Å; S287-W290 VanDerWaalsContact O-N 3.09Å; W290-A367 HydrophobicContact CD2-CB 4.4Å; W290-A367 HydrophobicContact CE3-CB 3.47Å; W290-A367 VanDerWaalsContact CE3-CB 3.47Å; W290-A367 HydrophobicContact CZ3-CB 3.64Å; W290-A367 PolarHBondContact O-N 3.16Å; W290-K368 HydrophobicContact CD2-CB 4.1Å; W290-K368 HydrophobicContact CG-CB 4.26Å; W290-K368 HydrophobicContact CZ2-CB 4.13Å; W290-K368 HydrophobicContact CZ2-CG 4.44Å; W290-K368 WeakPolarHBondContact O-CB 3.27Å; W290-K368 PolarHBondContact O-N 3.11Å; W290-A371 HydrophobicContact CH2-CB 3.54Å; W290-A371 HydrophobicContact CZ2-CB 3.97Å
291	E	94.9	Very high	94.3	Very high	115 Å²	115	65.1 Å²	65.1	54%	0.537	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	6.9	-177.1	-53.8	-161.8	143.5	0	0	113.5	F289 Q296 K368	F289-E291 VanDerWaalsContact C-N 3.32Å; F289-E291 PolarHBondContact O-N 3.39Å; E291-Q296 PolarHBondContact O-OE1 3.19Å; E291-Q296 VanDerWaalsContact O-OE1 3.05Å; E291-K368 HydrophobicContact CG-CD 4.02Å; E291-K368 IonicContact OE1-NZ 2.73Å; E291-K368 PolarHBondContact OE1-NZ 3.28Å
292	I	94.8	Very high	94.1	Very high	17 Å²	17	65.5 Å²	65.5	9%	0.087	33%	0.33	C	S	.	.			trans	-93.7	115.8	-176.1	-59	-178.2	0	0	0	109.7	F289 Q296 L297 E300 L302 W332	F289-I292 HydrophobicContact CD1-CD1 3.83Å; F289-I292 HydrophobicContact CE1-CD1 4.41Å; F289-I292 PolarHBondContact O-N 3.39Å; F289-I292 VanDerWaalsContact O-N 3.14Å; I292-Q296 HydrophobicContact CG2-CB 4.43Å; I292-L297 HydrophobicContact CG2-CB 3.96Å; I292-L297 HydrophobicContact CG2-CD1 4.2Å; I292-E300 HydrophobicContact CD1-CG 4.24Å; I292-L302 HydrophobicContact CD1-CD2 4.01Å; I292-W332 VanDerWaalsContact O-CH2 3.3Å; I292-W332 WeakPolarHBondContact O-CH2 3.49Å
293	S	95.1	Very high	94.1	Very high	14 Å²	14	62.6 Å²	62.6	10%	0.098	32%	0.317	C	S	.	.			trans	-88.8	167.8	170.5	63.4	0	0	0	0	112.8	A295 Q296 L297	S293-A295 PolarHBondContact O-N 3.14Å; S293-A295 VanDerWaalsContact O-N 3.15Å; S293-Q296 PolarHBondContact O-N 3.21Å; S293-Q296 VanDerWaalsContact OG-CD 3.26Å; S293-Q296 WeakPolarHBondContact OG-CG 3.4Å; S293-Q296 PolarHBondContact OG-N 3.11Å; S293-Q296 PolarHBondContact OG-OE1 3.01Å; S293-L297 PolarHBondContact O-N 3.17Å
294	K	95.5	Very high	94.1	Very high	80 Å²	80	62.3 Å²	62.3	35%	0.348	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-36.6	174.5	-174	174.5	-172.1	174.4	0	112.5	P298 W332 S364	K294-P298 WeakPolarHBondContact O-CD 3.44Å; K294-W332 HydrophobicContact CB-CD2 3.77Å; K294-W332 HydrophobicContact CB-CE3 4.39Å; K294-W332 HydrophobicContact CB-CG 3.83Å; K294-W332 HydrophobicContact CB-CZ2 4.36Å; K294-W332 HydrophobicContact CD-CB 4.37Å; K294-W332 HydrophobicContact CD-CG 3.98Å; K294-W332 HydrophobicContact CG-CB 3.94Å; K294-W332 HydrophobicContact CG-CD2 4.1Å; K294-W332 HydrophobicContact CG-CG 3.62Å; K294-S364 WeakPolarHBondContact CB-O 3.27Å; K294-S364 PolarHBondContact N-O 3.32Å
295	A	94.6	Very high	94.2	Very high	71 Å²	71	60.8 Å²	60.8	59%	0.587	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-26.4	-178.7	0	0	0	0	0	113.4	S293	S293-A295 PolarHBondContact O-N 3.14Å; S293-A295 VanDerWaalsContact O-N 3.15Å
296	Q	93.8	Very high	94.3	Very high	80 Å²	80	54 Å²	54	37%	0.374	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-33	177.7	-75.7	159.3	-34.7	0	0	111.9	E291 I292 S293 K299 E300	E291-Q296 PolarHBondContact O-OE1 3.19Å; E291-Q296 VanDerWaalsContact O-OE1 3.05Å; I292-Q296 HydrophobicContact CG2-CB 4.43Å; S293-Q296 PolarHBondContact O-N 3.21Å; S293-Q296 VanDerWaalsContact OG-CD 3.26Å; S293-Q296 WeakPolarHBondContact OG-CG 3.4Å; S293-Q296 PolarHBondContact OG-N 3.11Å; S293-Q296 PolarHBondContact OG-OE1 3.01Å; Q296-K299 WeakPolarHBondContact O-CA 3.33Å; Q296-K299 WeakPolarHBondContact O-CB 3.25Å; Q296-K299 PolarHBondContact O-N 3.13Å; Q296-E300 PolarHBondContact O-N 3.33Å
297	L	93.2	Very high	94.5	Very high	6 Å²	6	48 Å²	48	3%	0.031	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-48	-52.7	-175.9	178.8	68.5	0	0	0	112.7	I211 I292 S293 K299 E300 T327 I330 W332	I211-L297 HydrophobicContact CD1-CD2 4.41Å; I292-L297 HydrophobicContact CG2-CB 3.96Å; I292-L297 HydrophobicContact CG2-CD1 4.2Å; S293-L297 PolarHBondContact O-N 3.17Å; L297-K299 PolarHBondContact O-N 2.91Å; L297-K299 VanDerWaalsContact O-N 3.11Å; L297-E300 WeakPolarHBondContact O-CB 3.43Å; L297-E300 PolarHBondContact O-N 3.32Å; L297-T327 HydrophobicContact CD1-CG2 4.23Å; L297-T327 HydrophobicContact CG-CG2 4.27Å; L297-T327 WeakPolarHBondContact O-CG2 3.36Å; L297-I330 HydrophobicContact CD2-CB 4.19Å; L297-I330 HydrophobicContact CD2-CG2 3.93Å; L297-W332 HydrophobicContact CD2-CE3 4.08Å
298	P	91.7	Very high	94.6	Very high	102 Å²	102	47.7 Å²	47.7	66%	0.662	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-67.4	-14.1	-178.9	-20	33.9	0	0	0	115.3	K294	K294-P298 WeakPolarHBondContact O-CD 3.44Å
299	K	91.3	Very high	94.8	Very high	164 Å²	164	47.6 Å²	47.6	71%	0.713	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-87.5	-18	176.2	-58.5	178.2	-176.2	173.6	0	111.7	Q296 L297	Q296-K299 WeakPolarHBondContact O-CA 3.33Å; Q296-K299 WeakPolarHBondContact O-CB 3.25Å; Q296-K299 PolarHBondContact O-N 3.13Å; L297-K299 PolarHBondContact O-N 2.91Å; L297-K299 VanDerWaalsContact O-N 3.11Å
300	E	90.4	Very high	94.7	Very high	55 Å²	55	47.8 Å²	47.8	26%	0.257	24%	0.244	S	C	.	.			trans	-81.7	132.5	-176.8	-141.3	61.5	-155.2	0	0	110.8	K243 I292 Q296 L297 L302 T327	K243-E300 WeakPolarHBondContact CE-OE1 3.27Å; K243-E300 IonicContact NZ-OE1 2.74Å; K243-E300 PolarHBondContact NZ-OE1 2.92Å; I292-E300 HydrophobicContact CD1-CG 4.24Å; Q296-E300 PolarHBondContact O-N 3.33Å; L297-E300 WeakPolarHBondContact O-CB 3.43Å; L297-E300 PolarHBondContact O-N 3.32Å; E300-L302 HydrophobicContact CB-CD2 3.96Å; E300-L302 HydrophobicContact CB-CG 4.38Å; E300-L302 HydrophobicContact CG-CD2 3.79Å; E300-L302 HydrophobicContact CG-CG 4.48Å; E300-L302 PolarHBondContact O-N 3.44Å; E300-T327 WeakPolarHBondContact O-CB 3.43Å; E300-T327 VanDerWaalsContact O-CG2 3.22Å; E300-T327 WeakPolarHBondContact O-CG2 3.29Å; E300-T327 PolarHBondContact O-OG1 2.81Å
301	E	91.4	Very high	94.7	Very high	140 Å²	140	47.7 Å²	47.7	65%	0.654	25%	0.246	S	C	*	.			trans	-96.2	87.8	176.6	-61.7	-178.3	161.2	0	0	108.8	I53	I53-E301 HydrophobicContact CD1-CB 3.88Å; I53-E301 HydrophobicContact CD1-CG 3.58Å; I53-E301 WeakPolarHBondContact CD1-OE1 3.3Å; I53-E301 WeakPolarHBondContact CD1-OE2 3.43Å
302	L	93.5	Very high	94.6	Very high	12 Å²	12	43 Å²	43	6%	0.063	23%	0.225	C	C	.	.			trans	-135.5	153.9	-177.3	61	79.7	0	0	0	112.5	L241 F289 I292 E300 T327 I330	L241-L302 HydrophobicContact CD1-CB 3.91Å; L241-L302 HydrophobicContact CD1-CD1 4.42Å; F289-L302 HydrophobicContact CE1-CD1 4.18Å; F289-L302 HydrophobicContact CE1-CD2 3.78Å; F289-L302 HydrophobicContact CZ-CD1 4.42Å; F289-L302 HydrophobicContact CZ-CD2 4.41Å; I292-L302 HydrophobicContact CD1-CD2 4.01Å; E300-L302 HydrophobicContact CB-CD2 3.96Å; E300-L302 HydrophobicContact CB-CG 4.38Å; E300-L302 HydrophobicContact CG-CD2 3.79Å; E300-L302 HydrophobicContact CG-CG 4.48Å; E300-L302 PolarHBondContact O-N 3.44Å; L302-T327 PolarHBondContact N-OG1 3.11Å; L302-T327 PolarHBondContact O-N 3.35Å; L302-T327 VanDerWaalsContact O-N 3.14Å; L302-T327 PolarHBondContact O-OG1 3.17Å; L302-T327 VanDerWaalsContact O-OG1 3.14Å; L302-I330 HydrophobicContact CD1-CD1 3.67Å
303	E	96.5	Very high	94.5	Very high	12 Å²	12	47.3 Å²	47.3	6%	0.056	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	128.7	173.1	-179.3	176.9	174.4	0	0	109.5	R55 Y56 V57 I242 V305 S324 Y325 I326	R55-E303 WeakPolarHBondContact CA-OE2 3.33Å; Y56-E303 WeakPolarHBondContact CB-OE2 3.34Å; Y56-E303 PolarHBondContact N-OE1 3.41Å; Y56-E303 PolarHBondContact N-OE2 3.48Å; V57-E303 PolarHBondContact N-OE1 2.8Å; I242-E303 HydrophobicContact CB-CB 4.43Å; I242-E303 PolarHBondContact N-O 3.16Å; I242-E303 PolarHBondContact O-N 3.05Å; E303-V305 HydrophobicContact CG-CG2 4.29Å; E303-S324 VanDerWaalsContact OE1-CB 3.26Å; E303-S324 WeakPolarHBondContact OE1-CB 3.37Å; E303-S324 PolarHBondContact OE1-OG 3.25Å; E303-Y325 WeakPolarHBondContact CA-O 3.45Å; E303-I326 HydrophobicContact CB-CG2 4.45Å; E303-I326 HydrophobicContact CG-CG2 4.19Å
304	I	97.2	Very high	94.3	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	118.5	172.1	-57.4	172	0	0	0	107.4	L220 A239 K240 L241 I260 F289 V306 S324 Y325 I330	L220-I304 HydrophobicContact CD1-CD1 3.45Å; L220-I304 VanDerWaalsContact CD1-CD1 3.45Å; L220-I304 HydrophobicContact CD2-CD1 4.09Å; L220-I304 HydrophobicContact CG-CD1 4.42Å; A239-I304 HydrophobicContact CB-CG2 4.48Å; K240-I304 CarbonylContact O-C 3.43Å; K240-I304 WeakPolarHBondContact O-CA 3.38Å; L241-I304 HydrophobicContact CD1-CG1 4.29Å; I260-I304 HydrophobicContact CD1-CG1 4.21Å; I260-I304 HydrophobicContact CD1-CG2 3.87Å; F289-I304 HydrophobicContact CE1-CD1 4.37Å; F289-I304 HydrophobicContact CE2-CD1 4.19Å; F289-I304 HydrophobicContact CZ-CD1 3.56Å; F289-I304 HydrophobicContact CZ-CG1 3.91Å; I304-V306 HydrophobicContact CG2-CG2 4.06Å; I304-S324 CarbonylContact O-C 3.58Å; I304-S324 WeakPolarHBondContact O-CA 3.23Å; I304-S324 WeakPolarHBondContact O-CB 3.5Å; I304-Y325 PolarHBondContact N-O 2.92Å; I304-Y325 PolarHBondContact O-N 3.44Å; I304-I330 HydrophobicContact CD1-CD1 3.68Å; I304-I330 HydrophobicContact CG1-CD1 4.37Å
305	V	97.7	Very high	94.1	Very high	8 Å²	8	50.4 Å²	50.4	5%	0.048	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.1	171.4	177.3	0	0	0	0	108.7	V57 A239 K240 I242 E303 I307	V57-V305 HydrophobicContact CB-CG2 4.17Å; V57-V305 HydrophobicContact CG2-CG1 4.03Å; V57-V305 HydrophobicContact CG2-CG2 3.82Å; A239-V305 CarbonylContact C-O 3.58Å; A239-V305 WeakPolarHBondContact CA-O 3.39Å; K240-V305 PolarHBondContact N-O 3.34Å; K240-V305 PolarHBondContact O-N 3.21Å; I242-V305 HydrophobicContact CD1-CB 4.26Å; I242-V305 HydrophobicContact CD1-CG2 3.41Å; I242-V305 VanDerWaalsContact CD1-CG2 3.41Å; I242-V305 HydrophobicContact CG1-CG2 4.06Å; E303-V305 HydrophobicContact CG-CG2 4.29Å; V305-I307 HydrophobicContact CG1-CD1 4.42Å; V305-I307 HydrophobicContact CG1-CG1 4.04Å
306	V	97.6	Very high	94	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.3	177.9	178.2	0	0	0	0	108.8	F205 F222 I237 A239 I304 R322 S323 Y325	F205-V306 HydrophobicContact CD1-CG1 3.99Å; F205-V306 HydrophobicContact CE1-CB 4.43Å; F205-V306 HydrophobicContact CE1-CG1 3.57Å; F205-V306 HydrophobicContact CZ-CG1 4.4Å; F222-V306 HydrophobicContact CD1-CG2 4.14Å; F222-V306 HydrophobicContact CD2-CG1 4.1Å; F222-V306 HydrophobicContact CD2-CG2 4.34Å; F222-V306 HydrophobicContact CE1-CG1 4.4Å; F222-V306 HydrophobicContact CE1-CG2 3.82Å; F222-V306 HydrophobicContact CE2-CB 4.33Å; F222-V306 HydrophobicContact CE2-CG1 3.34Å; F222-V306 HydrophobicContact CE2-CG2 4.06Å; F222-V306 HydrophobicContact CG-CG2 4.38Å; F222-V306 HydrophobicContact CZ-CB 4.32Å; F222-V306 HydrophobicContact CZ-CG1 3.51Å; F222-V306 HydrophobicContact CZ-CG2 3.77Å; I237-V306 HydrophobicContact CD1-CG1 3.52Å; I237-V306 HydrophobicContact CG1-CG1 4.34Å; A239-V306 HydrophobicContact CB-CG2 4.41Å; I304-V306 HydrophobicContact CG2-CG2 4.06Å; V306-R322 WeakPolarHBondContact O-CA 3.34Å; V306-S323 PolarHBondContact N-O 3.45Å; V306-S323 PolarHBondContact O-N 2.94Å; V306-Y325 HydrophobicContact CG2-CD2 4.01Å; V306-Y325 HydrophobicContact CG2-CE2 3.76Å
307	I	97.4	Very high	94	Very high	18 Å²	18	48.7 Å²	48.7	9%	0.092	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	116.5	-175.9	-48.2	173.3	0	0	0	108.4	I237 R238 V305 E309 Q320 A321 R322	I237-I307 WeakPolarHBondContact CD1-O 3.18Å; R238-I307 HydrophobicContact CG-CB 3.74Å; R238-I307 HydrophobicContact CG-CD1 4.37Å; R238-I307 HydrophobicContact CG-CG1 4.43Å; R238-I307 HydrophobicContact CG-CG2 4.41Å; R238-I307 PolarHBondContact N-O 3.46Å; R238-I307 PolarHBondContact O-N 3.25Å; V305-I307 HydrophobicContact CG1-CD1 4.42Å; V305-I307 HydrophobicContact CG1-CG1 4.04Å; I307-E309 HydrophobicContact CG2-CG 4.08Å; I307-Q320 HydrophobicContact CG2-CG 3.47Å; I307-Q320 VanDerWaalsContact CG2-CG 3.47Å; I307-A321 WeakPolarHBondContact CA-O 3.49Å; I307-R322 HydrophobicContact CG1-CG 4.23Å; I307-R322 HydrophobicContact CG2-CG 4.1Å
308	L	96.7	Very high	94.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.1	170.9	-172.5	144.7	0	0	0	109	L203 F205 V224 S236 I237 L271 L273 Q320 A321	L203-L308 HydrophobicContact CD1-CD2 3.78Å; L203-L308 HydrophobicContact CD2-CD2 4.36Å; F205-L308 HydrophobicContact CE1-CB 4.18Å; F205-L308 HydrophobicContact CZ-CB 3.78Å; V224-L308 HydrophobicContact CG2-CD1 3.5Å; V224-L308 VanDerWaalsContact CG2-CD1 3.5Å; S236-L308 WeakPolarHBondContact O-CA 3.45Å; I237-L308 HydrophobicContact CD1-CB 3.89Å; I237-L308 HydrophobicContact CD1-CD1 4.4Å; I237-L308 HydrophobicContact CD1-CG 4.47Å; L271-L308 HydrophobicContact CD1-CD1 3.98Å; L273-L308 HydrophobicContact CD2-CD1 4.04Å; L308-Q320 CarbonylContact O-C 3.49Å; L308-Q320 WeakPolarHBondContact O-CA 3.47Å; L308-A321 PolarHBondContact N-O 3.33Å; L308-A321 PolarHBondContact O-N 3.38Å
309	E	95.6	Very high	94.2	Very high	51 Å²	51	48.9 Å²	48.9	24%	0.238	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.6	178.3	-70	-178.9	148.4	0	0	110.2	A235 S236 R238 I307 C319 Q320	A235-E309 CarbonylContact C-O 3.52Å; A235-E309 VanDerWaalsContact CA-O 3.3Å; A235-E309 WeakPolarHBondContact CA-O 3.33Å; S236-E309 PolarHBondContact N-O 3.48Å; S236-E309 PolarHBondContact O-N 2.65Å; R238-E309 IonicContact CZ-OE1 2.92Å; R238-E309 IonicContact CZ-OE2 3.14Å; R238-E309 IonicContact NE-OE2 3.55Å; R238-E309 VanDerWaalsContact NH1-CD 3.3Å; R238-E309 IonicContact NH1-OE1 2.78Å; R238-E309 PolarHBondContact NH1-OE1 2.82Å; R238-E309 IonicContact NH1-OE2 3.53Å; R238-E309 PolarHBondContact NH1-OE2 3.25Å; R238-E309 VanDerWaalsContact NH2-CD 3.33Å; R238-E309 IonicContact NH2-OE1 3.14Å; R238-E309 PolarHBondContact NH2-OE1 3.4Å; R238-E309 IonicContact NH2-OE2 2.76Å; I307-E309 HydrophobicContact CG2-CG 4.08Å; E309-C319 WeakPolarHBondContact CA-O 3.48Å; E309-Q320 HydrophobicContact CG-CB 4.2Å; E309-Q320 HydrophobicContact CG-CG 3.82Å; E309-Q320 PolarHBondContact OE1-NE2 2.85Å
310	G	94.8	Very high	94.3	Very high	7 Å²	7	44.2 Å²	44.2	7%	0.072	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.8	171.7	171.9	0	0	0	0	0	111.6	V233 T318 C319	V233-G310 CarbonylContact O-C 3.54Å; G310-T318 CarbonylContact O-C 3.59Å; G310-T318 WeakPolarHBondContact O-CA 3.37Å; G310-C319 PolarHBondContact N-O 2.87Å; G310-C319 VanDerWaalsContact N-O 3.14Å; G310-C319 PolarHBondContact O-N 3.39Å; G310-C319 PolarHBondContact O-SG 3.33Å
311	M	94.6	Very high	94.6	Very high	49 Å²	49	41.8 Å²	41.8	24%	0.241	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	140	-178.6	-67.5	-178.3	-70.3	0	0	111.9	V233 E234 E313 M317 T318	V233-M311 HydrophobicContact CB-CB 4.28Å; V233-M311 HydrophobicContact CG1-CE 4.12Å; V233-M311 PolarHBondContact N-O 2.71Å; V233-M311 PolarHBondContact O-N 2.76Å; E234-M311 HydrophobicContact CB-CE 4.15Å; E234-M311 VanDerWaalsContact CD-CE 3.5Å; E234-M311 HydrophobicContact CG-CE 3.97Å; E234-M311 VanDerWaalsContact OE2-CE 3.26Å; E234-M311 WeakPolarHBondContact OE2-CE 3.37Å; M311-E313 PolarHBondContact O-N 3.26Å; M311-M317 WeakPolarHBondContact CA-O 3.5Å; M311-T318 HydrophobicContact CG-CG2 3.84Å
312	V	93.7	Very high	94.8	Very high	15 Å²	15	38.8 Å²	38.8	9%	0.091	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	120.8	172.2	-173.3	0	0	0	0	108.9	P196 R199 A314 T315 G316 M317 C319	P196-V312 HydrophobicContact CB-CG2 3.68Å; R199-V312 HydrophobicContact CB-CG2 3.81Å; R199-V312 HydrophobicContact CG-CG1 4.25Å; R199-V312 HydrophobicContact CG-CG2 3.75Å; V312-A314 VanDerWaalsContact C-N 3.26Å; V312-A314 PolarHBondContact O-N 3.48Å; V312-A314 VanDerWaalsContact O-N 3.13Å; V312-T315 PolarHBondContact O-N 3.29Å; V312-G316 PolarHBondContact O-N 3.02Å; V312-M317 PolarHBondContact N-O 2.6Å; V312-C319 HydrophobicContact CG2-CB 3.97Å
313	E	92.2	Very high	95	Very high	108 Å²	108	38.4 Å²	38.4	51%	0.505	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-42.8	-175.9	-175.2	177.9	-168.9	0	0	114	H231 V233 M311	H231-E313 PolarHBondContact N-OE2 3.29Å; V233-E313 HydrophobicContact CG2-CB 4.32Å; M311-E313 PolarHBondContact O-N 3.26Å
314	A	91.8	Very high	95.1	Very high	99 Å²	99	37.9 Å²	37.9	82%	0.818	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-30.8	-175.7	0	0	0	0	0	114.9	V312	V312-A314 VanDerWaalsContact C-N 3.26Å; V312-A314 PolarHBondContact O-N 3.48Å; V312-A314 VanDerWaalsContact O-N 3.13Å
315	T	91.1	Very high	95.1	Very high	61 Å²	61	37.8 Å²	37.8	37%	0.374	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-15.7	-173.4	64.8	0	0	0	0	113.7	V312 M317	V312-T315 PolarHBondContact O-N 3.29Å; T315-M317 PolarHBondContact O-N 2.98Å; T315-M317 VanDerWaalsContact O-N 3.15Å; T315-M317 PolarHBondContact OG1-N 3Å
316	G	92	Very high	94.9	Very high	50 Å²	50	39.5 Å²	39.5	52%	0.515	23%	0.23	S	C	.	.			trans	65.9	6.7	-171.6	0	0	0	0	0	113.9	V312	V312-G316 PolarHBondContact O-N 3.02Å
317	M	93.2	Very high	94.8	Very high	64 Å²	64	40.4 Å²	40.4	32%	0.315	24%	0.236	S	C	.	.			trans	-87.3	141	-179.9	-57	-175	-153.8	0	0	110.8	S194 P196 M311 V312 T315	S194-M317 VanDerWaalsContact OG-CE 3.27Å; S194-M317 WeakPolarHBondContact OG-CE 3.4Å; P196-M317 HydrophobicContact CB-CB 4.17Å; P196-M317 HydrophobicContact CG-CB 3.81Å; M311-M317 WeakPolarHBondContact CA-O 3.5Å; V312-M317 PolarHBondContact N-O 2.6Å; T315-M317 PolarHBondContact O-N 2.98Å; T315-M317 VanDerWaalsContact O-N 3.15Å; T315-M317 PolarHBondContact OG1-N 3Å
318	T	94.7	Very high	94.6	Very high	107 Å²	107	44 Å²	44	66%	0.656	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	127.4	176.2	55.2	0	0	0	0	111.4	P196 G310 M311	P196-T318 WeakPolarHBondContact CG-O 3.48Å; G310-T318 CarbonylContact O-C 3.59Å; G310-T318 WeakPolarHBondContact O-CA 3.37Å; M311-T318 HydrophobicContact CG-CG2 3.84Å
319	C	94.3	Very high	94.6	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.034	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	152.5	171.2	77.9	0	0	0	0	110.7	P196 R199 E309 G310 V312	P196-C319 HydrophobicContact CB-CB 3.89Å; R199-C319 HydrophobicContact CB-CB 4.49Å; E309-C319 WeakPolarHBondContact CA-O 3.48Å; G310-C319 PolarHBondContact N-O 2.87Å; G310-C319 VanDerWaalsContact N-O 3.14Å; G310-C319 PolarHBondContact O-N 3.39Å; G310-C319 PolarHBondContact O-SG 3.33Å; V312-C319 HydrophobicContact CG2-CB 3.97Å
320	Q	94.6	Very high	94.6	Very high	67 Å²	67	43.3 Å²	43.3	31%	0.313	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	114.9	174.5	-175.3	-173.9	95.7	0	0	109.1	R238 I307 L308 E309 R322	R238-Q320 VanDerWaalsContact NH2-NE2 3.18Å; I307-Q320 HydrophobicContact CG2-CG 3.47Å; I307-Q320 VanDerWaalsContact CG2-CG 3.47Å; L308-Q320 CarbonylContact O-C 3.49Å; L308-Q320 WeakPolarHBondContact O-CA 3.47Å; E309-Q320 HydrophobicContact CG-CB 4.2Å; E309-Q320 HydrophobicContact CG-CG 3.82Å; E309-Q320 PolarHBondContact OE1-NE2 2.85Å; Q320-R322 HydrophobicContact CG-CG 4.22Å
321	A	95.9	Very high	94.7	Very high	3 Å²	3	44.9 Å²	44.9	3%	0.025	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	139.8	171.2	0	0	0	0	0	109.4	A200 L203 F205 I307 L308	A200-A321 HydrophobicContact CB-CB 4.09Å; L203-A321 HydrophobicContact CB-CB 3.79Å; L203-A321 HydrophobicContact CD1-CB 3.85Å; L203-A321 HydrophobicContact CG-CB 4.49Å; F205-A321 HydrophobicContact CE2-CB 3.86Å; F205-A321 HydrophobicContact CZ-CB 4.14Å; I307-A321 WeakPolarHBondContact CA-O 3.49Å; L308-A321 PolarHBondContact N-O 3.33Å; L308-A321 PolarHBondContact O-N 3.38Å
322	R	96.7	Very high	94.9	Very high	78 Å²	78	43.3 Å²	43.3	29%	0.294	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.8	-177.3	-64.9	179.5	-62.4	-72.7	-13	110	V57 G61 V306 I307 Q320	V57-R322 HydrophobicContact CG1-CB 4.49Å; G61-R322 WeakPolarHBondContact CA-O 3.42Å; G61-R322 PolarHBondContact N-O 3.02Å; G61-R322 PolarHBondContact O-NE 2.87Å; G61-R322 VanDerWaalsContact O-NE 3.12Å; G61-R322 PolarHBondContact O-NH2 3.13Å; V306-R322 WeakPolarHBondContact O-CA 3.34Å; I307-R322 HydrophobicContact CG1-CG 4.23Å; I307-R322 HydrophobicContact CG2-CG 4.1Å; Q320-R322 HydrophobicContact CG-CG 4.22Å
323	S	97.3	Very high	95	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.028	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	176.4	165.2	-159	0	0	0	0	109.8	K59 V306	K59-S323 PolarHBondContact O-OG 3.45Å; V306-S323 PolarHBondContact N-O 3.45Å; V306-S323 PolarHBondContact O-N 2.94Å
324	S	97.2	Very high	95.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	154.6	175.7	70.4	0	0	0	0	113.4	R55 V57 K59 E303 I304	R55-S324 PolarHBondContact NE-OG 3.46Å; R55-S324 PolarHBondContact NH2-O 3Å; R55-S324 PolarHBondContact NH2-OG 3.05Å; V57-S324 PolarHBondContact O-OG 2.97Å; K59-S324 VanDerWaalsContact CD-O 3.31Å; K59-S324 WeakPolarHBondContact CD-O 3.34Å; K59-S324 WeakPolarHBondContact CE-O 3.39Å; K59-S324 PolarHBondContact NZ-O 3.25Å; E303-S324 VanDerWaalsContact OE1-CB 3.26Å; E303-S324 WeakPolarHBondContact OE1-CB 3.37Å; E303-S324 PolarHBondContact OE1-OG 3.25Å; I304-S324 CarbonylContact O-C 3.58Å; I304-S324 WeakPolarHBondContact O-CA 3.23Å; I304-S324 WeakPolarHBondContact O-CB 3.5Å
325	Y	97.3	Very high	95.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	108.3	172.3	-56.9	-81.6	0	0	0	108.6	S206 H208 A209 F222 E303 I304 V306 E329	S206-Y325 WeakPolarHBondContact O-CE1 3.39Å; S206-Y325 PolarHBondContact O-OH 3.5Å; S206-Y325 PolarHBondContact OG-OH 3.28Å; H208-Y325 VanDerWaalsContact C-CE1 3.43Å; A209-Y325 HydrophobicContact CB-CD1 3.84Å; A209-Y325 HydrophobicContact CB-CD2 4.27Å; A209-Y325 HydrophobicContact CB-CE1 4.22Å; A209-Y325 HydrophobicContact CB-CG 3.88Å; F222-Y325 HydrophobicContact CB-CE2 3.85Å; F222-Y325 HydrophobicContact CG-CE2 4.08Å; E303-Y325 WeakPolarHBondContact CA-O 3.45Å; I304-Y325 PolarHBondContact N-O 2.92Å; I304-Y325 PolarHBondContact O-N 3.44Å; V306-Y325 HydrophobicContact CG2-CD2 4.01Å; V306-Y325 HydrophobicContact CG2-CE2 3.76Å; Y325-E329 WeakPolarHBondContact CA-OE2 3.5Å; Y325-E329 HydrophobicContact CD1-CB 4.49Å
326	I	95.3	Very high	95.9	Very high	44 Å²	44	38.5 Å²	38.5	23%	0.226	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	162.2	167.9	57	168.1	0	0	0	109.5	R55 E303 S328 E329	R55-I326 HydrophobicContact CB-CG2 3.88Å; E303-I326 HydrophobicContact CB-CG2 4.45Å; E303-I326 HydrophobicContact CG-CG2 4.19Å; I326-S328 WeakPolarHBondContact CD1-OG 3.21Å; I326-S328 PolarHBondContact O-N 2.91Å; I326-E329 HydrophobicContact CD1-CG 4.36Å; I326-E329 HydrophobicContact CG1-CB 4.3Å; I326-E329 HydrophobicContact CG1-CG 3.65Å; I326-E329 WeakPolarHBondContact CG1-OE2 3.41Å; I326-E329 PolarHBondContact N-OE2 3.4Å; I326-E329 WeakPolarHBondContact O-CA 3.42Å; I326-E329 WeakPolarHBondContact O-CB 3.29Å; I326-E329 PolarHBondContact O-N 3.13Å
327	T	94.6	Very high	96.2	Very high	19 Å²	19	37.3 Å²	37.3	12%	0.117	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-43.7	-42.8	179.3	-51.7	0	0	0	0	114.7	L297 E300 L302 E329 I330	L297-T327 HydrophobicContact CD1-CG2 4.23Å; L297-T327 HydrophobicContact CG-CG2 4.27Å; L297-T327 WeakPolarHBondContact O-CG2 3.36Å; E300-T327 WeakPolarHBondContact O-CB 3.43Å; E300-T327 VanDerWaalsContact O-CG2 3.22Å; E300-T327 WeakPolarHBondContact O-CG2 3.29Å; E300-T327 PolarHBondContact O-OG1 2.81Å; L302-T327 PolarHBondContact N-OG1 3.11Å; L302-T327 PolarHBondContact O-N 3.35Å; L302-T327 VanDerWaalsContact O-N 3.14Å; L302-T327 PolarHBondContact O-OG1 3.17Å; L302-T327 VanDerWaalsContact O-OG1 3.14Å; T327-E329 PolarHBondContact O-N 3.46Å; T327-I330 PolarHBondContact O-N 3.02Å
328	S	93.4	Very high	96.3	Very high	93 Å²	93	39 Å²	39	65%	0.65	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-72.5	-13.8	-178.7	59.6	0	0	0	0	114.6	I326	I326-S328 WeakPolarHBondContact CD1-OG 3.21Å; I326-S328 PolarHBondContact O-N 2.91Å
329	E	96.1	Very high	96.4	Very high	28 Å²	28	34.4 Å²	34.4	13%	0.131	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-96.8	4.4	178.8	-62.3	166.1	165.9	0	0	111.7	R55 K59 H208 A209 Y325 I326 T327	R55-E329 IonicContact CZ-OE1 3.5Å; R55-E329 IonicContact CZ-OE2 2.87Å; R55-E329 IonicContact NH1-OE1 3.67Å; R55-E329 PolarHBondContact NH1-OE1 3.13Å; R55-E329 IonicContact NH1-OE2 2.75Å; R55-E329 IonicContact NH2-OE1 2.72Å; R55-E329 PolarHBondContact NH2-OE1 3.27Å; R55-E329 IonicContact NH2-OE2 3.54Å; R55-E329 PolarHBondContact NH2-OE2 3.43Å; K59-E329 WeakPolarHBondContact CE-OE1 3.43Å; K59-E329 WeakPolarHBondContact CE-OE2 3.25Å; K59-E329 VanDerWaalsContact NZ-CD 3.27Å; K59-E329 IonicContact NZ-OE1 3.45Å; K59-E329 IonicContact NZ-OE2 3.66Å; K59-E329 PolarHBondContact NZ-OE2 2.99Å; H208-E329 WeakPolarHBondContact CA-O 3.45Å; A209-E329 PolarHBondContact N-O 2.71Å; Y325-E329 WeakPolarHBondContact CA-OE2 3.5Å; Y325-E329 HydrophobicContact CD1-CB 4.49Å; I326-E329 HydrophobicContact CD1-CG 4.36Å; I326-E329 HydrophobicContact CG1-CB 4.3Å; I326-E329 HydrophobicContact CG1-CG 3.65Å; I326-E329 WeakPolarHBondContact CG1-OE2 3.41Å; I326-E329 PolarHBondContact N-OE2 3.4Å; I326-E329 WeakPolarHBondContact O-CA 3.42Å; I326-E329 WeakPolarHBondContact O-CB 3.29Å; I326-E329 PolarHBondContact O-N 3.13Å; T327-E329 PolarHBondContact O-N 3.46Å
330	I	96.8	Very high	96.4	Very high	9 Å²	9	37.8 Å²	37.8	5%	0.046	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	109.8	176.2	-54.9	173.2	0	0	0	108.5	A209 I211 L297 L302 I304 T327	A209-I330 HydrophobicContact CB-CG1 4.36Å; A209-I330 CarbonylContact O-C 3.55Å; A209-I330 WeakPolarHBondContact O-CA 3.41Å; I211-I330 HydrophobicContact CD1-CG2 3.69Å; I211-I330 HydrophobicContact CG1-CG2 3.91Å; L297-I330 HydrophobicContact CD2-CB 4.19Å; L297-I330 HydrophobicContact CD2-CG2 3.93Å; L302-I330 HydrophobicContact CD1-CD1 3.67Å; I304-I330 HydrophobicContact CD1-CD1 3.68Å; I304-I330 HydrophobicContact CG1-CD1 4.37Å; T327-I330 PolarHBondContact O-N 3.02Å
331	L	97.1	Very high	96.4	Very high	40 Å²	40	37.6 Å²	37.6	21%	0.209	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	116.8	-175.9	-55.4	179.3	0	0	0	110.9	H208 A209 V210 I211 Y334	H208-L331 HydrophobicContact CB-CD1 3.83Å; H208-L331 HydrophobicContact CB-CG 4.07Å; A209-L331 PolarHBondContact O-N 3Å; V210-L331 CarbonylContact C-O 3.54Å; V210-L331 VanDerWaalsContact CA-O 3.31Å; V210-L331 WeakPolarHBondContact CA-O 3.29Å; V210-L331 HydrophobicContact CG1-CB 4.35Å; I211-L331 PolarHBondContact N-O 2.89Å; L331-Y334 HydrophobicContact CB-CD2 3.58Å; L331-Y334 HydrophobicContact CB-CE2 4.17Å; L331-Y334 HydrophobicContact CB-CG 3.79Å; L331-Y334 HydrophobicContact CD1-CD1 4.2Å; L331-Y334 HydrophobicContact CD1-CG 4.24Å
332	W	97.5	Very high	96.3	Very high	16 Å²	16	43.2 Å²	43.2	6%	0.061	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	127.4	178	-167.7	-67.6	0	0	0	111.9	I211 L218 I292 K294 L297 Y334 P363 L365	I211-W332 HydrophobicContact CB-CD2 4.39Å; I211-W332 HydrophobicContact CB-CE3 4.24Å; I211-W332 HydrophobicContact CD1-CE3 3.82Å; I211-W332 HydrophobicContact CD1-CZ3 3.97Å; I211-W332 HydrophobicContact CG2-CD2 4.11Å; I211-W332 HydrophobicContact CG2-CE3 4.01Å; I211-W332 HydrophobicContact CG2-CH2 4.34Å; I211-W332 HydrophobicContact CG2-CZ2 4.42Å; I211-W332 HydrophobicContact CG2-CZ3 4.13Å; L218-W332 HydrophobicContact CD1-CZ2 4.39Å; L218-W332 HydrophobicContact CD2-CH2 3.64Å; L218-W332 HydrophobicContact CD2-CZ2 3.81Å; I292-W332 VanDerWaalsContact O-CH2 3.3Å; I292-W332 WeakPolarHBondContact O-CH2 3.49Å; K294-W332 HydrophobicContact CB-CD2 3.77Å; K294-W332 HydrophobicContact CB-CE3 4.39Å; K294-W332 HydrophobicContact CB-CG 3.83Å; K294-W332 HydrophobicContact CB-CZ2 4.36Å; K294-W332 HydrophobicContact CD-CB 4.37Å; K294-W332 HydrophobicContact CD-CG 3.98Å; K294-W332 HydrophobicContact CG-CB 3.94Å; K294-W332 HydrophobicContact CG-CD2 4.1Å; K294-W332 HydrophobicContact CG-CG 3.62Å; L297-W332 HydrophobicContact CD2-CE3 4.08Å; W332-Y334 WeakPolarHBondContact O-CD2 3.38Å; W332-P363 PolarHBondContact NE1-O 2.97Å; W332-L365 WeakPolarHBondContact CZ2-O 3.09Å
333	G	96.5	Very high	96	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.01	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	20.5	-179.1	0	0	0	0	0	114.1	I211 E359 T360 T362	I211-G333 WeakPolarHBondContact O-CA 3.49Å; I211-G333 PolarHBondContact O-N 2.81Å; G333-E359 CarbonylContact O-C 3.58Å; G333-T360 PolarHBondContact O-N 2.78Å; G333-T360 VanDerWaalsContact O-O 3.12Å; G333-T360 PolarHBondContact O-OG1 3.07Å; G333-T362 WeakPolarHBondContact CA-OG1 3.15Å
334	Y	98	Very high	95.6	Very high	65 Å²	65	52.2 Å²	52.2	26%	0.255	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	156.2	-177.5	-75.4	-105.7	0	0	0	112.1	V210 I211 S212 L331 W332 Y358 E359	V210-Y334 WeakPolarHBondContact CB-O 3.36Å; V210-Y334 WeakPolarHBondContact CG2-O 3.44Å; I211-Y334 PolarHBondContact O-N 3.42Å; S212-Y334 VanDerWaalsContact CB-O 3.24Å; S212-Y334 WeakPolarHBondContact CB-O 3.14Å; S212-Y334 PolarHBondContact OG-O 3.27Å; L331-Y334 HydrophobicContact CB-CD2 3.58Å; L331-Y334 HydrophobicContact CB-CE2 4.17Å; L331-Y334 HydrophobicContact CB-CG 3.79Å; L331-Y334 HydrophobicContact CD1-CD1 4.2Å; L331-Y334 HydrophobicContact CD1-CG 4.24Å; W332-Y334 WeakPolarHBondContact O-CD2 3.38Å; Y334-Y358 CarbonylContact C-O 3.58Å; Y334-Y358 VanDerWaalsContact CA-O 3.3Å; Y334-Y358 WeakPolarHBondContact CA-O 3.35Å; Y334-E359 HydrophobicContact CD1-CB 4.39Å; Y334-E359 HydrophobicContact CE1-CB 4.06Å; Y334-E359 HydrophobicContact CE2-CG 4.3Å
335	R	97.9	Very high	95.3	Very high	104 Å²	104	55.6 Å²	55.6	39%	0.392	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	156.6	169.5	-73	-170.7	-175.9	162.2	-2.3	109.8	S212 M213 T357 Y358 T360	S212-R335 WeakPolarHBondContact OG-CG 2.91Å; M213-R335 PolarHBondContact O-NH2 3.41Å; R335-T357 CarbonylContact O-C 3.48Å; R335-T357 WeakPolarHBondContact O-CA 3.44Å; R335-T357 WeakPolarHBondContact O-CB 3.41Å; R335-Y358 HydrophobicContact CB-CD1 4.41Å; R335-Y358 HydrophobicContact CB-CE1 3.77Å; R335-Y358 HydrophobicContact CB-CE2 4.09Å; R335-Y358 PolarHBondContact N-O 2.93Å; R335-Y358 WeakPolarHBondContact O-CD1 3.48Å; R335-Y358 PolarHBondContact O-N 3.19Å; R335-T360 HydrophobicContact CB-CG2 4.17Å; R335-T360 HydrophobicContact CG-CG2 3.92Å
336	F	98	Very high	95	Very high	11 Å²	11	63.5 Å²	63.5	5%	0.048	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	135.8	176.4	-72.1	-74.2	0	0	0	111.6	S206 H208 V210 M221 R223 I278 T357 Y358	S206-F336 WeakPolarHBondContact OG-CZ 3.48Å; H208-F336 WeakPolarHBondContact O-CZ 3.33Å; V210-F336 HydrophobicContact CG1-CE1 4.49Å; V210-F336 HydrophobicContact CG1-CE2 4.36Å; V210-F336 HydrophobicContact CG1-CZ 4.18Å; V210-F336 HydrophobicContact CG2-CD2 3.84Å; V210-F336 HydrophobicContact CG2-CE2 3.57Å; V210-F336 HydrophobicContact CG2-CZ 4.19Å; M221-F336 HydrophobicContact CB-CE2 4.1Å; R223-F336 HydrophobicContact CB-CD1 4.38Å; R223-F336 HydrophobicContact CB-CE1 4.25Å; R223-F336 HydrophobicContact CB-CE2 4.41Å; R223-F336 HydrophobicContact CB-CZ 4.28Å; I278-F336 HydrophobicContact CD1-CB 3.96Å; I278-F336 HydrophobicContact CD1-CD2 4.13Å; I278-F336 HydrophobicContact CD1-CG 4.42Å; I278-F336 HydrophobicContact CG1-CD2 4.17Å; I278-F336 HydrophobicContact CG2-CD2 4.07Å; I278-F336 HydrophobicContact CG2-CE2 4.35Å; F336-T357 HydrophobicContact CD1-CG2 3.63Å; F336-T357 HydrophobicContact CE1-CG2 3.73Å; F336-T357 HydrophobicContact CG-CG2 4.41Å; F336-Y358 WeakPolarHBondContact O-CE1 3.43Å
337	T	97.4	Very high	94.9	Very high	25 Å²	25	69.7 Å²	69.7	15%	0.153	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-62.4	132.9	174.3	-55.4	0	0	0	0	109.9	R223 E356	R223-T337 PolarHBondContact NH1-O 2.94Å; R223-T337 VanDerWaalsContact NH1-O 3.13Å; R223-T337 PolarHBondContact NH2-O 3.34Å; T337-E356 PolarHBondContact N-O 2.98Å; T337-E356 WeakPolarHBondContact OG1-CG 3.3Å; T337-E356 PolarHBondContact OG1-O 2.72Å
338	P	96.3	Very high	94.9	Very high	100 Å²	100	73.6 Å²	73.6	65%	0.649	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-55.2	140.5	174.8	-24.6	34.5	0	0	0	111.7
339	V	95.7	Very high	94.9	Very high	10 Å²	10	70.8 Å²	70.8	6%	0.061	36%	0.363	C	S	.	.			trans	-117.6	-8.4	-176.9	-64.7	0	0	0	0	113.6	R223 P276 V349 D350 S353	R223-V339 VanDerWaalsContact NH1-CG1 3.25Å; P276-V339 HydrophobicContact CB-CG2 4.15Å; P276-V339 HydrophobicContact CG-CG2 4.21Å; V339-V349 HydrophobicContact CB-CG1 4.45Å; V339-V349 HydrophobicContact CG2-CG1 4.37Å; V339-V349 WeakPolarHBondContact O-CA 3.4Å; V339-D350 PolarHBondContact O-N 3.1Å; V339-S353 WeakPolarHBondContact CG1-O 3.47Å
340	L	94.7	Very high	94.9	Very high	77 Å²	77	72.3 Å²	72.3	40%	0.403	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.8	-176	-79.2	166.9	0	0	0	109.8	E348 V349	L340-E348 WeakPolarHBondContact CA-O 3.41Å; L340-V349 HydrophobicContact CD2-CG2 3.71Å
341	T	94.6	Very high	94.7	Very high	63 Å²	63	75.7 Å²	75.7	39%	0.387	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	156.2	168.3	55.4	0	0	0	0	109.4	Y347 E348	T341-Y347 WeakPolarHBondContact O-CA 3.38Å; T341-E348 PolarHBondContact N-O 2.72Å; T341-E348 PolarHBondContact O-N 3.45Å
342	L	94.2	Very high	94.6	Very high	121 Å²	121	80.7 Å²	80.7	63%	0.634	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	111.2	176.4	178.9	67.6	0	0	0	107.9	Y347	L342-Y347 HydrophobicContact CD1-CD1 4.3Å; L342-Y347 HydrophobicContact CD1-CE1 4.16Å
343	E	90.2	Very high	94.5	Very high	103 Å²	103	80.9 Å²	80.9	48%	0.481	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.9	-177.5	-63.3	-164.4	-166.6	0	0	110	G345 F346	E343-G345 PolarHBondContact O-N 3.01Å; E343-F346 PolarHBondContact N-O 3.22Å; E343-F346 PolarHBondContact O-N 2.95Å
344	D	88.4	Confident	94.6	Very high	168 Å²	168	80.9 Å²	80.9	90%	0.898	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.4	36.7	175.1	-67.3	-30.7	0	0	0	116.3
345	G	91.5	Very high	94.5	Very high	70 Å²	70	81.6 Å²	81.6	72%	0.722	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	1.9	178	0	0	0	0	0	115.4	E343	E343-G345 PolarHBondContact O-N 3.01Å
346	F	91.2	Very high	94.5	Very high	167 Å²	167	81.4 Å²	81.4	73%	0.732	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	151.3	172.4	-69.5	-88.6	0	0	0	111.1	E343	E343-F346 PolarHBondContact N-O 3.22Å; E343-F346 PolarHBondContact O-N 2.95Å
347	Y	93.9	Very high	94.5	Very high	174 Å²	174	82.3 Å²	82.3	68%	0.682	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	116.7	168.8	-74.3	-78.6	0	0	0	108.9	T341 L342	T341-Y347 WeakPolarHBondContact O-CA 3.38Å; L342-Y347 HydrophobicContact CD1-CD1 4.3Å; L342-Y347 HydrophobicContact CD1-CE1 4.16Å
348	E	93.4	Very high	94.5	Very high	100 Å²	100	86 Å²	86	47%	0.467	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.7	173.8	-174.3	167.7	178.3	0	0	110	L340 T341	L340-E348 WeakPolarHBondContact CA-O 3.41Å; T341-E348 PolarHBondContact N-O 2.72Å; T341-E348 PolarHBondContact O-N 3.45Å
349	V	94.7	Very high	94.5	Very high	34 Å²	34	87.2 Å²	87.2	21%	0.206	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	111	178.5	-177.5	0	0	0	0	108.5	P276 V339 L340 Y351	P276-V349 HydrophobicContact CG-CG1 3.66Å; V339-V349 HydrophobicContact CB-CG1 4.45Å; V339-V349 HydrophobicContact CG2-CG1 4.37Å; V339-V349 WeakPolarHBondContact O-CA 3.4Å; L340-V349 HydrophobicContact CD2-CG2 3.71Å; V349-Y351 HydrophobicContact CB-CD2 4.37Å; V349-Y351 HydrophobicContact CB-CE2 3.94Å; V349-Y351 HydrophobicContact CG1-CD2 3.95Å; V349-Y351 HydrophobicContact CG1-CE1 4.38Å; V349-Y351 HydrophobicContact CG1-CE2 3.65Å; V349-Y351 HydrophobicContact CG1-CG 4.44Å; V349-Y351 PolarHBondContact O-N 3.48Å
350	D	94.7	Very high	94.6	Very high	60 Å²	60	88 Å²	88	32%	0.321	45%	0.445	S	S	.	.			trans	-81.4	101.9	171.3	-177.1	14.4	0	0	0	110.6	V339 N352 S353	V339-D350 PolarHBondContact O-N 3.1Å; D350-N352 PolarHBondContact O-N 3.1Å; D350-N352 WeakPolarHBondContact OD1-CB 3.48Å; D350-N352 PolarHBondContact OD1-N 3.5Å; D350-N352 PolarHBondContact OD1-ND2 3.38Å; D350-S353 PolarHBondContact O-N 2.94Å
351	Y	94	Very high	94.6	Very high	81 Å²	81	90.6 Å²	90.6	32%	0.318	47%	0.469	S	S	.	.	S	Bend	trans	-72	-11.6	176.9	-75.7	-87.7	0	0	0	113.5	D226 L227 P276 V349 S353 F354	D226-Y351 PolarHBondContact O-OH 3.49Å; L227-Y351 HydrophobicContact CD2-CD1 3.64Å; L227-Y351 HydrophobicContact CD2-CE1 3.39Å; L227-Y351 HydrophobicContact CD2-CG 4.31Å; P276-Y351 HydrophobicContact CG-CE1 4.15Å; V349-Y351 HydrophobicContact CB-CD2 4.37Å; V349-Y351 HydrophobicContact CB-CE2 3.94Å; V349-Y351 HydrophobicContact CG1-CD2 3.95Å; V349-Y351 HydrophobicContact CG1-CE1 4.38Å; V349-Y351 HydrophobicContact CG1-CE2 3.65Å; V349-Y351 HydrophobicContact CG1-CG 4.44Å; V349-Y351 PolarHBondContact O-N 3.48Å; Y351-S353 VanDerWaalsContact C-N 3.34Å; Y351-F354 HydrophobicContact CD1-CB 4.3Å; Y351-F354 AromaticContact CD1-CD2 3.98Å; Y351-F354 HydrophobicContact CD1-CD2 3.98Å; Y351-F354 HydrophobicContact CD1-CG 4.32Å; Y351-F354 HydrophobicContact CE1-CD2 4.2Å; Y351-F354 WeakPolarHBondContact O-CB 3.31Å; Y351-F354 PolarHBondContact O-N 2.92Å; Y351-F354 VanDerWaalsContact O-N 3.16Å
352	N	95.2	Very high	94.6	Very high	144 Å²	144	88.4 Å²	88.4	77%	0.77	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-41	174.3	-61.2	-58.6	0	0	0	111	D350 F354	D350-N352 PolarHBondContact O-N 3.1Å; D350-N352 WeakPolarHBondContact OD1-CB 3.48Å; D350-N352 PolarHBondContact OD1-N 3.5Å; D350-N352 PolarHBondContact OD1-ND2 3.38Å; N352-F354 VanDerWaalsContact C-N 3.27Å; N352-F354 PolarHBondContact O-N 3.04Å
353	S	95.2	Very high	94.6	Very high	21 Å²	21	84.7 Å²	84.7	15%	0.147	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	8.6	174.5	-69.5	0	0	0	0	113.9	R223 V339 D350 Y351 H355 E356	R223-S353 PolarHBondContact NH1-O 3.17Å; R223-S353 VanDerWaalsContact NH1-O 3.14Å; V339-S353 WeakPolarHBondContact CG1-O 3.47Å; D350-S353 PolarHBondContact O-N 2.94Å; Y351-S353 VanDerWaalsContact C-N 3.34Å; S353-H355 PolarHBondContact O-N 3.35Å; S353-E356 PolarHBondContact O-N 2.88Å; S353-E356 PolarHBondContact OG-OE2 3.22Å
354	F	96.6	Very high	94.8	Very high	1 Å²	1	83.1 Å²	83.1	0%	0.004	44%	0.44	C	S	.	.	S	Bend	trans	-60.5	-45.1	-179.3	-179.4	-88.7	0	0	0	112.4	V204 R223 P276 Y351 N352	V204-F354 HydrophobicContact CB-CE1 4.26Å; V204-F354 HydrophobicContact CB-CZ 4.26Å; V204-F354 HydrophobicContact CG2-CE1 3.95Å; V204-F354 HydrophobicContact CG2-CE2 3.98Å; V204-F354 HydrophobicContact CG2-CZ 3.59Å; R223-F354 WeakPolarHBondContact CD-O 3.36Å; R223-F354 HydrophobicContact CG-CD2 4.27Å; R223-F354 HydrophobicContact CG-CE2 3.73Å; R223-F354 HydrophobicContact CG-CZ 3.91Å; R223-F354 PolarHBondContact NH1-O 3.41Å; P276-F354 HydrophobicContact CB-CD2 4.02Å; P276-F354 HydrophobicContact CB-CE2 3.79Å; P276-F354 HydrophobicContact CG-CD2 3.88Å; P276-F354 HydrophobicContact CG-CE2 3.92Å; Y351-F354 HydrophobicContact CD1-CB 4.3Å; Y351-F354 AromaticContact CD1-CD2 3.98Å; Y351-F354 HydrophobicContact CD1-CD2 3.98Å; Y351-F354 HydrophobicContact CD1-CG 4.32Å; Y351-F354 HydrophobicContact CE1-CD2 4.2Å; Y351-F354 WeakPolarHBondContact O-CB 3.31Å; Y351-F354 PolarHBondContact O-N 2.92Å; Y351-F354 VanDerWaalsContact O-N 3.16Å; N352-F354 VanDerWaalsContact C-N 3.27Å; N352-F354 PolarHBondContact O-N 3.04Å
355	H	97	Very high	95.1	Very high	80 Å²	80	78.1 Å²	78.1	37%	0.37	41%	0.412	S	S	.	.	S	Bend	trans	-90.5	-7.3	-177.8	-61.1	-83	0	0	0	113.4	F205 T207 S353	F205-H355 PolarHBondContact O-CE1 3.4Å; T207-H355 PolarHBondContact N-ND1 2.76Å; T207-H355 PolarHBondContact OG1-ND1 2.97Å; S353-H355 PolarHBondContact O-N 3.35Å
356	E	97.4	Very high	95.2	Very high	99 Å²	99	74.9 Å²	74.9	46%	0.463	38%	0.379	S	S	.	.			trans	-76.5	139.7	-171.8	-164.4	-175.4	176.9	0	0	112.1	T337 S353	T337-E356 PolarHBondContact N-O 2.98Å; T337-E356 WeakPolarHBondContact OG1-CG 3.3Å; T337-E356 PolarHBondContact OG1-O 2.72Å; S353-E356 PolarHBondContact O-N 2.88Å; S353-E356 PolarHBondContact OG-OE2 3.22Å
357	T	97.7	Very high	95.4	Very high	30 Å²	30	67.2 Å²	67.2	18%	0.184	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	141.9	-179.7	58.1	0	0	0	0	110.4	V210 R335 F336	V210-T357 HydrophobicContact CG1-CG2 3.6Å; R335-T357 CarbonylContact O-C 3.48Å; R335-T357 WeakPolarHBondContact O-CA 3.44Å; R335-T357 WeakPolarHBondContact O-CB 3.41Å; F336-T357 HydrophobicContact CD1-CG2 3.63Å; F336-T357 HydrophobicContact CE1-CG2 3.73Å; F336-T357 HydrophobicContact CG-CG2 4.41Å
358	Y	97.7	Very high	95.5	Very high	102 Å²	102	62.3 Å²	62.3	40%	0.4	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	150.9	177.5	66.2	-85	0	0	0	111.2	Y334 R335 F336 T360	Y334-Y358 CarbonylContact C-O 3.58Å; Y334-Y358 VanDerWaalsContact CA-O 3.3Å; Y334-Y358 WeakPolarHBondContact CA-O 3.35Å; R335-Y358 HydrophobicContact CB-CD1 4.41Å; R335-Y358 HydrophobicContact CB-CE1 3.77Å; R335-Y358 HydrophobicContact CB-CE2 4.09Å; R335-Y358 PolarHBondContact N-O 2.93Å; R335-Y358 WeakPolarHBondContact O-CD1 3.48Å; R335-Y358 PolarHBondContact O-N 3.19Å; F336-Y358 WeakPolarHBondContact O-CE1 3.43Å; Y358-T360 HydrophobicContact CD2-CG2 3.75Å; Y358-T360 HydrophobicContact CE2-CG2 3.38Å
359	E	97.6	Very high	95.5	Very high	126 Å²	126	61.1 Å²	61.1	59%	0.589	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	146.3	-178.6	-167	171.7	-165.2	0	0	111.4	G333 Y334	G333-E359 CarbonylContact O-C 3.58Å; Y334-E359 HydrophobicContact CD1-CB 4.39Å; Y334-E359 HydrophobicContact CE1-CB 4.06Å; Y334-E359 HydrophobicContact CE2-CG 4.3Å
360	T	96.2	Very high	95.4	Very high	28 Å²	28	61.2 Å²	61.2	17%	0.172	32%	0.322	C	S	.	.			trans	-140.9	150.5	-177.2	55.4	0	0	0	0	111.2	G333 R335 Y358 T362	G333-T360 PolarHBondContact O-N 2.78Å; G333-T360 VanDerWaalsContact O-O 3.12Å; G333-T360 PolarHBondContact O-OG1 3.07Å; R335-T360 HydrophobicContact CB-CG2 4.17Å; R335-T360 HydrophobicContact CG-CG2 3.92Å; Y358-T360 HydrophobicContact CD2-CG2 3.75Å; Y358-T360 HydrophobicContact CE2-CG2 3.38Å; T360-T362 PolarHBondContact O-N 3.48Å; T360-T362 PolarHBondContact O-OG1 3.25Å; T360-T362 PolarHBondContact OG1-OG1 3.43Å
361	S	95.1	Very high	95.3	Very high	130 Å²	130	60.3 Å²	60.3	91%	0.909	32%	0.323	S	S	*	.			trans	-61.7	105.7	174.1	-172	0	0	0	0	110.2
362	T	94.1	Very high	95.2	Very high	18 Å²	18	60.6 Å²	60.6	11%	0.11	33%	0.327	C	S	.	.			trans	-133.5	135.6	-177.4	-61.2	0	0	0	0	108.5	M213 L218 G333 T360	M213-T362 HydrophobicContact CG-CG2 4.23Å; L218-T362 HydrophobicContact CD1-CG2 4.16Å; G333-T362 WeakPolarHBondContact CA-OG1 3.15Å; T360-T362 PolarHBondContact O-N 3.48Å; T360-T362 PolarHBondContact O-OG1 3.25Å; T360-T362 PolarHBondContact OG1-OG1 3.43Å
363	P	94.6	Very high	95.1	Very high	42 Å²	42	57.9 Å²	57.9	27%	0.273	31%	0.312	S	S	.	.			trans	-56.2	144.2	176.1	-23.5	33.5	0	0	0	112.5	M213 W332 L365 L370	M213-P363 VanDerWaalsContact CG-CD 3.45Å; M213-P363 HydrophobicContact CG-CG 4.16Å; M213-P363 HydrophobicContact SD-CG 4.4Å; W332-P363 PolarHBondContact NE1-O 2.97Å; P363-L365 VanDerWaalsContact C-N 3.32Å; P363-L365 HydrophobicContact CB-CD1 4Å; P363-L370 HydrophobicContact CB-CD1 4.2Å; P363-L370 HydrophobicContact CB-CD2 3.75Å; P363-L370 HydrophobicContact CB-CG 4.47Å; P363-L370 HydrophobicContact CG-CD1 4.38Å; P363-L370 HydrophobicContact CG-CD2 3.93Å
364	S	94.5	Very high	94.8	Very high	71 Å²	71	59.3 Å²	59.3	50%	0.497	33%	0.325	S	S	.	.			trans	-84.7	-8.7	176.4	-61.9	0	0	0	0	113.6	K294	K294-S364 WeakPolarHBondContact CB-O 3.27Å; K294-S364 PolarHBondContact N-O 3.32Å
365	L	94.2	Very high	94.4	Very high	62 Å²	62	62.2 Å²	62.2	33%	0.325	35%	0.346	S	S	.	.	S	Bend	trans	-74	159.2	-175.8	-62.1	101.6	0	0	0	111.8	W332 P363 E369 L370 L373	W332-L365 WeakPolarHBondContact CZ2-O 3.09Å; P363-L365 VanDerWaalsContact C-N 3.32Å; P363-L365 HydrophobicContact CB-CD1 4Å; L365-E369 WeakPolarHBondContact CA-OE2 3.35Å; L365-E369 HydrophobicContact CB-CB 4.01Å; L365-E369 WeakPolarHBondContact CB-OE2 3.42Å; L365-E369 HydrophobicContact CD2-CB 3.95Å; L365-L370 HydrophobicContact CB-CD2 4.31Å; L365-L370 HydrophobicContact CB-CG 4.15Å; L365-L370 HydrophobicContact CD1-CD2 4.37Å; L365-L373 HydrophobicContact CD2-CD1 3.76Å
366	S	95.1	Very high	94	Very high	3 Å²	3	66.7 Å²	66.7	2%	0.021	36%	0.359	C	S	.	.			trans	-68.4	159.5	170	65.9	0	0	0	0	111.2	K368 E369 L370	S366-K368 PolarHBondContact O-N 3.15Å; S366-E369 PolarHBondContact N-OE2 2.88Å; S366-E369 PolarHBondContact O-N 3.29Å; S366-E369 VanDerWaalsContact OG-CD 3.28Å; S366-E369 VanDerWaalsContact OG-CG 3.27Å; S366-E369 WeakPolarHBondContact OG-CG 3.37Å; S366-E369 PolarHBondContact OG-N 3.35Å; S366-E369 PolarHBondContact OG-OE1 3.2Å; S366-L370 WeakPolarHBondContact O-CG 3.5Å; S366-L370 PolarHBondContact O-N 2.85Å
367	A	94.6	Very high	93.5	Very high	5 Å²	5	66 Å²	66	4%	0.041	37%	0.37	C	S	.	.	H	α-helix	trans	-61.7	-34.4	177.1	0	0	0	0	0	112	L218 I283 W290 L370 A371	L218-A367 HydrophobicContact CB-CB 4.35Å; L218-A367 HydrophobicContact CD2-CB 4.14Å; I283-A367 HydrophobicContact CB-CB 4.18Å; I283-A367 HydrophobicContact CG2-CB 3.53Å; W290-A367 HydrophobicContact CD2-CB 4.4Å; W290-A367 HydrophobicContact CE3-CB 3.47Å; W290-A367 VanDerWaalsContact CE3-CB 3.47Å; W290-A367 HydrophobicContact CZ3-CB 3.64Å; W290-A367 PolarHBondContact O-N 3.16Å; A367-L370 PolarHBondContact O-N 3.47Å; A367-A371 PolarHBondContact O-N 3.46Å
368	K	95	Very high	92.7	Very high	71 Å²	71	72.4 Å²	72.4	31%	0.309	40%	0.398	S	S	.	.	H	α-helix	trans	-58.3	-52.8	171.2	-176.8	178.1	179.2	179.6	0	112.7	W290 E291 S366 L370 A371 E372	W290-K368 HydrophobicContact CD2-CB 4.1Å; W290-K368 HydrophobicContact CG-CB 4.26Å; W290-K368 HydrophobicContact CZ2-CB 4.13Å; W290-K368 HydrophobicContact CZ2-CG 4.44Å; W290-K368 WeakPolarHBondContact O-CB 3.27Å; W290-K368 PolarHBondContact O-N 3.11Å; E291-K368 HydrophobicContact CG-CD 4.02Å; E291-K368 IonicContact OE1-NZ 2.73Å; E291-K368 PolarHBondContact OE1-NZ 3.28Å; S366-K368 PolarHBondContact O-N 3.15Å; K368-L370 VanDerWaalsContact C-N 3.27Å; K368-L370 PolarHBondContact O-N 3.25Å; K368-A371 PolarHBondContact O-N 2.91Å; K368-A371 VanDerWaalsContact O-N 3.17Å; K368-E372 WeakPolarHBondContact CE-OE1 3.23Å; K368-E372 WeakPolarHBondContact O-CG 3.46Å; K368-E372 PolarHBondContact O-N 3.23Å
369	E	94.3	Very high	91.4	Very high	76 Å²	76	71.6 Å²	71.6	36%	0.355	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-37	178.2	-74	162.3	-161	0	0	111.6	L365 S366 E372 L373	L365-E369 WeakPolarHBondContact CA-OE2 3.35Å; L365-E369 HydrophobicContact CB-CB 4.01Å; L365-E369 WeakPolarHBondContact CB-OE2 3.42Å; L365-E369 HydrophobicContact CD2-CB 3.95Å; S366-E369 PolarHBondContact N-OE2 2.88Å; S366-E369 PolarHBondContact O-N 3.29Å; S366-E369 VanDerWaalsContact OG-CD 3.28Å; S366-E369 VanDerWaalsContact OG-CG 3.27Å; S366-E369 WeakPolarHBondContact OG-CG 3.37Å; S366-E369 PolarHBondContact OG-N 3.35Å; S366-E369 PolarHBondContact OG-OE1 3.2Å; E369-E372 PolarHBondContact O-N 2.86Å; E369-L373 WeakPolarHBondContact O-CB 3.25Å; E369-L373 WeakPolarHBondContact O-CG 3.29Å; E369-L373 PolarHBondContact O-N 3.48Å
370	L	93.2	Very high	89.3	Confident	35 Å²	35	69 Å²	69	18%	0.183	40%	0.395	C	S	.	.	H	α-helix	trans	-63.5	-41.9	174.6	-74	172.2	0	0	0	112.2	M213 P363 L365 S366 A367 K368 L373 A374	M213-L370 HydrophobicContact SD-CD1 4.03Å; P363-L370 HydrophobicContact CB-CD1 4.2Å; P363-L370 HydrophobicContact CB-CD2 3.75Å; P363-L370 HydrophobicContact CB-CG 4.47Å; P363-L370 HydrophobicContact CG-CD1 4.38Å; P363-L370 HydrophobicContact CG-CD2 3.93Å; L365-L370 HydrophobicContact CB-CD2 4.31Å; L365-L370 HydrophobicContact CB-CG 4.15Å; L365-L370 HydrophobicContact CD1-CD2 4.37Å; S366-L370 WeakPolarHBondContact O-CG 3.5Å; S366-L370 PolarHBondContact O-N 2.85Å; A367-L370 PolarHBondContact O-N 3.47Å; K368-L370 VanDerWaalsContact C-N 3.27Å; K368-L370 PolarHBondContact O-N 3.25Å; L370-L373 PolarHBondContact O-N 3.3Å; L370-A374 WeakPolarHBondContact O-CB 3.38Å; L370-A374 PolarHBondContact O-N 2.85Å
371	A	92.4	Very high	87.4	Confident	42 Å²	42	74.4 Å²	74.4	35%	0.347	42%	0.421	S	S	.	.	H	α-helix	trans	-68.6	-36.9	175.7	0	0	0	0	0	112.4	W290 A367 K368 A374 S375	W290-A371 HydrophobicContact CH2-CB 3.54Å; W290-A371 HydrophobicContact CZ2-CB 3.97Å; A367-A371 PolarHBondContact O-N 3.46Å; K368-A371 PolarHBondContact O-N 2.91Å; K368-A371 VanDerWaalsContact O-N 3.17Å; A371-A374 PolarHBondContact O-N 3.46Å; A371-S375 WeakPolarHBondContact O-CB 3.48Å; A371-S375 PolarHBondContact O-N 3.16Å; A371-S375 PolarHBondContact O-OG 3.42Å
372	E	92.4	Very high	85.4	Confident	87 Å²	87	71 Å²	71	41%	0.407	40%	0.398	S	S	.	.	H	α-helix	trans	-64.5	-38.6	173.1	-72.7	176.4	-169	0	0	111.9	K368 E369 S375 R376	K368-E372 WeakPolarHBondContact CE-OE1 3.23Å; K368-E372 WeakPolarHBondContact O-CG 3.46Å; K368-E372 PolarHBondContact O-N 3.23Å; E369-E372 PolarHBondContact O-N 2.86Å; E372-S375 WeakPolarHBondContact CA-OG 3.24Å; E372-S375 PolarHBondContact O-OG 2.93Å; E372-R376 WeakPolarHBondContact O-CG 3.15Å; E372-R376 PolarHBondContact O-N 3.14Å; E372-R376 VanDerWaalsContact O-N 3.14Å
373	L	91.8	Very high	83.4	Confident	87 Å²	87	78.1 Å²	78.1	46%	0.455	42%	0.423	S	S	.	.	H	α-helix	trans	-69.7	-41	174	-72.4	176.7	0	0	0	112.4	L365 E369 L370 R376 A377	L365-L373 HydrophobicContact CD2-CD1 3.76Å; E369-L373 WeakPolarHBondContact O-CB 3.25Å; E369-L373 WeakPolarHBondContact O-CG 3.29Å; E369-L373 PolarHBondContact O-N 3.48Å; L370-L373 PolarHBondContact O-N 3.3Å; L373-R376 PolarHBondContact O-N 3.31Å; L373-A377 PolarHBondContact O-N 3.23Å
374	A	90	Very high	81.6	Confident	50 Å²	50	78.7 Å²	78.7	41%	0.413	43%	0.428	S	S	.	.	H	α-helix	trans	-63.3	-46.2	176.4	0	0	0	0	0	111.5	L370 A371 R376 A377 E378	L370-A374 WeakPolarHBondContact O-CB 3.38Å; L370-A374 PolarHBondContact O-N 2.85Å; A371-A374 PolarHBondContact O-N 3.46Å; A374-R376 VanDerWaalsContact C-N 3.31Å; A374-R376 PolarHBondContact O-N 2.87Å; A374-A377 WeakPolarHBondContact O-CA 3.35Å; A374-A377 WeakPolarHBondContact O-CB 3.42Å; A374-A377 PolarHBondContact O-N 2.84Å; A374-E378 PolarHBondContact O-N 3.41Å
375	S	88	Confident	79.7	Confident	62 Å²	62	79.1 Å²	79.1	43%	0.434	43%	0.427	S	S	.	.	H	α-helix	trans	-61.3	-37.6	176.8	59.1	0	0	0	0	112.5	A371 E372 A377 E378 L379	A371-S375 WeakPolarHBondContact O-CB 3.48Å; A371-S375 PolarHBondContact O-N 3.16Å; A371-S375 PolarHBondContact O-OG 3.42Å; E372-S375 WeakPolarHBondContact CA-OG 3.24Å; E372-S375 PolarHBondContact O-OG 2.93Å; S375-A377 VanDerWaalsContact C-N 3.32Å; S375-A377 PolarHBondContact O-N 2.83Å; S375-E378 PolarHBondContact O-N 3.5Å; S375-L379 WeakPolarHBondContact O-CG 3.32Å; S375-L379 PolarHBondContact O-N 2.95Å
376	R	89	Confident	78	Confident	175 Å²	175	79.8 Å²	79.8	66%	0.66	44%	0.437	S	S	*	.	H	α-helix	trans	-66.1	-32.4	172.3	-75.3	177	179.6	171.9	3.7	113.3	E372 L373 A374	E372-R376 WeakPolarHBondContact O-CG 3.15Å; E372-R376 PolarHBondContact O-N 3.14Å; E372-R376 VanDerWaalsContact O-N 3.14Å; L373-R376 PolarHBondContact O-N 3.31Å; A374-R376 VanDerWaalsContact C-N 3.31Å; A374-R376 PolarHBondContact O-N 2.87Å
377	A	86.7	Confident	76.3	Confident	84 Å²	84	82.8 Å²	82.8	69%	0.694	46%	0.458	S	S	*	.	H	α-helix	trans	-76.7	-29.2	178.1	0	0	0	0	0	112.8	L373 A374 S375 L379	L373-A377 PolarHBondContact O-N 3.23Å; A374-A377 WeakPolarHBondContact O-CA 3.35Å; A374-A377 WeakPolarHBondContact O-CB 3.42Å; A374-A377 PolarHBondContact O-N 2.84Å; S375-A377 VanDerWaalsContact C-N 3.32Å; S375-A377 PolarHBondContact O-N 2.83Å; A377-L379 VanDerWaalsContact C-N 3.33Å
378	E	80.8	Confident	74.6	Confident	164 Å²	164	89.1 Å²	89.1	77%	0.766	49%	0.485	S	S	*	.	H	α-helix	trans	-77.5	-16.5	175.5	-73.6	-179.6	-179.2	0	0	113.5	A374 S375 P380	A374-E378 PolarHBondContact O-N 3.41Å; S375-E378 PolarHBondContact O-N 3.5Å; E378-P380 WeakPolarHBondContact O-CD 3.39Å
379	L	68.9	Low	73.1	Confident	86 Å²	86	91.4 Å²	91.4	45%	0.45	50%	0.5	S	S	.	.	S	Bend	trans	-61.7	123.4	173.6	-69.6	179	0	0	0	109.4	S375 A377 L381 W383	S375-L379 WeakPolarHBondContact O-CG 3.32Å; S375-L379 PolarHBondContact O-N 2.95Å; A377-L379 VanDerWaalsContact C-N 3.33Å; L379-L381 PolarHBondContact O-N 3.48Å; L379-W383 HydrophobicContact CD1-CE3 4.47Å; L379-W383 HydrophobicContact CD1-CZ3 4.38Å; L379-W383 HydrophobicContact CD2-CE3 4.08Å; L379-W383 HydrophobicContact CD2-CH2 4.16Å; L379-W383 HydrophobicContact CD2-CZ3 3.4Å; L379-W383 HydrophobicContact CG-CZ3 4.31Å
380	P	55	Low	71.7	Confident	72 Å²	72	92.5 Å²	92.5	47%	0.468	51%	0.508	S	S	.	.			trans	-58.9	127.8	-179.1	22.1	-30.5	0	0	0	109.1	E378 S382 W383	E378-P380 WeakPolarHBondContact O-CD 3.39Å; P380-S382 PolarHBondContact O-N 3.45Å; P380-S382 PolarHBondContact O-OG 2.95Å; P380-W383 PolarHBondContact O-N 2.93Å; P380-W383 VanDerWaalsContact O-N 3.14Å
381	L	55	Low	70.3	Confident	140 Å²	140	96.8 Å²	96.8	73%	0.733	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-14.5	176.6	-81.2	161.4	0	0	0	113.5	L379 W383 S384 V385	L379-L381 PolarHBondContact O-N 3.48Å; L381-W383 PolarHBondContact O-N 3.38Å; L381-S384 PolarHBondContact O-N 3.28Å; L381-S384 VanDerWaalsContact O-N 3.13Å; L381-S384 PolarHBondContact O-OG 2.86Å; L381-V385 PolarHBondContact O-N 3Å; L381-V385 VanDerWaalsContact O-N 3.08Å
382	S	53.5	Low	69.1	Low	60 Å²	60	100.4 Å²	100.4	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-51.8	-36	172.6	58.1	0	0	0	0	113.5	P380 S386	P380-S382 PolarHBondContact O-N 3.45Å; P380-S382 PolarHBondContact O-OG 2.95Å; S382-S386 WeakPolarHBondContact O-CB 3.37Å; S382-S386 PolarHBondContact O-N 3.4Å; S382-S386 PolarHBondContact O-OG 3.26Å
383	W	51.7	Low	68.1	Low	167 Å²	167	98.5 Å²	98.5	63%	0.633	54%	0.536	S	S	*	.	H	α-helix	trans	-74.4	-32.3	179.4	-63.3	-23.7	0	0	0	113.1	L379 P380 L381 S387	L379-W383 HydrophobicContact CD1-CE3 4.47Å; L379-W383 HydrophobicContact CD1-CZ3 4.38Å; L379-W383 HydrophobicContact CD2-CE3 4.08Å; L379-W383 HydrophobicContact CD2-CH2 4.16Å; L379-W383 HydrophobicContact CD2-CZ3 3.4Å; L379-W383 HydrophobicContact CG-CZ3 4.31Å; P380-W383 PolarHBondContact O-N 2.93Å; P380-W383 VanDerWaalsContact O-N 3.14Å; L381-W383 PolarHBondContact O-N 3.38Å; W383-S387 VanDerWaalsContact O-CB 3.28Å; W383-S387 WeakPolarHBondContact O-CB 3.32Å; W383-S387 PolarHBondContact O-N 3.46Å
384	S	56.9	Low	67.2	Low	54 Å²	54	99.4 Å²	99.4	38%	0.378	54%	0.538	S	S	.	.	H	α-helix	trans	-75.9	-28.8	176.1	74.5	0	0	0	0	113.2	L381 K388	L381-S384 PolarHBondContact O-N 3.28Å; L381-S384 VanDerWaalsContact O-N 3.13Å; L381-S384 PolarHBondContact O-OG 2.86Å; S384-K388 VanDerWaalsContact O-CB 3.29Å; S384-K388 WeakPolarHBondContact O-CB 3.37Å; S384-K388 WeakPolarHBondContact O-CG 3.35Å; S384-K388 PolarHBondContact O-N 3.49Å
385	V	56	Low	66.4	Low	80 Å²	80	101.8 Å²	101.8	49%	0.485	54%	0.543	S	S	.	.	H	α-helix	trans	-83.7	-44.2	177.2	178.9	0	0	0	0	110.3	L381 K388 L389	L381-V385 PolarHBondContact O-N 3Å; L381-V385 VanDerWaalsContact O-N 3.08Å; V385-K388 PolarHBondContact O-N 2.94Å; V385-L389 HydrophobicContact CG1-CD1 3.85Å; V385-L389 WeakPolarHBondContact O-CB 3.44Å; V385-L389 PolarHBondContact O-N 2.88Å
386	S	57.7	Low	65.6	Low	76 Å²	76	104.5 Å²	104.5	53%	0.531	55%	0.548	S	S	.	.	H	α-helix	trans	-66	-36.7	176.1	-68.1	0	0	0	0	112.4	S382 L389 N390	S382-S386 WeakPolarHBondContact O-CB 3.37Å; S382-S386 PolarHBondContact O-N 3.4Å; S382-S386 PolarHBondContact O-OG 3.26Å; S386-L389 PolarHBondContact O-N 3.36Å; S386-N390 WeakPolarHBondContact O-CB 3.23Å; S386-N390 PolarHBondContact O-N 2.83Å
387	S	59.1	Low	65	Low	65 Å²	65	99.7 Å²	99.7	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-70.8	-34.5	174.8	94.8	0	0	0	0	112.3	W383 Q391	W383-S387 VanDerWaalsContact O-CB 3.28Å; W383-S387 WeakPolarHBondContact O-CB 3.32Å; W383-S387 PolarHBondContact O-N 3.46Å; S387-Q391 WeakPolarHBondContact O-CB 3.37Å; S387-Q391 PolarHBondContact O-N 3.44Å
388	K	59.3	Low	64.3	Low	139 Å²	139	100.8 Å²	100.8	60%	0.604	53%	0.529	S	S	*	.	H	α-helix	trans	-71.2	-36.6	173.8	-79.8	-177.3	178.6	-174.7	0	112.4	S384 V385 H392	S384-K388 VanDerWaalsContact O-CB 3.29Å; S384-K388 WeakPolarHBondContact O-CB 3.37Å; S384-K388 WeakPolarHBondContact O-CG 3.35Å; S384-K388 PolarHBondContact O-N 3.49Å; V385-K388 PolarHBondContact O-N 2.94Å; K388-H392 WeakPolarHBondContact O-CB 3.43Å; K388-H392 PolarHBondContact O-N 2.88Å
389	L	62.3	Low	63.9	Low	119 Å²	119	99.2 Å²	99.2	62%	0.623	52%	0.522	S	S	*	.	H	α-helix	trans	-68.6	-39.2	173.7	-113	91.7	0	0	0	111.2	V385 S386 H392 A393	V385-L389 HydrophobicContact CG1-CD1 3.85Å; V385-L389 WeakPolarHBondContact O-CB 3.44Å; V385-L389 PolarHBondContact O-N 2.88Å; S386-L389 PolarHBondContact O-N 3.36Å; L389-H392 PolarHBondContact O-N 3.06Å; L389-A393 VanDerWaalsContact O-CB 3.25Å; L389-A393 WeakPolarHBondContact O-CB 3.39Å; L389-A393 PolarHBondContact O-N 3.2Å
390	N	66.5	Low	64	Low	99 Å²	99	101.3 Å²	101.3	53%	0.529	53%	0.53	S	S	.	.	H	α-helix	trans	-66.6	-41.8	176.1	-123.9	60.8	0	0	0	111.4	S386 A393 E394	S386-N390 WeakPolarHBondContact O-CB 3.23Å; S386-N390 PolarHBondContact O-N 2.83Å; N390-A393 PolarHBondContact O-N 2.02Å; N390-E394 PolarHBondContact ND2-OE1 3.44Å; N390-E394 WeakPolarHBondContact O-CB 3.29Å; N390-E394 VanDerWaalsContact O-CG 3.3Å; N390-E394 WeakPolarHBondContact O-CG 3.21Å; N390-E394 PolarHBondContact O-N 3.17Å
391	Q	63.7	Low	64.8	Low	124 Å²	124	104.2 Å²	104.2	58%	0.579	54%	0.537	S	S	*	.	H	α-helix	trans	-63.9	-39.4	173.4	-88	-178.9	-11.9	0	0	112.5	S387 L395	S387-Q391 WeakPolarHBondContact O-CB 3.37Å; S387-Q391 PolarHBondContact O-N 3.44Å; Q391-L395 WeakPolarHBondContact O-CB 2.98Å; Q391-L395 WeakPolarHBondContact O-CD1 3.42Å; Q391-L395 VanDerWaalsContact O-CG 3.24Å; Q391-L395 WeakPolarHBondContact O-CG 3.04Å; Q391-L395 PolarHBondContact O-N 3.05Å
392	H	67.7	Low	65.6	Low	119 Å²	119	103.6 Å²	103.6	55%	0.551	53%	0.529	S	S	*	.	H	α-helix	trans	-67.3	-41.9	174.8	-101.2	-73.7	0	0	0	112.3	K388 L389 L395 E396	K388-H392 WeakPolarHBondContact O-CB 3.43Å; K388-H392 PolarHBondContact O-N 2.88Å; L389-H392 PolarHBondContact O-N 3.06Å; H392-L395 PolarHBondContact O-N 2.69Å; H392-E396 WeakPolarHBondContact O-CB 3.41Å; H392-E396 WeakPolarHBondContact O-CG 3.4Å; H392-E396 PolarHBondContact O-N 3.41Å
393	A	70.4	Confident	66.4	Low	47 Å²	47	105 Å²	105	39%	0.388	53%	0.531	S	S	.	.	H	α-helix	trans	-65.4	-42.1	177.7	0	0	0	0	0	111.4	L389 N390 E396 T397	L389-A393 VanDerWaalsContact O-CB 3.25Å; L389-A393 WeakPolarHBondContact O-CB 3.39Å; L389-A393 PolarHBondContact O-N 3.2Å; N390-A393 PolarHBondContact O-N 2.02Å; A393-E396 PolarHBondContact O-N 2.82Å; A393-T397 PolarHBondContact O-N 3.09Å; A393-T397 PolarHBondContact O-OG1 3.32Å
394	E	72.2	Confident	67.1	Low	106 Å²	106	102.4 Å²	102.4	50%	0.495	53%	0.529	S	S	.	.	H	α-helix	trans	-61.5	-44.6	175.4	-77.1	167.1	-163.8	0	0	111.3	N390 T397 E398	N390-E394 PolarHBondContact ND2-OE1 3.44Å; N390-E394 WeakPolarHBondContact O-CB 3.29Å; N390-E394 VanDerWaalsContact O-CG 3.3Å; N390-E394 WeakPolarHBondContact O-CG 3.21Å; N390-E394 PolarHBondContact O-N 3.17Å; E394-T397 WeakPolarHBondContact CA-OG1 3.37Å; E394-T397 PolarHBondContact O-N 3.15Å; E394-T397 PolarHBondContact O-OG1 3.4Å; E394-E398 WeakPolarHBondContact O-CG 3.36Å; E394-E398 PolarHBondContact O-N 3.39Å
395	L	73.1	Confident	67.5	Low	99 Å²	99	106.2 Å²	106.2	52%	0.518	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-38.9	175.5	-73.6	166.3	0	0	0	112.8	Q391 H392 E398 E399	Q391-L395 WeakPolarHBondContact O-CB 2.98Å; Q391-L395 WeakPolarHBondContact O-CD1 3.42Å; Q391-L395 VanDerWaalsContact O-CG 3.24Å; Q391-L395 WeakPolarHBondContact O-CG 3.04Å; Q391-L395 PolarHBondContact O-N 3.05Å; H392-L395 PolarHBondContact O-N 2.69Å; L395-E398 PolarHBondContact O-N 3.49Å; L395-E399 WeakPolarHBondContact O-CB 3.38Å; L395-E399 WeakPolarHBondContact O-CG 3.26Å; L395-E399 PolarHBondContact O-N 2.92Å
396	E	72.7	Confident	67.8	Low	119 Å²	119	108 Å²	108	56%	0.556	54%	0.544	S	S	*	.	H	α-helix	trans	-65.8	-41.5	175	-77.5	177.4	179.5	0	0	111.3	H392 A393 E399 E400	H392-E396 WeakPolarHBondContact O-CB 3.41Å; H392-E396 WeakPolarHBondContact O-CG 3.4Å; H392-E396 PolarHBondContact O-N 3.41Å; A393-E396 PolarHBondContact O-N 2.82Å; E396-E399 PolarHBondContact O-N 2.97Å; E396-E400 WeakPolarHBondContact O-CB 3.49Å; E396-E400 WeakPolarHBondContact O-CG 3.41Å; E396-E400 PolarHBondContact O-N 2.87Å
397	T	74.8	Confident	67.8	Low	75 Å²	75	110.4 Å²	110.4	46%	0.46	55%	0.547	S	S	.	.	H	α-helix	trans	-65.2	-39	172.7	28.5	0	0	0	0	112.9	A393 E394 E400 E401	A393-T397 PolarHBondContact O-N 3.09Å; A393-T397 PolarHBondContact O-OG1 3.32Å; E394-T397 WeakPolarHBondContact CA-OG1 3.37Å; E394-T397 PolarHBondContact O-N 3.15Å; E394-T397 PolarHBondContact O-OG1 3.4Å; T397-E400 PolarHBondContact O-N 3.13Å; T397-E401 WeakPolarHBondContact O-CB 3.33Å; T397-E401 WeakPolarHBondContact O-CG 3.46Å; T397-E401 PolarHBondContact O-N 2.7Å
398	E	72.5	Confident	67.7	Low	106 Å²	106	111.8 Å²	111.8	50%	0.495	55%	0.553	S	S	.	*	H	α-helix	trans	-67.9	-34.6	176	-76.7	-173.1	179	0	0	112.3	E394 L395 K402	E394-E398 WeakPolarHBondContact O-CG 3.36Å; E394-E398 PolarHBondContact O-N 3.39Å; L395-E398 PolarHBondContact O-N 3.49Å; E398-K402 WeakPolarHBondContact O-CB 3.21Å; E398-K402 WeakPolarHBondContact O-CG 3.47Å; E398-K402 PolarHBondContact O-N 3.37Å; E398-K402 VanDerWaalsContact O-N 3.07Å
399	E	73	Confident	67.6	Low	131 Å²	131	111.8 Å²	111.8	61%	0.612	56%	0.555	S	S	*	*	H	α-helix	trans	-71.6	-38.4	173.2	-79	-172.8	169.6	0	0	112	L395 E396 N403	L395-E399 WeakPolarHBondContact O-CB 3.38Å; L395-E399 WeakPolarHBondContact O-CG 3.26Å; L395-E399 PolarHBondContact O-N 2.92Å; E396-E399 PolarHBondContact O-N 2.97Å; E399-N403 VanDerWaalsContact O-CB 3.3Å; E399-N403 WeakPolarHBondContact O-CB 3.3Å; E399-N403 PolarHBondContact O-N 2.99Å; E399-N403 PolarHBondContact O-ND2 3.27Å
400	E	70.9	Confident	67.2	Low	130 Å²	130	115.5 Å²	115.5	61%	0.607	56%	0.561	S	S	*	*	H	α-helix	trans	-66.3	-41.6	174.1	-77.6	-172.4	166.6	0	0	112.1	E396 T397 N403 L404	E396-E400 WeakPolarHBondContact O-CB 3.49Å; E396-E400 WeakPolarHBondContact O-CG 3.41Å; E396-E400 PolarHBondContact O-N 2.87Å; T397-E400 PolarHBondContact O-N 3.13Å; E400-N403 PolarHBondContact O-N 3.43Å; E400-L404 PolarHBondContact O-N 2.87Å
401	E	71.8	Confident	66.6	Low	134 Å²	134	116.3 Å²	116.3	63%	0.626	57%	0.565	S	S	*	*	H	α-helix	trans	-64	-44.3	175.4	-78.1	-174.6	167.3	0	0	111.6	T397 N403 L404 E405	T397-E401 WeakPolarHBondContact O-CB 3.33Å; T397-E401 WeakPolarHBondContact O-CG 3.46Å; T397-E401 PolarHBondContact O-N 2.7Å; E401-N403 PolarHBondContact O-N 3.37Å; E401-L404 PolarHBondContact O-N 3.3Å; E401-E405 PolarHBondContact O-N 3.32Å
402	K	72.2	Confident	66	Low	127 Å²	127	112.2 Å²	112.2	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-63.4	-39.9	174.8	-78.9	175.5	-177.8	163.8	0	112.8	E398 L404 E405 E406	E398-K402 WeakPolarHBondContact O-CB 3.21Å; E398-K402 WeakPolarHBondContact O-CG 3.47Å; E398-K402 PolarHBondContact O-N 3.37Å; E398-K402 VanDerWaalsContact O-N 3.07Å; K402-L404 VanDerWaalsContact C-N 3.34Å; K402-E405 PolarHBondContact O-N 2.9Å; K402-E406 WeakPolarHBondContact O-CB 3.28Å; K402-E406 WeakPolarHBondContact O-CG 3.47Å; K402-E406 PolarHBondContact O-N 3.13Å
403	N	69.3	Low	65.1	Low	89 Å²	89	113.1 Å²	113.1	48%	0.476	57%	0.565	S	S	.	*	H	α-helix	trans	-68	-34.3	176.8	-77.2	-43.9	0	0	0	112	E399 E400 E401 Q407	E399-N403 VanDerWaalsContact O-CB 3.3Å; E399-N403 WeakPolarHBondContact O-CB 3.3Å; E399-N403 PolarHBondContact O-N 2.99Å; E399-N403 PolarHBondContact O-ND2 3.27Å; E400-N403 PolarHBondContact O-N 3.43Å; E401-N403 PolarHBondContact O-N 3.37Å; N403-Q407 WeakPolarHBondContact O-CB 3.36Å; N403-Q407 WeakPolarHBondContact O-CG 3.41Å; N403-Q407 PolarHBondContact O-N 3.46Å
404	L	67.7	Low	64.2	Low	113 Å²	113	116.4 Å²	116.4	59%	0.592	58%	0.58	S	S	*	*	H	α-helix	trans	-68.9	-42.9	172.7	-110.2	99.9	0	0	0	111.6	E400 E401 K402 Q407 T408	E400-L404 PolarHBondContact O-N 2.87Å; E401-L404 PolarHBondContact O-N 3.3Å; K402-L404 VanDerWaalsContact C-N 3.34Å; L404-Q407 PolarHBondContact O-N 2.78Å; L404-T408 WeakPolarHBondContact O-CB 3.48Å; L404-T408 PolarHBondContact O-N 2.95Å; L404-T408 PolarHBondContact O-OG1 3.5Å
405	E	65.1	Low	63	Low	133 Å²	133	115.2 Å²	115.2	62%	0.621	59%	0.588	S	S	*	*	H	α-helix	trans	-62.5	-45.9	175.8	-75.4	-175	160.7	0	0	111.2	E401 K402 Q407 T408 E409	E401-E405 PolarHBondContact O-N 3.32Å; K402-E405 PolarHBondContact O-N 2.9Å; E405-Q407 VanDerWaalsContact C-N 3.34Å; E405-Q407 PolarHBondContact O-N 3.39Å; E405-T408 PolarHBondContact O-N 3.3Å; E405-T408 VanDerWaalsContact O-N 3.12Å; E405-E409 WeakPolarHBondContact O-CG 3.25Å; E405-E409 PolarHBondContact O-N 3.42Å
406	E	62.2	Low	61.6	Low	118 Å²	118	117.8 Å²	117.8	55%	0.551	60%	0.602	S	S	*	*	H	α-helix	trans	-64.6	-34	176.5	-76.6	-171.1	177.7	0	0	113.1	K402 R410	K402-E406 WeakPolarHBondContact O-CB 3.28Å; K402-E406 WeakPolarHBondContact O-CG 3.47Å; K402-E406 PolarHBondContact O-N 3.13Å; E406-R410 WeakPolarHBondContact O-CB 3.36Å; E406-R410 PolarHBondContact O-N 3.17Å
407	Q	56.9	Low	60.4	Low	126 Å²	126	119.5 Å²	119.5	59%	0.589	61%	0.614	S	S	*	*	H	α-helix	trans	-72.5	-33	172.9	-79.6	-176.1	9.2	0	0	112.6	N403 L404 E405 N411	N403-Q407 WeakPolarHBondContact O-CB 3.36Å; N403-Q407 WeakPolarHBondContact O-CG 3.41Å; N403-Q407 PolarHBondContact O-N 3.46Å; L404-Q407 PolarHBondContact O-N 2.78Å; E405-Q407 VanDerWaalsContact C-N 3.34Å; E405-Q407 PolarHBondContact O-N 3.39Å; Q407-N411 VanDerWaalsContact O-CB 3.28Å; Q407-N411 WeakPolarHBondContact O-CB 3.43Å; Q407-N411 VanDerWaalsContact O-CG 3.28Å; Q407-N411 PolarHBondContact O-N 3.09Å; Q407-N411 PolarHBondContact O-ND2 2.86Å
408	T	58	Low	59	Low	94 Å²	94	124.9 Å²	124.9	58%	0.577	63%	0.634	S	S	*	*	H	α-helix	trans	-74.4	-36	177.9	-45.4	0	0	0	0	110.6	L404 E405 G412	L404-T408 WeakPolarHBondContact O-CB 3.48Å; L404-T408 PolarHBondContact O-N 2.95Å; L404-T408 PolarHBondContact O-OG1 3.5Å; E405-T408 PolarHBondContact O-N 3.3Å; E405-T408 VanDerWaalsContact O-N 3.12Å; T408-G412 PolarHBondContact O-N 3.39Å
409	E	56.7	Low	57.6	Low	140 Å²	140	127.6 Å²	127.6	65%	0.654	65%	0.652	S	S	*	*	H	α-helix	trans	-68.8	-42.5	171.3	-71.8	-171.2	159.9	0	0	111.8	E405 N411 G412 D413	E405-E409 WeakPolarHBondContact O-CG 3.25Å; E405-E409 PolarHBondContact O-N 3.42Å; E409-N411 VanDerWaalsContact C-N 3.34Å; E409-N411 PolarHBondContact O-N 3.29Å; E409-G412 PolarHBondContact O-N 3.1Å; E409-D413 PolarHBondContact O-N 3.23Å
410	R	54.2	Low	56.1	Low	197 Å²	197	130.9 Å²	130.9	74%	0.743	67%	0.668	S	S	*	*	H	α-helix	trans	-65.3	-33	174.5	-91.5	-173.5	-175.5	175.2	7.2	114.3	E406	E406-R410 WeakPolarHBondContact O-CB 3.36Å; E406-R410 PolarHBondContact O-N 3.17Å
411	N	53.6	Low	54.7	Low	116 Å²	116	130 Å²	130	62%	0.62	68%	0.676	S	S	*	*	H	α-helix	trans	-85.4	-19.8	176.7	-71	-26.6	0	0	0	112.4	Q407 E409	Q407-N411 VanDerWaalsContact O-CB 3.28Å; Q407-N411 WeakPolarHBondContact O-CB 3.43Å; Q407-N411 VanDerWaalsContact O-CG 3.28Å; Q407-N411 PolarHBondContact O-N 3.09Å; Q407-N411 PolarHBondContact O-ND2 2.86Å; E409-N411 VanDerWaalsContact C-N 3.34Å; E409-N411 PolarHBondContact O-N 3.29Å
412	G	51.2	Low	53.5	Low	38 Å²	38	133.4 Å²	133.4	39%	0.392	69%	0.689	S	S	.	*	H	α-helix	trans	-71.9	-29.5	173.4	0	0	0	0	0	113.8	T408 E409	T408-G412 PolarHBondContact O-N 3.39Å; E409-G412 PolarHBondContact O-N 3.1Å
413	D	49.7	Very low	51.9	Low	137 Å²	137	137.9 Å²	137.9	73%	0.733	73%	0.726	S	S	*	*	S	Bend	trans	-84.5	-6.8	178.9	-78.7	-22.7	0	0	0	114.4	E409	E409-D413 PolarHBondContact O-N 3.23Å
414	V	50.1	Low	51.1	Low	117 Å²	117	140.3 Å²	140.3	71%	0.709	74%	0.738	S	S	*	*	S	Bend	trans	-100.4	-8.6	177.4	-173.4	0	0	0	0	112.2
415	A	46.6	Very low	50.2	Low	80 Å²	80	141.7 Å²	141.7	66%	0.661	75%	0.746	S	S	*	*	S	Bend	trans	-96.5	7.6	-175.1	0	0	0	0	0	115.5
416	N	45.5	Very low	49.3	Very low	153 Å²	153	142.2 Å²	142.2	82%	0.818	75%	0.753	S	S	*	*	S	Bend	trans	-121.8	22.9	-175	-98.9	-19.6	0	0	0	115.4
417	L	45.8	Very low	48.6	Very low	155 Å²	155	143.6 Å²	143.6	81%	0.812	77%	0.765	S	S	*	*	S	Bend	trans	-119.3	8.8	-178.3	-90.9	158.1	0	0	0	116.1
418	E	46	Very low	48.1	Very low	188 Å²	188	144.8 Å²	144.8	88%	0.879	78%	0.776	S	S	*	*	S	Bend	trans	-133.8	67.5	177.7	-72.2	-171.2	149.9	0	0	112.5
419	N	42.7	Very low	47.4	Very low	164 Å²	164	148.1 Å²	148.1	88%	0.877	79%	0.789	S	S	*	*			trans	-168.5	64.2	155	-119.3	-8.6	0	0	0	115.1
420	E	42.1	Very low	46.7	Very low	199 Å²	199	148.7 Å²	148.7	93%	0.93	80%	0.799	S	S	*	*			trans	-139.9	82.8	158.9	-79.6	-165.8	142.4	0	0	110.6
421	S	40.8	Very low	46.2	Very low	111 Å²	111	145 Å²	145	78%	0.776	80%	0.803	S	S	*	*			trans	-161.4	88.1	155.4	54	0	0	0	0	111.6
422	K	47.1	Very low	45.6	Very low	207 Å²	207	147.4 Å²	147.4	90%	0.9	82%	0.818	S	S	*	*			trans	169.6	127.1	137.5	-96.2	166.9	-178.4	176.6	0	112.4
423	V	39.1	Very low	45.1	Very low	220 Å²	220	157.4 Å²	157.4	100%	1.333	86%	0.857	S	S	*	*			trans	85.4	0	171.2	-166.7	0	0	0	0	115.9

Retrieved 423 of 423 residues in 732.4 ms (Link to these results)

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