A0A077ZF58_TRITR Loading...

Thioredoxin domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZF58, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 351 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	37.4	Very low	32.8	Very low	250 Å²	250	154.2 Å²	154.2	100%	1.232	82%	0.821	S	S	*	*				0	123.4	0	-98.2	171.1	163.6	0	0	107.9
2	L	30.4	Very low	32.6	Very low	164 Å²	164	153.8 Å²	153.8	86%	0.859	82%	0.818	S	S	*	*			trans	-61	155	174.1	-84.9	101.2	0	0	0	111.8
3	V	35.1	Very low	32.5	Very low	126 Å²	126	155.5 Å²	155.5	76%	0.764	81%	0.814	S	S	*	*				170.2	104.3	125.8	155.8	0	0	0	0	105.3
4	R	27.9	Very low	32.9	Very low	224 Å²	224	152.6 Å²	152.6	85%	0.845	81%	0.81	S	S	*	*				62	139.5	98.4	-89	-173.6	173.2	179.4	-2.6	112.1
5	S	30.1	Very low	32.7	Very low	86 Å²	86	149 Å²	149	60%	0.601	80%	0.801	S	S	*	*			cis	178.7	147.5	1.1	43.2	0	0	0	0	106.7
6	T	33.3	Very low	32.7	Very low	125 Å²	125	149.4 Å²	149.4	77%	0.767	80%	0.802	S	S	*	*			trans	56.6	90.2	142.9	59.2	0	0	0	0	118.2
7	L	37.5	Very low	32.8	Very low	181 Å²	181	150.8 Å²	150.8	95%	0.948	81%	0.808	S	S	*	*			trans	-108.9	94.8	136.1	-88.2	154.7	0	0	0	106.6
8	G	29.3	Very low	32.7	Very low	66 Å²	66	150.4 Å²	150.4	68%	0.68	81%	0.805	S	S	*	*			trans	-80.6	125	171.5	0	0	0	0	0	109.7
9	L	38.2	Very low	32.7	Very low	169 Å²	169	148.8 Å²	148.8	89%	0.885	80%	0.801	S	S	*	*			trans	-144.8	89	148.7	-96.2	124	0	0	0	106.5
10	S	28.6	Very low	32.7	Very low	92 Å²	92	146.7 Å²	146.7	64%	0.643	79%	0.794	S	S	*	*			trans	-48.7	144.1	143.9	48.2	0	0	0	0	107.6
11	W	32.6	Very low	32.7	Very low	213 Å²	213	151 Å²	151	81%	0.807	80%	0.799	S	S	*	*				-155.3	127.4	55.6	-77.6	64.8	0	0	0	106.8
12	L	30.3	Very low	32.3	Very low	150 Å²	150	144.7 Å²	144.7	79%	0.785	77%	0.769	S	S	*	*				32.5	105.9	98	-70.8	170.4	0	0	0	114.4
13	F	32	Very low	32.4	Very low	176 Å²	176	141.2 Å²	141.2	77%	0.772	75%	0.751	S	S	*	*				-171.7	130	115.3	-101.1	-73.9	0	0	0	110.7
14	P	38.5	Very low	32.3	Very low	115 Å²	115	139.6 Å²	139.6	75%	0.747	74%	0.743	S	S	*	*			trans	-91.3	127.3	171.1	34.2	-26.5	0	0	0	109.7
15	S	28.8	Very low	32.6	Very low	98 Å²	98	136.5 Å²	136.5	69%	0.685	74%	0.736	S	S	*	*			trans	-163.8	119.1	166.5	38.5	0	0	0	0	111.9
16	L	33.4	Very low	32.6	Very low	155 Å²	155	135.4 Å²	135.4	81%	0.812	73%	0.728	S	S	*	*			trans	59.4	94.7	151.7	-77	84.4	0	0	0	116.2	L18	L16-L18 PolarHBondContact O-N 3.29Å
17	L	33.8	Very low	32.4	Very low	174 Å²	174	136 Å²	136	91%	0.911	73%	0.726	S	S	*	*			trans	-52.8	90.5	142.5	-84	148.9	0	0	0	108.2	V19	L17-V19 PolarHBondContact O-N 3.5Å
18	L	31.8	Very low	32	Very low	144 Å²	144	134.6 Å²	134.6	75%	0.754	72%	0.719	S	S	*	*			trans	-54.8	99.2	153.7	-89.9	143.5	0	0	0	105.8	L16 T20	L16-L18 PolarHBondContact O-N 3.29Å; L18-T20 PolarHBondContact O-N 3.13Å
19	V	32.4	Very low	31.9	Very low	120 Å²	120	135.7 Å²	135.7	73%	0.727	72%	0.721	S	S	*	*			trans	-59.3	91.1	155.1	177.4	0	0	0	0	104.1	L17 W21	L17-V19 PolarHBondContact O-N 3.5Å; V19-W21 PolarHBondContact O-N 3.38Å
20	T	33.6	Very low	31.5	Very low	106 Å²	106	136.1 Å²	136.1	65%	0.65	72%	0.718	S	S	*	*			trans	-57	108.1	170.7	48	0	0	0	0	105	L18 I22	L18-T20 PolarHBondContact O-N 3.13Å; T20-I22 VanDerWaalsContact C-N 3.26Å; T20-I22 PolarHBondContact O-N 2.87Å
21	W	30.9	Very low	31.6	Very low	238 Å²	238	134.8 Å²	134.8	90%	0.902	72%	0.719	S	S	*	*			trans	-53.8	101.6	162.6	-80.6	72	0	0	0	105.8	V19 D23	V19-W21 PolarHBondContact O-N 3.38Å; W21-D23 VanDerWaalsContact C-N 3.35Å; W21-D23 PolarHBondContact O-N 2.75Å
22	I	30.6	Very low	31.8	Very low	117 Å²	117	127.8 Å²	127.8	60%	0.6	70%	0.7	S	S	*	*			trans	-66.6	105.5	168.3	-63.8	169.1	0	0	0	103.7	T20 P24	T20-I22 VanDerWaalsContact C-N 3.26Å; T20-I22 PolarHBondContact O-N 2.87Å; I22-P24 WeakPolarHBondContact O-CD 3.37Å
23	D	32.5	Very low	32.3	Very low	91 Å²	91	125.7 Å²	125.7	49%	0.487	69%	0.689	S	S	.	*			trans	-56.2	121.8	176.8	-172.5	-16.7	0	0	0	108	W21 K25 S26	W21-D23 VanDerWaalsContact C-N 3.35Å; W21-D23 PolarHBondContact O-N 2.75Å; D23-K25 PolarHBondContact O-N 3.44Å; D23-K25 PolarHBondContact OD1-N 3.02Å; D23-K25 VanDerWaalsContact OD1-N 3.15Å; D23-S26 PolarHBondContact O-N 3.09Å; D23-S26 PolarHBondContact O-OG 2.96Å
24	P	32.6	Very low	33	Very low	92 Å²	92	118.1 Å²	118.1	60%	0.597	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-14.6	-180	20	-30.6	0	0	0	113.4	I22 S26 L27	I22-P24 WeakPolarHBondContact O-CD 3.37Å; P24-S26 VanDerWaalsContact C-N 3.32Å; P24-L27 PolarHBondContact O-N 3.45Å
25	K	33.3	Very low	33.5	Very low	159 Å²	159	112.8 Å²	112.8	69%	0.691	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-25.2	169.9	-68.7	-177.1	178.6	-177.9	0	113.9	D23 L27 L28	D23-K25 PolarHBondContact O-N 3.44Å; D23-K25 PolarHBondContact OD1-N 3.02Å; D23-K25 VanDerWaalsContact OD1-N 3.15Å; K25-L27 VanDerWaalsContact C-N 3.34Å; K25-L28 PolarHBondContact O-N 3.39Å
26	S	31.3	Very low	34.6	Very low	63 Å²	63	113 Å²	113	44%	0.441	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.5	-25	177.7	74.8	0	0	0	0	112.8	D23 P24 L28	D23-S26 PolarHBondContact O-N 3.09Å; D23-S26 PolarHBondContact O-OG 2.96Å; P24-S26 VanDerWaalsContact C-N 3.32Å; S26-L28 VanDerWaalsContact C-N 3.35Å
27	L	28.1	Very low	35.6	Very low	137 Å²	137	110.1 Å²	110.1	72%	0.717	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-15.7	175.6	-83.6	158.5	0	0	0	113.5	P24 K25	P24-L27 PolarHBondContact O-N 3.45Å; K25-L27 VanDerWaalsContact C-N 3.34Å
28	L	28.6	Very low	36.6	Very low	152 Å²	152	102.1 Å²	102.1	80%	0.796	56%	0.56	S	S	*	*	S	Bend	trans	-89.9	-12.4	179.2	-76.8	166.7	0	0	0	113.6	K25 S26	K25-L28 PolarHBondContact O-N 3.39Å; S26-L28 VanDerWaalsContact C-N 3.35Å
29	A	28	Very low	38.1	Very low	88 Å²	88	95.4 Å²	95.4	73%	0.727	53%	0.525	S	S	*	.	S	Bend	trans	-94.6	-7.9	-175.6	0	0	0	0	0	114.5
30	E	29.1	Very low	39.7	Very low	179 Å²	179	93.2 Å²	93.2	84%	0.836	51%	0.512	S	S	*	.	S	Bend	trans	-108.2	39.7	-163.9	-153.1	155.2	-152	0	0	113.7
31	G	30.5	Very low	41.1	Very low	64 Å²	64	91.8 Å²	91.8	66%	0.66	50%	0.497	S	S	*	.	S	Bend	trans	-149.4	7.7	-163.7	0	0	0	0	0	121.1
32	T	38.2	Very low	42.9	Very low	65 Å²	65	80.5 Å²	80.5	40%	0.399	45%	0.454	S	S	.	.			trans	-157.9	95	166.8	56.5	0	0	0	0	112.6	E34	T32-E34 PolarHBondContact O-N 3.33Å
33	N	39.6	Very low	44.6	Very low	106 Å²	106	78 Å²	78	57%	0.567	44%	0.442	S	S	*	.			trans	-60.5	126.6	158.3	-70	-9.9	0	0	0	107.1	E37 V38	N33-E37 HydrophobicContact CB-CB 4.1Å; N33-V38 HydrophobicContact CB-CG2 3.99Å; N33-V38 VanDerWaalsContact O-CG2 3.32Å; N33-V38 WeakPolarHBondContact O-CG2 3.41Å
34	E	47.7	Very low	46.4	Very low	17 Å²	17	80.2 Å²	80.2	8%	0.079	45%	0.45	C	S	.	.			trans	-68.9	164.5	-177.1	-73.2	-159.2	150.2	0	0	112.6	T32 V36 E37 V38 A268 R272	T32-E34 PolarHBondContact O-N 3.33Å; E34-V36 PolarHBondContact O-N 2.97Å; E34-E37 WeakPolarHBondContact O-CA 3.29Å; E34-E37 PolarHBondContact O-N 3.21Å; E34-V38 PolarHBondContact O-N 2.99Å; E34-A268 HydrophobicContact CG-CB 4.39Å; E34-A268 VanDerWaalsContact OE1-CB 3.32Å; E34-A268 WeakPolarHBondContact OE1-CB 3.45Å; E34-R272 IonicContact OE1-CZ 2.88Å; E34-R272 IonicContact OE1-NE 3.53Å; E34-R272 PolarHBondContact OE1-NE 3.49Å; E34-R272 IonicContact OE1-NH1 2.87Å; E34-R272 PolarHBondContact OE1-NH1 3Å; E34-R272 IonicContact OE1-NH2 3.77Å; E34-R272 PolarHBondContact OE1-NH2 3.44Å; E34-R272 VanDerWaalsContact OE1-NH2 3.13Å; E34-R272 IonicContact OE2-CZ 3.62Å; E34-R272 IonicContact OE2-NE 3.96Å; E34-R272 IonicContact OE2-NH1 3.81Å; E34-R272 PolarHBondContact OE2-NH1 3.03Å; E34-R272 IonicContact OE2-NH2 2.63Å; E34-R272 PolarHBondContact OE2-NH2 3.35Å
35	A	49.3	Very low	47.8	Very low	4 Å²	4	77.1 Å²	77.1	3%	0.033	43%	0.428	C	S	.	.	H	α-helix	trans	-44	-30.5	171.3	0	0	0	0	0	115.7	F73 D74	A35-F73 HydrophobicContact CB-CD1 3.31Å; A35-F73 HydrophobicContact CB-CE1 3.44Å; A35-F73 VanDerWaalsContact CB-CE1 3.44Å; A35-D74 WeakPolarHBondContact CB-OD1 3.4Å
36	V	51	Low	49.1	Very low	102 Å²	102	73 Å²	73	62%	0.618	41%	0.413	S	S	*	.	H	α-helix	trans	-76.5	-30.9	178.7	-175.8	0	0	0	0	111.7	E34	E34-V36 PolarHBondContact O-N 2.97Å
37	E	54.3	Low	50.8	Low	94 Å²	94	76.8 Å²	76.8	44%	0.439	43%	0.428	S	S	.	.	H	α-helix	trans	-93.2	-33.7	-177.3	-70.3	176.8	167.6	0	0	113.3	N33 E34 L39 T40	N33-E37 HydrophobicContact CB-CB 4.1Å; E34-E37 WeakPolarHBondContact O-CA 3.29Å; E34-E37 PolarHBondContact O-N 3.21Å; E37-L39 PolarHBondContact O-N 3.45Å; E37-L39 VanDerWaalsContact O-N 3.16Å; E37-T40 WeakPolarHBondContact O-CB 3.47Å; E37-T40 WeakPolarHBondContact O-CG2 3.43Å; E37-T40 PolarHBondContact O-N 3.25Å; E37-T40 PolarHBondContact O-OG1 3.43Å
38	V	54.8	Low	52.7	Low	7 Å²	7	72.5 Å²	72.5	4%	0.042	41%	0.413	C	S	.	.	H	α-helix	trans	-57.4	-33.9	-177.4	161.4	0	0	0	0	112.2	N33 E34 F73 D124	N33-V38 HydrophobicContact CB-CG2 3.99Å; N33-V38 VanDerWaalsContact O-CG2 3.32Å; N33-V38 WeakPolarHBondContact O-CG2 3.41Å; E34-V38 PolarHBondContact O-N 2.99Å; V38-F73 HydrophobicContact CB-CE2 4.29Å; V38-F73 HydrophobicContact CB-CZ 3.93Å; V38-F73 HydrophobicContact CG1-CD2 4.46Å; V38-F73 HydrophobicContact CG1-CE2 3.57Å; V38-F73 HydrophobicContact CG1-CZ 3.7Å; V38-F73 HydrophobicContact CG2-CZ 3.99Å; V38-D124 HydrophobicContact CG1-CB 4.5Å; V38-D124 WeakPolarHBondContact CG1-O 3.42Å; V38-D124 WeakPolarHBondContact O-CB 3.19Å
39	L	63.3	Low	54.3	Low	2 Å²	2	75.4 Å²	75.4	1%	0.01	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	20.2	-178.9	-61.4	177	0	0	0	113.5	E37 K41 C42 N43 A69 N70	E37-L39 PolarHBondContact O-N 3.45Å; E37-L39 VanDerWaalsContact O-N 3.16Å; L39-K41 PolarHBondContact O-N 3.16Å; L39-C42 HydrophobicContact CB-CB 3.95Å; L39-C42 HydrophobicContact CD2-CB 4.04Å; L39-C42 CarbonylContact O-C 3.51Å; L39-C42 WeakPolarHBondContact O-CA 3.39Å; L39-C42 WeakPolarHBondContact O-CB 3.33Å; L39-C42 PolarHBondContact O-N 3.38Å; L39-C42 VanDerWaalsContact O-N 3.17Å; L39-N43 WeakPolarHBondContact O-CB 3.13Å; L39-N43 PolarHBondContact O-N 2.97Å; L39-N43 PolarHBondContact O-ND2 2.57Å; L39-A69 HydrophobicContact CD1-CB 4.18Å; L39-A69 HydrophobicContact CD2-CB 3.79Å; L39-N70 HydrophobicContact CD1-CB 3.79Å
40	T	65.6	Low	55.9	Low	75 Å²	75	73.6 Å²	73.6	46%	0.46	40%	0.399	S	S	.	.	H	α-helix	trans	-52.3	-53.3	176.3	41.3	0	0	0	0	111.8	E37 C42 N43 E44	E37-T40 WeakPolarHBondContact O-CB 3.47Å; E37-T40 WeakPolarHBondContact O-CG2 3.43Å; E37-T40 PolarHBondContact O-N 3.25Å; E37-T40 PolarHBondContact O-OG1 3.43Å; T40-C42 VanDerWaalsContact C-N 3.34Å; T40-C42 PolarHBondContact O-N 2.94Å; T40-N43 WeakPolarHBondContact O-CB 3.26Å; T40-N43 PolarHBondContact O-N 3.02Å; T40-N43 VanDerWaalsContact O-N 3.1Å; T40-E44 WeakPolarHBondContact O-CG 3.49Å; T40-E44 PolarHBondContact O-N 2.79Å
41	K	64.1	Low	57.3	Low	75 Å²	75	70.5 Å²	70.5	33%	0.326	40%	0.397	S	S	.	.	H	α-helix	trans	-60.7	-44.1	176.5	-161.9	170.6	-174.4	170.7	0	111.2	L39 N43 E44 L45 E123 D124	L39-K41 PolarHBondContact O-N 3.16Å; K41-N43 VanDerWaalsContact C-N 3.31Å; K41-N43 PolarHBondContact O-N 2.83Å; K41-E44 PolarHBondContact O-N 2.77Å; K41-L45 HydrophobicContact CG-CD1 4.09Å; K41-L45 HydrophobicContact CG-CG 4.45Å; K41-L45 WeakPolarHBondContact O-CB 3.28Å; K41-L45 WeakPolarHBondContact O-CD1 3.35Å; K41-L45 WeakPolarHBondContact O-CG 3.49Å; K41-L45 PolarHBondContact O-N 2.71Å; K41-E123 IonicContact NZ-OE2 2.77Å; K41-E123 PolarHBondContact NZ-OE2 2.68Å; K41-D124 WeakPolarHBondContact CB-OD1 3.25Å
42	C	68.8	Low	59.1	Low	1 Å²	1	69.8 Å²	69.8	1%	0.007	38%	0.382	C	S	.	.	H	α-helix	trans	-56.8	-41	173.3	-84.7	0	0	0	0	113.5	L39 T40 L45 L46 C66 D124	L39-C42 HydrophobicContact CB-CB 3.95Å; L39-C42 HydrophobicContact CD2-CB 4.04Å; L39-C42 CarbonylContact O-C 3.51Å; L39-C42 WeakPolarHBondContact O-CA 3.39Å; L39-C42 WeakPolarHBondContact O-CB 3.33Å; L39-C42 PolarHBondContact O-N 3.38Å; L39-C42 VanDerWaalsContact O-N 3.17Å; T40-C42 VanDerWaalsContact C-N 3.34Å; T40-C42 PolarHBondContact O-N 2.94Å; C42-L45 PolarHBondContact O-N 2.79Å; C42-L46 WeakPolarHBondContact O-CB 3.47Å; C42-L46 VanDerWaalsContact O-CG 3.23Å; C42-L46 WeakPolarHBondContact O-CG 3.17Å; C42-L46 PolarHBondContact O-N 2.82Å; C42-C66 WeakPolarHBondContact CA-SG 3.15Å; C42-C66 HydrophobicContact CB-CB 3.49Å; C42-C66 VanDerWaalsContact CB-CB 3.49Å; C42-C66 WeakPolarHBondContact CB-SG 3.33Å; C42-C66 WeakPolarHBondContact SG-CA 3.21Å; C42-C66 WeakPolarHBondContact SG-CB 3.45Å; C42-C66 CovalentContact SG-SG 2.03Å; C42-C66 PolarHBondContact SG-SG 3.31Å; C42-D124 PolarHBondContact SG-OD2 2.88Å; C42-D124 VanDerWaalsContact SG-OD2 3.38Å
43	N	66	Low	60.2	Low	65 Å²	65	73.7 Å²	73.7	35%	0.348	39%	0.389	S	S	.	.	H	α-helix	trans	-69.5	-41.8	177.7	-72.9	-27.6	0	0	0	111.8	L39 T40 K41 L45 L46 N47	L39-N43 WeakPolarHBondContact O-CB 3.13Å; L39-N43 PolarHBondContact O-N 2.97Å; L39-N43 PolarHBondContact O-ND2 2.57Å; T40-N43 WeakPolarHBondContact O-CB 3.26Å; T40-N43 PolarHBondContact O-N 3.02Å; T40-N43 VanDerWaalsContact O-N 3.1Å; K41-N43 VanDerWaalsContact C-N 3.31Å; K41-N43 PolarHBondContact O-N 2.83Å; N43-L45 VanDerWaalsContact C-N 3.33Å; N43-L45 PolarHBondContact O-N 3.2Å; N43-L46 PolarHBondContact O-N 3.19Å; N43-N47 PolarHBondContact O-N 3.06Å; N43-N47 PolarHBondContact O-ND2 3Å
44	E	69.3	Low	61.2	Low	138 Å²	138	75.4 Å²	75.4	65%	0.645	39%	0.392	S	S	*	.	H	α-helix	trans	-59.9	-44.4	172.6	-70.4	177.7	178.1	0	0	111.4	T40 K41 N47 A48	T40-E44 WeakPolarHBondContact O-CG 3.49Å; T40-E44 PolarHBondContact O-N 2.79Å; K41-E44 PolarHBondContact O-N 2.77Å; E44-N47 PolarHBondContact O-N 3.03Å; E44-A48 PolarHBondContact O-N 3.34Å
45	L	63.8	Low	62.2	Low	27 Å²	27	77.3 Å²	77.3	14%	0.141	40%	0.404	C	S	.	.	H	α-helix	trans	-68.6	-39.8	179.6	-66.9	170	0	0	0	112.4	K41 C42 N43 N47 A48 W59 L62	K41-L45 HydrophobicContact CG-CD1 4.09Å; K41-L45 HydrophobicContact CG-CG 4.45Å; K41-L45 WeakPolarHBondContact O-CB 3.28Å; K41-L45 WeakPolarHBondContact O-CD1 3.35Å; K41-L45 WeakPolarHBondContact O-CG 3.49Å; K41-L45 PolarHBondContact O-N 2.71Å; C42-L45 PolarHBondContact O-N 2.79Å; N43-L45 VanDerWaalsContact C-N 3.33Å; N43-L45 PolarHBondContact O-N 3.2Å; L45-N47 PolarHBondContact O-N 3.46Å; L45-N47 VanDerWaalsContact O-N 3.1Å; L45-A48 PolarHBondContact O-N 3Å; L45-W59 HydrophobicContact CB-CH2 4.35Å; L45-W59 HydrophobicContact CB-CZ3 3.86Å; L45-W59 HydrophobicContact CD2-CE3 4.23Å; L45-W59 HydrophobicContact CD2-CH2 3.1Å; L45-W59 HydrophobicContact CD2-CZ2 3.58Å; L45-W59 HydrophobicContact CD2-CZ3 3.44Å; L45-W59 VanDerWaalsContact CD2-CZ3 3.44Å; L45-W59 HydrophobicContact CG-CH2 4.28Å; L45-W59 HydrophobicContact CG-CZ3 4.25Å; L45-W59 WeakPolarHBondContact O-CZ3 3.43Å; L45-L62 HydrophobicContact CD1-CD2 3.46Å; L45-L62 VanDerWaalsContact CD1-CD2 3.46Å; L45-L62 HydrophobicContact CD1-CG 3.99Å
46	L	60.9	Low	63	Low	73 Å²	73	82.7 Å²	82.7	38%	0.382	42%	0.424	S	S	.	.	H	α-helix	trans	-56.5	-26.9	174.2	-78	164.2	0	0	0	112.2	C42 N43 L63	C42-L46 WeakPolarHBondContact O-CB 3.47Å; C42-L46 VanDerWaalsContact O-CG 3.23Å; C42-L46 WeakPolarHBondContact O-CG 3.17Å; C42-L46 PolarHBondContact O-N 2.82Å; N43-L46 PolarHBondContact O-N 3.19Å; L46-L63 HydrophobicContact CB-CD2 4.38Å; L46-L63 HydrophobicContact CD2-CD2 3.62Å; L46-L63 HydrophobicContact CG-CD2 4.04Å
47	N	67	Low	63.8	Low	141 Å²	141	82.7 Å²	82.7	75%	0.754	42%	0.418	S	S	*	.	H	α-helix	trans	-96.4	-10.6	-177.4	-66.7	-33.9	0	0	0	114.7	N43 E44 L45	N43-N47 PolarHBondContact O-N 3.06Å; N43-N47 PolarHBondContact O-ND2 3Å; E44-N47 PolarHBondContact O-N 3.03Å; L45-N47 PolarHBondContact O-N 3.46Å; L45-N47 VanDerWaalsContact O-N 3.1Å
48	A	67.9	Low	64.5	Low	48 Å²	48	82.9 Å²	82.9	40%	0.397	42%	0.418	S	S	.	.			trans	-87.6	137.2	-173.5	0	0	0	0	0	113.8	E44 L45 W59	E44-A48 PolarHBondContact O-N 3.34Å; L45-A48 PolarHBondContact O-N 3Å; A48-W59 HydrophobicContact CB-CH2 3.59Å; A48-W59 HydrophobicContact CB-CZ3 3.75Å
49	K	61.7	Low	65.3	Low	213 Å²	213	84.7 Å²	84.7	93%	0.926	42%	0.424	S	S	*	.			trans	-92.4	120	174	-69.5	179.5	-179.3	174.8	0	110.3
50	T	60.8	Low	65.8	Low	50 Å²	50	92.1 Å²	92.1	31%	0.307	45%	0.452	S	S	.	.			trans	-115.4	149.9	-179	53.6	0	0	0	0	114.5	V55 W59	T50-V55 HydrophobicContact CG2-CG1 4.2Å; T50-W59 HydrophobicContact CG2-CD2 3.65Å; T50-W59 HydrophobicContact CG2-CE3 4.01Å; T50-W59 HydrophobicContact CG2-CG 4.26Å; T50-W59 HydrophobicContact CG2-CH2 3.73Å; T50-W59 HydrophobicContact CG2-CZ2 3.41Å; T50-W59 VanDerWaalsContact CG2-CZ2 3.41Å; T50-W59 HydrophobicContact CG2-CZ3 4.04Å
51	S	58.4	Low	66.4	Low	113 Å²	113	92.8 Å²	92.8	79%	0.79	45%	0.449	S	S	*	.			trans	-101.6	-40.1	-165.3	58.4	0	0	0	0	115.6
52	S	68.2	Low	67	Low	49 Å²	49	89.6 Å²	89.6	34%	0.343	44%	0.436	S	S	.	.			trans	-86.6	150.6	-172.6	118.4	0	0	0	0	113.1	V55 R56	S52-V55 VanDerWaalsContact OG-CB 3.24Å; S52-V55 WeakPolarHBondContact OG-CB 3.44Å; S52-V55 WeakPolarHBondContact OG-CG2 3.25Å; S52-V55 PolarHBondContact OG-N 3.39Å; S52-R56 WeakPolarHBondContact O-CB 3.46Å; S52-R56 VanDerWaalsContact O-CG 3.29Å; S52-R56 WeakPolarHBondContact O-CG 3.3Å; S52-R56 PolarHBondContact O-N 3.35Å
53	W	62.3	Low	67.4	Low	148 Å²	148	92 Å²	92	56%	0.561	45%	0.448	S	S	*	.	H	α-helix	trans	-72.9	-40.5	-175	80.3	-84.9	0	0	0	114.3	V55 R56 M57	W53-V55 VanDerWaalsContact C-N 3.31Å; W53-R56 WeakPolarHBondContact O-CB 3.43Å; W53-R56 PolarHBondContact O-N 3.4Å; W53-M57 HydrophobicContact CE3-CE 3.67Å; W53-M57 HydrophobicContact CE3-SD 4.38Å; W53-M57 HydrophobicContact CH2-CE 3.97Å; W53-M57 HydrophobicContact CZ3-CE 3.14Å; W53-M57 HydrophobicContact CZ3-SD 4.13Å; W53-M57 PolarHBondContact O-N 3.03Å
54	K	60.7	Low	68.1	Low	142 Å²	142	97.7 Å²	97.7	62%	0.617	47%	0.465	S	S	*	.	H	α-helix	trans	-63.7	-41.5	173.2	-72.9	-172.5	-179.9	177.4	0	110.3	M57 F58	K54-M57 PolarHBondContact O-N 3.31Å; K54-F58 PolarHBondContact O-N 3.39Å
55	V	67.5	Low	68.7	Low	56 Å²	56	91.6 Å²	91.6	34%	0.339	44%	0.437	S	S	.	.	H	α-helix	trans	-59.7	-49.8	171.5	174.8	0	0	0	0	108.6	T50 S52 W53 M57 F58 W59	T50-V55 HydrophobicContact CG2-CG1 4.2Å; S52-V55 VanDerWaalsContact OG-CB 3.24Å; S52-V55 WeakPolarHBondContact OG-CB 3.44Å; S52-V55 WeakPolarHBondContact OG-CG2 3.25Å; S52-V55 PolarHBondContact OG-N 3.39Å; W53-V55 VanDerWaalsContact C-N 3.31Å; V55-M57 VanDerWaalsContact C-N 3.32Å; V55-M57 PolarHBondContact O-N 3.29Å; V55-F58 PolarHBondContact O-N 2.89Å; V55-W59 HydrophobicContact CG1-CG 4.2Å; V55-W59 VanDerWaalsContact CG1-NE1 3.3Å; V55-W59 WeakPolarHBondContact O-CB 3.48Å; V55-W59 PolarHBondContact O-N 2.9Å
56	R	67.3	Low	69.5	Low	117 Å²	117	90.3 Å²	90.3	44%	0.442	43%	0.43	S	S	.	.	H	α-helix	trans	-55.2	-39	176.1	-81.4	-177.3	-75.8	154.4	-5.7	113.9	S52 W53 R60	S52-R56 WeakPolarHBondContact O-CB 3.46Å; S52-R56 VanDerWaalsContact O-CG 3.29Å; S52-R56 WeakPolarHBondContact O-CG 3.3Å; S52-R56 PolarHBondContact O-N 3.35Å; W53-R56 WeakPolarHBondContact O-CB 3.43Å; W53-R56 PolarHBondContact O-N 3.4Å; R56-R60 WeakPolarHBondContact O-CB 3.38Å; R56-R60 WeakPolarHBondContact O-CG 3.41Å; R56-R60 PolarHBondContact O-N 3.35Å
57	M	66.8	Low	70.3	Confident	102 Å²	102	89.2 Å²	89.2	50%	0.502	43%	0.431	S	S	.	.	H	α-helix	trans	-71	-48.1	177.7	-73.3	-160.1	-57.2	0	0	112.6	W53 K54 V55 W59 R60 Q61	W53-M57 HydrophobicContact CE3-CE 3.67Å; W53-M57 HydrophobicContact CE3-SD 4.38Å; W53-M57 HydrophobicContact CH2-CE 3.97Å; W53-M57 HydrophobicContact CZ3-CE 3.14Å; W53-M57 HydrophobicContact CZ3-SD 4.13Å; W53-M57 PolarHBondContact O-N 3.03Å; K54-M57 PolarHBondContact O-N 3.31Å; V55-M57 VanDerWaalsContact C-N 3.32Å; V55-M57 PolarHBondContact O-N 3.29Å; M57-W59 PolarHBondContact O-N 3.29Å; M57-R60 PolarHBondContact O-N 3.46Å; M57-Q61 PolarHBondContact O-N 3.06Å; M57-Q61 VanDerWaalsContact O-N 3.08Å
58	F	69.2	Low	70.9	Confident	98 Å²	98	86.1 Å²	86.1	43%	0.43	41%	0.414	S	S	.	.	H	α-helix	trans	-55.9	-44	173	175.1	-98	0	0	0	110.9	K54 V55 Q61 L62 N118	K54-F58 PolarHBondContact O-N 3.39Å; V55-F58 PolarHBondContact O-N 2.89Å; F58-Q61 PolarHBondContact O-N 3.1Å; F58-L62 HydrophobicContact CE1-CD2 4.09Å; F58-L62 HydrophobicContact CZ-CD2 4.46Å; F58-L62 WeakPolarHBondContact O-CB 3.46Å; F58-L62 PolarHBondContact O-N 3.05Å; F58-N118 WeakPolarHBondContact CE2-ND2 3.41Å
59	W	72.1	Confident	71.4	Confident	45 Å²	45	83.9 Å²	83.9	17%	0.17	40%	0.395	C	S	.	.	H	α-helix	trans	-63.2	-44	175.9	-84.5	68.4	0	0	0	112.4	L45 A48 T50 V55 M57 Q61 L62 L63	L45-W59 HydrophobicContact CB-CH2 4.35Å; L45-W59 HydrophobicContact CB-CZ3 3.86Å; L45-W59 HydrophobicContact CD2-CE3 4.23Å; L45-W59 HydrophobicContact CD2-CH2 3.1Å; L45-W59 HydrophobicContact CD2-CZ2 3.58Å; L45-W59 HydrophobicContact CD2-CZ3 3.44Å; L45-W59 VanDerWaalsContact CD2-CZ3 3.44Å; L45-W59 HydrophobicContact CG-CH2 4.28Å; L45-W59 HydrophobicContact CG-CZ3 4.25Å; L45-W59 WeakPolarHBondContact O-CZ3 3.43Å; A48-W59 HydrophobicContact CB-CH2 3.59Å; A48-W59 HydrophobicContact CB-CZ3 3.75Å; T50-W59 HydrophobicContact CG2-CD2 3.65Å; T50-W59 HydrophobicContact CG2-CE3 4.01Å; T50-W59 HydrophobicContact CG2-CG 4.26Å; T50-W59 HydrophobicContact CG2-CH2 3.73Å; T50-W59 HydrophobicContact CG2-CZ2 3.41Å; T50-W59 VanDerWaalsContact CG2-CZ2 3.41Å; T50-W59 HydrophobicContact CG2-CZ3 4.04Å; V55-W59 HydrophobicContact CG1-CG 4.2Å; V55-W59 VanDerWaalsContact CG1-NE1 3.3Å; V55-W59 WeakPolarHBondContact O-CB 3.48Å; V55-W59 PolarHBondContact O-N 2.9Å; M57-W59 PolarHBondContact O-N 3.29Å; W59-Q61 VanDerWaalsContact C-N 3.31Å; W59-Q61 PolarHBondContact O-N 3.01Å; W59-L62 PolarHBondContact O-N 3.48Å; W59-L63 VanDerWaalsContact O-CB 3.26Å; W59-L63 WeakPolarHBondContact O-CB 3.41Å; W59-L63 WeakPolarHBondContact O-CD1 3.45Å; W59-L63 WeakPolarHBondContact O-CG 3.46Å; W59-L63 PolarHBondContact O-N 3.3Å
60	R	73.5	Confident	72.1	Confident	158 Å²	158	76 Å²	76	60%	0.596	36%	0.363	S	S	*	.	H	α-helix	trans	-59.2	-41.5	176.1	-80.5	170.9	-176.8	-171.1	0.3	112.2	R56 M57 R64	R56-R60 WeakPolarHBondContact O-CB 3.38Å; R56-R60 WeakPolarHBondContact O-CG 3.41Å; R56-R60 PolarHBondContact O-N 3.35Å; M57-R60 PolarHBondContact O-N 3.46Å; R60-R64 WeakPolarHBondContact O-CG 3.44Å; R60-R64 PolarHBondContact O-N 2.84Å; R60-R64 VanDerWaalsContact O-N 3.09Å
61	Q	78.4	Confident	72.9	Confident	89 Å²	89	82 Å²	82	42%	0.416	38%	0.38	S	S	.	.	H	α-helix	trans	-66.1	-47.4	177.3	-175.7	178.3	-9.6	0	0	110.8	M57 F58 W59 L63 R64 L65	M57-Q61 PolarHBondContact O-N 3.06Å; M57-Q61 VanDerWaalsContact O-N 3.08Å; F58-Q61 PolarHBondContact O-N 3.1Å; W59-Q61 VanDerWaalsContact C-N 3.31Å; W59-Q61 PolarHBondContact O-N 3.01Å; Q61-L63 PolarHBondContact O-N 3.11Å; Q61-R64 PolarHBondContact O-N 2.92Å; Q61-L65 HydrophobicContact CG-CD1 4.38Å; Q61-L65 WeakPolarHBondContact O-CG 3.17Å; Q61-L65 PolarHBondContact O-N 3.5Å
62	L	77.5	Confident	74.1	Confident	9 Å²	9	80.2 Å²	80.2	5%	0.047	36%	0.356	C	S	.	.	H	α-helix	trans	-61.7	-43.6	177.9	-172.9	55.2	0	0	0	111.9	L45 F58 W59 R64 L65 C66 F121	L45-L62 HydrophobicContact CD1-CD2 3.46Å; L45-L62 VanDerWaalsContact CD1-CD2 3.46Å; L45-L62 HydrophobicContact CD1-CG 3.99Å; F58-L62 HydrophobicContact CE1-CD2 4.09Å; F58-L62 HydrophobicContact CZ-CD2 4.46Å; F58-L62 WeakPolarHBondContact O-CB 3.46Å; F58-L62 PolarHBondContact O-N 3.05Å; W59-L62 PolarHBondContact O-N 3.48Å; L62-R64 VanDerWaalsContact C-N 3.32Å; L62-R64 PolarHBondContact O-N 3.39Å; L62-L65 WeakPolarHBondContact O-CB 3.42Å; L62-L65 PolarHBondContact O-N 3.33Å; L62-C66 WeakPolarHBondContact O-CB 3.1Å; L62-C66 PolarHBondContact O-N 2.76Å; L62-C66 PolarHBondContact O-SG 3.48Å; L62-F121 HydrophobicContact CD1-CB 3.81Å; L62-F121 HydrophobicContact CD1-CD2 4.3Å; L62-F121 HydrophobicContact CD1-CG 4.49Å
63	L	77.1	Confident	74.5	Confident	50 Å²	50	78 Å²	78	26%	0.262	34%	0.34	S	S	.	.	H	α-helix	trans	-58.9	-40.3	175	-72.1	165.8	0	0	0	112.2	L46 W59 Q61 A67	L46-L63 HydrophobicContact CB-CD2 4.38Å; L46-L63 HydrophobicContact CD2-CD2 3.62Å; L46-L63 HydrophobicContact CG-CD2 4.04Å; W59-L63 VanDerWaalsContact O-CB 3.26Å; W59-L63 WeakPolarHBondContact O-CB 3.41Å; W59-L63 WeakPolarHBondContact O-CD1 3.45Å; W59-L63 WeakPolarHBondContact O-CG 3.46Å; W59-L63 PolarHBondContact O-N 3.3Å; Q61-L63 PolarHBondContact O-N 3.11Å; L63-A67 VanDerWaalsContact O-CB 3.27Å; L63-A67 WeakPolarHBondContact O-CB 3.21Å; L63-A67 PolarHBondContact O-N 2.78Å
64	R	79.4	Confident	75	Confident	186 Å²	186	72.1 Å²	72.1	70%	0.702	32%	0.32	S	S	*	.	H	α-helix	trans	-65.8	-43.6	175.5	-75.8	175.3	177.8	-176.9	-1.5	111.9	R60 Q61 L62 A67 M68	R60-R64 WeakPolarHBondContact O-CG 3.44Å; R60-R64 PolarHBondContact O-N 2.84Å; R60-R64 VanDerWaalsContact O-N 3.09Å; Q61-R64 PolarHBondContact O-N 2.92Å; L62-R64 VanDerWaalsContact C-N 3.32Å; L62-R64 PolarHBondContact O-N 3.39Å; R64-A67 PolarHBondContact O-N 3.08Å; R64-M68 WeakPolarHBondContact O-CG 3.45Å; R64-M68 PolarHBondContact O-N 2.61Å
65	L	83	Confident	76.1	Confident	10 Å²	10	68.4 Å²	68.4	5%	0.052	31%	0.307	C	S	.	.	H	α-helix	trans	-61.6	-47.3	176.3	-68.6	171	0	0	0	110.6	Q61 L62 A67 M68 A69 I114 T116 N118 F121	Q61-L65 HydrophobicContact CG-CD1 4.38Å; Q61-L65 WeakPolarHBondContact O-CG 3.17Å; Q61-L65 PolarHBondContact O-N 3.5Å; L62-L65 WeakPolarHBondContact O-CB 3.42Å; L62-L65 PolarHBondContact O-N 3.33Å; L65-A67 PolarHBondContact O-N 3.03Å; L65-M68 HydrophobicContact CD2-CE 4.1Å; L65-M68 PolarHBondContact O-N 3.23Å; L65-A69 WeakPolarHBondContact O-CB 3.41Å; L65-A69 PolarHBondContact O-N 3.32Å; L65-I114 HydrophobicContact CD2-CD1 4.45Å; L65-I114 HydrophobicContact CD2-CG2 3.37Å; L65-T116 WeakPolarHBondContact CD1-OG1 3.2Å; L65-N118 HydrophobicContact CD1-CB 4.15Å; L65-F121 HydrophobicContact CB-CD1 4.29Å; L65-F121 HydrophobicContact CB-CD2 3.71Å; L65-F121 HydrophobicContact CB-CE1 4.22Å; L65-F121 HydrophobicContact CB-CE2 3.64Å; L65-F121 HydrophobicContact CB-CG 4.03Å; L65-F121 HydrophobicContact CB-CZ 3.89Å; L65-F121 HydrophobicContact CD1-CB 4.21Å; L65-F121 HydrophobicContact CD1-CD1 4.14Å; L65-F121 HydrophobicContact CD1-CG 4.04Å; L65-F121 HydrophobicContact CD2-CE1 4.34Å
66	C	80.7	Confident	77	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-44.7	175.1	-72.6	0	0	0	0	112.8	C42 L62 M68 A69 N70	C42-C66 WeakPolarHBondContact CA-SG 3.15Å; C42-C66 HydrophobicContact CB-CB 3.49Å; C42-C66 VanDerWaalsContact CB-CB 3.49Å; C42-C66 WeakPolarHBondContact CB-SG 3.33Å; C42-C66 WeakPolarHBondContact SG-CA 3.21Å; C42-C66 WeakPolarHBondContact SG-CB 3.45Å; C42-C66 CovalentContact SG-SG 2.03Å; C42-C66 PolarHBondContact SG-SG 3.31Å; L62-C66 WeakPolarHBondContact O-CB 3.1Å; L62-C66 PolarHBondContact O-N 2.76Å; L62-C66 PolarHBondContact O-SG 3.48Å; C66-M68 PolarHBondContact O-N 3.41Å; C66-A69 PolarHBondContact O-N 3.15Å; C66-N70 VanDerWaalsContact O-CB 3.22Å; C66-N70 WeakPolarHBondContact O-CB 3.27Å; C66-N70 PolarHBondContact O-N 3.27Å
67	A	77.2	Confident	78.2	Confident	49 Å²	49	60.8 Å²	60.8	41%	0.405	27%	0.273	S	S	.	.	H	α-helix	trans	-64.8	-40.1	178.2	0	0	0	0	0	112.1	L63 R64 L65 R71	L63-A67 VanDerWaalsContact O-CB 3.27Å; L63-A67 WeakPolarHBondContact O-CB 3.21Å; L63-A67 PolarHBondContact O-N 2.78Å; R64-A67 PolarHBondContact O-N 3.08Å; L65-A67 PolarHBondContact O-N 3.03Å; A67-R71 WeakPolarHBondContact O-CB 3.4Å; A67-R71 PolarHBondContact O-N 3.45Å; A67-R71 VanDerWaalsContact O-N 3.1Å
68	M	79.7	Confident	79.5	Confident	77 Å²	77	56 Å²	56	38%	0.379	25%	0.249	S	C	.	.	H	α-helix	trans	-68.1	-44.1	174.7	-71.5	-171.6	-66.8	0	0	111.7	R64 L65 C66 R71 Y72 I114	R64-M68 WeakPolarHBondContact O-CG 3.45Å; R64-M68 PolarHBondContact O-N 2.61Å; L65-M68 HydrophobicContact CD2-CE 4.1Å; L65-M68 PolarHBondContact O-N 3.23Å; C66-M68 PolarHBondContact O-N 3.41Å; M68-R71 PolarHBondContact O-N 3.29Å; M68-Y72 VanDerWaalsContact O-CD2 3.26Å; M68-Y72 WeakPolarHBondContact O-CD2 3.38Å; M68-Y72 PolarHBondContact O-N 2.81Å; M68-I114 HydrophobicContact CB-CD1 3.8Å; M68-I114 HydrophobicContact CE-CD1 3.77Å; M68-I114 HydrophobicContact CE-CG1 3.95Å; M68-I114 HydrophobicContact SD-CD1 4.31Å; M68-I114 HydrophobicContact SD-CG1 4.36Å
69	A	78.3	Confident	80.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.2	-54	174.7	0	0	0	0	0	110	L39 L65 C66 R71 Y72 F73 L77 F121 F125	L39-A69 HydrophobicContact CD1-CB 4.18Å; L39-A69 HydrophobicContact CD2-CB 3.79Å; L65-A69 WeakPolarHBondContact O-CB 3.41Å; L65-A69 PolarHBondContact O-N 3.32Å; C66-A69 PolarHBondContact O-N 3.15Å; A69-R71 PolarHBondContact O-N 3.2Å; A69-Y72 PolarHBondContact O-N 3.4Å; A69-F73 WeakPolarHBondContact O-CB 3.39Å; A69-F73 PolarHBondContact O-N 2.89Å; A69-L77 HydrophobicContact CB-CD2 4.26Å; A69-F121 HydrophobicContact CB-CE2 3.94Å; A69-F121 HydrophobicContact CB-CZ 3.97Å; A69-F125 HydrophobicContact CB-CE2 4.26Å; A69-F125 HydrophobicContact CB-CZ 4.07Å
70	N	76.1	Confident	81.9	Confident	48 Å²	48	49.1 Å²	49.1	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-55.7	-31.7	178.9	-167.9	33.9	0	0	0	113.1	L39 C66 R264	L39-N70 HydrophobicContact CD1-CB 3.79Å; C66-N70 VanDerWaalsContact O-CB 3.22Å; C66-N70 WeakPolarHBondContact O-CB 3.27Å; C66-N70 PolarHBondContact O-N 3.27Å; N70-R264 PolarHBondContact O-NH2 3.04Å; N70-R264 VanDerWaalsContact OD1-CZ 3.3Å; N70-R264 PolarHBondContact OD1-NH1 2.87Å; N70-R264 PolarHBondContact OD1-NH2 3.01Å
71	R	78.7	Confident	82.9	Confident	177 Å²	177	41.6 Å²	41.6	67%	0.668	19%	0.192	S	C	*	.	H	α-helix	trans	-78.7	-35.5	178	-178.3	173.1	175.4	163.7	0.6	114	A67 M68 A69	A67-R71 WeakPolarHBondContact O-CB 3.4Å; A67-R71 PolarHBondContact O-N 3.45Å; A67-R71 VanDerWaalsContact O-N 3.1Å; M68-R71 PolarHBondContact O-N 3.29Å; A69-R71 PolarHBondContact O-N 3.2Å
72	Y	82.5	Confident	83.5	Confident	75 Å²	75	37.6 Å²	37.6	29%	0.294	17%	0.173	S	C	.	.	H	α-helix	trans	-114.7	-5.3	-168.2	-64.5	-70.3	0	0	0	114.6	M68 A69 D74 N75 H76 A112	M68-Y72 VanDerWaalsContact O-CD2 3.26Å; M68-Y72 WeakPolarHBondContact O-CD2 3.38Å; M68-Y72 PolarHBondContact O-N 2.81Å; A69-Y72 PolarHBondContact O-N 3.4Å; Y72-D74 VanDerWaalsContact C-N 3.35Å; Y72-D74 PolarHBondContact O-N 3.21Å; Y72-N75 CarbonylContact O-C 3.59Å; Y72-N75 PolarHBondContact O-N 2.84Å; Y72-H76 PolarHBondContact O-N 2.77Å; Y72-H76 VanDerWaalsContact O-N 3.13Å; Y72-A112 HydrophobicContact CD1-CB 4.01Å; Y72-A112 HydrophobicContact CD2-CB 3.65Å; Y72-A112 HydrophobicContact CE2-CB 4.19Å; Y72-A112 HydrophobicContact CG-CB 3.56Å
73	F	76.4	Confident	83.8	Confident	1 Å²	1	38 Å²	38	0%	0.004	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-39.1	-176.9	-164.4	-86.8	0	0	0	113.1	A35 V38 A69 N75 F125 A136 G139 L141	A35-F73 HydrophobicContact CB-CD1 3.31Å; A35-F73 HydrophobicContact CB-CE1 3.44Å; A35-F73 VanDerWaalsContact CB-CE1 3.44Å; V38-F73 HydrophobicContact CB-CE2 4.29Å; V38-F73 HydrophobicContact CB-CZ 3.93Å; V38-F73 HydrophobicContact CG1-CD2 4.46Å; V38-F73 HydrophobicContact CG1-CE2 3.57Å; V38-F73 HydrophobicContact CG1-CZ 3.7Å; V38-F73 HydrophobicContact CG2-CZ 3.99Å; A69-F73 WeakPolarHBondContact O-CB 3.39Å; A69-F73 PolarHBondContact O-N 2.89Å; F73-N75 VanDerWaalsContact C-N 3.28Å; F73-F125 HydrophobicContact CD2-CE1 4.16Å; F73-F125 HydrophobicContact CD2-CZ 4.14Å; F73-F125 AromaticContact CE2-CE1 3.95Å; F73-F125 HydrophobicContact CE2-CE1 3.95Å; F73-F125 HydrophobicContact CE2-CZ 4.22Å; F73-A136 HydrophobicContact CD2-CB 4.02Å; F73-A136 HydrophobicContact CE2-CB 4.02Å; F73-G139 VanDerWaalsContact CE1-CA 3.43Å; F73-G139 WeakPolarHBondContact CE1-O 3.49Å; F73-G139 PolarHBondContact O-N 2.88Å; F73-L141 HydrophobicContact CE2-CD2 3.64Å; F73-L141 HydrophobicContact CZ-CD2 3.7Å; F73-L141 HydrophobicContact CZ-CG 4.17Å
74	D	74.1	Confident	84.1	Confident	25 Å²	25	39 Å²	39	13%	0.134	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.1	175.8	-65.8	-40.8	0	0	0	113	A35 Y72 A138 R264	A35-D74 WeakPolarHBondContact CB-OD1 3.4Å; Y72-D74 VanDerWaalsContact C-N 3.35Å; Y72-D74 PolarHBondContact O-N 3.21Å; D74-A138 WeakPolarHBondContact O-CA 3.4Å; D74-R264 WeakPolarHBondContact OD2-CG 3.46Å; D74-R264 IonicContact OD2-CZ 3.47Å; D74-R264 IonicContact OD2-NE 2.76Å; D74-R264 PolarHBondContact OD2-NE 2.92Å; D74-R264 IonicContact OD2-NH2 2.74Å; D74-R264 PolarHBondContact OD2-NH2 2.9Å
75	N	82	Confident	84	Confident	65 Å²	65	33.6 Å²	33.6	35%	0.348	18%	0.179	S	C	.	.	S	Bend	trans	-93.6	-103	176.6	-67.6	-31.9	0	0	0	108.4	Y72 F73 V137 A138	Y72-N75 CarbonylContact O-C 3.59Å; Y72-N75 PolarHBondContact O-N 2.84Å; F73-N75 VanDerWaalsContact C-N 3.28Å; N75-V137 WeakPolarHBondContact O-CA 3.42Å; N75-A138 PolarHBondContact O-N 3.47Å
76	H	87.4	Confident	84	Confident	13 Å²	13	42.4 Å²	42.4	6%	0.06	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	121.4	175.9	60.6	175	0	0	0	111.2	Y72 G109 R110 P111 A112 Y135 A136 V137 Y205	Y72-H76 PolarHBondContact O-N 2.77Å; Y72-H76 VanDerWaalsContact O-N 3.13Å; H76-G109 PolarHBondContact CE1-O 3.45Å; H76-R110 VanDerWaalsContact NE2-C 3.32Å; H76-R110 PolarHBondContact NE2-O 2.87Å; H76-R110 VanDerWaalsContact NE2-O 3.13Å; H76-P111 HydrophobicContact CB-CB 4.47Å; H76-P111 WeakPolarHBondContact NE2-CA 3.3Å; H76-A112 PolarHBondContact O-N 3.23Å; H76-A112 VanDerWaalsContact O-N 3.1Å; H76-Y135 HydrophobicContact CB-CE2 3.87Å; H76-A136 CarbonylContact C-O 3.6Å; H76-A136 VanDerWaalsContact CA-O 3.25Å; H76-A136 WeakPolarHBondContact CA-O 3.25Å; H76-V137 HydrophobicContact CB-CG2 4.34Å; H76-Y205 HydrophobicContact CB-CD1 4.5Å; H76-Y205 HydrophobicContact CB-CE1 4.38Å; H76-Y205 AromaticContact CE1-CE1 3.8Å; H76-Y205 AromaticContact CE1-CZ 3.37Å; H76-Y205 PolarHBondContact CE1-OH 3.09Å; H76-Y205 AromaticContact CG-CE1 3.97Å; H76-Y205 AromaticContact CG-CZ 3.77Å; H76-Y205 AromaticContact ND1-CE1 3.31Å; H76-Y205 VanDerWaalsContact ND1-CE1 3.31Å; H76-Y205 WeakPolarHBondContact ND1-CE1 3.18Å; H76-Y205 AromaticContact ND1-CZ 3.29Å; H76-Y205 VanDerWaalsContact ND1-CZ 3.29Å; H76-Y205 PolarHBondContact ND1-OH 3.16Å; H76-Y205 AromaticContact NE2-CZ 3.88Å; H76-Y205 PolarHBondContact NE2-OH 3.35Å
77	L	92	Very high	84.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	125.5	-173.7	168.3	65.7	0	0	0	109.3	A69 V79 A112 I114 F125 Y135 A136	A69-L77 HydrophobicContact CB-CD2 4.26Å; L77-V79 HydrophobicContact CD1-CG2 4.17Å; L77-V79 HydrophobicContact CD2-CG2 3.9Å; L77-V79 HydrophobicContact CG-CG2 3.74Å; L77-A112 WeakPolarHBondContact CA-O 3.4Å; L77-A112 HydrophobicContact CD1-CB 3.73Å; L77-I114 HydrophobicContact CD1-CD1 3.7Å; L77-I114 HydrophobicContact CD1-CG1 3.88Å; L77-I114 HydrophobicContact CD2-CD1 4.39Å; L77-F125 HydrophobicContact CD2-CE1 4.18Å; L77-F125 HydrophobicContact CD2-CZ 3.89Å; L77-Y135 CarbonylContact O-C 3.49Å; L77-A136 HydrophobicContact CB-CB 4.3Å; L77-A136 PolarHBondContact N-O 3.07Å; L77-A136 PolarHBondContact O-N 3Å
78	I	94.7	Very high	84.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.2	172.1	-60.1	162.5	0	0	0	107.8	I102 P111 A112 Y113 I114 L133 Y135 M157	I78-I102 HydrophobicContact CD1-CD1 3.72Å; I78-I102 HydrophobicContact CD1-CG1 4.35Å; I78-P111 HydrophobicContact CD1-CB 3.74Å; I78-P111 HydrophobicContact CD1-CG 3.48Å; I78-P111 VanDerWaalsContact CD1-CG 3.48Å; I78-P111 HydrophobicContact CG1-CB 4.07Å; I78-P111 HydrophobicContact CG1-CG 4.35Å; I78-A112 PolarHBondContact N-O 3.41Å; I78-Y113 HydrophobicContact CB-CD2 3.99Å; I78-Y113 HydrophobicContact CG2-CD2 3.78Å; I78-Y113 HydrophobicContact CG2-CE2 4.09Å; I78-Y113 WeakPolarHBondContact O-CA 3.3Å; I78-I114 PolarHBondContact O-N 3.32Å; I78-L133 HydrophobicContact CG2-CD1 3.6Å; I78-Y135 HydrophobicContact CG1-CD2 3.52Å; I78-Y135 HydrophobicContact CG1-CE2 4.01Å; I78-Y135 HydrophobicContact CG1-CG 4.48Å; I78-M157 HydrophobicContact CD1-CE 3.34Å; I78-M157 HydrophobicContact CD1-SD 4.36Å; I78-M157 HydrophobicContact CG1-CE 4.11Å
79	V	94.8	Very high	85	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.8	176	-167.5	0	0	0	0	109.5	L77 F81 I114 T116 F121 F125 T134	L77-V79 HydrophobicContact CD1-CG2 4.17Å; L77-V79 HydrophobicContact CD2-CG2 3.9Å; L77-V79 HydrophobicContact CG-CG2 3.74Å; V79-F81 HydrophobicContact CB-CD2 4.33Å; V79-F81 HydrophobicContact CB-CE2 3.69Å; V79-F81 HydrophobicContact CB-CZ 4.03Å; V79-F81 HydrophobicContact CG1-CD1 4.31Å; V79-F81 HydrophobicContact CG1-CD2 3.91Å; V79-F81 HydrophobicContact CG1-CE1 3.84Å; V79-F81 HydrophobicContact CG1-CE2 3.4Å; V79-F81 HydrophobicContact CG1-CG 4.34Å; V79-F81 HydrophobicContact CG1-CZ 3.36Å; V79-I114 CarbonylContact C-O 3.37Å; V79-I114 WeakPolarHBondContact CA-O 3.42Å; V79-I114 HydrophobicContact CG1-CB 4.34Å; V79-I114 HydrophobicContact CG1-CG2 4.25Å; V79-I114 HydrophobicContact CG2-CB 4.5Å; V79-T116 HydrophobicContact CG1-CG2 3.88Å; V79-F121 HydrophobicContact CG1-CE1 3.98Å; V79-F125 HydrophobicContact CG2-CD1 4.26Å; V79-F125 HydrophobicContact CG2-CE1 3.72Å; V79-F125 HydrophobicContact CG2-CZ 3.97Å; V79-T134 PolarHBondContact N-O 2.89Å; V79-T134 PolarHBondContact O-N 2.75Å
80	L	96	Very high	85.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	107.5	170.2	180	66.1	0	0	0	109.2	C82 V94 D95 Y113 I114 K115 T116 L133 W148	L80-C82 VanDerWaalsContact CD1-SG 3.52Å; L80-C82 HydrophobicContact CG-CB 4.33Å; L80-C82 WeakPolarHBondContact CG-SG 3.11Å; L80-C82 PolarHBondContact O-N 3.22Å; L80-V94 HydrophobicContact CD1-CG1 4.28Å; L80-V94 HydrophobicContact CD2-CG1 4.47Å; L80-D95 HydrophobicContact CD2-CB 3.79Å; L80-Y113 HydrophobicContact CB-CE2 3.88Å; L80-Y113 WeakPolarHBondContact CD2-OH 3.19Å; L80-I114 PolarHBondContact N-O 2.97Å; L80-K115 HydrophobicContact CD2-CD 4.49Å; L80-K115 HydrophobicContact CD2-CG 4.44Å; L80-K115 VanDerWaalsContact O-CA 3.32Å; L80-K115 WeakPolarHBondContact O-CA 3.21Å; L80-T116 PolarHBondContact O-N 3.45Å; L80-L133 HydrophobicContact CB-CD1 4.22Å; L80-L133 HydrophobicContact CD1-CB 4.35Å; L80-L133 HydrophobicContact CD1-CD1 4.17Å; L80-W148 HydrophobicContact CD1-CH2 3.88Å; L80-W148 HydrophobicContact CD1-CZ3 3.94Å
81	F	94.6	Very high	86.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	105.9	173.3	-63.1	-85.9	0	0	0	109.8	V79 T116 F121 F125 V127 F130 P131 A132	V79-F81 HydrophobicContact CB-CD2 4.33Å; V79-F81 HydrophobicContact CB-CE2 3.69Å; V79-F81 HydrophobicContact CB-CZ 4.03Å; V79-F81 HydrophobicContact CG1-CD1 4.31Å; V79-F81 HydrophobicContact CG1-CD2 3.91Å; V79-F81 HydrophobicContact CG1-CE1 3.84Å; V79-F81 HydrophobicContact CG1-CE2 3.4Å; V79-F81 HydrophobicContact CG1-CG 4.34Å; V79-F81 HydrophobicContact CG1-CZ 3.36Å; F81-T116 CarbonylContact C-O 3.55Å; F81-T116 VanDerWaalsContact CA-O 3.3Å; F81-T116 WeakPolarHBondContact CA-O 3.26Å; F81-T116 HydrophobicContact CD1-CG2 3.53Å; F81-T116 HydrophobicContact CE1-CG2 3.65Å; F81-T116 HydrophobicContact CG-CG2 4.34Å; F81-F121 AromaticContact CE1-CD1 3.81Å; F81-F121 HydrophobicContact CE1-CD1 3.81Å; F81-F121 HydrophobicContact CE1-CE1 4.36Å; F81-F121 HydrophobicContact CZ-CD1 4.22Å; F81-F121 HydrophobicContact CZ-CE1 4.39Å; F81-F125 HydrophobicContact CE2-CB 4.08Å; F81-F125 HydrophobicContact CE2-CG 4.37Å; F81-F125 HydrophobicContact CZ-CB 3.75Å; F81-F125 HydrophobicContact CZ-CD2 4.11Å; F81-F125 AromaticContact CZ-CG 3.88Å; F81-F125 HydrophobicContact CZ-CG 3.88Å; F81-V127 HydrophobicContact CB-CG1 4.26Å; F81-V127 HydrophobicContact CD1-CG1 4.48Å; F81-V127 HydrophobicContact CD2-CB 4.28Å; F81-V127 HydrophobicContact CD2-CG1 4.07Å; F81-V127 HydrophobicContact CD2-CG2 3.83Å; F81-V127 HydrophobicContact CE2-CB 4.28Å; F81-V127 HydrophobicContact CE2-CG2 3.67Å; F81-V127 HydrophobicContact CG-CG1 4.02Å; F81-V127 HydrophobicContact CZ-CG2 4.29Å; F81-F130 HydrophobicContact CB-CD1 3.63Å; F81-F130 HydrophobicContact CB-CE1 3.54Å; F81-F130 HydrophobicContact CB-CG 4.3Å; F81-F130 HydrophobicContact CB-CZ 4.08Å; F81-F130 AromaticContact CD1-CE1 3.88Å; F81-F130 HydrophobicContact CD1-CE1 3.88Å; F81-F130 HydrophobicContact CD1-CZ 4.05Å; F81-F130 HydrophobicContact CG-CE1 4.02Å; F81-P131 VanDerWaalsContact O-CA 3.31Å; F81-P131 WeakPolarHBondContact O-CA 3.39Å; F81-A132 WeakPolarHBondContact CA-O 3.48Å; F81-A132 HydrophobicContact CB-CB 4.07Å; F81-A132 HydrophobicContact CD2-CB 4.25Å; F81-A132 PolarHBondContact N-O 2.8Å; F81-A132 PolarHBondContact O-N 2.71Å
82	C	92.2	Very high	87.1	Confident	4 Å²	4	48.4 Å²	48.4	3%	0.027	24%	0.24	C	C	.	.			trans	-137.9	119.8	-175.5	-83.4	0	0	0	0	109.8	L80 C91 T116 D117	L80-C82 VanDerWaalsContact CD1-SG 3.52Å; L80-C82 HydrophobicContact CG-CB 4.33Å; L80-C82 WeakPolarHBondContact CG-SG 3.11Å; L80-C82 PolarHBondContact O-N 3.22Å; C82-C91 HydrophobicContact CB-CB 3.61Å; C82-C91 WeakPolarHBondContact CB-SG 3.37Å; C82-C91 WeakPolarHBondContact SG-CB 3.42Å; C82-C91 CovalentContact SG-SG 2.02Å; C82-C91 PolarHBondContact SG-SG 3.12Å; C82-T116 PolarHBondContact N-O 3.04Å; C82-D117 WeakPolarHBondContact O-CB 3.23Å
83	G	83.8	Confident	87.6	Confident	19 Å²	19	50.1 Å²	50.1	20%	0.196	25%	0.249	C	C	.	.			trans	-71.9	-155.4	170.5	0	0	0	0	0	112.4	T85	G83-T85 PolarHBondContact O-N 2.86Å
84	S	82.3	Confident	88.5	Confident	70 Å²	70	50 Å²	50	49%	0.49	25%	0.249	S	C	.	.			trans	-52.9	132.3	179.2	-176.6	0	0	0	0	112.5	K86 R87 Y88	S84-K86 PolarHBondContact O-N 3.31Å; S84-K86 VanDerWaalsContact O-N 3.15Å; S84-K86 PolarHBondContact OG-N 3.41Å; S84-R87 WeakPolarHBondContact O-CA 2.95Å; S84-R87 WeakPolarHBondContact O-CB 3.45Å; S84-R87 PolarHBondContact O-N 3.36Å; S84-Y88 PolarHBondContact O-N 2.88Å
85	T	78.4	Confident	89.5	Confident	73 Å²	73	49.5 Å²	49.5	45%	0.448	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-23.6	175.4	51.4	0	0	0	0	113.1	G83 R87 Y88	G83-T85 PolarHBondContact O-N 2.86Å; T85-R87 VanDerWaalsContact C-N 3.34Å; T85-Y88 CarbonylContact O-C 3.43Å
86	K	82	Confident	90.1	Very high	195 Å²	195	51.4 Å²	51.4	85%	0.848	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-35.6	172	-65.2	-174.1	178.2	-176.5	0	112.1	S84	S84-K86 PolarHBondContact O-N 3.31Å; S84-K86 VanDerWaalsContact O-N 3.15Å; S84-K86 PolarHBondContact OG-N 3.41Å
87	R	82.9	Confident	90.5	Very high	182 Å²	182	51.9 Å²	51.9	69%	0.687	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-34.8	179.7	-171.2	179.7	-73.7	-179.9	-2.9	111.4	S84 T85	S84-R87 WeakPolarHBondContact O-CA 2.95Å; S84-R87 WeakPolarHBondContact O-CB 3.45Å; S84-R87 PolarHBondContact O-N 3.36Å; T85-R87 VanDerWaalsContact C-N 3.34Å
88	Y	87.3	Confident	90.7	Very high	56 Å²	56	51.9 Å²	51.9	22%	0.22	26%	0.255	C	S	.	.			trans	-130	79.2	-176.8	-52.7	-68.9	0	0	0	110.9	S84 T85 V90 C91 F130 P131	S84-Y88 PolarHBondContact O-N 2.88Å; T85-Y88 CarbonylContact O-C 3.43Å; Y88-V90 PolarHBondContact O-N 3.39Å; Y88-C91 VanDerWaalsContact O-CB 3.26Å; Y88-C91 WeakPolarHBondContact O-CB 3.18Å; Y88-C91 PolarHBondContact O-N 3.21Å; Y88-C91 VanDerWaalsContact O-N 3.13Å; Y88-F130 WeakPolarHBondContact CE1-O 3.12Å; Y88-F130 HydrophobicContact CE2-CB 4.2Å; Y88-F130 PolarHBondContact OH-O 3.26Å; Y88-P131 HydrophobicContact CD1-CG 4.21Å
89	P	89.6	Confident	90.7	Very high	89 Å²	89	57.9 Å²	57.9	58%	0.578	28%	0.278	S	S	*	.	H	α-helix	trans	-62.6	-31	179.3	23.9	-33.2	0	0	0	112.3	C91 K92	P89-C91 PolarHBondContact O-N 3.28Å; P89-K92 WeakPolarHBondContact O-CB 3.4Å; P89-K92 PolarHBondContact O-N 2.83Å; P89-K92 VanDerWaalsContact O-N 3.1Å
90	V	91.1	Very high	90.7	Very high	36 Å²	36	64.1 Å²	64.1	22%	0.218	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-32.5	175.5	70.3	0	0	0	0	112.7	Y88 K92 K93 V94 W148	Y88-V90 PolarHBondContact O-N 3.39Å; V90-K92 VanDerWaalsContact C-N 3.26Å; V90-K92 PolarHBondContact O-N 3.47Å; V90-K93 PolarHBondContact O-N 3.17Å; V90-V94 HydrophobicContact CG2-CG2 4.15Å; V90-V94 WeakPolarHBondContact O-CG2 3.29Å; V90-V94 PolarHBondContact O-N 2.83Å; V90-W148 HydrophobicContact CG1-CB 4.24Å; V90-W148 HydrophobicContact CG1-CE3 4.37Å; V90-W148 HydrophobicContact CG2-CB 4.15Å
91	C	93	Very high	90.6	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.007	32%	0.319	C	S	.	.	H	α-helix	trans	-60.2	-34.8	176.7	-82.3	0	0	0	0	113	C82 Y88 P89 D95 P131	C82-C91 HydrophobicContact CB-CB 3.61Å; C82-C91 WeakPolarHBondContact CB-SG 3.37Å; C82-C91 WeakPolarHBondContact SG-CB 3.42Å; C82-C91 CovalentContact SG-SG 2.02Å; C82-C91 PolarHBondContact SG-SG 3.12Å; Y88-C91 VanDerWaalsContact O-CB 3.26Å; Y88-C91 WeakPolarHBondContact O-CB 3.18Å; Y88-C91 PolarHBondContact O-N 3.21Å; Y88-C91 VanDerWaalsContact O-N 3.13Å; P89-C91 PolarHBondContact O-N 3.28Å; C91-D95 WeakPolarHBondContact O-CB 3.24Å; C91-D95 PolarHBondContact O-N 3.31Å; C91-P131 VanDerWaalsContact SG-CB 3.57Å
92	K	92.4	Very high	90.5	Very high	113 Å²	113	67.9 Å²	67.9	49%	0.491	32%	0.322	S	S	.	.	H	α-helix	trans	-66.6	-47.7	179.8	-177.7	-178.6	171.4	-174.7	0	110.3	P89 V90 D95 E96	P89-K92 WeakPolarHBondContact O-CB 3.4Å; P89-K92 PolarHBondContact O-N 2.83Å; P89-K92 VanDerWaalsContact O-N 3.1Å; V90-K92 VanDerWaalsContact C-N 3.26Å; V90-K92 PolarHBondContact O-N 3.47Å; K92-D95 PolarHBondContact O-N 3.07Å; K92-E96 WeakPolarHBondContact CE-OE1 3.18Å; K92-E96 IonicContact NZ-OE1 3.96Å; K92-E96 WeakPolarHBondContact O-CG 3.46Å; K92-E96 PolarHBondContact O-N 3.05Å
93	K	93.3	Very high	90.5	Very high	110 Å²	110	70.8 Å²	70.8	48%	0.478	34%	0.343	S	S	.	.	H	α-helix	trans	-60.4	-49.3	177.6	-74.2	165	147.3	-100.6	0	112	V90 D95 E96 M97 E150	V90-K93 PolarHBondContact O-N 3.17Å; K93-D95 VanDerWaalsContact C-N 3.35Å; K93-D95 PolarHBondContact O-N 2.99Å; K93-E96 PolarHBondContact O-N 3.13Å; K93-M97 WeakPolarHBondContact O-CB 2.99Å; K93-M97 PolarHBondContact O-N 3.45Å; K93-E150 HydrophobicContact CB-CG 3.82Å; K93-E150 VanDerWaalsContact CB-OE1 3.31Å; K93-E150 WeakPolarHBondContact CB-OE1 3.36Å; K93-E150 WeakPolarHBondContact CD-OE1 3.23Å; K93-E150 WeakPolarHBondContact CG-OE1 3.3Å; K93-E150 IonicContact NZ-OE1 2.75Å; K93-E150 PolarHBondContact NZ-OE1 2.87Å
94	V	95.3	Very high	90.9	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-40.2	177.7	171.6	0	0	0	0	111.6	L80 V90 M97 L98 W148 V153	L80-V94 HydrophobicContact CD1-CG1 4.28Å; L80-V94 HydrophobicContact CD2-CG1 4.47Å; V90-V94 HydrophobicContact CG2-CG2 4.15Å; V90-V94 WeakPolarHBondContact O-CG2 3.29Å; V90-V94 PolarHBondContact O-N 2.83Å; V94-M97 HydrophobicContact CB-CE 4.45Å; V94-M97 HydrophobicContact CG1-CE 4.14Å; V94-M97 PolarHBondContact O-N 3.28Å; V94-L98 HydrophobicContact CG1-CD1 3.75Å; V94-L98 HydrophobicContact CG1-CG 4.16Å; V94-L98 WeakPolarHBondContact O-CB 2.87Å; V94-L98 VanDerWaalsContact O-CG 3.24Å; V94-L98 WeakPolarHBondContact O-CG 3.26Å; V94-L98 PolarHBondContact O-N 2.97Å; V94-W148 HydrophobicContact CG1-CZ3 4.32Å; V94-W148 HydrophobicContact CG2-CE3 4.33Å; V94-W148 HydrophobicContact CG2-CZ3 4.47Å; V94-V153 HydrophobicContact CG1-CG1 4.02Å; V94-V153 HydrophobicContact CG1-CG2 4.37Å; V94-V153 HydrophobicContact CG2-CG2 4.21Å
95	D	95	Very high	91.3	Very high	13 Å²	13	74.9 Å²	74.9	7%	0.07	35%	0.354	C	S	.	.	H	α-helix	trans	-63.3	-43.8	176.6	179.3	42.2	0	0	0	112.6	L80 C91 K92 K93 R99 Y113 K115	L80-D95 HydrophobicContact CD2-CB 3.79Å; C91-D95 WeakPolarHBondContact O-CB 3.24Å; C91-D95 PolarHBondContact O-N 3.31Å; K92-D95 PolarHBondContact O-N 3.07Å; K93-D95 VanDerWaalsContact C-N 3.35Å; K93-D95 PolarHBondContact O-N 2.99Å; D95-R99 WeakPolarHBondContact O-CB 3.22Å; D95-R99 VanDerWaalsContact O-CG 3.23Å; D95-R99 WeakPolarHBondContact O-CG 3.33Å; D95-R99 PolarHBondContact O-N 3.39Å; D95-R99 IonicContact OD1-CZ 3.34Å; D95-R99 IonicContact OD1-NE 2.84Å; D95-R99 PolarHBondContact OD1-NE 3.34Å; D95-R99 IonicContact OD1-NH2 3.02Å; D95-R99 PolarHBondContact OD1-NH2 2.91Å; D95-R99 IonicContact OD2-NE 3.52Å; D95-R99 IonicContact OD2-NH2 3.75Å; D95-Y113 VanDerWaalsContact OD1-CE1 3.3Å; D95-Y113 WeakPolarHBondContact OD1-CE1 3.27Å; D95-Y113 PolarHBondContact OD1-OH 3.21Å; D95-K115 HydrophobicContact CB-CD 4.18Å; D95-K115 VanDerWaalsContact CG-CD 3.47Å; D95-K115 WeakPolarHBondContact OD2-CD 3.47Å; D95-K115 IonicContact OD2-NZ 2.75Å; D95-K115 PolarHBondContact OD2-NZ 3.19Å
96	E	94.6	Very high	91.7	Very high	105 Å²	105	74.7 Å²	74.7	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-63	-47.5	176.8	-74	168.1	-176.2	0	0	111.1	K92 K93 R99 Q100	K92-E96 WeakPolarHBondContact CE-OE1 3.18Å; K92-E96 IonicContact NZ-OE1 3.96Å; K92-E96 WeakPolarHBondContact O-CG 3.46Å; K92-E96 PolarHBondContact O-N 3.05Å; K93-E96 PolarHBondContact O-N 3.13Å; E96-R99 PolarHBondContact O-N 3.29Å; E96-Q100 PolarHBondContact O-N 3.4Å; E96-Q100 VanDerWaalsContact O-N 3.08Å
97	M	95.3	Very high	91.8	Very high	24 Å²	24	69.9 Å²	69.9	12%	0.118	35%	0.347	C	S	.	.	H	α-helix	trans	-61.5	-46.3	177	172.5	-86.7	-61.2	0	0	112.3	K93 V94 R99 Q100 R101 V153 D154	K93-M97 WeakPolarHBondContact O-CB 2.99Å; K93-M97 PolarHBondContact O-N 3.45Å; V94-M97 HydrophobicContact CB-CE 4.45Å; V94-M97 HydrophobicContact CG1-CE 4.14Å; V94-M97 PolarHBondContact O-N 3.28Å; M97-R99 PolarHBondContact O-N 3.39Å; M97-Q100 PolarHBondContact O-N 3.44Å; M97-R101 WeakPolarHBondContact O-CB 3.31Å; M97-R101 PolarHBondContact O-N 3.49Å; M97-V153 HydrophobicContact CE-CB 3.94Å; M97-V153 HydrophobicContact CE-CG1 3.77Å; M97-D154 HydrophobicContact SD-CB 4.14Å
98	L	96	Very high	91.6	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.8	-42.4	177.7	-75.4	173.7	0	0	0	111.7	V94 Q100 R101 I102 Y113 L133 V153 M157	V94-L98 HydrophobicContact CG1-CD1 3.75Å; V94-L98 HydrophobicContact CG1-CG 4.16Å; V94-L98 WeakPolarHBondContact O-CB 2.87Å; V94-L98 VanDerWaalsContact O-CG 3.24Å; V94-L98 WeakPolarHBondContact O-CG 3.26Å; V94-L98 PolarHBondContact O-N 2.97Å; L98-Q100 PolarHBondContact O-N 2.89Å; L98-R101 PolarHBondContact O-N 3.44Å; L98-I102 VanDerWaalsContact O-CB 3.28Å; L98-I102 WeakPolarHBondContact O-CB 3.44Å; L98-I102 WeakPolarHBondContact O-CD1 3.42Å; L98-I102 WeakPolarHBondContact O-CG1 3.3Å; L98-I102 PolarHBondContact O-N 3.27Å; L98-Y113 HydrophobicContact CB-CE2 4.18Å; L98-Y113 HydrophobicContact CD1-CE2 3.76Å; L98-L133 HydrophobicContact CD1-CD1 3.93Å; L98-V153 HydrophobicContact CD2-CG1 4.43Å; L98-M157 HydrophobicContact CD2-CG 3.68Å; L98-M157 HydrophobicContact CD2-SD 4.09Å
99	R	95.5	Very high	91.3	Very high	126 Å²	126	66.5 Å²	66.5	48%	0.475	34%	0.343	S	S	.	.	H	α-helix	trans	-61	-45.8	177.5	-74.9	172.9	-169.1	-74.6	-10.6	112	D95 E96 M97 I102 S103 Y113	D95-R99 WeakPolarHBondContact O-CB 3.22Å; D95-R99 VanDerWaalsContact O-CG 3.23Å; D95-R99 WeakPolarHBondContact O-CG 3.33Å; D95-R99 PolarHBondContact O-N 3.39Å; D95-R99 IonicContact OD1-CZ 3.34Å; D95-R99 IonicContact OD1-NE 2.84Å; D95-R99 PolarHBondContact OD1-NE 3.34Å; D95-R99 IonicContact OD1-NH2 3.02Å; D95-R99 PolarHBondContact OD1-NH2 2.91Å; D95-R99 IonicContact OD2-NE 3.52Å; D95-R99 IonicContact OD2-NH2 3.75Å; E96-R99 PolarHBondContact O-N 3.29Å; M97-R99 PolarHBondContact O-N 3.39Å; R99-I102 PolarHBondContact O-N 3.1Å; R99-S103 WeakPolarHBondContact O-CB 3.1Å; R99-S103 PolarHBondContact O-N 3.11Å; R99-S103 PolarHBondContact O-OG 3.35Å; R99-Y113 HydrophobicContact CG-CD1 4.18Å; R99-Y113 HydrophobicContact CG-CE1 3.82Å
100	Q	95	Very high	91.3	Very high	130 Å²	130	67.4 Å²	67.4	61%	0.607	34%	0.335	S	S	*	.	H	α-helix	trans	-63.9	-44.2	178.1	-175.3	-179.3	4.9	0	0	111.5	E96 M97 L98 S103 N104	E96-Q100 PolarHBondContact O-N 3.4Å; E96-Q100 VanDerWaalsContact O-N 3.08Å; M97-Q100 PolarHBondContact O-N 3.44Å; L98-Q100 PolarHBondContact O-N 2.89Å; Q100-S103 WeakPolarHBondContact CA-OG 3.43Å; Q100-S103 PolarHBondContact O-N 3.49Å; Q100-S103 PolarHBondContact O-OG 3.08Å; Q100-N104 VanDerWaalsContact O-CG 3.29Å; Q100-N104 PolarHBondContact O-N 3.16Å; Q100-N104 PolarHBondContact O-ND2 3.31Å; Q100-N104 PolarHBondContact O-OD1 3.3Å
101	R	92.8	Very high	91.3	Very high	68 Å²	68	65.8 Å²	65.8	26%	0.257	33%	0.325	S	S	.	.	H	α-helix	trans	-62	-47.5	178.1	-174.2	172.5	-176.9	109.1	6.3	111.3	M97 L98 S103 N104 D154 S158	M97-R101 WeakPolarHBondContact O-CB 3.31Å; M97-R101 PolarHBondContact O-N 3.49Å; L98-R101 PolarHBondContact O-N 3.44Å; R101-S103 PolarHBondContact O-N 3Å; R101-N104 PolarHBondContact O-N 3.44Å; R101-D154 IonicContact CZ-OD1 3.76Å; R101-D154 IonicContact NE-OD1 3.79Å; R101-D154 IonicContact NH1-OD1 3.5Å; R101-D154 PolarHBondContact NH1-OD1 3.18Å; R101-D154 IonicContact NH1-OD2 3.58Å; R101-D154 PolarHBondContact NH1-OD2 3.38Å; R101-D154 VanDerWaalsContact NH1-OD2 3.13Å; R101-S158 VanDerWaalsContact CZ-OG 3.26Å; R101-S158 PolarHBondContact NH1-OG 2.8Å; R101-S158 VanDerWaalsContact NH1-OG 3.07Å; R101-S158 VanDerWaalsContact NH2-CA 3.29Å; R101-S158 PolarHBondContact NH2-OG 2.92Å
102	I	93.1	Very high	91.2	Very high	11 Å²	11	66.7 Å²	66.7	6%	0.056	33%	0.333	C	S	.	.	H	α-helix	trans	-68	-34.9	-178	-67.2	171.9	0	0	0	111.4	I78 L98 R99 N104 I105 R110 P111 Y113	I78-I102 HydrophobicContact CD1-CD1 3.72Å; I78-I102 HydrophobicContact CD1-CG1 4.35Å; L98-I102 VanDerWaalsContact O-CB 3.28Å; L98-I102 WeakPolarHBondContact O-CB 3.44Å; L98-I102 WeakPolarHBondContact O-CD1 3.42Å; L98-I102 WeakPolarHBondContact O-CG1 3.3Å; L98-I102 PolarHBondContact O-N 3.27Å; R99-I102 PolarHBondContact O-N 3.1Å; I102-N104 PolarHBondContact O-N 3.06Å; I102-I105 PolarHBondContact O-N 3.27Å; I102-R110 HydrophobicContact CG2-CG 3.47Å; I102-R110 VanDerWaalsContact CG2-CG 3.47Å; I102-R110 PolarHBondContact O-NE 3.41Å; I102-R110 VanDerWaalsContact O-NE 3.11Å; I102-P111 HydrophobicContact CD1-CG 4.35Å; I102-P111 HydrophobicContact CG1-CG 4.17Å; I102-P111 HydrophobicContact CG2-CG 4.43Å; I102-Y113 HydrophobicContact CD1-CD2 3.98Å; I102-Y113 HydrophobicContact CD1-CG 3.81Å
103	S	92.6	Very high	91.3	Very high	66 Å²	66	63.4 Å²	63.4	46%	0.462	32%	0.318	S	S	.	.	H	α-helix	trans	-64	-29.3	175.4	58.1	0	0	0	0	113.2	R99 Q100 R101 I105 R110	R99-S103 WeakPolarHBondContact O-CB 3.1Å; R99-S103 PolarHBondContact O-N 3.11Å; R99-S103 PolarHBondContact O-OG 3.35Å; Q100-S103 WeakPolarHBondContact CA-OG 3.43Å; Q100-S103 PolarHBondContact O-N 3.49Å; Q100-S103 PolarHBondContact O-OG 3.08Å; R101-S103 PolarHBondContact O-N 3Å; S103-I105 VanDerWaalsContact C-N 3.27Å; S103-I105 PolarHBondContact O-N 2.89Å; S103-R110 PolarHBondContact O-NH2 3.26Å
104	N	92.5	Very high	91.2	Very high	130 Å²	130	58.6 Å²	58.6	70%	0.695	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-12.8	178.7	-65.7	-9.9	0	0	0	113.2	Q100 R101 I102	Q100-N104 VanDerWaalsContact O-CG 3.29Å; Q100-N104 PolarHBondContact O-N 3.16Å; Q100-N104 PolarHBondContact O-ND2 3.31Å; Q100-N104 PolarHBondContact O-OD1 3.3Å; R101-N104 PolarHBondContact O-N 3.44Å; I102-N104 PolarHBondContact O-N 3.06Å
105	I	89.9	Confident	91.1	Very high	44 Å²	44	62.1 Å²	62.1	23%	0.226	31%	0.312	C	S	.	.	S	Bend	trans	-83	137.4	178.2	-56.8	170.7	0	0	0	109.6	I102 S103 G109 R110 L161	I102-I105 PolarHBondContact O-N 3.27Å; S103-I105 VanDerWaalsContact C-N 3.27Å; S103-I105 PolarHBondContact O-N 2.89Å; I105-G109 VanDerWaalsContact CG2-O 3.28Å; I105-G109 WeakPolarHBondContact CG2-O 3.42Å; I105-R110 HydrophobicContact CG2-CB 4.45Å; I105-R110 PolarHBondContact O-NE 3.4Å; I105-R110 VanDerWaalsContact O-NE 3.16Å; I105-R110 PolarHBondContact O-NH2 3.48Å; I105-L161 HydrophobicContact CD1-CD1 3.89Å
106	S	87.8	Confident	91	Very high	69 Å²	69	61.7 Å²	61.7	48%	0.483	31%	0.31	S	S	.	.			trans	-54.5	143.1	174.1	171.9	0	0	0	0	111.8	E108 G109 R110	S106-E108 PolarHBondContact O-N 3.08Å; S106-E108 VanDerWaalsContact O-N 3.16Å; S106-G109 CarbonylContact O-C 3.55Å; S106-G109 PolarHBondContact O-N 3.4Å; S106-R110 PolarHBondContact O-N 3.43Å; S106-R110 VanDerWaalsContact O-N 3.08Å
107	S	83.2	Confident	90.7	Very high	95 Å²	95	61.1 Å²	61.1	66%	0.664	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-51.3	-40.4	-175.1	48.9	0	0	0	0	113.6	G109 R110	S107-G109 PolarHBondContact O-N 3.04Å; S107-R110 PolarHBondContact O-N 2.77Å
108	E	78	Confident	90.3	Very high	157 Å²	157	60.4 Å²	60.4	73%	0.734	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-65.3	-21.2	-178.8	-67.8	176.2	176.6	0	0	113.8	S106 K201	S106-E108 PolarHBondContact O-N 3.08Å; S106-E108 VanDerWaalsContact O-N 3.16Å; E108-K201 VanDerWaalsContact C-NZ 3.31Å; E108-K201 WeakPolarHBondContact O-CD 3.33Å
109	G	82.2	Confident	89.8	Confident	9 Å²	9	66 Å²	66	9%	0.093	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-127.7	17.7	-176.2	0	0	0	0	0	113.4	H76 I105 S106 S107 P111	H76-G109 PolarHBondContact CE1-O 3.45Å; I105-G109 VanDerWaalsContact CG2-O 3.28Å; I105-G109 WeakPolarHBondContact CG2-O 3.42Å; S106-G109 CarbonylContact O-C 3.55Å; S106-G109 PolarHBondContact O-N 3.4Å; S107-G109 PolarHBondContact O-N 3.04Å; G109-P111 WeakPolarHBondContact O-CD 3.3Å
110	R	88.2	Confident	89.1	Confident	108 Å²	108	61.1 Å²	61.1	41%	0.408	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-82.8	118	-179.1	-176.7	179.9	-67	164.4	0.8	109.3	H76 I102 S103 I105 S106 S107	H76-R110 VanDerWaalsContact NE2-C 3.32Å; H76-R110 PolarHBondContact NE2-O 2.87Å; H76-R110 VanDerWaalsContact NE2-O 3.13Å; I102-R110 HydrophobicContact CG2-CG 3.47Å; I102-R110 VanDerWaalsContact CG2-CG 3.47Å; I102-R110 PolarHBondContact O-NE 3.41Å; I102-R110 VanDerWaalsContact O-NE 3.11Å; S103-R110 PolarHBondContact O-NH2 3.26Å; I105-R110 HydrophobicContact CG2-CB 4.45Å; I105-R110 PolarHBondContact O-NE 3.4Å; I105-R110 VanDerWaalsContact O-NE 3.16Å; I105-R110 PolarHBondContact O-NH2 3.48Å; S106-R110 PolarHBondContact O-N 3.43Å; S106-R110 VanDerWaalsContact O-N 3.08Å; S107-R110 PolarHBondContact O-N 2.77Å
111	P	91.3	Very high	88.6	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.019	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-62.8	142.1	174.5	27.2	-33.9	0	0	0	110.8	H76 I78 I102 G109 L161	H76-P111 HydrophobicContact CB-CB 4.47Å; H76-P111 WeakPolarHBondContact NE2-CA 3.3Å; I78-P111 HydrophobicContact CD1-CB 3.74Å; I78-P111 HydrophobicContact CD1-CG 3.48Å; I78-P111 VanDerWaalsContact CD1-CG 3.48Å; I78-P111 HydrophobicContact CG1-CB 4.07Å; I78-P111 HydrophobicContact CG1-CG 4.35Å; I102-P111 HydrophobicContact CD1-CG 4.35Å; I102-P111 HydrophobicContact CG1-CG 4.17Å; I102-P111 HydrophobicContact CG2-CG 4.43Å; G109-P111 WeakPolarHBondContact O-CD 3.3Å; P111-L161 HydrophobicContact CG-CD2 4.33Å
112	A	92.1	Very high	88.4	Confident	20 Å²	20	51.7 Å²	51.7	17%	0.165	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	140.7	166.2	0	0	0	0	0	108.4	Y72 H76 L77 I78	Y72-A112 HydrophobicContact CD1-CB 4.01Å; Y72-A112 HydrophobicContact CD2-CB 3.65Å; Y72-A112 HydrophobicContact CE2-CB 4.19Å; Y72-A112 HydrophobicContact CG-CB 3.56Å; H76-A112 PolarHBondContact O-N 3.23Å; H76-A112 VanDerWaalsContact O-N 3.1Å; L77-A112 WeakPolarHBondContact CA-O 3.4Å; L77-A112 HydrophobicContact CD1-CB 3.73Å; I78-A112 PolarHBondContact N-O 3.41Å
113	Y	93.7	Very high	88	Confident	43 Å²	43	55.8 Å²	55.8	17%	0.169	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	125.3	-178.8	177.3	-117.5	0	0	0	110.8	I78 L80 D95 L98 R99 I102	I78-Y113 HydrophobicContact CB-CD2 3.99Å; I78-Y113 HydrophobicContact CG2-CD2 3.78Å; I78-Y113 HydrophobicContact CG2-CE2 4.09Å; I78-Y113 WeakPolarHBondContact O-CA 3.3Å; L80-Y113 HydrophobicContact CB-CE2 3.88Å; L80-Y113 WeakPolarHBondContact CD2-OH 3.19Å; D95-Y113 VanDerWaalsContact OD1-CE1 3.3Å; D95-Y113 WeakPolarHBondContact OD1-CE1 3.27Å; D95-Y113 PolarHBondContact OD1-OH 3.21Å; L98-Y113 HydrophobicContact CB-CE2 4.18Å; L98-Y113 HydrophobicContact CD1-CE2 3.76Å; R99-Y113 HydrophobicContact CG-CD1 4.18Å; R99-Y113 HydrophobicContact CG-CE1 3.82Å; I102-Y113 HydrophobicContact CD1-CD2 3.98Å; I102-Y113 HydrophobicContact CD1-CG 3.81Å
114	I	92.5	Very high	87.5	Confident	9 Å²	9	53.6 Å²	53.6	5%	0.046	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130	178.8	-64.4	176.2	0	0	0	107.9	L65 M68 L77 I78 V79 L80 T116	L65-I114 HydrophobicContact CD2-CD1 4.45Å; L65-I114 HydrophobicContact CD2-CG2 3.37Å; M68-I114 HydrophobicContact CB-CD1 3.8Å; M68-I114 HydrophobicContact CE-CD1 3.77Å; M68-I114 HydrophobicContact CE-CG1 3.95Å; M68-I114 HydrophobicContact SD-CD1 4.31Å; M68-I114 HydrophobicContact SD-CG1 4.36Å; L77-I114 HydrophobicContact CD1-CD1 3.7Å; L77-I114 HydrophobicContact CD1-CG1 3.88Å; L77-I114 HydrophobicContact CD2-CD1 4.39Å; I78-I114 PolarHBondContact O-N 3.32Å; V79-I114 CarbonylContact C-O 3.37Å; V79-I114 WeakPolarHBondContact CA-O 3.42Å; V79-I114 HydrophobicContact CG1-CB 4.34Å; V79-I114 HydrophobicContact CG1-CG2 4.25Å; V79-I114 HydrophobicContact CG2-CB 4.5Å; L80-I114 PolarHBondContact N-O 2.97Å; I114-T116 HydrophobicContact CG2-CG2 4.37Å
115	K	92.6	Very high	87.1	Confident	74 Å²	74	47.4 Å²	47.4	32%	0.322	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.1	163	177	-179.9	177.9	-175.7	0	108.5	L80 D95	L80-K115 HydrophobicContact CD2-CD 4.49Å; L80-K115 HydrophobicContact CD2-CG 4.44Å; L80-K115 VanDerWaalsContact O-CA 3.32Å; L80-K115 WeakPolarHBondContact O-CA 3.21Å; D95-K115 HydrophobicContact CB-CD 4.18Å; D95-K115 VanDerWaalsContact CG-CD 3.47Å; D95-K115 WeakPolarHBondContact OD2-CD 3.47Å; D95-K115 IonicContact OD2-NZ 2.75Å; D95-K115 PolarHBondContact OD2-NZ 3.19Å
116	T	91.6	Very high	87	Confident	4 Å²	4	48.5 Å²	48.5	3%	0.025	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	149.6	-175.2	-174.6	0	0	0	0	111.7	L65 V79 L80 F81 C82 I114 N118 F121	L65-T116 WeakPolarHBondContact CD1-OG1 3.2Å; V79-T116 HydrophobicContact CG1-CG2 3.88Å; L80-T116 PolarHBondContact O-N 3.45Å; F81-T116 CarbonylContact C-O 3.55Å; F81-T116 VanDerWaalsContact CA-O 3.3Å; F81-T116 WeakPolarHBondContact CA-O 3.26Å; F81-T116 HydrophobicContact CD1-CG2 3.53Å; F81-T116 HydrophobicContact CE1-CG2 3.65Å; F81-T116 HydrophobicContact CG-CG2 4.34Å; C82-T116 PolarHBondContact N-O 3.04Å; I114-T116 HydrophobicContact CG2-CG2 4.37Å; T116-N118 WeakPolarHBondContact OG1-CB 3.15Å; T116-N118 PolarHBondContact OG1-N 3.43Å; T116-F121 HydrophobicContact CG2-CD1 3.88Å; T116-F121 HydrophobicContact CG2-CE1 4.29Å
117	D	89.6	Confident	87.1	Confident	94 Å²	94	45.6 Å²	45.6	50%	0.503	24%	0.237	S	C	.	.			trans	-111.4	11.2	171.9	61.8	-13.7	0	0	0	111.8	C82 F119 F130	C82-D117 WeakPolarHBondContact O-CB 3.23Å; D117-F119 PolarHBondContact O-N 2.87Å; D117-F130 WeakPolarHBondContact O-CE2 3.36Å
118	N	87.2	Confident	87.4	Confident	9 Å²	9	47.1 Å²	47.1	5%	0.048	23%	0.234	C	C	.	.			trans	-84.6	106.6	-176.5	-169.3	-38.7	0	0	0	111.5	F58 L65 T116 A120 F121 G122	F58-N118 WeakPolarHBondContact CE2-ND2 3.41Å; L65-N118 HydrophobicContact CD1-CB 4.15Å; T116-N118 WeakPolarHBondContact OG1-CB 3.15Å; T116-N118 PolarHBondContact OG1-N 3.43Å; N118-A120 PolarHBondContact O-N 2.79Å; N118-A120 WeakPolarHBondContact OD1-CB 3.47Å; N118-A120 PolarHBondContact OD1-N 3.36Å; N118-F121 HydrophobicContact CB-CB 4.07Å; N118-F121 PolarHBondContact O-N 3.03Å; N118-F121 PolarHBondContact OD1-N 2.7Å; N118-F121 VanDerWaalsContact OD1-N 3.14Å; N118-G122 PolarHBondContact O-N 3.27Å
119	F	84.6	Confident	87.9	Confident	116 Å²	116	47 Å²	47	51%	0.509	23%	0.233	S	C	.	.	H	α-helix	trans	-61.3	-37.5	176.9	-74.3	-82.8	0	0	0	113.7	D117 F121 G122 E123 F130	D117-F119 PolarHBondContact O-N 2.87Å; F119-F121 VanDerWaalsContact C-N 3.28Å; F119-F121 PolarHBondContact O-N 2.86Å; F119-G122 WeakPolarHBondContact O-CA 3.4Å; F119-G122 PolarHBondContact O-N 3.18Å; F119-E123 PolarHBondContact O-N 1.97Å; F119-F130 AromaticContact CD1-CE1 3.97Å; F119-F130 HydrophobicContact CD1-CE1 3.97Å; F119-F130 HydrophobicContact CD1-CE2 4.07Å; F119-F130 AromaticContact CD1-CZ 3.73Å; F119-F130 HydrophobicContact CD1-CZ 3.73Å; F119-F130 HydrophobicContact CD2-CE2 4.09Å; F119-F130 HydrophobicContact CD2-CZ 4.32Å; F119-F130 HydrophobicContact CE1-CD1 4.11Å; F119-F130 AromaticContact CE1-CD2 3.92Å; F119-F130 HydrophobicContact CE1-CD2 3.92Å; F119-F130 AromaticContact CE1-CE1 3.99Å; F119-F130 HydrophobicContact CE1-CE1 3.99Å; F119-F130 AromaticContact CE1-CE2 3.83Å; F119-F130 HydrophobicContact CE1-CE2 3.83Å; F119-F130 HydrophobicContact CE1-CG 4.05Å; F119-F130 AromaticContact CE1-CZ 3.87Å; F119-F130 HydrophobicContact CE1-CZ 3.87Å; F119-F130 HydrophobicContact CE2-CD2 4.19Å; F119-F130 AromaticContact CE2-CE2 3.85Å; F119-F130 HydrophobicContact CE2-CE2 3.85Å; F119-F130 HydrophobicContact CE2-CZ 4.44Å; F119-F130 HydrophobicContact CG-CE2 4.2Å; F119-F130 AromaticContact CG-CZ 3.97Å; F119-F130 HydrophobicContact CG-CZ 3.97Å; F119-F130 AromaticContact CZ-CD2 3.69Å; F119-F130 HydrophobicContact CZ-CD2 3.69Å; F119-F130 AromaticContact CZ-CE2 3.72Å; F119-F130 HydrophobicContact CZ-CE2 3.72Å; F119-F130 HydrophobicContact CZ-CG 4.2Å; F119-F130 HydrophobicContact CZ-CZ 4.23Å
120	A	81.5	Confident	88.4	Confident	24 Å²	24	47.3 Å²	47.3	20%	0.198	23%	0.231	C	C	.	.	H	α-helix	trans	-66.3	-33.4	179.5	0	0	0	0	0	112	N118	N118-A120 PolarHBondContact O-N 2.79Å; N118-A120 WeakPolarHBondContact OD1-CB 3.47Å; N118-A120 PolarHBondContact OD1-N 3.36Å
121	F	84.8	Confident	88.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-73.5	-29.7	170.3	-175.7	-109.5	0	0	0	112.1	L62 L65 A69 V79 F81 T116 N118 F119 F125	L62-F121 HydrophobicContact CD1-CB 3.81Å; L62-F121 HydrophobicContact CD1-CD2 4.3Å; L62-F121 HydrophobicContact CD1-CG 4.49Å; L65-F121 HydrophobicContact CB-CD1 4.29Å; L65-F121 HydrophobicContact CB-CD2 3.71Å; L65-F121 HydrophobicContact CB-CE1 4.22Å; L65-F121 HydrophobicContact CB-CE2 3.64Å; L65-F121 HydrophobicContact CB-CG 4.03Å; L65-F121 HydrophobicContact CB-CZ 3.89Å; L65-F121 HydrophobicContact CD1-CB 4.21Å; L65-F121 HydrophobicContact CD1-CD1 4.14Å; L65-F121 HydrophobicContact CD1-CG 4.04Å; L65-F121 HydrophobicContact CD2-CE1 4.34Å; A69-F121 HydrophobicContact CB-CE2 3.94Å; A69-F121 HydrophobicContact CB-CZ 3.97Å; V79-F121 HydrophobicContact CG1-CE1 3.98Å; F81-F121 AromaticContact CE1-CD1 3.81Å; F81-F121 HydrophobicContact CE1-CD1 3.81Å; F81-F121 HydrophobicContact CE1-CE1 4.36Å; F81-F121 HydrophobicContact CZ-CD1 4.22Å; F81-F121 HydrophobicContact CZ-CE1 4.39Å; T116-F121 HydrophobicContact CG2-CD1 3.88Å; T116-F121 HydrophobicContact CG2-CE1 4.29Å; N118-F121 HydrophobicContact CB-CB 4.07Å; N118-F121 PolarHBondContact O-N 3.03Å; N118-F121 PolarHBondContact OD1-N 2.7Å; N118-F121 VanDerWaalsContact OD1-N 3.14Å; F119-F121 VanDerWaalsContact C-N 3.28Å; F119-F121 PolarHBondContact O-N 2.86Å; F121-F125 HydrophobicContact CD1-CD2 4.5Å; F121-F125 HydrophobicContact CD1-CE2 4.42Å; F121-F125 HydrophobicContact CD2-CE2 4.38Å; F121-F125 HydrophobicContact CE1-CD2 4.16Å; F121-F125 AromaticContact CE1-CE2 3.73Å; F121-F125 HydrophobicContact CE1-CE2 3.73Å; F121-F125 HydrophobicContact CE1-CZ 4.36Å; F121-F125 HydrophobicContact CE2-CD2 4.41Å; F121-F125 AromaticContact CE2-CE2 3.66Å; F121-F125 HydrophobicContact CE2-CE2 3.66Å; F121-F125 HydrophobicContact CZ-CD2 4.12Å; F121-F125 AromaticContact CZ-CE2 3.3Å; F121-F125 HydrophobicContact CZ-CE2 3.3Å; F121-F125 AromaticContact CZ-CZ 3.89Å; F121-F125 HydrophobicContact CZ-CZ 3.89Å; F121-F125 WeakPolarHBondContact O-CD2 3.49Å
122	G	87	Confident	88.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.5	-39.2	174	0	0	0	0	0	113.4	N118 F119 D124 F125 S126 V127	N118-G122 PolarHBondContact O-N 3.27Å; F119-G122 WeakPolarHBondContact O-CA 3.4Å; F119-G122 PolarHBondContact O-N 3.18Å; G122-D124 VanDerWaalsContact C-N 3.32Å; G122-D124 PolarHBondContact O-N 3.26Å; G122-F125 CarbonylContact O-C 3.54Å; G122-F125 WeakPolarHBondContact O-CA 3.38Å; G122-F125 PolarHBondContact O-N 2.79Å; G122-S126 PolarHBondContact O-N 2.7Å; G122-V127 CarbonylContact C-O 3.53Å; G122-V127 WeakPolarHBondContact O-CB 3.48Å; G122-V127 PolarHBondContact O-N 3.25Å
123	E	84.9	Confident	89.1	Confident	98 Å²	98	43.2 Å²	43.2	46%	0.458	22%	0.218	S	C	.	.	H	α-helix	trans	-55.4	-44.2	177.3	-73.2	177.5	169.9	0	0	112.6	K41 F119 F125 S126	K41-E123 IonicContact NZ-OE2 2.77Å; K41-E123 PolarHBondContact NZ-OE2 2.68Å; F119-E123 PolarHBondContact O-N 1.97Å; E123-F125 PolarHBondContact O-N 3.23Å; E123-S126 WeakPolarHBondContact O-CA 3.36Å; E123-S126 PolarHBondContact O-N 3.17Å
124	D	82.2	Confident	89.1	Confident	19 Å²	19	41.2 Å²	41.2	10%	0.102	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-34.8	176.8	-69.2	-7.5	0	0	0	110.9	V38 K41 C42 G122 S126	V38-D124 HydrophobicContact CG1-CB 4.5Å; V38-D124 WeakPolarHBondContact CG1-O 3.42Å; V38-D124 WeakPolarHBondContact O-CB 3.19Å; K41-D124 WeakPolarHBondContact CB-OD1 3.25Å; C42-D124 PolarHBondContact SG-OD2 2.88Å; C42-D124 VanDerWaalsContact SG-OD2 3.38Å; G122-D124 VanDerWaalsContact C-N 3.32Å; G122-D124 PolarHBondContact O-N 3.26Å; D124-S126 VanDerWaalsContact C-N 3.27Å; D124-S126 PolarHBondContact O-N 3.49Å
125	F	85.1	Confident	89.1	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	14.1	175	-75	-102.7	0	0	0	113.3	A69 F73 L77 V79 F81 F121 G122 E123 V127 T134 A136 L141 H143	A69-F125 HydrophobicContact CB-CE2 4.26Å; A69-F125 HydrophobicContact CB-CZ 4.07Å; F73-F125 HydrophobicContact CD2-CE1 4.16Å; F73-F125 HydrophobicContact CD2-CZ 4.14Å; F73-F125 AromaticContact CE2-CE1 3.95Å; F73-F125 HydrophobicContact CE2-CE1 3.95Å; F73-F125 HydrophobicContact CE2-CZ 4.22Å; L77-F125 HydrophobicContact CD2-CE1 4.18Å; L77-F125 HydrophobicContact CD2-CZ 3.89Å; V79-F125 HydrophobicContact CG2-CD1 4.26Å; V79-F125 HydrophobicContact CG2-CE1 3.72Å; V79-F125 HydrophobicContact CG2-CZ 3.97Å; F81-F125 HydrophobicContact CE2-CB 4.08Å; F81-F125 HydrophobicContact CE2-CG 4.37Å; F81-F125 HydrophobicContact CZ-CB 3.75Å; F81-F125 HydrophobicContact CZ-CD2 4.11Å; F81-F125 AromaticContact CZ-CG 3.88Å; F81-F125 HydrophobicContact CZ-CG 3.88Å; F121-F125 HydrophobicContact CD1-CD2 4.5Å; F121-F125 HydrophobicContact CD1-CE2 4.42Å; F121-F125 HydrophobicContact CD2-CE2 4.38Å; F121-F125 HydrophobicContact CE1-CD2 4.16Å; F121-F125 AromaticContact CE1-CE2 3.73Å; F121-F125 HydrophobicContact CE1-CE2 3.73Å; F121-F125 HydrophobicContact CE1-CZ 4.36Å; F121-F125 HydrophobicContact CE2-CD2 4.41Å; F121-F125 AromaticContact CE2-CE2 3.66Å; F121-F125 HydrophobicContact CE2-CE2 3.66Å; F121-F125 HydrophobicContact CZ-CD2 4.12Å; F121-F125 AromaticContact CZ-CE2 3.3Å; F121-F125 HydrophobicContact CZ-CE2 3.3Å; F121-F125 AromaticContact CZ-CZ 3.89Å; F121-F125 HydrophobicContact CZ-CZ 3.89Å; F121-F125 WeakPolarHBondContact O-CD2 3.49Å; G122-F125 CarbonylContact O-C 3.54Å; G122-F125 WeakPolarHBondContact O-CA 3.38Å; G122-F125 PolarHBondContact O-N 2.79Å; E123-F125 PolarHBondContact O-N 3.23Å; F125-V127 HydrophobicContact CB-CG2 4.21Å; F125-V127 PolarHBondContact O-N 2.87Å; F125-T134 HydrophobicContact CD1-CG2 3.96Å; F125-A136 HydrophobicContact CE1-CB 4.29Å; F125-L141 HydrophobicContact CD1-CD2 3.75Å; F125-L141 HydrophobicContact CE1-CD2 4.15Å; F125-H143 PolarHBondContact O-CE1 3.41Å
126	S	87.5	Confident	89	Confident	67 Å²	67	37.4 Å²	37.4	47%	0.469	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	30.5	-175.7	-53.8	0	0	0	0	113.9	G122 E123 D124	G122-S126 PolarHBondContact O-N 2.7Å; E123-S126 WeakPolarHBondContact O-CA 3.36Å; E123-S126 PolarHBondContact O-N 3.17Å; D124-S126 VanDerWaalsContact C-N 3.27Å; D124-S126 PolarHBondContact O-N 3.49Å
127	V	90.2	Very high	88.9	Confident	8 Å²	8	37.2 Å²	37.2	5%	0.048	19%	0.193	C	C	.	.			trans	-103.8	113.4	178.7	174.3	0	0	0	0	110.2	F81 G122 F125 F130 A132 T134	F81-V127 HydrophobicContact CB-CG1 4.26Å; F81-V127 HydrophobicContact CD1-CG1 4.48Å; F81-V127 HydrophobicContact CD2-CB 4.28Å; F81-V127 HydrophobicContact CD2-CG1 4.07Å; F81-V127 HydrophobicContact CD2-CG2 3.83Å; F81-V127 HydrophobicContact CE2-CB 4.28Å; F81-V127 HydrophobicContact CE2-CG2 3.67Å; F81-V127 HydrophobicContact CG-CG1 4.02Å; F81-V127 HydrophobicContact CZ-CG2 4.29Å; G122-V127 CarbonylContact C-O 3.53Å; G122-V127 WeakPolarHBondContact O-CB 3.48Å; G122-V127 PolarHBondContact O-N 3.25Å; F125-V127 HydrophobicContact CB-CG2 4.21Å; F125-V127 PolarHBondContact O-N 2.87Å; V127-F130 HydrophobicContact CG1-CD1 4.02Å; V127-F130 HydrophobicContact CG1-CE1 3.86Å; V127-A132 HydrophobicContact CB-CB 4.45Å; V127-A132 HydrophobicContact CG1-CB 3.43Å; V127-A132 VanDerWaalsContact CG1-CB 3.43Å; V127-A132 HydrophobicContact CG2-CB 4.13Å; V127-T134 WeakPolarHBondContact CG2-OG1 3.25Å
128	H	88.7	Confident	88.7	Confident	128 Å²	128	32.8 Å²	32.8	59%	0.593	17%	0.169	S	C	*	.			trans	-106.1	-11.8	179.9	-56.5	-62.3	0	0	0	114.3
129	H	89.7	Confident	88.4	Confident	154 Å²	154	32.5 Å²	32.5	71%	0.713	17%	0.168	S	C	*	.	S	Bend	trans	-139.1	143.7	-175.9	-58.6	93.7	0	0	0	111.3	A132	H129-A132 WeakPolarHBondContact O-CB 3.47Å
130	F	91.9	Very high	88.5	Confident	15 Å²	15	28.8 Å²	28.8	7%	0.066	15%	0.151	C	C	.	.	S	Bend	trans	-109.7	146.2	174.4	-63.2	-3.9	0	0	0	110.2	F81 Y88 D117 F119 V127	F81-F130 HydrophobicContact CB-CD1 3.63Å; F81-F130 HydrophobicContact CB-CE1 3.54Å; F81-F130 HydrophobicContact CB-CG 4.3Å; F81-F130 HydrophobicContact CB-CZ 4.08Å; F81-F130 AromaticContact CD1-CE1 3.88Å; F81-F130 HydrophobicContact CD1-CE1 3.88Å; F81-F130 HydrophobicContact CD1-CZ 4.05Å; F81-F130 HydrophobicContact CG-CE1 4.02Å; Y88-F130 WeakPolarHBondContact CE1-O 3.12Å; Y88-F130 HydrophobicContact CE2-CB 4.2Å; Y88-F130 PolarHBondContact OH-O 3.26Å; D117-F130 WeakPolarHBondContact O-CE2 3.36Å; F119-F130 AromaticContact CD1-CE1 3.97Å; F119-F130 HydrophobicContact CD1-CE1 3.97Å; F119-F130 HydrophobicContact CD1-CE2 4.07Å; F119-F130 AromaticContact CD1-CZ 3.73Å; F119-F130 HydrophobicContact CD1-CZ 3.73Å; F119-F130 HydrophobicContact CD2-CE2 4.09Å; F119-F130 HydrophobicContact CD2-CZ 4.32Å; F119-F130 HydrophobicContact CE1-CD1 4.11Å; F119-F130 AromaticContact CE1-CD2 3.92Å; F119-F130 HydrophobicContact CE1-CD2 3.92Å; F119-F130 AromaticContact CE1-CE1 3.99Å; F119-F130 HydrophobicContact CE1-CE1 3.99Å; F119-F130 AromaticContact CE1-CE2 3.83Å; F119-F130 HydrophobicContact CE1-CE2 3.83Å; F119-F130 HydrophobicContact CE1-CG 4.05Å; F119-F130 AromaticContact CE1-CZ 3.87Å; F119-F130 HydrophobicContact CE1-CZ 3.87Å; F119-F130 HydrophobicContact CE2-CD2 4.19Å; F119-F130 AromaticContact CE2-CE2 3.85Å; F119-F130 HydrophobicContact CE2-CE2 3.85Å; F119-F130 HydrophobicContact CE2-CZ 4.44Å; F119-F130 HydrophobicContact CG-CE2 4.2Å; F119-F130 AromaticContact CG-CZ 3.97Å; F119-F130 HydrophobicContact CG-CZ 3.97Å; F119-F130 AromaticContact CZ-CD2 3.69Å; F119-F130 HydrophobicContact CZ-CD2 3.69Å; F119-F130 AromaticContact CZ-CE2 3.72Å; F119-F130 HydrophobicContact CZ-CE2 3.72Å; F119-F130 HydrophobicContact CZ-CG 4.2Å; F119-F130 HydrophobicContact CZ-CZ 4.23Å; V127-F130 HydrophobicContact CG1-CD1 4.02Å; V127-F130 HydrophobicContact CG1-CE1 3.86Å
131	P	93.9	Very high	88.9	Confident	28 Å²	28	29.3 Å²	29.3	18%	0.182	15%	0.15	C	C	.	.	S	Bend	cis	-77.6	146.6	0.8	34.8	-34	0	0	0	111.9	F81 Y88 C91 W148	F81-P131 VanDerWaalsContact O-CA 3.31Å; F81-P131 WeakPolarHBondContact O-CA 3.39Å; Y88-P131 HydrophobicContact CD1-CG 4.21Å; C91-P131 VanDerWaalsContact SG-CB 3.57Å; P131-W148 HydrophobicContact CB-CD2 4.24Å; P131-W148 HydrophobicContact CB-CE3 4.29Å; P131-W148 HydrophobicContact CB-CH2 3.8Å; P131-W148 HydrophobicContact CB-CZ2 3.76Å; P131-W148 HydrophobicContact CB-CZ3 4.08Å; P131-W148 HydrophobicContact CG-CD2 3.77Å; P131-W148 HydrophobicContact CG-CE3 4.22Å; P131-W148 HydrophobicContact CG-CG 4.18Å; P131-W148 HydrophobicContact CG-CH2 4.36Å; P131-W148 HydrophobicContact CG-CZ2 3.95Å; P131-W148 HydrophobicContact CG-CZ3 4.49Å; P131-W148 VanDerWaalsContact O-CZ2 3.25Å; P131-W148 WeakPolarHBondContact O-CZ2 3.43Å
132	A	95.4	Very high	89.2	Confident	16 Å²	16	30.6 Å²	30.6	13%	0.132	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	144	173.2	0	0	0	0	0	109.9	F81 V127 H129	F81-A132 WeakPolarHBondContact CA-O 3.48Å; F81-A132 HydrophobicContact CB-CB 4.07Å; F81-A132 HydrophobicContact CD2-CB 4.25Å; F81-A132 PolarHBondContact N-O 2.8Å; F81-A132 PolarHBondContact O-N 2.71Å; V127-A132 HydrophobicContact CB-CB 4.45Å; V127-A132 HydrophobicContact CG1-CB 3.43Å; V127-A132 VanDerWaalsContact CG1-CB 3.43Å; V127-A132 HydrophobicContact CG2-CB 4.13Å; H129-A132 WeakPolarHBondContact O-CB 3.47Å
133	L	96.5	Very high	89.6	Confident	1 Å²	1	34 Å²	34	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	121.4	172.6	176.1	67.3	0	0	0	107.4	I78 L80 L98 F144 W148 V153 W156 M157	I78-L133 HydrophobicContact CG2-CD1 3.6Å; L80-L133 HydrophobicContact CB-CD1 4.22Å; L80-L133 HydrophobicContact CD1-CB 4.35Å; L80-L133 HydrophobicContact CD1-CD1 4.17Å; L98-L133 HydrophobicContact CD1-CD1 3.93Å; L133-F144 HydrophobicContact CB-CB 3.91Å; L133-F144 HydrophobicContact CD2-CB 4.28Å; L133-F144 HydrophobicContact CG-CB 4.38Å; L133-F144 PolarHBondContact O-N 2.87Å; L133-W148 HydrophobicContact CB-CH2 3.8Å; L133-W148 HydrophobicContact CB-CZ2 4.36Å; L133-V153 HydrophobicContact CD2-CG1 3.46Å; L133-V153 VanDerWaalsContact CD2-CG1 3.46Å; L133-W156 HydrophobicContact CD2-CE3 3.89Å; L133-W156 HydrophobicContact CD2-CZ3 3.55Å; L133-W156 HydrophobicContact CG-CH2 4.46Å; L133-W156 HydrophobicContact CG-CZ3 3.82Å; L133-M157 HydrophobicContact CD2-SD 4.44Å
134	T	94	Very high	90.1	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	131.9	-179.6	-58.2	0	0	0	0	109.2	V79 F125 V127 L141 F142 H143	V79-T134 PolarHBondContact N-O 2.89Å; V79-T134 PolarHBondContact O-N 2.75Å; F125-T134 HydrophobicContact CD1-CG2 3.96Å; V127-T134 WeakPolarHBondContact CG2-OG1 3.25Å; T134-L141 HydrophobicContact CG2-CB 4.29Å; T134-L141 HydrophobicContact CG2-CD2 3.9Å; T134-F142 CarbonylContact C-O 3.51Å; T134-F142 WeakPolarHBondContact CA-O 3.3Å; T134-H143 PolarHBondContact OG1-CE1 2.84Å; T134-H143 PolarHBondContact OG1-ND1 3.36Å
135	Y	93	Very high	90.6	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.016	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	112.3	170.8	179.3	-130.4	0	0	0	108.9	H76 L77 I78 V137 F142 M160	H76-Y135 HydrophobicContact CB-CE2 3.87Å; L77-Y135 CarbonylContact O-C 3.49Å; I78-Y135 HydrophobicContact CG1-CD2 3.52Å; I78-Y135 HydrophobicContact CG1-CE2 4.01Å; I78-Y135 HydrophobicContact CG1-CG 4.48Å; Y135-V137 HydrophobicContact CD1-CB 4.33Å; Y135-V137 HydrophobicContact CD1-CG1 4.08Å; Y135-V137 HydrophobicContact CE1-CB 3.71Å; Y135-V137 HydrophobicContact CE1-CG1 3.69Å; Y135-V137 HydrophobicContact CE1-CG2 4.32Å; Y135-V137 HydrophobicContact CE2-CB 4.36Å; Y135-F142 HydrophobicContact CD1-CD2 4.43Å; Y135-F142 PolarHBondContact N-O 3.23Å; Y135-F142 PolarHBondContact O-N 3.15Å; Y135-M160 HydrophobicContact CD1-CB 4.02Å; Y135-M160 HydrophobicContact CD1-CE 3.58Å; Y135-M160 HydrophobicContact CD1-CG 4.39Å; Y135-M160 HydrophobicContact CE1-CB 4.14Å; Y135-M160 HydrophobicContact CE1-CE 4.1Å
136	A	90	Very high	91	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.6	170.8	0	0	0	0	0	108.7	F73 H76 L77 F125 R140 L141	F73-A136 HydrophobicContact CD2-CB 4.02Å; F73-A136 HydrophobicContact CE2-CB 4.02Å; H76-A136 CarbonylContact C-O 3.6Å; H76-A136 VanDerWaalsContact CA-O 3.25Å; H76-A136 WeakPolarHBondContact CA-O 3.25Å; L77-A136 HydrophobicContact CB-CB 4.3Å; L77-A136 PolarHBondContact N-O 3.07Å; L77-A136 PolarHBondContact O-N 3Å; F125-A136 HydrophobicContact CE1-CB 4.29Å; A136-R140 CarbonylContact C-O 3.46Å; A136-R140 VanDerWaalsContact CA-O 3.25Å; A136-R140 WeakPolarHBondContact CA-O 3.25Å; A136-L141 HydrophobicContact CB-CD2 3.67Å
137	V	89	Confident	91.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	130.4	176.5	59.8	0	0	0	0	109.9	N75 H76 Y135 G139 R140 F142 Y205 K208	N75-V137 WeakPolarHBondContact O-CA 3.42Å; H76-V137 HydrophobicContact CB-CG2 4.34Å; Y135-V137 HydrophobicContact CD1-CB 4.33Å; Y135-V137 HydrophobicContact CD1-CG1 4.08Å; Y135-V137 HydrophobicContact CE1-CB 3.71Å; Y135-V137 HydrophobicContact CE1-CG1 3.69Å; Y135-V137 HydrophobicContact CE1-CG2 4.32Å; Y135-V137 HydrophobicContact CE2-CB 4.36Å; V137-G139 PolarHBondContact O-N 2.63Å; V137-R140 PolarHBondContact N-O 2.75Å; V137-R140 PolarHBondContact O-N 3.23Å; V137-F142 HydrophobicContact CG1-CD2 3.73Å; V137-F142 HydrophobicContact CG1-CE2 3.37Å; V137-F142 HydrophobicContact CG1-CZ 4.48Å; V137-Y205 HydrophobicContact CG2-CD1 4Å; V137-Y205 HydrophobicContact CG2-CG 3.94Å; V137-K208 HydrophobicContact CG1-CB 4.46Å; V137-K208 HydrophobicContact CG1-CG 4.08Å; V137-K208 HydrophobicContact CG2-CB 4.34Å
138	A	86	Confident	91.5	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.008	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	36.7	-178.1	0	0	0	0	0	112.6	D74 N75 R140 Y205 A267	D74-A138 WeakPolarHBondContact O-CA 3.4Å; N75-A138 PolarHBondContact O-N 3.47Å; A138-R140 VanDerWaalsContact C-N 3.3Å; A138-R140 PolarHBondContact O-N 3.24Å; A138-Y205 WeakPolarHBondContact CB-O 3.32Å; A138-A267 HydrophobicContact CB-CB 3.57Å
139	G	81.5	Confident	91.7	Very high	2 Å²	2	39.2 Å²	39.2	2%	0.021	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	3.9	-179	0	0	0	0	0	116.8	F73 V137	F73-G139 VanDerWaalsContact CE1-CA 3.43Å; F73-G139 WeakPolarHBondContact CE1-O 3.49Å; F73-G139 PolarHBondContact O-N 2.88Å; V137-G139 PolarHBondContact O-N 2.63Å
140	R	85.9	Confident	91.9	Very high	39 Å²	39	34.9 Å²	34.9	15%	0.147	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	139.9	174.1	-170.5	171.1	176.1	122.2	-1.1	111.1	A136 V137 A138 F142 S209 D212	A136-R140 CarbonylContact C-O 3.46Å; A136-R140 VanDerWaalsContact CA-O 3.25Å; A136-R140 WeakPolarHBondContact CA-O 3.25Å; V137-R140 PolarHBondContact N-O 2.75Å; V137-R140 PolarHBondContact O-N 3.23Å; A138-R140 VanDerWaalsContact C-N 3.3Å; A138-R140 PolarHBondContact O-N 3.24Å; R140-F142 HydrophobicContact CB-CE2 3.91Å; R140-F142 HydrophobicContact CB-CZ 4.46Å; R140-F142 HydrophobicContact CG-CD2 4.4Å; R140-F142 HydrophobicContact CG-CE2 3.8Å; R140-F142 HydrophobicContact CG-CZ 3.99Å; R140-S209 WeakPolarHBondContact CD-O 3.41Å; R140-D212 IonicContact CZ-OD1 3.17Å; R140-D212 IonicContact CZ-OD2 3.13Å; R140-D212 IonicContact NH1-OD1 2.68Å; R140-D212 IonicContact NH1-OD2 2.81Å; R140-D212 IonicContact NH2-OD1 3.38Å; R140-D212 IonicContact NH2-OD2 2.69Å; R140-D212 PolarHBondContact NH2-OD2 3.35Å
141	L	89.7	Confident	92	Very high	34 Å²	34	40 Å²	40	18%	0.178	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	132.8	175.6	-60.7	-178.9	0	0	0	111.3	F73 F125 T134 A136	F73-L141 HydrophobicContact CE2-CD2 3.64Å; F73-L141 HydrophobicContact CZ-CD2 3.7Å; F73-L141 HydrophobicContact CZ-CG 4.17Å; F125-L141 HydrophobicContact CD1-CD2 3.75Å; F125-L141 HydrophobicContact CE1-CD2 4.15Å; T134-L141 HydrophobicContact CG2-CB 4.29Å; T134-L141 HydrophobicContact CG2-CD2 3.9Å; A136-L141 HydrophobicContact CB-CD2 3.67Å
142	F	91.9	Very high	92.1	Very high	27 Å²	27	39.7 Å²	39.7	12%	0.118	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	115.4	172	-64.5	-89.9	0	0	0	109.1	T134 Y135 V137 R140 W156 M160 K208	T134-F142 CarbonylContact C-O 3.51Å; T134-F142 WeakPolarHBondContact CA-O 3.3Å; Y135-F142 HydrophobicContact CD1-CD2 4.43Å; Y135-F142 PolarHBondContact N-O 3.23Å; Y135-F142 PolarHBondContact O-N 3.15Å; V137-F142 HydrophobicContact CG1-CD2 3.73Å; V137-F142 HydrophobicContact CG1-CE2 3.37Å; V137-F142 HydrophobicContact CG1-CZ 4.48Å; R140-F142 HydrophobicContact CB-CE2 3.91Å; R140-F142 HydrophobicContact CB-CZ 4.46Å; R140-F142 HydrophobicContact CG-CD2 4.4Å; R140-F142 HydrophobicContact CG-CE2 3.8Å; R140-F142 HydrophobicContact CG-CZ 3.99Å; F142-W156 HydrophobicContact CB-CZ2 4.12Å; F142-M160 HydrophobicContact CB-CE 3.64Å; F142-M160 HydrophobicContact CD1-CE 3.59Å; F142-M160 HydrophobicContact CD2-CE 3.66Å; F142-M160 HydrophobicContact CE1-CE 4.08Å; F142-M160 HydrophobicContact CE2-CE 4.16Å; F142-M160 HydrophobicContact CG-CE 3.33Å; F142-M160 HydrophobicContact CZ-CE 4.33Å; F142-K208 WeakPolarHBondContact CZ-O 3.2Å
143	H	94.3	Very high	92.2	Very high	71 Å²	71	38.9 Å²	38.9	33%	0.329	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	134.9	177.6	-56.3	-60.9	0	0	0	110.6	F125 T134 T145	F125-H143 PolarHBondContact O-CE1 3.41Å; T134-H143 PolarHBondContact OG1-CE1 2.84Å; T134-H143 PolarHBondContact OG1-ND1 3.36Å; H143-T145 PolarHBondContact O-N 2.91Å
144	F	95.8	Very high	92.1	Very high	20 Å²	20	41.4 Å²	41.4	9%	0.088	22%	0.221	C	C	.	.			trans	-71.7	116.7	168.3	179.5	-105.3	0	0	0	109.6	L133 G146 I147 W148 A152 V153 W156	L133-F144 HydrophobicContact CB-CB 3.91Å; L133-F144 HydrophobicContact CD2-CB 4.28Å; L133-F144 HydrophobicContact CG-CB 4.38Å; L133-F144 PolarHBondContact O-N 2.87Å; F144-G146 VanDerWaalsContact CE1-O 3.26Å; F144-G146 WeakPolarHBondContact CE1-O 3.35Å; F144-I147 WeakPolarHBondContact CZ-O 3.42Å; F144-W148 HydrophobicContact CD1-CZ2 4.3Å; F144-W148 HydrophobicContact CE1-CD2 4.49Å; F144-A152 HydrophobicContact CZ-CB 4.11Å; F144-V153 HydrophobicContact CD1-CG2 4.21Å; F144-V153 HydrophobicContact CE1-CG2 3.77Å; F144-V153 HydrophobicContact CE2-CG2 4.21Å; F144-V153 HydrophobicContact CZ-CG2 3.76Å; F144-W156 HydrophobicContact CB-CD2 4.26Å; F144-W156 HydrophobicContact CB-CE3 4.19Å; F144-W156 HydrophobicContact CB-CH2 4.22Å; F144-W156 HydrophobicContact CB-CZ2 4.29Å; F144-W156 HydrophobicContact CB-CZ3 4.19Å; F144-W156 HydrophobicContact CD2-CB 3.77Å; F144-W156 AromaticContact CD2-CD2 3.66Å; F144-W156 HydrophobicContact CD2-CD2 3.66Å; F144-W156 AromaticContact CD2-CE3 3.99Å; F144-W156 HydrophobicContact CD2-CE3 3.99Å; F144-W156 AromaticContact CD2-CG 3.57Å; F144-W156 HydrophobicContact CD2-CG 3.57Å; F144-W156 HydrophobicContact CE2-CB 3.77Å; F144-W156 HydrophobicContact CE2-CG 4.08Å; F144-W156 HydrophobicContact CG-CD2 4.43Å; F144-W156 HydrophobicContact CG-CE3 4.48Å
145	T	93.7	Very high	92.2	Very high	134 Å²	134	49.1 Å²	49.1	82%	0.822	25%	0.251	S	S	*	.			trans	-109.4	3.9	179.7	54.8	0	0	0	0	113.1	H143	H143-T145 PolarHBondContact O-N 2.91Å
146	G	93.4	Very high	92.3	Very high	37 Å²	37	50.7 Å²	50.7	38%	0.381	26%	0.256	S	S	.	.	S	Bend	trans	-78.2	-179.8	-178.8	0	0	0	0	0	113.9	F144 W148	F144-G146 VanDerWaalsContact CE1-O 3.26Å; F144-G146 WeakPolarHBondContact CE1-O 3.35Å; G146-W148 PolarHBondContact O-N 2.88Å
147	I	93.1	Very high	92.5	Very high	143 Å²	143	50.7 Å²	50.7	73%	0.733	26%	0.257	S	S	*	.			trans	-66.9	132.6	172.8	-59.9	170.4	0	0	0	108.9	F144 S149 A152	F144-I147 WeakPolarHBondContact CZ-O 3.42Å; I147-S149 PolarHBondContact O-N 2.85Å; I147-A152 WeakPolarHBondContact O-CB 3.48Å
148	W	93.2	Very high	92.6	Very high	63 Å²	63	52.4 Å²	52.4	24%	0.239	27%	0.269	C	S	.	.	S	Bend	trans	-71.1	94.3	176.9	-78.8	87.5	0	0	0	111.4	L80 V90 V94 P131 L133 F144 G146	L80-W148 HydrophobicContact CD1-CH2 3.88Å; L80-W148 HydrophobicContact CD1-CZ3 3.94Å; V90-W148 HydrophobicContact CG1-CB 4.24Å; V90-W148 HydrophobicContact CG1-CE3 4.37Å; V90-W148 HydrophobicContact CG2-CB 4.15Å; V94-W148 HydrophobicContact CG1-CZ3 4.32Å; V94-W148 HydrophobicContact CG2-CE3 4.33Å; V94-W148 HydrophobicContact CG2-CZ3 4.47Å; P131-W148 HydrophobicContact CB-CD2 4.24Å; P131-W148 HydrophobicContact CB-CE3 4.29Å; P131-W148 HydrophobicContact CB-CH2 3.8Å; P131-W148 HydrophobicContact CB-CZ2 3.76Å; P131-W148 HydrophobicContact CB-CZ3 4.08Å; P131-W148 HydrophobicContact CG-CD2 3.77Å; P131-W148 HydrophobicContact CG-CE3 4.22Å; P131-W148 HydrophobicContact CG-CG 4.18Å; P131-W148 HydrophobicContact CG-CH2 4.36Å; P131-W148 HydrophobicContact CG-CZ2 3.95Å; P131-W148 HydrophobicContact CG-CZ3 4.49Å; P131-W148 VanDerWaalsContact O-CZ2 3.25Å; P131-W148 WeakPolarHBondContact O-CZ2 3.43Å; L133-W148 HydrophobicContact CB-CH2 3.8Å; L133-W148 HydrophobicContact CB-CZ2 4.36Å; F144-W148 HydrophobicContact CD1-CZ2 4.3Å; F144-W148 HydrophobicContact CE1-CD2 4.49Å; G146-W148 PolarHBondContact O-N 2.88Å
149	S	93.6	Very high	92.8	Very high	34 Å²	34	57 Å²	57	24%	0.238	29%	0.29	C	S	.	.	S	Bend	trans	-142.5	161.8	167.7	92.3	0	0	0	0	110	I147 E151 A152 V153	I147-S149 PolarHBondContact O-N 2.85Å; S149-E151 VanDerWaalsContact C-N 3.29Å; S149-E151 VanDerWaalsContact CB-OE2 3.26Å; S149-E151 WeakPolarHBondContact CB-OE2 3.43Å; S149-E151 PolarHBondContact O-N 2.82Å; S149-E151 PolarHBondContact OG-N 3.21Å; S149-E151 PolarHBondContact OG-OE2 3.39Å; S149-A152 WeakPolarHBondContact OG-CB 3.19Å; S149-A152 PolarHBondContact OG-N 2.81Å; S149-A152 VanDerWaalsContact OG-N 3.09Å; S149-V153 WeakPolarHBondContact O-CB 3.11Å; S149-V153 VanDerWaalsContact O-CG2 3.32Å; S149-V153 WeakPolarHBondContact O-CG2 3.38Å; S149-V153 PolarHBondContact O-N 2.82Å; S149-V153 VanDerWaalsContact O-N 3.11Å
150	E	93.8	Very high	93.2	Very high	62 Å²	62	57.3 Å²	57.3	29%	0.29	29%	0.291	S	S	.	.	H	α-helix	trans	-60.5	-43.4	177.8	-66.1	174.9	-128.2	0	0	110.5	K93 D154	K93-E150 HydrophobicContact CB-CG 3.82Å; K93-E150 VanDerWaalsContact CB-OE1 3.31Å; K93-E150 WeakPolarHBondContact CB-OE1 3.36Å; K93-E150 WeakPolarHBondContact CD-OE1 3.23Å; K93-E150 WeakPolarHBondContact CG-OE1 3.3Å; K93-E150 IonicContact NZ-OE1 2.75Å; K93-E150 PolarHBondContact NZ-OE1 2.87Å; E150-D154 WeakPolarHBondContact O-CB 3.12Å; E150-D154 PolarHBondContact O-N 2.95Å
151	E	94.5	Very high	93.3	Very high	122 Å²	122	58 Å²	58	57%	0.57	30%	0.297	S	S	*	.	H	α-helix	trans	-70.3	-39.8	-176.8	-50.3	75.9	-166.3	0	0	112.4	S149 R155	S149-E151 VanDerWaalsContact C-N 3.29Å; S149-E151 VanDerWaalsContact CB-OE2 3.26Å; S149-E151 WeakPolarHBondContact CB-OE2 3.43Å; S149-E151 PolarHBondContact O-N 2.82Å; S149-E151 PolarHBondContact OG-N 3.21Å; S149-E151 PolarHBondContact OG-OE2 3.39Å; E151-R155 VanDerWaalsContact O-CB 3.32Å; E151-R155 WeakPolarHBondContact O-CB 3.18Å; E151-R155 PolarHBondContact O-N 3.46Å
152	A	96.6	Very high	93.1	Very high	22 Å²	22	60.8 Å²	60.8	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-69	-42.7	179.4	0	0	0	0	0	111.3	F144 I147 S149 W156	F144-A152 HydrophobicContact CZ-CB 4.11Å; I147-A152 WeakPolarHBondContact O-CB 3.48Å; S149-A152 WeakPolarHBondContact OG-CB 3.19Å; S149-A152 PolarHBondContact OG-N 2.81Å; S149-A152 VanDerWaalsContact OG-N 3.09Å; A152-W156 WeakPolarHBondContact O-CB 3.43Å; A152-W156 PolarHBondContact O-N 2.92Å; A152-W156 VanDerWaalsContact O-N 3.07Å
153	V	96.5	Very high	92.6	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-66.9	-43	174.9	176.2	0	0	0	0	110.5	V94 M97 L98 L133 F144 S149 R155 W156 M157	V94-V153 HydrophobicContact CG1-CG1 4.02Å; V94-V153 HydrophobicContact CG1-CG2 4.37Å; V94-V153 HydrophobicContact CG2-CG2 4.21Å; M97-V153 HydrophobicContact CE-CB 3.94Å; M97-V153 HydrophobicContact CE-CG1 3.77Å; L98-V153 HydrophobicContact CD2-CG1 4.43Å; L133-V153 HydrophobicContact CD2-CG1 3.46Å; L133-V153 VanDerWaalsContact CD2-CG1 3.46Å; F144-V153 HydrophobicContact CD1-CG2 4.21Å; F144-V153 HydrophobicContact CE1-CG2 3.77Å; F144-V153 HydrophobicContact CE2-CG2 4.21Å; F144-V153 HydrophobicContact CZ-CG2 3.76Å; S149-V153 WeakPolarHBondContact O-CB 3.11Å; S149-V153 VanDerWaalsContact O-CG2 3.32Å; S149-V153 WeakPolarHBondContact O-CG2 3.38Å; S149-V153 PolarHBondContact O-N 2.82Å; S149-V153 VanDerWaalsContact O-N 3.11Å; V153-R155 VanDerWaalsContact C-N 3.33Å; V153-R155 PolarHBondContact O-N 2.98Å; V153-W156 PolarHBondContact O-N 3.06Å; V153-M157 HydrophobicContact CG1-CG 4.14Å; V153-M157 WeakPolarHBondContact O-CB 3.36Å; V153-M157 WeakPolarHBondContact O-CG 3.44Å; V153-M157 PolarHBondContact O-N 3.24Å
154	D	95.1	Very high	92.1	Very high	53 Å²	53	61.4 Å²	61.4	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-39.7	179.5	-170.8	70.4	0	0	0	112.4	M97 R101 E150 M157 S158	M97-D154 HydrophobicContact SD-CB 4.14Å; R101-D154 IonicContact CZ-OD1 3.76Å; R101-D154 IonicContact NE-OD1 3.79Å; R101-D154 IonicContact NH1-OD1 3.5Å; R101-D154 PolarHBondContact NH1-OD1 3.18Å; R101-D154 IonicContact NH1-OD2 3.58Å; R101-D154 PolarHBondContact NH1-OD2 3.38Å; R101-D154 VanDerWaalsContact NH1-OD2 3.13Å; E150-D154 WeakPolarHBondContact O-CB 3.12Å; E150-D154 PolarHBondContact O-N 2.95Å; D154-M157 PolarHBondContact O-N 3.22Å; D154-S158 WeakPolarHBondContact O-CB 3.13Å; D154-S158 PolarHBondContact O-N 2.82Å; D154-S158 PolarHBondContact O-OG 3.03Å
155	R	95.8	Very high	91.9	Very high	164 Å²	164	61.5 Å²	61.5	62%	0.619	33%	0.334	S	S	*	.	H	α-helix	trans	-63.2	-46	173.7	-171	-174.6	-55.5	148.8	5.9	111.6	E151 V153 S158 Q159	E151-R155 VanDerWaalsContact O-CB 3.32Å; E151-R155 WeakPolarHBondContact O-CB 3.18Å; E151-R155 PolarHBondContact O-N 3.46Å; V153-R155 VanDerWaalsContact C-N 3.33Å; V153-R155 PolarHBondContact O-N 2.98Å; R155-S158 WeakPolarHBondContact O-CB 3.41Å; R155-S158 PolarHBondContact O-N 2.92Å; R155-Q159 WeakPolarHBondContact O-CG 3.49Å; R155-Q159 PolarHBondContact O-N 2.85Å
156	W	95.3	Very high	91.8	Very high	36 Å²	36	59.6 Å²	59.6	14%	0.136	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-46.3	176.6	-179.7	77	0	0	0	111.2	L133 F142 F144 A152 V153 S158 Q159 M160	L133-W156 HydrophobicContact CD2-CE3 3.89Å; L133-W156 HydrophobicContact CD2-CZ3 3.55Å; L133-W156 HydrophobicContact CG-CH2 4.46Å; L133-W156 HydrophobicContact CG-CZ3 3.82Å; F142-W156 HydrophobicContact CB-CZ2 4.12Å; F144-W156 HydrophobicContact CB-CD2 4.26Å; F144-W156 HydrophobicContact CB-CE3 4.19Å; F144-W156 HydrophobicContact CB-CH2 4.22Å; F144-W156 HydrophobicContact CB-CZ2 4.29Å; F144-W156 HydrophobicContact CB-CZ3 4.19Å; F144-W156 HydrophobicContact CD2-CB 3.77Å; F144-W156 AromaticContact CD2-CD2 3.66Å; F144-W156 HydrophobicContact CD2-CD2 3.66Å; F144-W156 AromaticContact CD2-CE3 3.99Å; F144-W156 HydrophobicContact CD2-CE3 3.99Å; F144-W156 AromaticContact CD2-CG 3.57Å; F144-W156 HydrophobicContact CD2-CG 3.57Å; F144-W156 HydrophobicContact CE2-CB 3.77Å; F144-W156 HydrophobicContact CE2-CG 4.08Å; F144-W156 HydrophobicContact CG-CD2 4.43Å; F144-W156 HydrophobicContact CG-CE3 4.48Å; A152-W156 WeakPolarHBondContact O-CB 3.43Å; A152-W156 PolarHBondContact O-N 2.92Å; A152-W156 VanDerWaalsContact O-N 3.07Å; V153-W156 PolarHBondContact O-N 3.06Å; W156-S158 VanDerWaalsContact C-N 3.29Å; W156-S158 PolarHBondContact O-N 2.9Å; W156-Q159 WeakPolarHBondContact O-CB 3.38Å; W156-Q159 PolarHBondContact O-N 2.99Å; W156-Q159 VanDerWaalsContact O-N 3.16Å; W156-M160 HydrophobicContact CD2-CG 3.93Å; W156-M160 HydrophobicContact CE3-CG 4.39Å; W156-M160 HydrophobicContact CG-CG 4.36Å; W156-M160 HydrophobicContact CH2-CG 4.42Å; W156-M160 HydrophobicContact CZ2-CG 3.95Å; W156-M160 WeakPolarHBondContact O-CB 3.45Å; W156-M160 VanDerWaalsContact O-CG 3.29Å; W156-M160 WeakPolarHBondContact O-CG 3.31Å; W156-M160 PolarHBondContact O-N 3.03Å
157	M	93.1	Very high	91.8	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-38.6	175.3	-74.9	-54	-48.6	0	0	112.5	I78 L98 L133 V153 D154 M160 L161	I78-M157 HydrophobicContact CD1-CE 3.34Å; I78-M157 HydrophobicContact CD1-SD 4.36Å; I78-M157 HydrophobicContact CG1-CE 4.11Å; L98-M157 HydrophobicContact CD2-CG 3.68Å; L98-M157 HydrophobicContact CD2-SD 4.09Å; L133-M157 HydrophobicContact CD2-SD 4.44Å; V153-M157 HydrophobicContact CG1-CG 4.14Å; V153-M157 WeakPolarHBondContact O-CB 3.36Å; V153-M157 WeakPolarHBondContact O-CG 3.44Å; V153-M157 PolarHBondContact O-N 3.24Å; D154-M157 PolarHBondContact O-N 3.22Å; M157-M160 PolarHBondContact O-N 2.86Å; M157-L161 HydrophobicContact CE-CD1 3.8Å; M157-L161 HydrophobicContact CE-CD2 4.36Å; M157-L161 HydrophobicContact CE-CG 3.96Å; M157-L161 WeakPolarHBondContact O-CB 3.47Å; M157-L161 VanDerWaalsContact O-CG 3.23Å; M157-L161 WeakPolarHBondContact O-CG 3.46Å; M157-L161 PolarHBondContact O-N 3.43Å
158	S	92.5	Very high	91.9	Very high	36 Å²	36	56.6 Å²	56.6	25%	0.252	29%	0.287	S	S	.	.	H	α-helix	trans	-59.6	-50.1	174.1	-59.9	0	0	0	0	111	R101 D154 R155 W156 M160 L161 T162	R101-S158 VanDerWaalsContact CZ-OG 3.26Å; R101-S158 PolarHBondContact NH1-OG 2.8Å; R101-S158 VanDerWaalsContact NH1-OG 3.07Å; R101-S158 VanDerWaalsContact NH2-CA 3.29Å; R101-S158 PolarHBondContact NH2-OG 2.92Å; D154-S158 WeakPolarHBondContact O-CB 3.13Å; D154-S158 PolarHBondContact O-N 2.82Å; D154-S158 PolarHBondContact O-OG 3.03Å; R155-S158 WeakPolarHBondContact O-CB 3.41Å; R155-S158 PolarHBondContact O-N 2.92Å; W156-S158 VanDerWaalsContact C-N 3.29Å; W156-S158 PolarHBondContact O-N 2.9Å; S158-M160 VanDerWaalsContact C-N 3.28Å; S158-M160 PolarHBondContact O-N 2.94Å; S158-L161 PolarHBondContact O-N 3.15Å; S158-T162 PolarHBondContact O-N 2.89Å; S158-T162 VanDerWaalsContact O-N 3.13Å; S158-T162 PolarHBondContact O-OG1 3.37Å
159	Q	90.6	Very high	91.9	Very high	98 Å²	98	56.1 Å²	56.1	46%	0.458	29%	0.29	S	S	.	.	H	α-helix	trans	-61.8	-35.9	176	-67.8	172.3	-21.2	0	0	112.6	R155 W156 K208	R155-Q159 WeakPolarHBondContact O-CG 3.49Å; R155-Q159 PolarHBondContact O-N 2.85Å; W156-Q159 WeakPolarHBondContact O-CB 3.38Å; W156-Q159 PolarHBondContact O-N 2.99Å; W156-Q159 VanDerWaalsContact O-N 3.16Å; Q159-K208 PolarHBondContact O-NZ 3.34Å
160	M	89.6	Confident	91.8	Very high	8 Å²	8	55.2 Å²	55.2	4%	0.039	28%	0.283	C	S	.	.	H	α-helix	trans	-74.7	-29.7	-179.2	-67	-50	-73.5	0	0	113.5	Y135 F142 W156 M157 S158 K208	Y135-M160 HydrophobicContact CD1-CB 4.02Å; Y135-M160 HydrophobicContact CD1-CE 3.58Å; Y135-M160 HydrophobicContact CD1-CG 4.39Å; Y135-M160 HydrophobicContact CE1-CB 4.14Å; Y135-M160 HydrophobicContact CE1-CE 4.1Å; F142-M160 HydrophobicContact CB-CE 3.64Å; F142-M160 HydrophobicContact CD1-CE 3.59Å; F142-M160 HydrophobicContact CD2-CE 3.66Å; F142-M160 HydrophobicContact CE1-CE 4.08Å; F142-M160 HydrophobicContact CE2-CE 4.16Å; F142-M160 HydrophobicContact CG-CE 3.33Å; F142-M160 HydrophobicContact CZ-CE 4.33Å; W156-M160 HydrophobicContact CD2-CG 3.93Å; W156-M160 HydrophobicContact CE3-CG 4.39Å; W156-M160 HydrophobicContact CG-CG 4.36Å; W156-M160 HydrophobicContact CH2-CG 4.42Å; W156-M160 HydrophobicContact CZ2-CG 3.95Å; W156-M160 WeakPolarHBondContact O-CB 3.45Å; W156-M160 VanDerWaalsContact O-CG 3.29Å; W156-M160 WeakPolarHBondContact O-CG 3.31Å; W156-M160 PolarHBondContact O-N 3.03Å; M157-M160 PolarHBondContact O-N 2.86Å; S158-M160 VanDerWaalsContact C-N 3.28Å; S158-M160 PolarHBondContact O-N 2.94Å; M160-K208 VanDerWaalsContact CE-CE 3.41Å; M160-K208 WeakPolarHBondContact O-CD 3.43Å; M160-K208 VanDerWaalsContact O-CE 3.31Å; M160-K208 WeakPolarHBondContact O-CE 3.4Å; M160-K208 WeakPolarHBondContact SD-CE 3.39Å
161	L	86.7	Confident	91.7	Very high	52 Å²	52	57.9 Å²	57.9	27%	0.272	30%	0.304	S	S	.	.	H	α-helix	trans	-93.6	-11.8	-178.3	-66.3	171.1	0	0	0	114.2	I105 P111 M157 S158	I105-L161 HydrophobicContact CD1-CD1 3.89Å; P111-L161 HydrophobicContact CG-CD2 4.33Å; M157-L161 HydrophobicContact CE-CD1 3.8Å; M157-L161 HydrophobicContact CE-CD2 4.36Å; M157-L161 HydrophobicContact CE-CG 3.96Å; M157-L161 WeakPolarHBondContact O-CB 3.47Å; M157-L161 VanDerWaalsContact O-CG 3.23Å; M157-L161 WeakPolarHBondContact O-CG 3.46Å; M157-L161 PolarHBondContact O-N 3.43Å; S158-L161 PolarHBondContact O-N 3.15Å
162	T	85.8	Confident	91.6	Very high	94 Å²	94	54.1 Å²	54.1	58%	0.577	29%	0.287	S	S	*	.	S	Bend	trans	-70.9	127.5	174.1	-58.1	0	0	0	0	110.8	S158	S158-T162 PolarHBondContact O-N 2.89Å; S158-T162 VanDerWaalsContact O-N 3.13Å; S158-T162 PolarHBondContact O-OG1 3.37Å
163	S	81.9	Confident	91.4	Very high	56 Å²	56	53 Å²	53	39%	0.392	28%	0.279	S	S	.	.			trans	-70.6	137.4	170.3	-180	0	0	0	0	110.6	V165 D204	S163-V165 PolarHBondContact OG-N 3.48Å; S163-D204 VanDerWaalsContact OG-CG 3.25Å; S163-D204 PolarHBondContact OG-OD1 3.4Å
164	S	82.9	Confident	91	Very high	54 Å²	54	54.2 Å²	54.2	38%	0.378	28%	0.284	S	S	.	.			trans	-103.1	0.5	173.1	55.9	0	0	0	0	112.9
165	V	92.3	Very high	90.6	Very high	23 Å²	23	57.4 Å²	57.4	14%	0.139	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-82.3	132.5	-175	-175.3	0	0	0	0	110.8	S163 D204 A207 F218 K220	S163-V165 PolarHBondContact OG-N 3.48Å; V165-D204 WeakPolarHBondContact CB-OD1 3.27Å; V165-D204 HydrophobicContact CG2-CB 4.49Å; V165-D204 WeakPolarHBondContact CG2-OD1 3.39Å; V165-A207 HydrophobicContact CG2-CB 3.37Å; V165-F218 WeakPolarHBondContact CA-O 3.41Å; V165-F218 HydrophobicContact CG1-CB 4.48Å; V165-F218 HydrophobicContact CG2-CB 4.01Å; V165-K220 HydrophobicContact CG1-CD 3.9Å; V165-K220 HydrophobicContact CG1-CG 3.65Å
166	R	92	Very high	90.1	Very high	94 Å²	94	50.4 Å²	50.4	36%	0.355	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	142	174.8	-53	-174.3	-170.1	126	13.3	111.2	D217 F218 F219 K220	R166-D217 IonicContact CZ-OD2 3.83Å; R166-D217 IonicContact NH1-OD2 3.61Å; R166-D217 PolarHBondContact NH1-OD2 2.84Å; R166-D217 IonicContact NH2-OD1 3.13Å; R166-D217 IonicContact NH2-OD2 3.68Å; R166-F218 PolarHBondContact N-O 2.8Å; R166-F219 HydrophobicContact CB-CD1 3.97Å; R166-F219 HydrophobicContact CB-CE1 4.29Å; R166-F219 CarbonylContact O-C 3.33Å; R166-F219 VanDerWaalsContact O-CA 3.26Å; R166-F219 WeakPolarHBondContact O-CA 3.28Å; R166-K220 PolarHBondContact O-N 3.43Å
167	L	93.5	Very high	89.6	Confident	115 Å²	115	50.2 Å²	50.2	60%	0.602	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	129.7	166.3	-176.7	68.5	0	0	0	108	K220	L167-K220 HydrophobicContact CD1-CB 4.11Å
168	V	94.4	Very high	89.2	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.012	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154.6	177.2	-60.8	0	0	0	0	110.2	N172 F173 V176 F219 K220 L221	V168-N172 WeakPolarHBondContact CA-OD1 3.49Å; V168-N172 VanDerWaalsContact CB-OD1 3.31Å; V168-N172 WeakPolarHBondContact CB-OD1 3.47Å; V168-F173 HydrophobicContact CG2-CD2 4.04Å; V168-V176 HydrophobicContact CG1-CB 4.47Å; V168-V176 HydrophobicContact CG1-CG1 4.37Å; V168-F219 HydrophobicContact CG1-CB 4.18Å; V168-F219 HydrophobicContact CG1-CD1 3.98Å; V168-F219 HydrophobicContact CG1-CD2 4.46Å; V168-F219 HydrophobicContact CG1-CG 3.96Å; V168-F219 HydrophobicContact CG2-CB 3.82Å; V168-F219 HydrophobicContact CG2-CG 4.34Å; V168-K220 WeakPolarHBondContact CG2-O 3.03Å; V168-K220 PolarHBondContact N-O 2.97Å; V168-L221 HydrophobicContact CG2-CB 3.99Å; V168-L221 HydrophobicContact CG2-CD1 4.3Å; V168-L221 HydrophobicContact CG2-CG 4.33Å
169	D	93.5	Very high	88.8	Confident	53 Å²	53	62.7 Å²	62.7	28%	0.283	32%	0.32	S	S	.	.			trans	-137.9	-179.9	176.4	59.7	36.7	0	0	0	110.1	T171 N172 F173	D169-T171 PolarHBondContact O-N 3.35Å; D169-T171 VanDerWaalsContact O-N 3.11Å; D169-T171 WeakPolarHBondContact OD1-CA 3.48Å; D169-T171 WeakPolarHBondContact OD1-CB 3.43Å; D169-T171 PolarHBondContact OD1-N 2.86Å; D169-T171 PolarHBondContact OD1-OG1 3.25Å; D169-N172 PolarHBondContact N-OD1 3.04Å; D169-N172 PolarHBondContact O-N 2.95Å; D169-N172 PolarHBondContact O-OD1 3.2Å; D169-N172 PolarHBondContact OD1-N 2.95Å; D169-N172 VanDerWaalsContact OD1-N 3.08Å; D169-N172 PolarHBondContact OD1-ND2 3.37Å; D169-F173 VanDerWaalsContact O-CB 3.26Å; D169-F173 WeakPolarHBondContact O-CB 3.22Å; D169-F173 PolarHBondContact O-N 3.31Å
170	S	91.6	Very high	88.3	Confident	14 Å²	14	60.5 Å²	60.5	10%	0.098	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-24.3	177.3	44.8	0	0	0	0	114.5	N227	S170-N227 WeakPolarHBondContact CB-OD1 3.41Å; S170-N227 PolarHBondContact N-OD1 2.9Å; S170-N227 PolarHBondContact OG-OD1 3.25Å
171	T	91.2	Very high	88	Confident	119 Å²	119	63.4 Å²	63.4	73%	0.73	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-30.1	-175.1	70.7	0	0	0	0	113.5	D169	D169-T171 PolarHBondContact O-N 3.35Å; D169-T171 VanDerWaalsContact O-N 3.11Å; D169-T171 WeakPolarHBondContact OD1-CA 3.48Å; D169-T171 WeakPolarHBondContact OD1-CB 3.43Å; D169-T171 PolarHBondContact OD1-N 2.86Å; D169-T171 PolarHBondContact OD1-OG1 3.25Å
172	N	92.5	Very high	88.2	Confident	42 Å²	42	61.7 Å²	61.7	23%	0.225	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-8.8	-174.3	66.2	28.8	0	0	0	114	V168 D169 E174 E175 V176	V168-N172 WeakPolarHBondContact CA-OD1 3.49Å; V168-N172 VanDerWaalsContact CB-OD1 3.31Å; V168-N172 WeakPolarHBondContact CB-OD1 3.47Å; D169-N172 PolarHBondContact N-OD1 3.04Å; D169-N172 PolarHBondContact O-N 2.95Å; D169-N172 PolarHBondContact O-OD1 3.2Å; D169-N172 PolarHBondContact OD1-N 2.95Å; D169-N172 VanDerWaalsContact OD1-N 3.08Å; D169-N172 PolarHBondContact OD1-ND2 3.37Å; N172-E174 PolarHBondContact O-N 3.46Å; N172-E175 PolarHBondContact O-N 2.04Å; N172-V176 HydrophobicContact CB-CG2 4.47Å; N172-V176 VanDerWaalsContact O-CG2 3.3Å; N172-V176 WeakPolarHBondContact O-CG2 3.4Å; N172-V176 PolarHBondContact O-N 3.33Å
173	F	92	Very high	88.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-55.6	-46.7	-173.5	178.5	-100.5	0	0	0	112.8	V168 D169 V176 R177 V185 L221 F230 F235	V168-F173 HydrophobicContact CG2-CD2 4.04Å; D169-F173 VanDerWaalsContact O-CB 3.26Å; D169-F173 WeakPolarHBondContact O-CB 3.22Å; D169-F173 PolarHBondContact O-N 3.31Å; F173-V176 PolarHBondContact O-N 2.57Å; F173-R177 HydrophobicContact CE1-CB 4.49Å; F173-R177 HydrophobicContact CZ-CG 4.48Å; F173-R177 WeakPolarHBondContact O-CB 3.37Å; F173-R177 PolarHBondContact O-N 3.09Å; F173-V185 HydrophobicContact CE2-CG2 4.04Å; F173-L221 HydrophobicContact CD2-CD1 4.49Å; F173-F230 HydrophobicContact CB-CE1 4.11Å; F173-F230 HydrophobicContact CB-CZ 3.89Å; F173-F230 HydrophobicContact CD1-CE1 4.13Å; F173-F230 AromaticContact CD1-CZ 3.6Å; F173-F230 HydrophobicContact CD1-CZ 3.6Å; F173-F230 HydrophobicContact CE1-CZ 4.33Å; F173-F230 HydrophobicContact CG-CE1 4.05Å; F173-F230 AromaticContact CG-CZ 3.88Å; F173-F230 HydrophobicContact CG-CZ 3.88Å; F173-F235 HydrophobicContact CE1-CE2 4.4Å; F173-F235 HydrophobicContact CE1-CZ 4.07Å; F173-F235 AromaticContact CE2-CZ 3.83Å; F173-F235 HydrophobicContact CE2-CZ 3.83Å; F173-F235 HydrophobicContact CZ-CE1 4.28Å; F173-F235 HydrophobicContact CZ-CE2 4.21Å; F173-F235 AromaticContact CZ-CZ 3.47Å; F173-F235 HydrophobicContact CZ-CZ 3.47Å; F173-F235 VanDerWaalsContact CZ-CZ 3.47Å
174	E	88	Confident	89.2	Confident	25 Å²	25	54.7 Å²	54.7	12%	0.117	28%	0.281	C	S	.	.	H	α-helix	trans	-68.7	-42.7	-177.7	-69.8	-55.5	140.6	0	0	112.9	N172 V176 R177 Q178 R234	N172-E174 PolarHBondContact O-N 3.46Å; E174-V176 VanDerWaalsContact C-N 3.26Å; E174-V176 PolarHBondContact O-N 3.41Å; E174-R177 PolarHBondContact O-N 2.74Å; E174-R177 IonicContact OE1-NE 3.76Å; E174-R177 IonicContact OE2-CZ 3.34Å; E174-R177 IonicContact OE2-NE 3.03Å; E174-R177 PolarHBondContact OE2-NE 3.16Å; E174-R177 IonicContact OE2-NH2 2.77Å; E174-R177 PolarHBondContact OE2-NH2 3.17Å; E174-Q178 WeakPolarHBondContact O-CB 3.49Å; E174-Q178 VanDerWaalsContact O-CG 3.25Å; E174-Q178 WeakPolarHBondContact O-CG 3.29Å; E174-Q178 PolarHBondContact O-N 3.11Å; E174-R234 IonicContact OE1-CZ 3.17Å; E174-R234 IonicContact OE1-NE 2.79Å; E174-R234 PolarHBondContact OE1-NE 3.13Å; E174-R234 IonicContact OE1-NH2 2.71Å; E174-R234 PolarHBondContact OE1-NH2 3.08Å; E174-R234 IonicContact OE2-NH2 3.34Å; E174-R234 PolarHBondContact OE2-NH2 3.22Å
175	E	87.7	Confident	89.8	Confident	119 Å²	119	52.1 Å²	52.1	56%	0.556	26%	0.264	S	S	*	.	H	α-helix	trans	-60.5	-40.6	178.2	-165	-151.5	134	0	0	111.1	N172 R179	N172-E175 PolarHBondContact O-N 2.04Å; E175-R179 IonicContact OE1-CZ 3.67Å; E175-R179 IonicContact OE1-NH2 2.78Å; E175-R179 PolarHBondContact OE1-NH2 3.36Å
176	V	85.3	Confident	90	Very high	17 Å²	17	51 Å²	51	10%	0.103	26%	0.257	C	S	.	.	H	α-helix	trans	-77.9	-40.7	-178.6	-177.6	0	0	0	0	110.9	V168 N172 F173 E174 Q178 R179 F219	V168-V176 HydrophobicContact CG1-CB 4.47Å; V168-V176 HydrophobicContact CG1-CG1 4.37Å; N172-V176 HydrophobicContact CB-CG2 4.47Å; N172-V176 VanDerWaalsContact O-CG2 3.3Å; N172-V176 WeakPolarHBondContact O-CG2 3.4Å; N172-V176 PolarHBondContact O-N 3.33Å; F173-V176 PolarHBondContact O-N 2.57Å; E174-V176 VanDerWaalsContact C-N 3.26Å; E174-V176 PolarHBondContact O-N 3.41Å; V176-Q178 PolarHBondContact O-N 3.24Å; V176-R179 WeakPolarHBondContact O-CB 3.29Å; V176-R179 PolarHBondContact O-N 2.92Å; V176-F219 HydrophobicContact CG1-CD1 4.41Å; V176-F219 HydrophobicContact CG1-CE1 3.53Å; V176-F219 HydrophobicContact CG1-CE2 4.33Å; V176-F219 HydrophobicContact CG1-CZ 3.49Å; V176-F219 VanDerWaalsContact CG1-CZ 3.49Å
177	R	84.9	Confident	90.1	Very high	33 Å²	33	46.6 Å²	46.6	13%	0.125	24%	0.24	C	C	.	.	H	α-helix	trans	-62.8	-41.2	179.5	-175.6	-171.4	71.1	91.7	-2.5	111.7	F173 E174 R179 H180 N252	F173-R177 HydrophobicContact CE1-CB 4.49Å; F173-R177 HydrophobicContact CZ-CG 4.48Å; F173-R177 WeakPolarHBondContact O-CB 3.37Å; F173-R177 PolarHBondContact O-N 3.09Å; E174-R177 PolarHBondContact O-N 2.74Å; E174-R177 IonicContact OE1-NE 3.76Å; E174-R177 IonicContact OE2-CZ 3.34Å; E174-R177 IonicContact OE2-NE 3.03Å; E174-R177 PolarHBondContact OE2-NE 3.16Å; E174-R177 IonicContact OE2-NH2 2.77Å; E174-R177 PolarHBondContact OE2-NH2 3.17Å; R177-R179 PolarHBondContact O-N 3.33Å; R177-H180 PolarHBondContact O-N 2.96Å; R177-H180 VanDerWaalsContact O-N 3.13Å; R177-N252 PolarHBondContact NH1-OD1 3.44Å; R177-N252 PolarHBondContact NH2-OD1 3.48Å
178	Q	84.2	Confident	90.2	Very high	148 Å²	148	41.7 Å²	41.7	69%	0.692	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.3	-178.7	-74.1	176.3	14.8	0	0	113.9	E174 V176 H180	E174-Q178 WeakPolarHBondContact O-CB 3.49Å; E174-Q178 VanDerWaalsContact O-CG 3.25Å; E174-Q178 WeakPolarHBondContact O-CG 3.29Å; E174-Q178 PolarHBondContact O-N 3.11Å; V176-Q178 PolarHBondContact O-N 3.24Å; Q178-H180 VanDerWaalsContact C-N 3.32Å
179	R	84	Confident	90.1	Very high	150 Å²	150	42.2 Å²	42.2	57%	0.566	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-25.5	177.2	-61.2	-179.7	-173	-168.7	2.2	113.1	E175 V176 R177	E175-R179 IonicContact OE1-CZ 3.67Å; E175-R179 IonicContact OE1-NH2 2.78Å; E175-R179 PolarHBondContact OE1-NH2 3.36Å; V176-R179 WeakPolarHBondContact O-CB 3.29Å; V176-R179 PolarHBondContact O-N 2.92Å; R177-R179 PolarHBondContact O-N 3.33Å
180	H	81.1	Confident	90	Very high	52 Å²	52	44.6 Å²	44.6	24%	0.241	23%	0.227	C	C	.	.			trans	-133.4	138.7	-175	-66	-93.6	0	0	0	111.3	R177 Q178 T182 D217	R177-H180 PolarHBondContact O-N 2.96Å; R177-H180 VanDerWaalsContact O-N 3.13Å; Q178-H180 VanDerWaalsContact C-N 3.32Å; H180-T182 PolarHBondContact O-N 3.05Å; H180-D217 HydrophobicContact CB-CB 4.35Å; H180-D217 IonicContact CD2-OD1 2.83Å; H180-D217 IonicContact CD2-OD2 3.86Å; H180-D217 PolarHBondContact CD2-OD2 2.66Å; H180-D217 IonicContact CE1-OD1 3.92Å; H180-D217 IonicContact CE1-OD2 3.01Å; H180-D217 IonicContact CG-OD2 3.85Å; H180-D217 IonicContact NE2-OD1 2.65Å; H180-D217 IonicContact NE2-OD2 3.61Å; H180-D217 PolarHBondContact NE2-OD2 3.43Å; H180-D217 VanDerWaalsContact NE2-OD2 3.17Å
181	A	83	Confident	89.8	Confident	70 Å²	70	52 Å²	52	58%	0.579	26%	0.26	S	S	*	.	S	Bend	trans	-67.4	-25.1	-179.4	0	0	0	0	0	112.9	A250	A181-A250 WeakPolarHBondContact O-CA 3.35Å
182	T	91	Very high	89.6	Confident	15 Å²	15	49.4 Å²	49.4	9%	0.092	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134	-177.7	-57.2	0	0	0	0	110.5	H180 I216 D217 L248 V249 A250 I278	H180-T182 PolarHBondContact O-N 3.05Å; T182-I216 HydrophobicContact CG2-CG1 4.32Å; T182-I216 HydrophobicContact CG2-CG2 4.5Å; T182-I216 WeakPolarHBondContact O-CA 3.26Å; T182-D217 PolarHBondContact O-N 3.25Å; T182-L248 HydrophobicContact CG2-CD1 3.68Å; T182-V249 CarbonylContact C-O 3.45Å; T182-V249 WeakPolarHBondContact CA-O 3.32Å; T182-A250 HydrophobicContact CG2-CB 4.25Å; T182-I278 HydrophobicContact CG2-CD1 4.08Å; T182-I278 HydrophobicContact CG2-CG1 4.31Å
183	S	93.2	Very high	89.4	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.014	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.6	174.2	61.2	0	0	0	0	111.9	D217 V249	S183-D217 CarbonylContact C-O 3.5Å; S183-D217 WeakPolarHBondContact CA-O 2.9Å; S183-V249 PolarHBondContact N-O 3.23Å; S183-V249 PolarHBondContact O-N 3.41Å
184	V	94.6	Very high	89.1	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	117.8	177.2	-172.4	0	0	0	0	108	W203 I216 D217 F218 F219 V246 V247 L248 I274	V184-W203 HydrophobicContact CB-CZ2 4.47Å; V184-W203 HydrophobicContact CG1-CH2 3.65Å; V184-W203 HydrophobicContact CG1-CZ2 3.8Å; V184-I216 HydrophobicContact CG2-CG2 3.77Å; V184-D217 PolarHBondContact N-O 3.39Å; V184-F218 HydrophobicContact CB-CD1 3.87Å; V184-F218 HydrophobicContact CB-CE1 3.87Å; V184-F218 HydrophobicContact CB-CG 4.42Å; V184-F218 HydrophobicContact CB-CZ 4.42Å; V184-F218 HydrophobicContact CG1-CD1 4.23Å; V184-F218 HydrophobicContact CG1-CE1 4.06Å; V184-F218 HydrophobicContact CG2-CD1 4.47Å; V184-F218 HydrophobicContact CG2-CE1 4.06Å; V184-F218 HydrophobicContact CG2-CZ 4.15Å; V184-F218 CarbonylContact O-C 3.52Å; V184-F218 WeakPolarHBondContact O-CA 3.34Å; V184-F219 PolarHBondContact O-N 3.4Å; V184-V246 HydrophobicContact CG1-CG1 3.62Å; V184-V247 WeakPolarHBondContact CA-O 3.4Å; V184-L248 HydrophobicContact CG2-CD1 3.81Å; V184-I274 HydrophobicContact CG1-CD1 4.44Å; V184-I274 HydrophobicContact CG2-CD1 3.76Å; V184-I274 HydrophobicContact CG2-CG1 4.03Å
185	V	95.3	Very high	89.1	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	124.5	-175.2	-170.5	0	0	0	0	109.3	F173 L187 F219 L221 V246 V247 V249	F173-V185 HydrophobicContact CE2-CG2 4.04Å; V185-L187 HydrophobicContact CG1-CD2 3.88Å; V185-F219 HydrophobicContact CG1-CB 4.46Å; V185-F219 HydrophobicContact CG2-CB 4.35Å; V185-F219 HydrophobicContact CG2-CD2 4.16Å; V185-L221 HydrophobicContact CG1-CB 3.93Å; V185-V246 WeakPolarHBondContact O-CA 3.46Å; V185-V247 PolarHBondContact N-O 3.45Å; V185-V247 PolarHBondContact O-N 2.9Å; V185-V249 HydrophobicContact CG2-CG2 3.92Å
186	L	96.1	Very high	89.2	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	114.4	165	-176.7	76.7	0	0	0	109.4	A199 W203 F219 L221 P244 Q245 V246 I261	L186-A199 VanDerWaalsContact CD2-CA 3.49Å; L186-A199 HydrophobicContact CD2-CB 3.83Å; L186-W203 HydrophobicContact CB-CD2 3.86Å; L186-W203 VanDerWaalsContact CB-CE2 3.49Å; L186-W203 HydrophobicContact CB-CE3 4.42Å; L186-W203 HydrophobicContact CB-CG 4.22Å; L186-W203 HydrophobicContact CB-CH2 4.34Å; L186-W203 HydrophobicContact CB-CZ2 3.77Å; L186-W203 HydrophobicContact CD1-CD2 4.38Å; L186-W203 HydrophobicContact CD1-CE3 4.18Å; L186-W203 HydrophobicContact CD1-CZ3 4.31Å; L186-W203 HydrophobicContact CD2-CB 3.98Å; L186-W203 HydrophobicContact CD2-CD2 3.97Å; L186-W203 HydrophobicContact CD2-CE3 4.41Å; L186-W203 HydrophobicContact CD2-CG 3.75Å; L186-W203 HydrophobicContact CG-CD2 4.31Å; L186-F219 PolarHBondContact N-O 3.41Å; L186-L221 PolarHBondContact O-N 2.65Å; L186-P244 HydrophobicContact CD1-CB 3.88Å; L186-P244 HydrophobicContact CG-CB 4.44Å; L186-Q245 WeakPolarHBondContact CA-O 3.45Å; L186-V246 HydrophobicContact CD1-CG2 3.78Å; L186-I261 HydrophobicContact CD1-CD1 4.03Å
187	L	95.3	Very high	89.3	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	122.3	169.8	-53.3	176.7	0	0	0	108.4	V185 L221 V231 I237 C239 P244 Q245 V247	V185-L187 HydrophobicContact CG1-CD2 3.88Å; L187-L221 HydrophobicContact CD2-CB 4.1Å; L187-L221 HydrophobicContact CD2-CD1 4.42Å; L187-L221 HydrophobicContact CD2-CD2 4.3Å; L187-V231 HydrophobicContact CD1-CG1 3.87Å; L187-V231 HydrophobicContact CD2-CG1 4.26Å; L187-V231 HydrophobicContact CD2-CG2 3.96Å; L187-I237 HydrophobicContact CD1-CG2 4.23Å; L187-C239 HydrophobicContact CB-CB 4.42Å; L187-C239 HydrophobicContact CD1-CB 4.42Å; L187-P244 CarbonylContact O-C 3.58Å; L187-P244 VanDerWaalsContact O-CA 3.25Å; L187-P244 WeakPolarHBondContact O-CA 3.31Å; L187-P244 VanDerWaalsContact O-CB 3.25Å; L187-P244 WeakPolarHBondContact O-CB 3.36Å; L187-Q245 HydrophobicContact CB-CB 4.28Å; L187-Q245 HydrophobicContact CD1-CB 4.4Å; L187-Q245 PolarHBondContact N-O 2.7Å; L187-Q245 PolarHBondContact O-N 3.35Å; L187-V247 HydrophobicContact CD1-CG2 3.73Å; L187-V247 HydrophobicContact CG-CG2 4.23Å
188	Y	94.9	Very high	89.3	Confident	12 Å²	12	58.7 Å²	58.7	5%	0.047	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	162.2	-177.7	75.3	-78.6	0	0	0	111.5	Q190 A199 K220 L221 E222 C223	Y188-Q190 HydrophobicContact CE2-CG 4.02Å; Y188-A199 HydrophobicContact CD1-CB 3.67Å; Y188-A199 HydrophobicContact CD2-CB 3.33Å; Y188-A199 HydrophobicContact CE1-CB 3.99Å; Y188-A199 HydrophobicContact CE2-CB 3.66Å; Y188-A199 HydrophobicContact CG-CB 3.32Å; Y188-K220 HydrophobicContact CD1-CB 4.44Å; Y188-K220 HydrophobicContact CE1-CB 3.87Å; Y188-L221 VanDerWaalsContact CD1-O 3.3Å; Y188-L221 WeakPolarHBondContact CD1-O 3.26Å; Y188-L221 PolarHBondContact N-O 3.1Å; Y188-E222 HydrophobicContact CE1-CB 4.11Å; Y188-E222 HydrophobicContact CE2-CB 4.33Å; Y188-E222 HydrophobicContact CE2-CG 4.29Å; Y188-E222 CarbonylContact O-C 3.51Å; Y188-E222 WeakPolarHBondContact O-CA 3.39Å; Y188-C223 PolarHBondContact O-N 2.69Å
189	S	93	Very high	89.4	Confident	13 Å²	13	52 Å²	52	9%	0.091	27%	0.271	C	S	.	.			trans	-123.8	133.3	174	174.6	0	0	0	0	110.4	E191 C195 C243	S189-E191 VanDerWaalsContact C-N 3.26Å; S189-E191 PolarHBondContact OG-N 3.28Å; S189-C195 PolarHBondContact N-SG 3.32Å; S189-C195 VanDerWaalsContact N-SG 3.41Å; S189-C243 PolarHBondContact N-SG 2.89Å
190	Q	90.8	Very high	89.5	Confident	104 Å²	104	46.4 Å²	46.4	49%	0.486	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-23.8	174.2	-68	-72.7	14.1	0	0	112.6	Y188 N192 E222	Y188-Q190 HydrophobicContact CE2-CG 4.02Å; Q190-N192 PolarHBondContact O-N 3.26Å; Q190-E222 VanDerWaalsContact CG-CD 3.47Å; Q190-E222 HydrophobicContact CG-CG 3.97Å; Q190-E222 WeakPolarHBondContact CG-OE1 3.42Å
191	E	87.7	Confident	89.7	Confident	169 Å²	169	47 Å²	47	79%	0.79	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.2	-179.1	-61.1	178.2	174.2	0	0	112.2	S189	S189-E191 VanDerWaalsContact C-N 3.26Å; S189-E191 PolarHBondContact OG-N 3.28Å
192	N	87.3	Confident	89.9	Confident	64 Å²	64	45.7 Å²	45.7	34%	0.342	24%	0.241	S	C	.	.	S	Bend	trans	-107.3	107.4	176.5	-179.2	-18.3	0	0	0	109.9	Q190 L194 C195 A196	Q190-N192 PolarHBondContact O-N 3.26Å; N192-L194 VanDerWaalsContact C-N 3.27Å; N192-L194 PolarHBondContact O-N 3.41Å; N192-L194 PolarHBondContact OD1-N 2.86Å; N192-L194 VanDerWaalsContact OD1-N 3.09Å; N192-C195 HydrophobicContact CB-CB 3.84Å; N192-C195 WeakPolarHBondContact O-CA 3.44Å; N192-C195 WeakPolarHBondContact O-CB 3.5Å; N192-C195 PolarHBondContact O-N 3.48Å; N192-C195 PolarHBondContact OD1-N 3.35Å; N192-A196 PolarHBondContact O-N 2.81Å
193	E	87.3	Confident	89.9	Confident	172 Å²	172	45 Å²	45	80%	0.804	24%	0.237	S	C	*	.	H	α-helix	trans	-53.4	-41.1	-178.5	-65.8	-174.6	170	0	0	113.3	C195 A196 A197	E193-C195 VanDerWaalsContact C-N 3.32Å; E193-C195 PolarHBondContact O-N 3.33Å; E193-A196 PolarHBondContact O-N 3.03Å; E193-A197 WeakPolarHBondContact O-CB 3.29Å; E193-A197 PolarHBondContact O-N 2.76Å
194	L	85.9	Confident	89.8	Confident	119 Å²	119	46.3 Å²	46.3	62%	0.623	24%	0.244	S	C	*	.	H	α-helix	trans	-66.5	-36.7	177.7	-70.3	176.5	0	0	0	111.5	N192 Y198 Y262	N192-L194 VanDerWaalsContact C-N 3.27Å; N192-L194 PolarHBondContact O-N 3.41Å; N192-L194 PolarHBondContact OD1-N 2.86Å; N192-L194 VanDerWaalsContact OD1-N 3.09Å; L194-Y198 VanDerWaalsContact O-CD2 3.29Å; L194-Y198 WeakPolarHBondContact O-CD2 3.5Å; L194-Y262 HydrophobicContact CB-CE1 4.45Å
195	C	88.9	Confident	89.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-71.7	-44.8	177.2	-168.5	0	0	0	0	111.5	S189 N192 E193 A197 Y198 C243 P244	S189-C195 PolarHBondContact N-SG 3.32Å; S189-C195 VanDerWaalsContact N-SG 3.41Å; N192-C195 HydrophobicContact CB-CB 3.84Å; N192-C195 WeakPolarHBondContact O-CA 3.44Å; N192-C195 WeakPolarHBondContact O-CB 3.5Å; N192-C195 PolarHBondContact O-N 3.48Å; N192-C195 PolarHBondContact OD1-N 3.35Å; E193-C195 VanDerWaalsContact C-N 3.32Å; E193-C195 PolarHBondContact O-N 3.33Å; C195-A197 VanDerWaalsContact C-N 3.29Å; C195-A197 PolarHBondContact O-N 3.21Å; C195-Y198 PolarHBondContact O-N 2.93Å; C195-C243 HydrophobicContact CB-CB 3.92Å; C195-C243 WeakPolarHBondContact CB-SG 3.31Å; C195-C243 WeakPolarHBondContact SG-CB 3.33Å; C195-C243 CovalentContact SG-SG 2.04Å; C195-C243 PolarHBondContact SG-SG 3.16Å; C195-P244 HydrophobicContact CB-CG 4.4Å; C195-P244 WeakPolarHBondContact SG-CA 3.45Å; C195-P244 VanDerWaalsContact SG-CB 3.54Å; C195-P244 VanDerWaalsContact SG-CG 3.58Å
196	A	89.2	Confident	89.2	Confident	20 Å²	20	47.5 Å²	47.5	17%	0.165	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-35.7	178.3	0	0	0	0	0	112.8	N192 E193 Y198 A199 G200	N192-A196 PolarHBondContact O-N 2.81Å; E193-A196 PolarHBondContact O-N 3.03Å; A196-Y198 VanDerWaalsContact C-N 3.28Å; A196-Y198 PolarHBondContact O-N 2.87Å; A196-A199 WeakPolarHBondContact O-CB 3.23Å; A196-A199 PolarHBondContact O-N 3.13Å; A196-A199 VanDerWaalsContact O-N 3.1Å; A196-G200 PolarHBondContact O-N 3.06Å
197	A	86.7	Confident	89	Confident	67 Å²	67	47.6 Å²	47.6	55%	0.554	25%	0.249	S	C	*	.	H	α-helix	trans	-57.5	-37.9	179.7	0	0	0	0	0	113.3	E193 C195 G200	E193-A197 WeakPolarHBondContact O-CB 3.29Å; E193-A197 PolarHBondContact O-N 2.76Å; C195-A197 VanDerWaalsContact C-N 3.29Å; C195-A197 PolarHBondContact O-N 3.21Å; A197-G200 PolarHBondContact O-N 3.11Å
198	Y	85.7	Confident	88.7	Confident	53 Å²	53	47.9 Å²	47.9	21%	0.208	25%	0.25	C	S	.	.	I	π-helix	trans	-75	-28	179.2	-76.6	-97.3	0	0	0	112.6	L194 C195 A196 G200 W202 W203 P244 I261 Y262	L194-Y198 VanDerWaalsContact O-CD2 3.29Å; L194-Y198 WeakPolarHBondContact O-CD2 3.5Å; C195-Y198 PolarHBondContact O-N 2.93Å; A196-Y198 VanDerWaalsContact C-N 3.28Å; A196-Y198 PolarHBondContact O-N 2.87Å; Y198-G200 PolarHBondContact O-N 3.34Å; Y198-W202 AromaticContact CD1-CD2 3.69Å; Y198-W202 HydrophobicContact CD1-CD2 3.69Å; Y198-W202 AromaticContact CD1-CE3 3.58Å; Y198-W202 HydrophobicContact CD1-CE3 3.58Å; Y198-W202 HydrophobicContact CD1-CG 4.27Å; Y198-W202 HydrophobicContact CD1-CH2 4.15Å; Y198-W202 HydrophobicContact CD1-CZ2 4.26Å; Y198-W202 AromaticContact CD1-CZ3 3.81Å; Y198-W202 HydrophobicContact CD1-CZ3 3.81Å; Y198-W202 HydrophobicContact CE1-CD2 4.26Å; Y198-W202 HydrophobicContact CE1-CZ2 4.43Å; Y198-W202 HydrophobicContact CG-CE3 4.33Å; Y198-W203 WeakPolarHBondContact O-CB 3.4Å; Y198-W203 PolarHBondContact O-N 2.83Å; Y198-P244 HydrophobicContact CD2-CG 4.49Å; Y198-P244 HydrophobicContact CG-CG 4.27Å; Y198-I261 HydrophobicContact CD1-CD1 4.33Å; Y198-I261 VanDerWaalsContact CE1-O 3.29Å; Y198-I261 WeakPolarHBondContact CE1-O 3.31Å; Y198-I261 HydrophobicContact CG-CD1 4.44Å; Y198-Y262 HydrophobicContact CD2-CD1 4.21Å; Y198-Y262 AromaticContact CD2-CE1 3.93Å; Y198-Y262 HydrophobicContact CD2-CE1 3.93Å; Y198-Y262 AromaticContact CE2-CD1 3.38Å; Y198-Y262 HydrophobicContact CE2-CD1 3.38Å; Y198-Y262 AromaticContact CE2-CE1 3.46Å; Y198-Y262 HydrophobicContact CE2-CE1 3.46Å; Y198-Y262 VanDerWaalsContact CE2-CE1 3.46Å; Y198-Y262 AromaticContact CZ-CD1 3.62Å
199	A	86.7	Confident	88.4	Confident	9 Å²	9	47.3 Å²	47.3	7%	0.074	25%	0.248	C	C	.	.	I	π-helix	trans	-71.2	-8.2	171.8	0	0	0	0	0	113.5	L186 Y188 A196 K220	L186-A199 VanDerWaalsContact CD2-CA 3.49Å; L186-A199 HydrophobicContact CD2-CB 3.83Å; Y188-A199 HydrophobicContact CD1-CB 3.67Å; Y188-A199 HydrophobicContact CD2-CB 3.33Å; Y188-A199 HydrophobicContact CE1-CB 3.99Å; Y188-A199 HydrophobicContact CE2-CB 3.66Å; Y188-A199 HydrophobicContact CG-CB 3.32Å; A196-A199 WeakPolarHBondContact O-CB 3.23Å; A196-A199 PolarHBondContact O-N 3.13Å; A196-A199 VanDerWaalsContact O-N 3.1Å; A199-K220 VanDerWaalsContact O-CD 3.25Å; A199-K220 WeakPolarHBondContact O-CD 3.35Å; A199-K220 WeakPolarHBondContact O-CE 3.32Å; A199-K220 PolarHBondContact O-NZ 2.86Å
200	G	85.9	Confident	88.1	Confident	31 Å²	31	46.9 Å²	46.9	32%	0.32	25%	0.245	S	C	.	.	I	π-helix	trans	-71.9	-141.2	172	0	0	0	0	0	113.4	A196 A197 Y198 W202 W203 K220	A196-G200 PolarHBondContact O-N 3.06Å; A197-G200 PolarHBondContact O-N 3.11Å; Y198-G200 PolarHBondContact O-N 3.34Å; G200-W202 VanDerWaalsContact C-N 3.27Å; G200-W202 PolarHBondContact O-N 3.04Å; G200-W203 PolarHBondContact O-N 3.44Å; G200-K220 PolarHBondContact O-NZ 3.09Å
201	K	85.1	Confident	87.8	Confident	66 Å²	66	46.9 Å²	46.9	29%	0.287	24%	0.241	S	C	.	.	I	π-helix	trans	-69.1	-23.3	-174.9	-66.9	178.5	175.9	147.7	0	114	E108 W203 D204 Y205	E108-K201 VanDerWaalsContact C-NZ 3.31Å; E108-K201 WeakPolarHBondContact O-CD 3.33Å; K201-W203 VanDerWaalsContact C-N 3.29Å; K201-W203 PolarHBondContact O-N 3.24Å; K201-D204 WeakPolarHBondContact O-CB 3.18Å; K201-D204 PolarHBondContact O-N 3.36Å; K201-D204 VanDerWaalsContact O-N 3.11Å; K201-Y205 HydrophobicContact CB-CE1 4.18Å; K201-Y205 HydrophobicContact CB-CE2 4.2Å; K201-Y205 WeakPolarHBondContact CB-OH 3.32Å; K201-Y205 WeakPolarHBondContact O-CD1 3.41Å; K201-Y205 WeakPolarHBondContact O-CD2 3.33Å; K201-Y205 VanDerWaalsContact O-CG 3.26Å; K201-Y205 PolarHBondContact O-N 3.34Å
202	W	86.7	Confident	87.5	Confident	42 Å²	42	42.9 Å²	42.9	16%	0.159	23%	0.225	C	C	.	.	I	π-helix	trans	-57.6	-44.4	176.6	179.1	86.9	0	0	0	111.4	Y198 G200 D204 Y205 V206 I261 A266 A267 I270	Y198-W202 AromaticContact CD1-CD2 3.69Å; Y198-W202 HydrophobicContact CD1-CD2 3.69Å; Y198-W202 AromaticContact CD1-CE3 3.58Å; Y198-W202 HydrophobicContact CD1-CE3 3.58Å; Y198-W202 HydrophobicContact CD1-CG 4.27Å; Y198-W202 HydrophobicContact CD1-CH2 4.15Å; Y198-W202 HydrophobicContact CD1-CZ2 4.26Å; Y198-W202 AromaticContact CD1-CZ3 3.81Å; Y198-W202 HydrophobicContact CD1-CZ3 3.81Å; Y198-W202 HydrophobicContact CE1-CD2 4.26Å; Y198-W202 HydrophobicContact CE1-CZ2 4.43Å; Y198-W202 HydrophobicContact CG-CE3 4.33Å; G200-W202 VanDerWaalsContact C-N 3.27Å; G200-W202 PolarHBondContact O-N 3.04Å; W202-D204 VanDerWaalsContact C-N 3.31Å; W202-D204 PolarHBondContact O-N 2.9Å; W202-Y205 WeakPolarHBondContact O-CB 3.46Å; W202-Y205 PolarHBondContact O-N 3.01Å; W202-Y205 VanDerWaalsContact O-N 3.08Å; W202-V206 HydrophobicContact CD2-CG2 4.1Å; W202-V206 HydrophobicContact CE3-CG2 4.02Å; W202-V206 HydrophobicContact CH2-CG2 3.74Å; W202-V206 HydrophobicContact CZ2-CG2 3.78Å; W202-V206 HydrophobicContact CZ3-CG2 3.87Å; W202-V206 PolarHBondContact O-N 2.93Å; W202-I261 HydrophobicContact CH2-CB 4.06Å; W202-I261 HydrophobicContact CZ3-CD1 4.32Å; W202-A266 HydrophobicContact CZ2-CB 4.21Å; W202-A267 HydrophobicContact CZ2-CB 4.42Å; W202-I270 HydrophobicContact CH2-CD1 3.84Å
203	W	91.8	Very high	87.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.9	-33.7	176.4	-170	-125.8	0	0	0	113	V184 L186 Y198 G200 K201 Y205 V206 A207 F218 F219 K220 V246 I270	V184-W203 HydrophobicContact CB-CZ2 4.47Å; V184-W203 HydrophobicContact CG1-CH2 3.65Å; V184-W203 HydrophobicContact CG1-CZ2 3.8Å; L186-W203 HydrophobicContact CB-CD2 3.86Å; L186-W203 VanDerWaalsContact CB-CE2 3.49Å; L186-W203 HydrophobicContact CB-CE3 4.42Å; L186-W203 HydrophobicContact CB-CG 4.22Å; L186-W203 HydrophobicContact CB-CH2 4.34Å; L186-W203 HydrophobicContact CB-CZ2 3.77Å; L186-W203 HydrophobicContact CD1-CD2 4.38Å; L186-W203 HydrophobicContact CD1-CE3 4.18Å; L186-W203 HydrophobicContact CD1-CZ3 4.31Å; L186-W203 HydrophobicContact CD2-CB 3.98Å; L186-W203 HydrophobicContact CD2-CD2 3.97Å; L186-W203 HydrophobicContact CD2-CE3 4.41Å; L186-W203 HydrophobicContact CD2-CG 3.75Å; L186-W203 HydrophobicContact CG-CD2 4.31Å; Y198-W203 WeakPolarHBondContact O-CB 3.4Å; Y198-W203 PolarHBondContact O-N 2.83Å; G200-W203 PolarHBondContact O-N 3.44Å; K201-W203 VanDerWaalsContact C-N 3.29Å; K201-W203 PolarHBondContact O-N 3.24Å; W203-Y205 VanDerWaalsContact C-N 3.25Å; W203-Y205 PolarHBondContact O-N 3.07Å; W203-V206 HydrophobicContact CE3-CB 3.9Å; W203-V206 HydrophobicContact CE3-CG1 4.12Å; W203-V206 HydrophobicContact CE3-CG2 4.07Å; W203-V206 HydrophobicContact CH2-CG1 4.47Å; W203-V206 HydrophobicContact CZ3-CB 4.14Å; W203-V206 HydrophobicContact CZ3-CG1 3.83Å; W203-V206 HydrophobicContact CZ3-CG2 4.41Å; W203-V206 PolarHBondContact O-N 3.41Å; W203-A207 PolarHBondContact O-N 3.08Å; W203-F218 HydrophobicContact CH2-CD1 4.2Å; W203-F218 HydrophobicContact CH2-CE1 4.37Å; W203-F218 AromaticContact CZ2-CD1 3.7Å; W203-F218 HydrophobicContact CZ2-CD1 3.7Å; W203-F218 HydrophobicContact CZ2-CE1 4.31Å; W203-F219 PolarHBondContact NE1-O 3.23Å; W203-K220 VanDerWaalsContact CD1-CE 3.4Å; W203-K220 VanDerWaalsContact CD1-CG 3.42Å; W203-K220 HydrophobicContact CG-CG 4.45Å; W203-V246 HydrophobicContact CH2-CB 4.39Å; W203-V246 HydrophobicContact CH2-CG1 3.76Å; W203-V246 HydrophobicContact CH2-CG2 3.74Å; W203-V246 HydrophobicContact CZ3-CG1 4.41Å; W203-V246 HydrophobicContact CZ3-CG2 3.69Å; W203-I270 HydrophobicContact CZ3-CD1 4.24Å
204	D	90.3	Very high	87.2	Confident	30 Å²	30	43.4 Å²	43.4	16%	0.16	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-35.1	173	-55.3	-30.3	0	0	0	111.1	S163 V165 K201 W202 K208 K220	S163-D204 VanDerWaalsContact OG-CG 3.25Å; S163-D204 PolarHBondContact OG-OD1 3.4Å; V165-D204 WeakPolarHBondContact CB-OD1 3.27Å; V165-D204 HydrophobicContact CG2-CB 4.49Å; V165-D204 WeakPolarHBondContact CG2-OD1 3.39Å; K201-D204 WeakPolarHBondContact O-CB 3.18Å; K201-D204 PolarHBondContact O-N 3.36Å; K201-D204 VanDerWaalsContact O-N 3.11Å; W202-D204 VanDerWaalsContact C-N 3.31Å; W202-D204 PolarHBondContact O-N 2.9Å; D204-K208 VanDerWaalsContact O-CB 3.27Å; D204-K208 WeakPolarHBondContact O-CB 3.4Å; D204-K208 PolarHBondContact O-N 3.02Å; D204-K220 WeakPolarHBondContact OD1-CE 3.5Å; D204-K220 IonicContact OD1-NZ 3.27Å; D204-K220 PolarHBondContact OD1-NZ 3.13Å; D204-K220 IonicContact OD2-NZ 2.7Å
205	Y	88.4	Confident	87.3	Confident	26 Å²	26	41.1 Å²	41.1	10%	0.102	21%	0.208	C	C	.	.	H	α-helix	trans	-68.3	-42	174.6	-55	-25.1	0	0	0	112	H76 V137 A138 K201 W202 W203 K208 S209	H76-Y205 HydrophobicContact CB-CD1 4.5Å; H76-Y205 HydrophobicContact CB-CE1 4.38Å; H76-Y205 AromaticContact CE1-CE1 3.8Å; H76-Y205 AromaticContact CE1-CZ 3.37Å; H76-Y205 PolarHBondContact CE1-OH 3.09Å; H76-Y205 AromaticContact CG-CE1 3.97Å; H76-Y205 AromaticContact CG-CZ 3.77Å; H76-Y205 AromaticContact ND1-CE1 3.31Å; H76-Y205 VanDerWaalsContact ND1-CE1 3.31Å; H76-Y205 WeakPolarHBondContact ND1-CE1 3.18Å; H76-Y205 AromaticContact ND1-CZ 3.29Å; H76-Y205 VanDerWaalsContact ND1-CZ 3.29Å; H76-Y205 PolarHBondContact ND1-OH 3.16Å; H76-Y205 AromaticContact NE2-CZ 3.88Å; H76-Y205 PolarHBondContact NE2-OH 3.35Å; V137-Y205 HydrophobicContact CG2-CD1 4Å; V137-Y205 HydrophobicContact CG2-CG 3.94Å; A138-Y205 WeakPolarHBondContact CB-O 3.32Å; K201-Y205 HydrophobicContact CB-CE1 4.18Å; K201-Y205 HydrophobicContact CB-CE2 4.2Å; K201-Y205 WeakPolarHBondContact CB-OH 3.32Å; K201-Y205 WeakPolarHBondContact O-CD1 3.41Å; K201-Y205 WeakPolarHBondContact O-CD2 3.33Å; K201-Y205 VanDerWaalsContact O-CG 3.26Å; K201-Y205 PolarHBondContact O-N 3.34Å; W202-Y205 WeakPolarHBondContact O-CB 3.46Å; W202-Y205 PolarHBondContact O-N 3.01Å; W202-Y205 VanDerWaalsContact O-N 3.08Å; W203-Y205 VanDerWaalsContact C-N 3.25Å; W203-Y205 PolarHBondContact O-N 3.07Å; Y205-K208 PolarHBondContact O-N 3.48Å; Y205-S209 PolarHBondContact O-N 3.27Å
206	V	90.2	Very high	87.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-51.4	174.8	179.3	0	0	0	0	110.1	W202 W203 K208 S209 F218 A267 I270	W202-V206 HydrophobicContact CD2-CG2 4.1Å; W202-V206 HydrophobicContact CE3-CG2 4.02Å; W202-V206 HydrophobicContact CH2-CG2 3.74Å; W202-V206 HydrophobicContact CZ2-CG2 3.78Å; W202-V206 HydrophobicContact CZ3-CG2 3.87Å; W202-V206 PolarHBondContact O-N 2.93Å; W203-V206 HydrophobicContact CE3-CB 3.9Å; W203-V206 HydrophobicContact CE3-CG1 4.12Å; W203-V206 HydrophobicContact CE3-CG2 4.07Å; W203-V206 HydrophobicContact CH2-CG1 4.47Å; W203-V206 HydrophobicContact CZ3-CB 4.14Å; W203-V206 HydrophobicContact CZ3-CG1 3.83Å; W203-V206 HydrophobicContact CZ3-CG2 4.41Å; W203-V206 PolarHBondContact O-N 3.41Å; V206-K208 VanDerWaalsContact C-N 3.27Å; V206-K208 PolarHBondContact O-N 3.01Å; V206-S209 WeakPolarHBondContact O-CB 3.32Å; V206-S209 PolarHBondContact O-N 3.06Å; V206-S209 PolarHBondContact O-OG 3.42Å; V206-F218 HydrophobicContact CG1-CE1 4.28Å; V206-A267 HydrophobicContact CG2-CB 3.8Å; V206-I270 HydrophobicContact CG1-CB 4.44Å; V206-I270 HydrophobicContact CG1-CD1 4.45Å; V206-I270 HydrophobicContact CG1-CG2 3.98Å
207	A	91.8	Very high	87.4	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-57.4	-41.9	176.5	0	0	0	0	0	111.8	V165 W203 S209 V210 F218	V165-A207 HydrophobicContact CG2-CB 3.37Å; W203-A207 PolarHBondContact O-N 3.08Å; A207-S209 VanDerWaalsContact C-N 3.28Å; A207-S209 PolarHBondContact O-N 3.25Å; A207-V210 PolarHBondContact O-N 2.82Å; A207-V210 VanDerWaalsContact O-N 3.11Å; A207-F218 HydrophobicContact CB-CB 3.62Å; A207-F218 HydrophobicContact CB-CD1 3.69Å; A207-F218 HydrophobicContact CB-CD2 3.76Å; A207-F218 HydrophobicContact CB-CE1 4.29Å; A207-F218 HydrophobicContact CB-CE2 4.34Å; A207-F218 HydrophobicContact CB-CG 3.39Å
208	K	89.4	Confident	87.8	Confident	8 Å²	8	38.6 Å²	38.6	4%	0.035	18%	0.182	C	C	.	.	H	α-helix	trans	-64.3	-32.1	177.4	-169.7	68.3	-161.8	176.7	0	113	V137 F142 Q159 M160 D204 Y205 V206 V210 Y211	V137-K208 HydrophobicContact CG1-CB 4.46Å; V137-K208 HydrophobicContact CG1-CG 4.08Å; V137-K208 HydrophobicContact CG2-CB 4.34Å; F142-K208 WeakPolarHBondContact CZ-O 3.2Å; Q159-K208 PolarHBondContact O-NZ 3.34Å; M160-K208 VanDerWaalsContact CE-CE 3.41Å; M160-K208 WeakPolarHBondContact O-CD 3.43Å; M160-K208 VanDerWaalsContact O-CE 3.31Å; M160-K208 WeakPolarHBondContact O-CE 3.4Å; M160-K208 WeakPolarHBondContact SD-CE 3.39Å; D204-K208 VanDerWaalsContact O-CB 3.27Å; D204-K208 WeakPolarHBondContact O-CB 3.4Å; D204-K208 PolarHBondContact O-N 3.02Å; Y205-K208 PolarHBondContact O-N 3.48Å; V206-K208 VanDerWaalsContact C-N 3.27Å; V206-K208 PolarHBondContact O-N 3.01Å; K208-V210 PolarHBondContact O-N 2.84Å; K208-Y211 HydrophobicContact CD-CD2 4.34Å; K208-Y211 HydrophobicContact CD-CG 4.43Å; K208-Y211 VanDerWaalsContact NZ-CD2 3.26Å; K208-Y211 WeakPolarHBondContact O-CB 3.25Å; K208-Y211 PolarHBondContact O-N 3.36Å; K208-Y211 VanDerWaalsContact O-N 3.16Å
209	S	87.3	Confident	88.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-10.4	176.4	81	0	0	0	0	114	R140 Y205 V206 A207	R140-S209 WeakPolarHBondContact CD-O 3.41Å; Y205-S209 PolarHBondContact O-N 3.27Å; V206-S209 WeakPolarHBondContact O-CB 3.32Å; V206-S209 PolarHBondContact O-N 3.06Å; V206-S209 PolarHBondContact O-OG 3.42Å; A207-S209 VanDerWaalsContact C-N 3.28Å; A207-S209 PolarHBondContact O-N 3.25Å
210	V	87.9	Confident	88.6	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.024	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	17.6	178.2	-168.4	0	0	0	0	110.6	A207 K208 D212 R213 I216 F218 R271 I274	A207-V210 PolarHBondContact O-N 2.82Å; A207-V210 VanDerWaalsContact O-N 3.11Å; K208-V210 PolarHBondContact O-N 2.84Å; V210-D212 PolarHBondContact O-N 3.27Å; V210-D212 VanDerWaalsContact O-N 3.09Å; V210-R213 HydrophobicContact CG1-CB 3.91Å; V210-R213 HydrophobicContact CG1-CG 4.01Å; V210-R213 PolarHBondContact O-N 3.16Å; V210-I216 HydrophobicContact CG1-CD1 4.23Å; V210-F218 HydrophobicContact CB-CE2 3.86Å; V210-F218 HydrophobicContact CB-CZ 3.77Å; V210-F218 HydrophobicContact CG1-CE2 4.17Å; V210-F218 HydrophobicContact CG1-CZ 4.19Å; V210-F218 HydrophobicContact CG2-CE2 4.42Å; V210-F218 HydrophobicContact CG2-CZ 3.82Å; V210-R271 HydrophobicContact CG2-CB 4.33Å; V210-R271 HydrophobicContact CG2-CG 4.1Å; V210-I274 HydrophobicContact CG2-CD1 4.5Å
211	Y	82.9	Confident	89.1	Confident	104 Å²	104	35.4 Å²	35.4	41%	0.408	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.1	-174	174.8	-98.3	0	0	0	115.1	K208 R213	K208-Y211 HydrophobicContact CD-CD2 4.34Å; K208-Y211 HydrophobicContact CD-CG 4.43Å; K208-Y211 VanDerWaalsContact NZ-CD2 3.26Å; K208-Y211 WeakPolarHBondContact O-CB 3.25Å; K208-Y211 PolarHBondContact O-N 3.36Å; K208-Y211 VanDerWaalsContact O-N 3.16Å; Y211-R213 VanDerWaalsContact C-N 3.25Å; Y211-R213 PolarHBondContact O-N 2.92Å
212	D	82.6	Confident	89.6	Confident	85 Å²	85	34.9 Å²	34.9	46%	0.455	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.4	175.3	51.2	-35.2	0	0	0	113.3	R140 V210 K214	R140-D212 IonicContact CZ-OD1 3.17Å; R140-D212 IonicContact CZ-OD2 3.13Å; R140-D212 IonicContact NH1-OD1 2.68Å; R140-D212 IonicContact NH1-OD2 2.81Å; R140-D212 IonicContact NH2-OD1 3.38Å; R140-D212 IonicContact NH2-OD2 2.69Å; R140-D212 PolarHBondContact NH2-OD2 3.35Å; V210-D212 PolarHBondContact O-N 3.27Å; V210-D212 VanDerWaalsContact O-N 3.09Å; D212-K214 PolarHBondContact O-N 3.32Å
213	R	84	Confident	89.9	Confident	69 Å²	69	33.2 Å²	33.2	26%	0.26	15%	0.152	S	C	.	.			trans	-92.5	87.2	176.9	-65	-67.6	-62.8	-86.3	-0.9	111.1	V210 Y211 D215 I216	V210-R213 HydrophobicContact CG1-CB 3.91Å; V210-R213 HydrophobicContact CG1-CG 4.01Å; V210-R213 PolarHBondContact O-N 3.16Å; Y211-R213 VanDerWaalsContact C-N 3.25Å; Y211-R213 PolarHBondContact O-N 2.92Å; R213-D215 WeakPolarHBondContact CA-OD1 3.25Å; R213-D215 WeakPolarHBondContact CB-OD1 3.45Å; R213-D215 IonicContact CZ-OD1 2.94Å; R213-D215 IonicContact CZ-OD2 3.73Å; R213-D215 IonicContact NE-OD1 2.72Å; R213-D215 PolarHBondContact NE-OD1 2.78Å; R213-D215 IonicContact NE-OD2 3.98Å; R213-D215 PolarHBondContact NE-OD2 3.07Å; R213-D215 IonicContact NH2-OD1 2.71Å; R213-D215 IonicContact NH2-OD2 2.87Å; R213-D215 PolarHBondContact NH2-OD2 2.8Å; R213-D215 PolarHBondContact O-N 3.07Å; R213-I216 HydrophobicContact CB-CB 4.39Å; R213-I216 HydrophobicContact CB-CD1 3.82Å; R213-I216 HydrophobicContact CB-CG1 4.04Å; R213-I216 HydrophobicContact CG-CD1 4.16Å; R213-I216 PolarHBondContact O-N 3.29Å
214	K	84	Confident	89.8	Confident	177 Å²	177	34.7 Å²	34.7	77%	0.77	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-11.3	176.9	-62.4	-176.1	-178.9	178.9	0	113.9	D212 I216	D212-K214 PolarHBondContact O-N 3.32Å; K214-I216 VanDerWaalsContact C-N 3.32Å
215	D	87.1	Confident	89.8	Confident	71 Å²	71	35.2 Å²	35.2	38%	0.38	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-9.4	177	58.6	-51.5	0	0	0	113.3	R213	R213-D215 WeakPolarHBondContact CA-OD1 3.25Å; R213-D215 WeakPolarHBondContact CB-OD1 3.45Å; R213-D215 IonicContact CZ-OD1 2.94Å; R213-D215 IonicContact CZ-OD2 3.73Å; R213-D215 IonicContact NE-OD1 2.72Å; R213-D215 PolarHBondContact NE-OD1 2.78Å; R213-D215 IonicContact NE-OD2 3.98Å; R213-D215 PolarHBondContact NE-OD2 3.07Å; R213-D215 IonicContact NH2-OD1 2.71Å; R213-D215 IonicContact NH2-OD2 2.87Å; R213-D215 PolarHBondContact NH2-OD2 2.8Å; R213-D215 PolarHBondContact O-N 3.07Å
216	I	90.2	Very high	89.9	Confident	11 Å²	11	36.3 Å²	36.3	6%	0.056	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	124	-176.6	-53.7	177.3	0	0	0	110.2	T182 V184 V210 R213 K214 F218 I274 I278	T182-I216 HydrophobicContact CG2-CG1 4.32Å; T182-I216 HydrophobicContact CG2-CG2 4.5Å; T182-I216 WeakPolarHBondContact O-CA 3.26Å; V184-I216 HydrophobicContact CG2-CG2 3.77Å; V210-I216 HydrophobicContact CG1-CD1 4.23Å; R213-I216 HydrophobicContact CB-CB 4.39Å; R213-I216 HydrophobicContact CB-CD1 3.82Å; R213-I216 HydrophobicContact CB-CG1 4.04Å; R213-I216 HydrophobicContact CG-CD1 4.16Å; R213-I216 PolarHBondContact O-N 3.29Å; K214-I216 VanDerWaalsContact C-N 3.32Å; I216-F218 HydrophobicContact CG2-CD2 4.38Å; I216-F218 HydrophobicContact CG2-CE2 3.89Å; I216-F218 HydrophobicContact CG2-CZ 4.44Å; I216-I274 HydrophobicContact CD1-CG2 3.51Å; I216-I278 HydrophobicContact CD1-CD1 3.5Å; I216-I278 VanDerWaalsContact CD1-CD1 3.5Å; I216-I278 HydrophobicContact CG1-CD1 4.22Å
217	D	91.2	Very high	90.1	Very high	18 Å²	18	37.4 Å²	37.4	10%	0.096	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	144.1	173.6	-102.7	0.7	0	0	0	111.6	R166 H180 T182 S183 V184 F219	R166-D217 IonicContact CZ-OD2 3.83Å; R166-D217 IonicContact NH1-OD2 3.61Å; R166-D217 PolarHBondContact NH1-OD2 2.84Å; R166-D217 IonicContact NH2-OD1 3.13Å; R166-D217 IonicContact NH2-OD2 3.68Å; H180-D217 HydrophobicContact CB-CB 4.35Å; H180-D217 IonicContact CD2-OD1 2.83Å; H180-D217 IonicContact CD2-OD2 3.86Å; H180-D217 PolarHBondContact CD2-OD2 2.66Å; H180-D217 IonicContact CE1-OD1 3.92Å; H180-D217 IonicContact CE1-OD2 3.01Å; H180-D217 IonicContact CG-OD2 3.85Å; H180-D217 IonicContact NE2-OD1 2.65Å; H180-D217 IonicContact NE2-OD2 3.61Å; H180-D217 PolarHBondContact NE2-OD2 3.43Å; H180-D217 VanDerWaalsContact NE2-OD2 3.17Å; T182-D217 PolarHBondContact O-N 3.25Å; S183-D217 CarbonylContact C-O 3.5Å; S183-D217 WeakPolarHBondContact CA-O 2.9Å; V184-D217 PolarHBondContact N-O 3.39Å; D217-F219 HydrophobicContact CB-CE1 3.67Å; D217-F219 HydrophobicContact CB-CE2 4.28Å; D217-F219 HydrophobicContact CB-CZ 3.48Å; D217-F219 VanDerWaalsContact CB-CZ 3.48Å
218	F	94.1	Very high	90.1	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.2	176.8	-75.3	-102.6	0	0	0	110.3	V165 R166 V184 W203 V206 A207 V210 I216 I274	V165-F218 WeakPolarHBondContact CA-O 3.41Å; V165-F218 HydrophobicContact CG1-CB 4.48Å; V165-F218 HydrophobicContact CG2-CB 4.01Å; R166-F218 PolarHBondContact N-O 2.8Å; V184-F218 HydrophobicContact CB-CD1 3.87Å; V184-F218 HydrophobicContact CB-CE1 3.87Å; V184-F218 HydrophobicContact CB-CG 4.42Å; V184-F218 HydrophobicContact CB-CZ 4.42Å; V184-F218 HydrophobicContact CG1-CD1 4.23Å; V184-F218 HydrophobicContact CG1-CE1 4.06Å; V184-F218 HydrophobicContact CG2-CD1 4.47Å; V184-F218 HydrophobicContact CG2-CE1 4.06Å; V184-F218 HydrophobicContact CG2-CZ 4.15Å; V184-F218 CarbonylContact O-C 3.52Å; V184-F218 WeakPolarHBondContact O-CA 3.34Å; W203-F218 HydrophobicContact CH2-CD1 4.2Å; W203-F218 HydrophobicContact CH2-CE1 4.37Å; W203-F218 AromaticContact CZ2-CD1 3.7Å; W203-F218 HydrophobicContact CZ2-CD1 3.7Å; W203-F218 HydrophobicContact CZ2-CE1 4.31Å; V206-F218 HydrophobicContact CG1-CE1 4.28Å; A207-F218 HydrophobicContact CB-CB 3.62Å; A207-F218 HydrophobicContact CB-CD1 3.69Å; A207-F218 HydrophobicContact CB-CD2 3.76Å; A207-F218 HydrophobicContact CB-CE1 4.29Å; A207-F218 HydrophobicContact CB-CE2 4.34Å; A207-F218 HydrophobicContact CB-CG 3.39Å; V210-F218 HydrophobicContact CB-CE2 3.86Å; V210-F218 HydrophobicContact CB-CZ 3.77Å; V210-F218 HydrophobicContact CG1-CE2 4.17Å; V210-F218 HydrophobicContact CG1-CZ 4.19Å; V210-F218 HydrophobicContact CG2-CE2 4.42Å; V210-F218 HydrophobicContact CG2-CZ 3.82Å; I216-F218 HydrophobicContact CG2-CD2 4.38Å; I216-F218 HydrophobicContact CG2-CE2 3.89Å; I216-F218 HydrophobicContact CG2-CZ 4.44Å; F218-I274 HydrophobicContact CE1-CD1 4.2Å; F218-I274 HydrophobicContact CZ-CD1 3.94Å
219	F	95.1	Very high	90.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	155.6	-178	-55.6	-37.8	0	0	0	112.2	R166 V168 V176 V184 V185 L186 W203 D217	R166-F219 HydrophobicContact CB-CD1 3.97Å; R166-F219 HydrophobicContact CB-CE1 4.29Å; R166-F219 CarbonylContact O-C 3.33Å; R166-F219 VanDerWaalsContact O-CA 3.26Å; R166-F219 WeakPolarHBondContact O-CA 3.28Å; V168-F219 HydrophobicContact CG1-CB 4.18Å; V168-F219 HydrophobicContact CG1-CD1 3.98Å; V168-F219 HydrophobicContact CG1-CD2 4.46Å; V168-F219 HydrophobicContact CG1-CG 3.96Å; V168-F219 HydrophobicContact CG2-CB 3.82Å; V168-F219 HydrophobicContact CG2-CG 4.34Å; V176-F219 HydrophobicContact CG1-CD1 4.41Å; V176-F219 HydrophobicContact CG1-CE1 3.53Å; V176-F219 HydrophobicContact CG1-CE2 4.33Å; V176-F219 HydrophobicContact CG1-CZ 3.49Å; V176-F219 VanDerWaalsContact CG1-CZ 3.49Å; V184-F219 PolarHBondContact O-N 3.4Å; V185-F219 HydrophobicContact CG1-CB 4.46Å; V185-F219 HydrophobicContact CG2-CB 4.35Å; V185-F219 HydrophobicContact CG2-CD2 4.16Å; L186-F219 PolarHBondContact N-O 3.41Å; W203-F219 PolarHBondContact NE1-O 3.23Å; D217-F219 HydrophobicContact CB-CE1 3.67Å; D217-F219 HydrophobicContact CB-CE2 4.28Å; D217-F219 HydrophobicContact CB-CZ 3.48Å; D217-F219 VanDerWaalsContact CB-CZ 3.48Å
220	K	95.2	Very high	90.7	Very high	26 Å²	26	42.6 Å²	42.6	11%	0.113	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.3	167.4	-66	170.8	-171.3	-179.2	0	107.6	V165 R166 L167 V168 Y188 A199 G200 W203 D204	V165-K220 HydrophobicContact CG1-CD 3.9Å; V165-K220 HydrophobicContact CG1-CG 3.65Å; R166-K220 PolarHBondContact O-N 3.43Å; L167-K220 HydrophobicContact CD1-CB 4.11Å; V168-K220 WeakPolarHBondContact CG2-O 3.03Å; V168-K220 PolarHBondContact N-O 2.97Å; Y188-K220 HydrophobicContact CD1-CB 4.44Å; Y188-K220 HydrophobicContact CE1-CB 3.87Å; A199-K220 VanDerWaalsContact O-CD 3.25Å; A199-K220 WeakPolarHBondContact O-CD 3.35Å; A199-K220 WeakPolarHBondContact O-CE 3.32Å; A199-K220 PolarHBondContact O-NZ 2.86Å; G200-K220 PolarHBondContact O-NZ 3.09Å; W203-K220 VanDerWaalsContact CD1-CE 3.4Å; W203-K220 VanDerWaalsContact CD1-CG 3.42Å; W203-K220 HydrophobicContact CG-CG 4.45Å; D204-K220 WeakPolarHBondContact OD1-CE 3.5Å; D204-K220 IonicContact OD1-NZ 3.27Å; D204-K220 PolarHBondContact OD1-NZ 3.13Å; D204-K220 IonicContact OD2-NZ 2.7Å
221	L	95.4	Very high	91	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	116.7	176.9	-168.9	165.2	0	0	0	109	V168 F173 V185 L186 L187 Y188 C223 N227 F230 V231	V168-L221 HydrophobicContact CG2-CB 3.99Å; V168-L221 HydrophobicContact CG2-CD1 4.3Å; V168-L221 HydrophobicContact CG2-CG 4.33Å; F173-L221 HydrophobicContact CD2-CD1 4.49Å; V185-L221 HydrophobicContact CG1-CB 3.93Å; L186-L221 PolarHBondContact O-N 2.65Å; L187-L221 HydrophobicContact CD2-CB 4.1Å; L187-L221 HydrophobicContact CD2-CD1 4.42Å; L187-L221 HydrophobicContact CD2-CD2 4.3Å; Y188-L221 VanDerWaalsContact CD1-O 3.3Å; Y188-L221 WeakPolarHBondContact CD1-O 3.26Å; Y188-L221 PolarHBondContact N-O 3.1Å; L221-C223 PolarHBondContact O-N 2.72Å; L221-N227 HydrophobicContact CD2-CB 4.06Å; L221-F230 HydrophobicContact CD1-CD1 4.16Å; L221-F230 HydrophobicContact CD1-CE1 3.96Å; L221-V231 HydrophobicContact CD1-CG2 4.04Å; L221-V231 HydrophobicContact CD2-CG2 3.45Å; L221-V231 VanDerWaalsContact CD2-CG2 3.45Å; L221-V231 HydrophobicContact CG-CG2 4.41Å
222	E	95	Very high	91.5	Very high	55 Å²	55	43.8 Å²	43.8	26%	0.257	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	122.1	178.1	-172.7	-170.8	160.9	0	0	110.5	Y188 Q190 S224 N227	Y188-E222 HydrophobicContact CE1-CB 4.11Å; Y188-E222 HydrophobicContact CE2-CB 4.33Å; Y188-E222 HydrophobicContact CE2-CG 4.29Å; Y188-E222 CarbonylContact O-C 3.51Å; Y188-E222 WeakPolarHBondContact O-CA 3.39Å; Q190-E222 VanDerWaalsContact CG-CD 3.47Å; Q190-E222 HydrophobicContact CG-CG 3.97Å; Q190-E222 WeakPolarHBondContact CG-OE1 3.42Å; E222-S224 VanDerWaalsContact CD-OG 3.27Å; E222-S224 PolarHBondContact O-N 3.13Å; E222-S224 PolarHBondContact OE1-OG 2.81Å; E222-N227 WeakPolarHBondContact O-CB 3.47Å; E222-N227 PolarHBondContact O-ND2 3.48Å
223	C	93	Very high	92	Very high	7 Å²	7	43.4 Å²	43.4	5%	0.047	22%	0.215	C	C	.	.			trans	-96.1	64.5	-175.4	-137.8	0	0	0	0	113	Y188 L221 C239	Y188-C223 PolarHBondContact O-N 2.69Å; L221-C223 PolarHBondContact O-N 2.72Å; C223-C239 HydrophobicContact CB-CB 3.56Å; C223-C239 WeakPolarHBondContact CB-SG 3.28Å; C223-C239 WeakPolarHBondContact SG-CB 3.13Å; C223-C239 CovalentContact SG-SG 1.97Å; C223-C239 PolarHBondContact SG-SG 3.48Å
224	S	90.9	Very high	92.4	Very high	30 Å²	30	40.7 Å²	40.7	21%	0.21	21%	0.205	C	C	.	.	S	Bend	trans	-129.9	159	174.2	62.5	0	0	0	0	110	E222 V226 N227 K228	E222-S224 VanDerWaalsContact CD-OG 3.27Å; E222-S224 PolarHBondContact O-N 3.13Å; E222-S224 PolarHBondContact OE1-OG 2.81Å; S224-V226 PolarHBondContact O-N 3.31Å; S224-N227 WeakPolarHBondContact O-CB 3.18Å; S224-N227 PolarHBondContact O-N 3.04Å; S224-K228 PolarHBondContact O-N 3.4Å
225	G	89.2	Confident	92.9	Very high	42 Å²	42	32.3 Å²	32.3	43%	0.433	17%	0.168	S	C	.	.	H	α-helix	trans	48.8	-126.1	175.8	0	0	0	0	0	114.5	N227 K228 F229	G225-N227 VanDerWaalsContact C-N 3.32Å; G225-N227 PolarHBondContact O-N 3.19Å; G225-K228 WeakPolarHBondContact O-CB 3.38Å; G225-K228 PolarHBondContact O-N 3.36Å; G225-F229 PolarHBondContact O-N 2.91Å
226	V	91.9	Very high	93.1	Very high	48 Å²	48	32.6 Å²	32.6	29%	0.291	18%	0.176	S	C	.	.	H	α-helix	trans	-64	-34.4	-179.6	-179.2	0	0	0	0	112.2	S224 K228 F229 F230 Y296 F299	S224-V226 PolarHBondContact O-N 3.31Å; V226-K228 VanDerWaalsContact C-N 3.29Å; V226-K228 PolarHBondContact O-N 2.8Å; V226-F229 WeakPolarHBondContact O-CB 3.13Å; V226-F229 PolarHBondContact O-N 2.88Å; V226-F229 VanDerWaalsContact O-N 3.17Å; V226-F230 PolarHBondContact O-N 3.05Å; V226-Y296 HydrophobicContact CG1-CD1 3.66Å; V226-Y296 HydrophobicContact CG1-CE1 3.5Å; V226-Y296 VanDerWaalsContact CG1-CE1 3.5Å; V226-F299 HydrophobicContact CB-CE1 4.5Å; V226-F299 HydrophobicContact CG2-CD1 4.46Å; V226-F299 HydrophobicContact CG2-CE1 4.12Å
227	N	93.6	Very high	93.2	Very high	24 Å²	24	32.5 Å²	32.5	13%	0.128	18%	0.176	C	C	.	.	H	α-helix	trans	-67.5	-32	178.3	-70.6	-18.8	0	0	0	112	S170 L221 E222 S224 G225 F229 F230 V231	S170-N227 WeakPolarHBondContact CB-OD1 3.41Å; S170-N227 PolarHBondContact N-OD1 2.9Å; S170-N227 PolarHBondContact OG-OD1 3.25Å; L221-N227 HydrophobicContact CD2-CB 4.06Å; E222-N227 WeakPolarHBondContact O-CB 3.47Å; E222-N227 PolarHBondContact O-ND2 3.48Å; S224-N227 WeakPolarHBondContact O-CB 3.18Å; S224-N227 PolarHBondContact O-N 3.04Å; G225-N227 VanDerWaalsContact C-N 3.32Å; G225-N227 PolarHBondContact O-N 3.19Å; N227-F229 VanDerWaalsContact C-N 3.34Å; N227-F230 PolarHBondContact O-N 3.18Å; N227-V231 VanDerWaalsContact O-CG2 3.3Å; N227-V231 WeakPolarHBondContact O-CG2 3.17Å; N227-V231 PolarHBondContact O-N 3.05Å
228	K	93.1	Very high	93.1	Very high	91 Å²	91	35.9 Å²	35.9	40%	0.396	19%	0.194	S	C	.	.	H	α-helix	trans	-62.6	-43.1	172	179.6	175	-178.7	176.3	0	111.7	S224 G225 V226 K232	S224-K228 PolarHBondContact O-N 3.4Å; G225-K228 WeakPolarHBondContact O-CB 3.38Å; G225-K228 PolarHBondContact O-N 3.36Å; V226-K228 VanDerWaalsContact C-N 3.29Å; V226-K228 PolarHBondContact O-N 2.8Å; K228-K232 WeakPolarHBondContact O-CB 3.34Å; K228-K232 PolarHBondContact O-N 2.86Å
229	F	93	Very high	92.9	Very high	27 Å²	27	35.6 Å²	35.6	12%	0.118	19%	0.193	C	C	.	.	H	α-helix	trans	-61.8	-48.4	173.9	171.9	-99	0	0	0	111.3	G225 V226 N227 V231 K232 Q233 P291 E295 Y296 F299	G225-F229 PolarHBondContact O-N 2.91Å; V226-F229 WeakPolarHBondContact O-CB 3.13Å; V226-F229 PolarHBondContact O-N 2.88Å; V226-F229 VanDerWaalsContact O-N 3.17Å; N227-F229 VanDerWaalsContact C-N 3.34Å; F229-V231 PolarHBondContact O-N 3.05Å; F229-K232 PolarHBondContact O-N 3.31Å; F229-Q233 HydrophobicContact CD1-CG 4.49Å; F229-Q233 HydrophobicContact CD2-CG 4.14Å; F229-Q233 HydrophobicContact CE1-CG 4.05Å; F229-Q233 HydrophobicContact CE2-CG 3.66Å; F229-Q233 HydrophobicContact CZ-CG 3.59Å; F229-Q233 WeakPolarHBondContact O-CG 3.48Å; F229-Q233 PolarHBondContact O-N 2.79Å; F229-P291 HydrophobicContact CE1-CB 3.87Å; F229-P291 HydrophobicContact CE1-CG 4.24Å; F229-E295 HydrophobicContact CE1-CB 4.42Å; F229-E295 HydrophobicContact CZ-CB 4.02Å; F229-Y296 AromaticContact CD1-CD1 3.85Å; F229-Y296 HydrophobicContact CD1-CD1 3.85Å; F229-Y296 AromaticContact CD1-CE1 3.8Å; F229-Y296 HydrophobicContact CD1-CE1 3.8Å; F229-Y296 AromaticContact CE1-CD1 3.93Å; F229-Y296 HydrophobicContact CE1-CD1 3.93Å; F229-Y296 HydrophobicContact CE1-CE1 4.07Å; F229-F299 HydrophobicContact CB-CD1 4.03Å; F229-F299 HydrophobicContact CB-CD2 3.88Å; F229-F299 HydrophobicContact CB-CE1 3.97Å; F229-F299 HydrophobicContact CB-CE2 3.82Å; F229-F299 HydrophobicContact CB-CG 3.97Å; F229-F299 HydrophobicContact CB-CZ 3.85Å; F229-F299 HydrophobicContact CD1-CB 4.39Å; F229-F299 HydrophobicContact CD1-CG 4.34Å; F229-F299 HydrophobicContact CD2-CB 4.05Å; F229-F299 AromaticContact CD2-CD2 3.64Å; F229-F299 HydrophobicContact CD2-CD2 3.64Å; F229-F299 HydrophobicContact CD2-CE2 4.28Å; F229-F299 AromaticContact CD2-CG 3.87Å; F229-F299 HydrophobicContact CD2-CG 3.87Å; F229-F299 HydrophobicContact CE2-CB 4.16Å; F229-F299 HydrophobicContact CE2-CD2 4.42Å; F229-F299 HydrophobicContact CE2-CG 4.47Å; F229-F299 HydrophobicContact CG-CB 4.17Å; F229-F299 HydrophobicContact CG-CD1 4.19Å; F229-F299 AromaticContact CG-CD2 3.88Å; F229-F299 HydrophobicContact CG-CD2 3.88Å; F229-F299 HydrophobicContact CG-CE2 4.33Å; F229-F299 AromaticContact CG-CG 3.79Å; F229-F299 HydrophobicContact CG-CG 3.79Å; F229-F299 HydrophobicContact CZ-CB 4.39Å
230	F	94.5	Very high	92.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-54.8	-49.2	176.3	172	-105.6	0	0	0	112.2	F173 L221 V226 N227 K232 Q233 R234 F235 P291 Y296	F173-F230 HydrophobicContact CB-CE1 4.11Å; F173-F230 HydrophobicContact CB-CZ 3.89Å; F173-F230 HydrophobicContact CD1-CE1 4.13Å; F173-F230 AromaticContact CD1-CZ 3.6Å; F173-F230 HydrophobicContact CD1-CZ 3.6Å; F173-F230 HydrophobicContact CE1-CZ 4.33Å; F173-F230 HydrophobicContact CG-CE1 4.05Å; F173-F230 AromaticContact CG-CZ 3.88Å; F173-F230 HydrophobicContact CG-CZ 3.88Å; L221-F230 HydrophobicContact CD1-CD1 4.16Å; L221-F230 HydrophobicContact CD1-CE1 3.96Å; V226-F230 PolarHBondContact O-N 3.05Å; N227-F230 PolarHBondContact O-N 3.18Å; F230-K232 PolarHBondContact O-N 2.81Å; F230-Q233 PolarHBondContact O-N 2.78Å; F230-R234 HydrophobicContact CD2-CB 4.23Å; F230-R234 HydrophobicContact CE2-CB 3.97Å; F230-R234 HydrophobicContact CE2-CG 4.03Å; F230-R234 HydrophobicContact CZ-CB 4.13Å; F230-R234 HydrophobicContact CZ-CG 3.92Å; F230-R234 WeakPolarHBondContact O-CB 3.25Å; F230-R234 PolarHBondContact O-N 3.49Å; F230-F235 AromaticContact CE1-CE2 3.9Å; F230-F235 HydrophobicContact CE1-CE2 3.9Å; F230-F235 HydrophobicContact CZ-CE2 4.47Å; F230-P291 HydrophobicContact CD2-CG 4.17Å; F230-Y296 VanDerWaalsContact CD2-OH 3.26Å; F230-Y296 WeakPolarHBondContact CD2-OH 3.43Å
231	V	94.6	Very high	91.7	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-43.7	179.2	172.8	0	0	0	0	111.4	L187 L221 N227 F229 Q233 F235 S236 I237 C239	L187-V231 HydrophobicContact CD1-CG1 3.87Å; L187-V231 HydrophobicContact CD2-CG1 4.26Å; L187-V231 HydrophobicContact CD2-CG2 3.96Å; L221-V231 HydrophobicContact CD1-CG2 4.04Å; L221-V231 HydrophobicContact CD2-CG2 3.45Å; L221-V231 VanDerWaalsContact CD2-CG2 3.45Å; L221-V231 HydrophobicContact CG-CG2 4.41Å; N227-V231 VanDerWaalsContact O-CG2 3.3Å; N227-V231 WeakPolarHBondContact O-CG2 3.17Å; N227-V231 PolarHBondContact O-N 3.05Å; F229-V231 PolarHBondContact O-N 3.05Å; V231-Q233 VanDerWaalsContact C-N 3.33Å; V231-Q233 PolarHBondContact O-N 3.13Å; V231-F235 HydrophobicContact CB-CD2 4.39Å; V231-F235 HydrophobicContact CG1-CB 4.27Å; V231-F235 HydrophobicContact CG1-CD2 4.25Å; V231-F235 HydrophobicContact CG1-CG 4.42Å; V231-F235 HydrophobicContact CG2-CD2 4.38Å; V231-F235 HydrophobicContact CG2-CE2 4.49Å; V231-F235 WeakPolarHBondContact O-CA 3.49Å; V231-F235 VanDerWaalsContact O-CB 3.27Å; V231-F235 WeakPolarHBondContact O-CB 3.38Å; V231-F235 PolarHBondContact O-N 2.97Å; V231-S236 PolarHBondContact O-N 2.96Å; V231-I237 HydrophobicContact CG1-CB 4.42Å; V231-C239 HydrophobicContact CG1-CB 3.99Å
232	K	93.6	Very high	91.2	Very high	133 Å²	133	47.4 Å²	47.4	58%	0.578	26%	0.264	S	S	*	.	H	α-helix	trans	-60.7	-41.6	178.4	-175.5	177.4	178.7	-177.8	0	112.2	K228 F229 F230 S236 I237	K228-K232 WeakPolarHBondContact O-CB 3.34Å; K228-K232 PolarHBondContact O-N 2.86Å; F229-K232 PolarHBondContact O-N 3.31Å; F230-K232 PolarHBondContact O-N 2.81Å; K232-S236 WeakPolarHBondContact O-CA 3.24Å; K232-S236 PolarHBondContact O-N 3.11Å; K232-I237 WeakPolarHBondContact CA-O 3.43Å
233	Q	93.2	Very high	90.8	Very high	77 Å²	77	45.2 Å²	45.2	36%	0.36	26%	0.255	S	S	.	.	H	α-helix	trans	-78.2	-51.3	-179.8	-65.4	-59.5	-14.2	0	0	112.1	F229 F230 V231 M288 P291	F229-Q233 HydrophobicContact CD1-CG 4.49Å; F229-Q233 HydrophobicContact CD2-CG 4.14Å; F229-Q233 HydrophobicContact CE1-CG 4.05Å; F229-Q233 HydrophobicContact CE2-CG 3.66Å; F229-Q233 HydrophobicContact CZ-CG 3.59Å; F229-Q233 WeakPolarHBondContact O-CG 3.48Å; F229-Q233 PolarHBondContact O-N 2.79Å; F230-Q233 PolarHBondContact O-N 2.78Å; V231-Q233 VanDerWaalsContact C-N 3.33Å; V231-Q233 PolarHBondContact O-N 3.13Å; Q233-M288 WeakPolarHBondContact O-CB 3.02Å; Q233-M288 WeakPolarHBondContact O-CG 3.08Å; Q233-P291 HydrophobicContact CB-CG 3.77Å; Q233-P291 HydrophobicContact CG-CG 4.37Å
234	R	92.5	Very high	90.8	Very high	12 Å²	12	45.4 Å²	45.4	5%	0.045	26%	0.256	C	S	.	.	H	α-helix	trans	-72.3	-42.6	-173.9	-174.4	81.9	178.3	99.6	-3	112.6	E174 F230 L287 M288	E174-R234 IonicContact OE1-CZ 3.17Å; E174-R234 IonicContact OE1-NE 2.79Å; E174-R234 PolarHBondContact OE1-NE 3.13Å; E174-R234 IonicContact OE1-NH2 2.71Å; E174-R234 PolarHBondContact OE1-NH2 3.08Å; E174-R234 IonicContact OE2-NH2 3.34Å; E174-R234 PolarHBondContact OE2-NH2 3.22Å; F230-R234 HydrophobicContact CD2-CB 4.23Å; F230-R234 HydrophobicContact CE2-CB 3.97Å; F230-R234 HydrophobicContact CE2-CG 4.03Å; F230-R234 HydrophobicContact CZ-CB 4.13Å; F230-R234 HydrophobicContact CZ-CG 3.92Å; F230-R234 WeakPolarHBondContact O-CB 3.25Å; F230-R234 PolarHBondContact O-N 3.49Å; R234-L287 HydrophobicContact CG-CD1 4.15Å; R234-L287 HydrophobicContact CG-CG 4.32Å; R234-L287 PolarHBondContact NH1-O 2.81Å; R234-L287 WeakPolarHBondContact O-CD1 3.23Å; R234-M288 WeakPolarHBondContact CD-O 3.44Å; R234-M288 PolarHBondContact NH1-O 3.49Å; R234-M288 PolarHBondContact O-N 3.38Å
235	F	93.8	Very high	90.9	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-11	-176.5	-62.1	-109.3	0	0	0	112.5	F173 F230 V231 I237 V247 V249 I254 L287	F173-F235 HydrophobicContact CE1-CE2 4.4Å; F173-F235 HydrophobicContact CE1-CZ 4.07Å; F173-F235 AromaticContact CE2-CZ 3.83Å; F173-F235 HydrophobicContact CE2-CZ 3.83Å; F173-F235 HydrophobicContact CZ-CE1 4.28Å; F173-F235 HydrophobicContact CZ-CE2 4.21Å; F173-F235 AromaticContact CZ-CZ 3.47Å; F173-F235 HydrophobicContact CZ-CZ 3.47Å; F173-F235 VanDerWaalsContact CZ-CZ 3.47Å; F230-F235 AromaticContact CE1-CE2 3.9Å; F230-F235 HydrophobicContact CE1-CE2 3.9Å; F230-F235 HydrophobicContact CZ-CE2 4.47Å; V231-F235 HydrophobicContact CB-CD2 4.39Å; V231-F235 HydrophobicContact CG1-CB 4.27Å; V231-F235 HydrophobicContact CG1-CD2 4.25Å; V231-F235 HydrophobicContact CG1-CG 4.42Å; V231-F235 HydrophobicContact CG2-CD2 4.38Å; V231-F235 HydrophobicContact CG2-CE2 4.49Å; V231-F235 WeakPolarHBondContact O-CA 3.49Å; V231-F235 VanDerWaalsContact O-CB 3.27Å; V231-F235 WeakPolarHBondContact O-CB 3.38Å; V231-F235 PolarHBondContact O-N 2.97Å; F235-I237 HydrophobicContact CB-CB 4.16Å; F235-I237 HydrophobicContact CB-CD1 3.95Å; F235-I237 HydrophobicContact CB-CG1 4.11Å; F235-I237 WeakPolarHBondContact O-CG1 3.42Å; F235-I237 PolarHBondContact O-N 3.16Å; F235-V247 HydrophobicContact CD1-CG1 4.11Å; F235-V247 HydrophobicContact CE1-CG1 4.34Å; F235-V249 HydrophobicContact CE1-CG2 3.97Å; F235-I254 HydrophobicContact CB-CD1 4.03Å; F235-I254 HydrophobicContact CD1-CD1 4.29Å; F235-I254 HydrophobicContact CD1-CG2 4.15Å; F235-I254 WeakPolarHBondContact O-CD1 3.22Å; F235-L287 HydrophobicContact CD1-CD1 3.82Å; F235-L287 HydrophobicContact CD2-CD1 4.41Å; F235-L287 HydrophobicContact CE1-CD1 4.07Å; F235-L287 HydrophobicContact CG-CD1 4.02Å; F235-L287 HydrophobicContact CZ-CD1 4.48Å
236	S	92.3	Very high	91.2	Very high	78 Å²	78	43.1 Å²	43.1	55%	0.545	23%	0.231	S	C	.	.			trans	55.5	29.3	-171.1	-62.5	0	0	0	0	113.6	V231 K232 M288	V231-S236 PolarHBondContact O-N 2.96Å; K232-S236 WeakPolarHBondContact O-CA 3.24Å; K232-S236 PolarHBondContact O-N 3.11Å; S236-M288 WeakPolarHBondContact OG-CG 3.32Å
237	I	91.5	Very high	91.3	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.041	22%	0.217	C	C	.	.			trans	-116	134	-176.6	-69.1	169.9	0	0	0	109.6	L187 V231 K232 F235 C239 V247 I254 M256	L187-I237 HydrophobicContact CD1-CG2 4.23Å; V231-I237 HydrophobicContact CG1-CB 4.42Å; K232-I237 WeakPolarHBondContact CA-O 3.43Å; F235-I237 HydrophobicContact CB-CB 4.16Å; F235-I237 HydrophobicContact CB-CD1 3.95Å; F235-I237 HydrophobicContact CB-CG1 4.11Å; F235-I237 WeakPolarHBondContact O-CG1 3.42Å; F235-I237 PolarHBondContact O-N 3.16Å; I237-C239 PolarHBondContact O-N 3.11Å; I237-V247 HydrophobicContact CD1-CG1 4.45Å; I237-V247 HydrophobicContact CD1-CG2 3.77Å; I237-I254 HydrophobicContact CD1-CD1 4.06Å; I237-M256 HydrophobicContact CD1-CG 3.62Å; I237-M256 HydrophobicContact CD1-SD 3.62Å; I237-M256 HydrophobicContact CG1-CG 4.38Å; I237-M256 HydrophobicContact CG1-SD 3.77Å; I237-M256 HydrophobicContact CG2-SD 4.41Å
238	D	89.8	Confident	91.4	Very high	89 Å²	89	39.7 Å²	39.7	48%	0.476	21%	0.211	S	C	.	.			trans	-82.7	102.5	161.9	-171.4	5.8	0	0	0	109.6	A240 Q245	D238-A240 PolarHBondContact O-N 3.19Å; D238-A240 VanDerWaalsContact OD1-CB 3.27Å; D238-A240 WeakPolarHBondContact OD1-CB 3.47Å; D238-A240 PolarHBondContact OD1-N 3.34Å; D238-Q245 PolarHBondContact O-NE2 3.4Å
239	C	88.8	Confident	91.4	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.007	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6.3	179	62.5	0	0	0	0	113.8	L187 C223 V231 I237	L187-C239 HydrophobicContact CB-CB 4.42Å; L187-C239 HydrophobicContact CD1-CB 4.42Å; C223-C239 HydrophobicContact CB-CB 3.56Å; C223-C239 WeakPolarHBondContact CB-SG 3.28Å; C223-C239 WeakPolarHBondContact SG-CB 3.13Å; C223-C239 CovalentContact SG-SG 1.97Å; C223-C239 PolarHBondContact SG-SG 3.48Å; V231-C239 HydrophobicContact CG1-CB 3.99Å; I237-C239 PolarHBondContact O-N 3.11Å
240	A	83.4	Confident	91.3	Very high	38 Å²	38	34.8 Å²	34.8	31%	0.314	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-36.7	178	0	0	0	0	0	111.1	D238	D238-A240 PolarHBondContact O-N 3.19Å; D238-A240 VanDerWaalsContact OD1-CB 3.27Å; D238-A240 WeakPolarHBondContact OD1-CB 3.47Å; D238-A240 PolarHBondContact OD1-N 3.34Å
241	M	82	Confident	90.9	Very high	143 Å²	143	40.8 Å²	40.8	70%	0.704	22%	0.224	S	C	*	.	S	Bend	trans	-150.3	127.8	-176.4	-68.9	-64.1	-75.7	0	0	111.8
242	P	86.1	Confident	90.6	Very high	92 Å²	92	44.7 Å²	44.7	60%	0.597	25%	0.245	S	C	*	.	S	Bend	cis	-67.9	156.4	-11	28.6	-35.4	0	0	0	112.1	Q245	P242-Q245 VanDerWaalsContact CD-NE2 3.33Å; P242-Q245 HydrophobicContact CG-CG 4.24Å; P242-Q245 WeakPolarHBondContact O-CG 3.47Å; P242-Q245 PolarHBondContact O-NE2 3.45Å
243	C	87.1	Confident	90.5	Very high	10 Å²	10	42.2 Å²	42.2	7%	0.068	24%	0.235	C	C	.	.	S	Bend	trans	-130.9	134.3	174.6	-168	0	0	0	0	107.9	S189 C195 Y262	S189-C243 PolarHBondContact N-SG 2.89Å; C195-C243 HydrophobicContact CB-CB 3.92Å; C195-C243 WeakPolarHBondContact CB-SG 3.31Å; C195-C243 WeakPolarHBondContact SG-CB 3.33Å; C195-C243 CovalentContact SG-SG 2.04Å; C195-C243 PolarHBondContact SG-SG 3.16Å; C243-Y262 WeakPolarHBondContact O-CE2 3.42Å; C243-Y262 PolarHBondContact O-OH 2.89Å
244	P	91.8	Very high	90.5	Very high	10 Å²	10	38.6 Å²	38.6	7%	0.065	22%	0.218	C	C	.	.	S	Bend	cis	-83.7	163.1	-3.5	7.2	10.4	0	0	0	112.1	L186 L187 C195 Y198 I261 Y262	L186-P244 HydrophobicContact CD1-CB 3.88Å; L186-P244 HydrophobicContact CG-CB 4.44Å; L187-P244 CarbonylContact O-C 3.58Å; L187-P244 VanDerWaalsContact O-CA 3.25Å; L187-P244 WeakPolarHBondContact O-CA 3.31Å; L187-P244 VanDerWaalsContact O-CB 3.25Å; L187-P244 WeakPolarHBondContact O-CB 3.36Å; C195-P244 HydrophobicContact CB-CG 4.4Å; C195-P244 WeakPolarHBondContact SG-CA 3.45Å; C195-P244 VanDerWaalsContact SG-CB 3.54Å; C195-P244 VanDerWaalsContact SG-CG 3.58Å; Y198-P244 HydrophobicContact CD2-CG 4.49Å; Y198-P244 HydrophobicContact CG-CG 4.27Å; P244-I261 HydrophobicContact CB-CD1 3.64Å; P244-I261 HydrophobicContact CG-CD1 3.38Å; P244-I261 HydrophobicContact CG-CG1 4.22Å; P244-Y262 WeakPolarHBondContact CD-OH 3.23Å
245	Q	93.5	Very high	90.6	Very high	21 Å²	21	39.9 Å²	39.9	10%	0.098	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.9	176.8	-67.6	165.5	-10	0	0	110.2	L186 L187 D238 P242	L186-Q245 WeakPolarHBondContact CA-O 3.45Å; L187-Q245 HydrophobicContact CB-CB 4.28Å; L187-Q245 HydrophobicContact CD1-CB 4.4Å; L187-Q245 PolarHBondContact N-O 2.7Å; L187-Q245 PolarHBondContact O-N 3.35Å; D238-Q245 PolarHBondContact O-NE2 3.4Å; P242-Q245 VanDerWaalsContact CD-NE2 3.33Å; P242-Q245 HydrophobicContact CG-CG 4.24Å; P242-Q245 WeakPolarHBondContact O-CG 3.47Å; P242-Q245 PolarHBondContact O-NE2 3.45Å
246	V	94.9	Very high	90.6	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.018	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127.6	173.8	175.4	0	0	0	0	108.2	V184 V185 L186 W203 F257 I261 I270	V184-V246 HydrophobicContact CG1-CG1 3.62Å; V185-V246 WeakPolarHBondContact O-CA 3.46Å; L186-V246 HydrophobicContact CD1-CG2 3.78Å; W203-V246 HydrophobicContact CH2-CB 4.39Å; W203-V246 HydrophobicContact CH2-CG1 3.76Å; W203-V246 HydrophobicContact CH2-CG2 3.74Å; W203-V246 HydrophobicContact CZ3-CG1 4.41Å; W203-V246 HydrophobicContact CZ3-CG2 3.69Å; V246-F257 HydrophobicContact CB-CB 3.78Å; V246-F257 HydrophobicContact CB-CG 4.44Å; V246-F257 HydrophobicContact CG1-CB 4.17Å; V246-F257 WeakPolarHBondContact O-CB 3.44Å; V246-F257 PolarHBondContact O-N 3.07Å; V246-I261 HydrophobicContact CG2-CG2 4.01Å; V246-I270 HydrophobicContact CG1-CG2 4.41Å; V246-I270 HydrophobicContact CG2-CD1 4.17Å
247	V	94.9	Very high	90.6	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	125.1	179.6	-173.9	0	0	0	0	108.9	V184 V185 L187 F235 I237 V249 I254 M256	V184-V247 WeakPolarHBondContact CA-O 3.4Å; V185-V247 PolarHBondContact N-O 3.45Å; V185-V247 PolarHBondContact O-N 2.9Å; L187-V247 HydrophobicContact CD1-CG2 3.73Å; L187-V247 HydrophobicContact CG-CG2 4.23Å; F235-V247 HydrophobicContact CD1-CG1 4.11Å; F235-V247 HydrophobicContact CE1-CG1 4.34Å; I237-V247 HydrophobicContact CD1-CG1 4.45Å; I237-V247 HydrophobicContact CD1-CG2 3.77Å; V247-V249 HydrophobicContact CG1-CG2 4.22Å; V247-I254 HydrophobicContact CG1-CB 3.81Å; V247-I254 HydrophobicContact CG1-CG2 4.11Å; V247-M256 HydrophobicContact CG2-CG 4.45Å
248	L	94.6	Very high	90.4	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	130.2	168.7	-178.6	65.5	0	0	0	108.3	T182 V184 I254 K255 F273 E277 W284	T182-L248 HydrophobicContact CG2-CD1 3.68Å; V184-L248 HydrophobicContact CG2-CD1 3.81Å; L248-I254 CarbonylContact O-C 3.6Å; L248-I254 VanDerWaalsContact O-CA 3.22Å; L248-I254 WeakPolarHBondContact O-CA 3.49Å; L248-K255 PolarHBondContact N-O 2.78Å; L248-K255 PolarHBondContact O-N 3.5Å; L248-F273 HydrophobicContact CB-CE1 3.97Å; L248-F273 HydrophobicContact CD2-CE1 4.38Å; L248-E277 HydrophobicContact CD2-CB 3.7Å; L248-W284 HydrophobicContact CB-CH2 4.38Å; L248-W284 HydrophobicContact CD2-CH2 3.35Å; L248-W284 HydrophobicContact CD2-CZ2 3.64Å; L248-W284 HydrophobicContact CD2-CZ3 4.35Å; L248-W284 HydrophobicContact CG-CH2 3.56Å; L248-W284 HydrophobicContact CG-CZ2 4.34Å; L248-W284 HydrophobicContact CG-CZ3 4.17Å
249	V	93.2	Very high	90.3	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	121.4	179.9	-173.4	0	0	0	0	108.1	T182 S183 V185 F235 V247 H253 I254 L287	T182-V249 CarbonylContact C-O 3.45Å; T182-V249 WeakPolarHBondContact CA-O 3.32Å; S183-V249 PolarHBondContact N-O 3.23Å; S183-V249 PolarHBondContact O-N 3.41Å; V185-V249 HydrophobicContact CG2-CG2 3.92Å; F235-V249 HydrophobicContact CE1-CG2 3.97Å; V247-V249 HydrophobicContact CG1-CG2 4.22Å; V249-H253 WeakPolarHBondContact CA-O 3.35Å; V249-I254 HydrophobicContact CB-CG2 4.45Å; V249-I254 HydrophobicContact CG1-CG2 4.26Å; V249-I254 HydrophobicContact CG2-CG2 3.98Å; V249-L287 HydrophobicContact CG1-CD2 4.02Å
250	A	90.9	Very high	90	Very high	11 Å²	11	48.9 Å²	48.9	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	136.2	177.2	0	0	0	0	0	110.1	A181 T182 N252 H253 W284	A181-A250 WeakPolarHBondContact O-CA 3.35Å; T182-A250 HydrophobicContact CG2-CB 4.25Å; A250-N252 VanDerWaalsContact C-N 3.33Å; A250-N252 PolarHBondContact O-N 3.48Å; A250-H253 PolarHBondContact N-O 2.78Å; A250-H253 WeakPolarHBondContact O-CA 3.09Å; A250-H253 WeakPolarHBondContact O-CB 3.43Å; A250-H253 PolarHBondContact O-N 2.94Å; A250-W284 HydrophobicContact CB-CH2 3.66Å; A250-W284 HydrophobicContact CB-CZ3 3.7Å
251	N	86.9	Confident	90.1	Very high	127 Å²	127	47.2 Å²	47.2	68%	0.679	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	45.4	174.5	-59.5	-33.5	0	0	0	114.7	H253	N251-H253 PolarHBondContact O-N 3.33Å; N251-H253 PolarHBondContact O-ND1 2.93Å
252	N	88.2	Confident	90.2	Very high	82 Å²	82	44.9 Å²	44.9	44%	0.439	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	21.5	-174.7	-64.3	-11.4	0	0	0	115	R177 A250 L287	R177-N252 PolarHBondContact NH1-OD1 3.44Å; R177-N252 PolarHBondContact NH2-OD1 3.48Å; A250-N252 VanDerWaalsContact C-N 3.33Å; A250-N252 PolarHBondContact O-N 3.48Å; N252-L287 WeakPolarHBondContact O-CB 3.37Å; N252-L287 PolarHBondContact O-N 2.78Å
253	H	91.8	Very high	89.7	Confident	80 Å²	80	43 Å²	43	37%	0.37	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	157.3	170.9	-64.3	75.8	0	0	0	109.8	V249 A250 N251 W284 Q285	V249-H253 WeakPolarHBondContact CA-O 3.35Å; A250-H253 PolarHBondContact N-O 2.78Å; A250-H253 WeakPolarHBondContact O-CA 3.09Å; A250-H253 WeakPolarHBondContact O-CB 3.43Å; A250-H253 PolarHBondContact O-N 2.94Å; N251-H253 PolarHBondContact O-N 3.33Å; N251-H253 PolarHBondContact O-ND1 2.93Å; H253-W284 HydrophobicContact CB-CB 4Å; H253-W284 HydrophobicContact CB-CD2 4.38Å; H253-W284 HydrophobicContact CB-CE3 3.68Å; H253-Q285 CarbonylContact C-O 3.45Å; H253-Q285 WeakPolarHBondContact CA-O 3.5Å; H253-Q285 WeakPolarHBondContact CB-O 3.35Å
254	I	93.7	Very high	89.1	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.8	175	64.1	178.2	0	0	0	112	F235 I237 V247 L248 V249 Q285 L287	F235-I254 HydrophobicContact CB-CD1 4.03Å; F235-I254 HydrophobicContact CD1-CD1 4.29Å; F235-I254 HydrophobicContact CD1-CG2 4.15Å; F235-I254 WeakPolarHBondContact O-CD1 3.22Å; I237-I254 HydrophobicContact CD1-CD1 4.06Å; V247-I254 HydrophobicContact CG1-CB 3.81Å; V247-I254 HydrophobicContact CG1-CG2 4.11Å; L248-I254 CarbonylContact O-C 3.6Å; L248-I254 VanDerWaalsContact O-CA 3.22Å; L248-I254 WeakPolarHBondContact O-CA 3.49Å; V249-I254 HydrophobicContact CB-CG2 4.45Å; V249-I254 HydrophobicContact CG1-CG2 4.26Å; V249-I254 HydrophobicContact CG2-CG2 3.98Å; I254-Q285 HydrophobicContact CG1-CB 3.91Å; I254-Q285 PolarHBondContact N-O 3.2Å; I254-Q285 PolarHBondContact O-N 3.05Å; I254-L287 HydrophobicContact CD1-CD1 4.47Å; I254-L287 HydrophobicContact CG2-CB 4.05Å; I254-L287 HydrophobicContact CG2-CD1 3.22Å; I254-L287 HydrophobicContact CG2-CG 4.08Å
255	K	93.7	Very high	88.4	Confident	40 Å²	40	49.2 Å²	49.2	17%	0.174	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	125.7	167.9	-163.2	162.5	178.3	166.9	0	110	L248 F273 E277 E282 W284	L248-K255 PolarHBondContact N-O 2.78Å; L248-K255 PolarHBondContact O-N 3.5Å; K255-F273 HydrophobicContact CB-CZ 4.26Å; K255-F273 HydrophobicContact CD-CE2 4.46Å; K255-F273 HydrophobicContact CD-CZ 4.4Å; K255-F273 HydrophobicContact CG-CE2 4.35Å; K255-F273 HydrophobicContact CG-CZ 3.95Å; K255-E277 HydrophobicContact CD-CG 4.1Å; K255-E277 WeakPolarHBondContact CD-OE2 3.48Å; K255-E277 WeakPolarHBondContact CE-OE1 3.44Å; K255-E277 WeakPolarHBondContact CE-OE2 3.37Å; K255-E277 IonicContact NZ-OE1 3.6Å; K255-E277 PolarHBondContact NZ-OE1 2.84Å; K255-E277 IonicContact NZ-OE2 3.4Å; K255-E277 PolarHBondContact NZ-OE2 2.76Å; K255-E282 PolarHBondContact NZ-O 2.94Å; K255-W284 HydrophobicContact CB-CD2 3.84Å; K255-W284 HydrophobicContact CB-CE3 3.95Å; K255-W284 HydrophobicContact CB-CG 4.29Å; K255-W284 HydrophobicContact CB-CZ2 4.41Å; K255-W284 HydrophobicContact CB-CZ3 4.3Å; K255-W284 HydrophobicContact CD-CD2 4.26Å; K255-W284 HydrophobicContact CD-CG 4.18Å
256	M	93.1	Very high	88	Confident	81 Å²	81	48.3 Å²	48.3	40%	0.399	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	138.3	176.7	-65.8	-170.6	-68.6	0	0	110.3	I237 V247 P258 F273	I237-M256 HydrophobicContact CD1-CG 3.62Å; I237-M256 HydrophobicContact CD1-SD 3.62Å; I237-M256 HydrophobicContact CG1-CG 4.38Å; I237-M256 HydrophobicContact CG1-SD 3.77Å; I237-M256 HydrophobicContact CG2-SD 4.41Å; V247-M256 HydrophobicContact CG2-CG 4.45Å; M256-P258 WeakPolarHBondContact O-CD 3.38Å; M256-F273 WeakPolarHBondContact O-CZ 3.18Å
257	F	92.5	Very high	87.5	Confident	19 Å²	19	48.3 Å²	48.3	8%	0.083	25%	0.253	C	S	.	.			trans	-65.9	120.5	166.9	-177.9	-112.4	0	0	0	109	V246 L259 I261 Q269 I270 F273	V246-F257 HydrophobicContact CB-CB 3.78Å; V246-F257 HydrophobicContact CB-CG 4.44Å; V246-F257 HydrophobicContact CG1-CB 4.17Å; V246-F257 WeakPolarHBondContact O-CB 3.44Å; V246-F257 PolarHBondContact O-N 3.07Å; F257-L259 VanDerWaalsContact C-N 3.34Å; F257-L259 HydrophobicContact CD1-CB 4.38Å; F257-L259 WeakPolarHBondContact CD1-O 3.35Å; F257-L259 HydrophobicContact CE1-CB 3.63Å; F257-L259 WeakPolarHBondContact CE1-O 3.26Å; F257-L259 HydrophobicContact CZ-CB 3.75Å; F257-L259 HydrophobicContact CZ-CD1 4.28Å; F257-L259 HydrophobicContact CZ-CG 4.34Å; F257-L259 PolarHBondContact O-N 3.42Å; F257-I261 HydrophobicContact CD1-CG2 3.85Å; F257-I261 HydrophobicContact CE1-CG2 3.88Å; F257-Q269 HydrophobicContact CE2-CB 4.27Å; F257-Q269 HydrophobicContact CZ-CB 3.85Å; F257-I270 HydrophobicContact CD1-CG1 4.09Å; F257-I270 HydrophobicContact CD2-CG1 4.1Å; F257-I270 HydrophobicContact CE1-CG1 3.81Å; F257-I270 HydrophobicContact CE2-CB 4.46Å; F257-I270 HydrophobicContact CE2-CG1 3.85Å; F257-I270 HydrophobicContact CG-CG1 4.22Å; F257-I270 HydrophobicContact CZ-CG1 3.69Å; F257-F273 HydrophobicContact CB-CD1 4.44Å; F257-F273 HydrophobicContact CB-CE1 4.23Å; F257-F273 HydrophobicContact CD2-CB 3.81Å; F257-F273 AromaticContact CD2-CD1 3.74Å; F257-F273 HydrophobicContact CD2-CD1 3.74Å; F257-F273 HydrophobicContact CD2-CD2 4.13Å; F257-F273 HydrophobicContact CD2-CE1 4.3Å; F257-F273 AromaticContact CD2-CG 3.64Å; F257-F273 HydrophobicContact CD2-CG 3.64Å; F257-F273 HydrophobicContact CE2-CB 3.85Å; F257-F273 HydrophobicContact CE2-CG 4.18Å
258	P	88.1	Confident	87	Confident	102 Å²	102	48.4 Å²	48.4	66%	0.662	25%	0.253	S	S	*	.			trans	-80.2	-13.4	-167.3	29.5	-34.9	0	0	0	114.1	M256	M256-P258 WeakPolarHBondContact O-CD 3.38Å
259	L	86.9	Confident	86.7	Confident	95 Å²	95	51 Å²	51	50%	0.497	27%	0.266	S	S	.	.	S	Bend	trans	-103.3	157.4	-173.8	-56.8	176	0	0	0	112	F257 I261	F257-L259 VanDerWaalsContact C-N 3.34Å; F257-L259 HydrophobicContact CD1-CB 4.38Å; F257-L259 WeakPolarHBondContact CD1-O 3.35Å; F257-L259 HydrophobicContact CE1-CB 3.63Å; F257-L259 WeakPolarHBondContact CE1-O 3.26Å; F257-L259 HydrophobicContact CZ-CB 3.75Å; F257-L259 HydrophobicContact CZ-CD1 4.28Å; F257-L259 HydrophobicContact CZ-CG 4.34Å; F257-L259 PolarHBondContact O-N 3.42Å; L259-I261 PolarHBondContact O-N 3.2Å
260	S	83.6	Confident	86.6	Confident	67 Å²	67	50.9 Å²	50.9	47%	0.469	27%	0.265	S	S	.	.			trans	-71	126.8	173.7	175.4	0	0	0	0	111.3	Y262 S263	S260-Y262 PolarHBondContact O-N 3.42Å; S260-Y262 WeakPolarHBondContact OG-CD2 3.39Å; S260-Y262 PolarHBondContact OG-N 2.82Å; S260-S263 PolarHBondContact O-OG 3.22Å
261	I	85.6	Confident	86.4	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.021	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-4.8	177.3	62.3	170.2	0	0	0	113.8	L186 Y198 W202 P244 V246 F257 L259 S263 A266 I270	L186-I261 HydrophobicContact CD1-CD1 4.03Å; Y198-I261 HydrophobicContact CD1-CD1 4.33Å; Y198-I261 VanDerWaalsContact CE1-O 3.29Å; Y198-I261 WeakPolarHBondContact CE1-O 3.31Å; Y198-I261 HydrophobicContact CG-CD1 4.44Å; W202-I261 HydrophobicContact CH2-CB 4.06Å; W202-I261 HydrophobicContact CZ3-CD1 4.32Å; P244-I261 HydrophobicContact CB-CD1 3.64Å; P244-I261 HydrophobicContact CG-CD1 3.38Å; P244-I261 HydrophobicContact CG-CG1 4.22Å; V246-I261 HydrophobicContact CG2-CG2 4.01Å; F257-I261 HydrophobicContact CD1-CG2 3.85Å; F257-I261 HydrophobicContact CE1-CG2 3.88Å; L259-I261 PolarHBondContact O-N 3.2Å; I261-S263 PolarHBondContact O-N 3.13Å; I261-A266 HydrophobicContact CB-CB 4.43Å; I261-I270 HydrophobicContact CG2-CD1 3.91Å
262	Y	82.6	Confident	86.5	Confident	94 Å²	94	50 Å²	50	37%	0.369	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-14.9	174.8	-66	-70.4	0	0	0	113.6	L194 Y198 C243 P244 S260	L194-Y262 HydrophobicContact CB-CE1 4.45Å; Y198-Y262 HydrophobicContact CD2-CD1 4.21Å; Y198-Y262 AromaticContact CD2-CE1 3.93Å; Y198-Y262 HydrophobicContact CD2-CE1 3.93Å; Y198-Y262 AromaticContact CE2-CD1 3.38Å; Y198-Y262 HydrophobicContact CE2-CD1 3.38Å; Y198-Y262 AromaticContact CE2-CE1 3.46Å; Y198-Y262 HydrophobicContact CE2-CE1 3.46Å; Y198-Y262 VanDerWaalsContact CE2-CE1 3.46Å; Y198-Y262 AromaticContact CZ-CD1 3.62Å; C243-Y262 WeakPolarHBondContact O-CE2 3.42Å; C243-Y262 PolarHBondContact O-OH 2.89Å; P244-Y262 WeakPolarHBondContact CD-OH 3.23Å; S260-Y262 PolarHBondContact O-N 3.42Å; S260-Y262 WeakPolarHBondContact OG-CD2 3.39Å; S260-Y262 PolarHBondContact OG-N 2.82Å
263	S	77	Confident	86.6	Confident	52 Å²	52	47 Å²	47	36%	0.364	23%	0.233	S	C	.	.	S	Bend	trans	-79.1	150.4	-177.4	71.8	0	0	0	0	112.7	S260 I261 A266	S260-S263 PolarHBondContact O-OG 3.22Å; I261-S263 PolarHBondContact O-N 3.13Å; S263-A266 WeakPolarHBondContact O-CB 3.3Å; S263-A266 PolarHBondContact O-N 2.8Å
264	R	72.8	Confident	86.5	Confident	142 Å²	142	43.2 Å²	43.2	54%	0.536	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	138.7	170.1	-169.6	175.5	-179.8	-169.6	-7.7	110	N70 D74 A266	N70-R264 PolarHBondContact O-NH2 3.04Å; N70-R264 VanDerWaalsContact OD1-CZ 3.3Å; N70-R264 PolarHBondContact OD1-NH1 2.87Å; N70-R264 PolarHBondContact OD1-NH2 3.01Å; D74-R264 WeakPolarHBondContact OD2-CG 3.46Å; D74-R264 IonicContact OD2-CZ 3.47Å; D74-R264 IonicContact OD2-NE 2.76Å; D74-R264 PolarHBondContact OD2-NE 2.92Å; D74-R264 IonicContact OD2-NH2 2.74Å; D74-R264 PolarHBondContact OD2-NH2 2.9Å; R264-A266 VanDerWaalsContact C-N 3.26Å; R264-A266 PolarHBondContact O-N 3.1Å
265	G	77.8	Confident	86.2	Confident	9 Å²	9	46.9 Å²	46.9	9%	0.093	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	2.5	-176.1	0	0	0	0	0	114.5	A267 A268 Q269	G265-A267 PolarHBondContact O-N 2.79Å; G265-A268 PolarHBondContact O-N 2.9Å; G265-Q269 PolarHBondContact O-N 2.96Å
266	A	84.6	Confident	86	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-53	-38.1	176.2	0	0	0	0	0	112.8	W202 I261 S263 R264 A268 Q269 I270	W202-A266 HydrophobicContact CZ2-CB 4.21Å; I261-A266 HydrophobicContact CB-CB 4.43Å; S263-A266 WeakPolarHBondContact O-CB 3.3Å; S263-A266 PolarHBondContact O-N 2.8Å; R264-A266 VanDerWaalsContact C-N 3.26Å; R264-A266 PolarHBondContact O-N 3.1Å; A266-A268 VanDerWaalsContact C-N 3.35Å; A266-A268 PolarHBondContact O-N 2.77Å; A266-Q269 PolarHBondContact O-N 2.89Å; A266-I270 WeakPolarHBondContact O-CD1 3.32Å; A266-I270 VanDerWaalsContact O-CG1 3.23Å; A266-I270 WeakPolarHBondContact O-CG1 3.02Å; A266-I270 PolarHBondContact O-N 3.49Å
267	A	86.1	Confident	85.8	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.033	23%	0.233	C	C	.	.	H	α-helix	trans	-60.4	-42.2	177.3	0	0	0	0	0	113	A138 W202 V206 G265 I270 R271	A138-A267 HydrophobicContact CB-CB 3.57Å; W202-A267 HydrophobicContact CZ2-CB 4.42Å; V206-A267 HydrophobicContact CG2-CB 3.8Å; G265-A267 PolarHBondContact O-N 2.79Å; A267-I270 PolarHBondContact O-N 3.37Å; A267-R271 PolarHBondContact O-N 3.05Å
268	A	83.4	Confident	85.3	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-69.3	-38.8	177.3	0	0	0	0	0	111.2	E34 G265 A266 R271 R272	E34-A268 HydrophobicContact CG-CB 4.39Å; E34-A268 VanDerWaalsContact OE1-CB 3.32Å; E34-A268 WeakPolarHBondContact OE1-CB 3.45Å; G265-A268 PolarHBondContact O-N 2.9Å; A266-A268 VanDerWaalsContact C-N 3.35Å; A266-A268 PolarHBondContact O-N 2.77Å; A268-R271 PolarHBondContact O-N 2.95Å; A268-R272 PolarHBondContact O-N 3.28Å
269	Q	88	Confident	84.9	Confident	56 Å²	56	47.5 Å²	47.5	26%	0.262	24%	0.244	S	C	.	.	H	α-helix	trans	-63.4	-41.6	173.6	-65.3	172.1	6.7	0	0	112.5	F257 G265 A266 R271 R272 F273	F257-Q269 HydrophobicContact CE2-CB 4.27Å; F257-Q269 HydrophobicContact CZ-CB 3.85Å; G265-Q269 PolarHBondContact O-N 2.96Å; A266-Q269 PolarHBondContact O-N 2.89Å; Q269-R271 VanDerWaalsContact C-N 3.35Å; Q269-R272 PolarHBondContact O-N 3.28Å; Q269-F273 VanDerWaalsContact O-CB 3.3Å; Q269-F273 WeakPolarHBondContact O-CB 3.11Å; Q269-F273 PolarHBondContact O-N 3.34Å
270	I	91	Very high	84.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.2	-44.1	175.3	-69.7	161.6	0	0	0	110.1	W202 W203 V206 V246 F257 I261 A266 A267 F273 I274	W202-I270 HydrophobicContact CH2-CD1 3.84Å; W203-I270 HydrophobicContact CZ3-CD1 4.24Å; V206-I270 HydrophobicContact CG1-CB 4.44Å; V206-I270 HydrophobicContact CG1-CD1 4.45Å; V206-I270 HydrophobicContact CG1-CG2 3.98Å; V246-I270 HydrophobicContact CG1-CG2 4.41Å; V246-I270 HydrophobicContact CG2-CD1 4.17Å; F257-I270 HydrophobicContact CD1-CG1 4.09Å; F257-I270 HydrophobicContact CD2-CG1 4.1Å; F257-I270 HydrophobicContact CE1-CG1 3.81Å; F257-I270 HydrophobicContact CE2-CB 4.46Å; F257-I270 HydrophobicContact CE2-CG1 3.85Å; F257-I270 HydrophobicContact CG-CG1 4.22Å; F257-I270 HydrophobicContact CZ-CG1 3.69Å; I261-I270 HydrophobicContact CG2-CD1 3.91Å; A266-I270 WeakPolarHBondContact O-CD1 3.32Å; A266-I270 VanDerWaalsContact O-CG1 3.23Å; A266-I270 WeakPolarHBondContact O-CG1 3.02Å; A266-I270 PolarHBondContact O-N 3.49Å; A267-I270 PolarHBondContact O-N 3.37Å; I270-F273 WeakPolarHBondContact O-CB 2.9Å; I270-F273 PolarHBondContact O-N 3.32Å; I270-I274 HydrophobicContact CG2-CD1 3.77Å; I270-I274 HydrophobicContact CG2-CG1 4.4Å; I270-I274 WeakPolarHBondContact O-CD1 3.26Å; I270-I274 VanDerWaalsContact O-CG1 3.25Å; I270-I274 WeakPolarHBondContact O-CG1 3.3Å; I270-I274 PolarHBondContact O-N 3.19Å
271	R	87.7	Confident	84.2	Confident	2 Å²	2	48 Å²	48	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-58.6	-50.7	175.4	-179.4	178.9	72.6	-128.1	3.1	111.6	V210 A267 A268 Q269 F273 I274 E275	V210-R271 HydrophobicContact CG2-CB 4.33Å; V210-R271 HydrophobicContact CG2-CG 4.1Å; A267-R271 PolarHBondContact O-N 3.05Å; A268-R271 PolarHBondContact O-N 2.95Å; Q269-R271 VanDerWaalsContact C-N 3.35Å; R271-F273 VanDerWaalsContact C-N 3.27Å; R271-F273 PolarHBondContact O-N 3.08Å; R271-I274 PolarHBondContact O-N 2.95Å; R271-E275 WeakPolarHBondContact CG-OE1 3.4Å; R271-E275 WeakPolarHBondContact O-CG 3.49Å; R271-E275 PolarHBondContact O-N 2.75Å
272	R	87.5	Confident	84	Confident	119 Å²	119	54.3 Å²	54.3	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-57.8	-41.4	176.4	-75.5	-164.8	-176.7	122.7	-12.4	112.1	E34 A268 Q269 E275 A276	E34-R272 IonicContact OE1-CZ 2.88Å; E34-R272 IonicContact OE1-NE 3.53Å; E34-R272 PolarHBondContact OE1-NE 3.49Å; E34-R272 IonicContact OE1-NH1 2.87Å; E34-R272 PolarHBondContact OE1-NH1 3Å; E34-R272 IonicContact OE1-NH2 3.77Å; E34-R272 PolarHBondContact OE1-NH2 3.44Å; E34-R272 VanDerWaalsContact OE1-NH2 3.13Å; E34-R272 IonicContact OE2-CZ 3.62Å; E34-R272 IonicContact OE2-NE 3.96Å; E34-R272 IonicContact OE2-NH1 3.81Å; E34-R272 PolarHBondContact OE2-NH1 3.03Å; E34-R272 IonicContact OE2-NH2 2.63Å; E34-R272 PolarHBondContact OE2-NH2 3.35Å; A268-R272 PolarHBondContact O-N 3.28Å; Q269-R272 PolarHBondContact O-N 3.28Å; R272-E275 PolarHBondContact O-N 2.88Å; R272-A276 VanDerWaalsContact O-CB 3.3Å; R272-A276 WeakPolarHBondContact O-CB 2.93Å; R272-A276 PolarHBondContact O-N 2.86Å
273	F	90.9	Very high	84.1	Confident	18 Å²	18	53.2 Å²	53.2	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-48.3	177	171.5	-101.9	0	0	0	111	L248 K255 M256 F257 Q269 I270 R271 E275 A276 E277	L248-F273 HydrophobicContact CB-CE1 3.97Å; L248-F273 HydrophobicContact CD2-CE1 4.38Å; K255-F273 HydrophobicContact CB-CZ 4.26Å; K255-F273 HydrophobicContact CD-CE2 4.46Å; K255-F273 HydrophobicContact CD-CZ 4.4Å; K255-F273 HydrophobicContact CG-CE2 4.35Å; K255-F273 HydrophobicContact CG-CZ 3.95Å; M256-F273 WeakPolarHBondContact O-CZ 3.18Å; F257-F273 HydrophobicContact CB-CD1 4.44Å; F257-F273 HydrophobicContact CB-CE1 4.23Å; F257-F273 HydrophobicContact CD2-CB 3.81Å; F257-F273 AromaticContact CD2-CD1 3.74Å; F257-F273 HydrophobicContact CD2-CD1 3.74Å; F257-F273 HydrophobicContact CD2-CD2 4.13Å; F257-F273 HydrophobicContact CD2-CE1 4.3Å; F257-F273 AromaticContact CD2-CG 3.64Å; F257-F273 HydrophobicContact CD2-CG 3.64Å; F257-F273 HydrophobicContact CE2-CB 3.85Å; F257-F273 HydrophobicContact CE2-CG 4.18Å; Q269-F273 VanDerWaalsContact O-CB 3.3Å; Q269-F273 WeakPolarHBondContact O-CB 3.11Å; Q269-F273 PolarHBondContact O-N 3.34Å; I270-F273 WeakPolarHBondContact O-CB 2.9Å; I270-F273 PolarHBondContact O-N 3.32Å; R271-F273 VanDerWaalsContact C-N 3.27Å; R271-F273 PolarHBondContact O-N 3.08Å; F273-E275 VanDerWaalsContact C-N 3.34Å; F273-E275 PolarHBondContact O-N 3.43Å; F273-A276 PolarHBondContact O-N 3.36Å; F273-E277 HydrophobicContact CD2-CG 3.59Å; F273-E277 HydrophobicContact CE1-CG 4.43Å; F273-E277 HydrophobicContact CE2-CG 3.46Å; F273-E277 VanDerWaalsContact CE2-CG 3.46Å; F273-E277 HydrophobicContact CG-CG 4.15Å; F273-E277 HydrophobicContact CZ-CG 3.92Å; F273-E277 VanDerWaalsContact O-CB 3.23Å; F273-E277 WeakPolarHBondContact O-CB 3.47Å; F273-E277 WeakPolarHBondContact O-CG 3.21Å; F273-E277 PolarHBondContact O-N 3.16Å
274	I	90.5	Very high	84.8	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-58.1	-46.9	176	-66.4	161.3	0	0	0	110.9	V184 V210 I216 F218 I270 R271 I278	V184-I274 HydrophobicContact CG1-CD1 4.44Å; V184-I274 HydrophobicContact CG2-CD1 3.76Å; V184-I274 HydrophobicContact CG2-CG1 4.03Å; V210-I274 HydrophobicContact CG2-CD1 4.5Å; I216-I274 HydrophobicContact CD1-CG2 3.51Å; F218-I274 HydrophobicContact CE1-CD1 4.2Å; F218-I274 HydrophobicContact CZ-CD1 3.94Å; I270-I274 HydrophobicContact CG2-CD1 3.77Å; I270-I274 HydrophobicContact CG2-CG1 4.4Å; I270-I274 WeakPolarHBondContact O-CD1 3.26Å; I270-I274 VanDerWaalsContact O-CG1 3.25Å; I270-I274 WeakPolarHBondContact O-CG1 3.3Å; I270-I274 PolarHBondContact O-N 3.19Å; R271-I274 PolarHBondContact O-N 2.95Å; I274-I278 HydrophobicContact CG2-CD1 3.65Å; I274-I278 WeakPolarHBondContact O-CB 3.49Å; I274-I278 WeakPolarHBondContact O-CD1 3.46Å; I274-I278 WeakPolarHBondContact O-CG1 2.98Å; I274-I278 PolarHBondContact O-N 2.89Å
275	E	87.5	Confident	85.7	Confident	78 Å²	78	50.3 Å²	50.3	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-42.3	-179.2	-72.3	169	-177.6	0	0	112.5	R271 R272 F273	R271-E275 WeakPolarHBondContact CG-OE1 3.4Å; R271-E275 WeakPolarHBondContact O-CG 3.49Å; R271-E275 PolarHBondContact O-N 2.75Å; R272-E275 PolarHBondContact O-N 2.88Å; F273-E275 VanDerWaalsContact C-N 3.34Å; F273-E275 PolarHBondContact O-N 3.43Å
276	A	88.7	Confident	86.4	Confident	53 Å²	53	56.6 Å²	56.6	44%	0.438	31%	0.307	S	S	.	.	H	α-helix	trans	-70.5	-47.4	179.4	0	0	0	0	0	112	R272 F273 T279 N280	R272-A276 VanDerWaalsContact O-CB 3.3Å; R272-A276 WeakPolarHBondContact O-CB 2.93Å; R272-A276 PolarHBondContact O-N 2.86Å; F273-A276 PolarHBondContact O-N 3.36Å; A276-T279 PolarHBondContact O-N 3.26Å; A276-T279 VanDerWaalsContact O-N 3.15Å; A276-T279 PolarHBondContact O-OG1 3.4Å; A276-N280 PolarHBondContact O-N 3.36Å
277	E	88.6	Confident	86.7	Confident	31 Å²	31	56.9 Å²	56.9	15%	0.145	31%	0.309	C	S	.	.	H	α-helix	trans	-74	-30.8	-170.1	-68.4	-59.7	165.9	0	0	113.9	L248 K255 F273 T279 N280 W284	L248-E277 HydrophobicContact CD2-CB 3.7Å; K255-E277 HydrophobicContact CD-CG 4.1Å; K255-E277 WeakPolarHBondContact CD-OE2 3.48Å; K255-E277 WeakPolarHBondContact CE-OE1 3.44Å; K255-E277 WeakPolarHBondContact CE-OE2 3.37Å; K255-E277 IonicContact NZ-OE1 3.6Å; K255-E277 PolarHBondContact NZ-OE1 2.84Å; K255-E277 IonicContact NZ-OE2 3.4Å; K255-E277 PolarHBondContact NZ-OE2 2.76Å; F273-E277 HydrophobicContact CD2-CG 3.59Å; F273-E277 HydrophobicContact CE1-CG 4.43Å; F273-E277 HydrophobicContact CE2-CG 3.46Å; F273-E277 VanDerWaalsContact CE2-CG 3.46Å; F273-E277 HydrophobicContact CG-CG 4.15Å; F273-E277 HydrophobicContact CZ-CG 3.92Å; F273-E277 VanDerWaalsContact O-CB 3.23Å; F273-E277 WeakPolarHBondContact O-CB 3.47Å; F273-E277 WeakPolarHBondContact O-CG 3.21Å; F273-E277 PolarHBondContact O-N 3.16Å; E277-T279 PolarHBondContact O-N 3.05Å; E277-N280 CarbonylContact O-C 3.57Å; E277-N280 PolarHBondContact O-N 3.4Å; E277-W284 HydrophobicContact CB-CZ2 3.97Å; E277-W284 PolarHBondContact OE2-NE1 2.97Å
278	I	82.6	Confident	86.9	Confident	55 Å²	55	61 Å²	61	28%	0.282	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-28	173.1	-70.3	170.9	0	0	0	111.1	T182 I216 I274	T182-I278 HydrophobicContact CG2-CD1 4.08Å; T182-I278 HydrophobicContact CG2-CG1 4.31Å; I216-I278 HydrophobicContact CD1-CD1 3.5Å; I216-I278 VanDerWaalsContact CD1-CD1 3.5Å; I216-I278 HydrophobicContact CG1-CD1 4.22Å; I274-I278 HydrophobicContact CG2-CD1 3.65Å; I274-I278 WeakPolarHBondContact O-CB 3.49Å; I274-I278 WeakPolarHBondContact O-CD1 3.46Å; I274-I278 WeakPolarHBondContact O-CG1 2.98Å; I274-I278 PolarHBondContact O-N 2.89Å
279	T	79.7	Confident	87.2	Confident	115 Å²	115	64.9 Å²	64.9	71%	0.706	36%	0.36	S	S	*	.	H	α-helix	trans	-91	-20.7	179.6	67.2	0	0	0	0	114.1	A276 E277	A276-T279 PolarHBondContact O-N 3.26Å; A276-T279 VanDerWaalsContact O-N 3.15Å; A276-T279 PolarHBondContact O-OG1 3.4Å; E277-T279 PolarHBondContact O-N 3.05Å
280	N	82.8	Confident	87.3	Confident	71 Å²	71	67.1 Å²	67.1	38%	0.38	37%	0.371	S	S	.	.			trans	-129.8	97.9	-179.2	-173.2	11.5	0	0	0	112	A276 E277 E282	A276-N280 PolarHBondContact O-N 3.36Å; E277-N280 CarbonylContact O-C 3.57Å; E277-N280 PolarHBondContact O-N 3.4Å; N280-E282 PolarHBondContact ND2-OE2 2.83Å; N280-E282 PolarHBondContact O-N 2.79Å; N280-E282 VanDerWaalsContact OD1-CG 3.29Å; N280-E282 WeakPolarHBondContact OD1-CG 3.43Å; N280-E282 PolarHBondContact OD1-N 3.17Å
281	P	72.1	Confident	87.2	Confident	101 Å²	101	67.4 Å²	67.4	66%	0.656	37%	0.373	S	S	*	.			trans	-76.9	20.7	-178.4	31.8	-35	0	0	0	115.1	W284	P281-W284 VanDerWaalsContact CA-CD1 3.43Å
282	E	82.1	Confident	87.4	Confident	137 Å²	137	69.9 Å²	69.9	64%	0.64	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	134.5	178	-77.5	176.7	169.3	0	0	113	K255 N280 W284	K255-E282 PolarHBondContact NZ-O 2.94Å; N280-E282 PolarHBondContact ND2-OE2 2.83Å; N280-E282 PolarHBondContact O-N 2.79Å; N280-E282 VanDerWaalsContact OD1-CG 3.29Å; N280-E282 WeakPolarHBondContact OD1-CG 3.43Å; N280-E282 PolarHBondContact OD1-N 3.17Å; E282-W284 VanDerWaalsContact C-N 3.32Å; E282-W284 PolarHBondContact O-N 3Å
283	G	85.4	Confident	87.5	Confident	72 Å²	72	70.5 Å²	70.5	74%	0.742	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	17.1	174.3	0	0	0	0	0	115.2
284	W	92	Very high	87.6	Confident	36 Å²	36	75.1 Å²	75.1	14%	0.136	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-74.6	143.6	173.8	-72.5	61.6	0	0	0	111.2	L248 A250 H253 K255 E277 P281 E282	L248-W284 HydrophobicContact CB-CH2 4.38Å; L248-W284 HydrophobicContact CD2-CH2 3.35Å; L248-W284 HydrophobicContact CD2-CZ2 3.64Å; L248-W284 HydrophobicContact CD2-CZ3 4.35Å; L248-W284 HydrophobicContact CG-CH2 3.56Å; L248-W284 HydrophobicContact CG-CZ2 4.34Å; L248-W284 HydrophobicContact CG-CZ3 4.17Å; A250-W284 HydrophobicContact CB-CH2 3.66Å; A250-W284 HydrophobicContact CB-CZ3 3.7Å; H253-W284 HydrophobicContact CB-CB 4Å; H253-W284 HydrophobicContact CB-CD2 4.38Å; H253-W284 HydrophobicContact CB-CE3 3.68Å; K255-W284 HydrophobicContact CB-CD2 3.84Å; K255-W284 HydrophobicContact CB-CE3 3.95Å; K255-W284 HydrophobicContact CB-CG 4.29Å; K255-W284 HydrophobicContact CB-CZ2 4.41Å; K255-W284 HydrophobicContact CB-CZ3 4.3Å; K255-W284 HydrophobicContact CD-CD2 4.26Å; K255-W284 HydrophobicContact CD-CG 4.18Å; E277-W284 HydrophobicContact CB-CZ2 3.97Å; E277-W284 PolarHBondContact OE2-NE1 2.97Å; P281-W284 VanDerWaalsContact CA-CD1 3.43Å; E282-W284 VanDerWaalsContact C-N 3.32Å; E282-W284 PolarHBondContact O-N 3Å
285	Q	91.4	Very high	87.7	Confident	97 Å²	97	79 Å²	79	45%	0.453	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	146.9	176.7	-66	176.8	-25.8	0	0	109.8	H253 I254	H253-Q285 CarbonylContact C-O 3.45Å; H253-Q285 WeakPolarHBondContact CA-O 3.5Å; H253-Q285 WeakPolarHBondContact CB-O 3.35Å; I254-Q285 HydrophobicContact CG1-CB 3.91Å; I254-Q285 PolarHBondContact N-O 3.2Å; I254-Q285 PolarHBondContact O-N 3.05Å
286	E	91.1	Very high	87.9	Confident	141 Å²	141	76.9 Å²	76.9	66%	0.659	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	136.5	174.8	-170.8	173.9	-172.6	0	0	110.5	M288	E286-M288 PolarHBondContact O-N 3.1Å
287	L	90.9	Very high	88	Confident	7 Å²	7	79.2 Å²	79.2	4%	0.037	44%	0.437	C	S	.	.			trans	-83.1	107	172.9	-169.1	76.1	0	0	0	108.3	R234 F235 V249 N252 I254	R234-L287 HydrophobicContact CG-CD1 4.15Å; R234-L287 HydrophobicContact CG-CG 4.32Å; R234-L287 PolarHBondContact NH1-O 2.81Å; R234-L287 WeakPolarHBondContact O-CD1 3.23Å; F235-L287 HydrophobicContact CD1-CD1 3.82Å; F235-L287 HydrophobicContact CD2-CD1 4.41Å; F235-L287 HydrophobicContact CE1-CD1 4.07Å; F235-L287 HydrophobicContact CG-CD1 4.02Å; F235-L287 HydrophobicContact CZ-CD1 4.48Å; V249-L287 HydrophobicContact CG1-CD2 4.02Å; N252-L287 WeakPolarHBondContact O-CB 3.37Å; N252-L287 PolarHBondContact O-N 2.78Å; I254-L287 HydrophobicContact CD1-CD1 4.47Å; I254-L287 HydrophobicContact CG2-CB 4.05Å; I254-L287 HydrophobicContact CG2-CD1 3.22Å; I254-L287 HydrophobicContact CG2-CG 4.08Å
288	M	91.7	Very high	88.1	Confident	89 Å²	89	80.6 Å²	80.6	44%	0.438	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-58.3	150.4	-175.4	-58.8	-57.9	-66.7	0	0	112.7	Q233 R234 S236 E286	Q233-M288 WeakPolarHBondContact O-CB 3.02Å; Q233-M288 WeakPolarHBondContact O-CG 3.08Å; R234-M288 WeakPolarHBondContact CD-O 3.44Å; R234-M288 PolarHBondContact NH1-O 3.49Å; R234-M288 PolarHBondContact O-N 3.38Å; S236-M288 WeakPolarHBondContact OG-CG 3.32Å; E286-M288 PolarHBondContact O-N 3.1Å
289	A	89.9	Confident	88.5	Confident	83 Å²	83	79.8 Å²	79.8	69%	0.686	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-50.5	155.1	179.9	0	0	0	0	0	114.7
290	E	88.4	Confident	89.1	Confident	103 Å²	103	80 Å²	80	48%	0.481	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-58.8	136.6	172.7	-174.4	178.6	-178.7	0	0	110.4	S292	E290-S292 PolarHBondContact O-N 2.83Å
291	P	89.7	Confident	89.5	Confident	6 Å²	6	81.9 Å²	81.9	4%	0.039	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-59.9	136.1	175.2	-20.6	32.5	0	0	0	111.1	F229 F230 Q233 E295 Y296	F229-P291 HydrophobicContact CE1-CB 3.87Å; F229-P291 HydrophobicContact CE1-CG 4.24Å; F230-P291 HydrophobicContact CD2-CG 4.17Å; Q233-P291 HydrophobicContact CB-CG 3.77Å; Q233-P291 HydrophobicContact CG-CG 4.37Å; P291-E295 WeakPolarHBondContact CA-OE2 3.45Å; P291-E295 HydrophobicContact CB-CB 4.47Å; P291-Y296 HydrophobicContact CB-CD2 4.31Å; P291-Y296 HydrophobicContact CB-CE2 3.83Å; P291-Y296 HydrophobicContact CG-CE2 4.45Å; P291-Y296 WeakPolarHBondContact O-CE2 3.46Å
292	S	91.7	Very high	90.3	Very high	55 Å²	55	82.9 Å²	82.9	39%	0.385	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-70.5	156.9	176.1	62.3	0	0	0	0	112.3	E290 L294 E295 Y296	E290-S292 PolarHBondContact O-N 2.83Å; S292-L294 PolarHBondContact O-N 2.96Å; S292-L294 VanDerWaalsContact O-N 3.13Å; S292-E295 PolarHBondContact N-OE2 2.93Å; S292-E295 WeakPolarHBondContact O-CB 3.37Å; S292-E295 PolarHBondContact O-N 2.94Å; S292-E295 VanDerWaalsContact OG-CG 3.29Å; S292-E295 WeakPolarHBondContact OG-CG 3.46Å; S292-E295 PolarHBondContact OG-N 3.48Å; S292-E295 PolarHBondContact OG-OE2 3.26Å; S292-Y296 WeakPolarHBondContact O-CD2 3.48Å; S292-Y296 PolarHBondContact O-N 2.87Å; S292-Y296 VanDerWaalsContact O-N 3.09Å
293	D	90.3	Very high	90.6	Very high	132 Å²	132	80.9 Å²	80.9	71%	0.706	43%	0.432	S	S	*	.	H	α-helix	trans	-53.1	-35.5	173.9	-64.3	-16.6	0	0	0	112.4	Y296 M297	D293-Y296 PolarHBondContact O-N 2.69Å; D293-M297 WeakPolarHBondContact O-CG 3.39Å; D293-M297 PolarHBondContact O-N 3.02Å
294	L	92.6	Very high	90.7	Very high	114 Å²	114	79.3 Å²	79.3	60%	0.597	41%	0.413	S	S	*	.	H	α-helix	trans	-65.9	-40.8	177.2	-176.5	61.7	0	0	0	112	S292 M297 V298	S292-L294 PolarHBondContact O-N 2.96Å; S292-L294 VanDerWaalsContact O-N 3.13Å; L294-M297 HydrophobicContact CB-CE 4.38Å; L294-M297 HydrophobicContact CD1-CE 3.86Å; L294-M297 PolarHBondContact O-N 2.8Å; L294-V298 WeakPolarHBondContact O-CG2 3.27Å; L294-V298 PolarHBondContact O-N 3.29Å
295	E	91.6	Very high	90.6	Very high	82 Å²	82	82 Å²	82	38%	0.383	43%	0.429	S	S	.	.	H	α-helix	trans	-66.8	-39.2	177.4	-74.6	169.3	132	0	0	111.7	F229 P291 S292 V298 F299	F229-E295 HydrophobicContact CE1-CB 4.42Å; F229-E295 HydrophobicContact CZ-CB 4.02Å; P291-E295 WeakPolarHBondContact CA-OE2 3.45Å; P291-E295 HydrophobicContact CB-CB 4.47Å; S292-E295 PolarHBondContact N-OE2 2.93Å; S292-E295 WeakPolarHBondContact O-CB 3.37Å; S292-E295 PolarHBondContact O-N 2.94Å; S292-E295 VanDerWaalsContact OG-CG 3.29Å; S292-E295 WeakPolarHBondContact OG-CG 3.46Å; S292-E295 PolarHBondContact OG-N 3.48Å; S292-E295 PolarHBondContact OG-OE2 3.26Å; E295-V298 PolarHBondContact O-N 3.13Å; E295-F299 PolarHBondContact O-N 2.02Å
296	Y	91.7	Very high	90.3	Very high	34 Å²	34	79.8 Å²	79.8	13%	0.133	43%	0.427	C	S	.	.	H	α-helix	trans	-61.5	-46.1	171.1	-76.3	-64.2	0	0	0	112.1	V226 F229 F230 P291 S292 D293 V298 F299 E300	V226-Y296 HydrophobicContact CG1-CD1 3.66Å; V226-Y296 HydrophobicContact CG1-CE1 3.5Å; V226-Y296 VanDerWaalsContact CG1-CE1 3.5Å; F229-Y296 AromaticContact CD1-CD1 3.85Å; F229-Y296 HydrophobicContact CD1-CD1 3.85Å; F229-Y296 AromaticContact CD1-CE1 3.8Å; F229-Y296 HydrophobicContact CD1-CE1 3.8Å; F229-Y296 AromaticContact CE1-CD1 3.93Å; F229-Y296 HydrophobicContact CE1-CD1 3.93Å; F229-Y296 HydrophobicContact CE1-CE1 4.07Å; F230-Y296 VanDerWaalsContact CD2-OH 3.26Å; F230-Y296 WeakPolarHBondContact CD2-OH 3.43Å; P291-Y296 HydrophobicContact CB-CD2 4.31Å; P291-Y296 HydrophobicContact CB-CE2 3.83Å; P291-Y296 HydrophobicContact CG-CE2 4.45Å; P291-Y296 WeakPolarHBondContact O-CE2 3.46Å; S292-Y296 WeakPolarHBondContact O-CD2 3.48Å; S292-Y296 PolarHBondContact O-N 2.87Å; S292-Y296 VanDerWaalsContact O-N 3.09Å; D293-Y296 PolarHBondContact O-N 2.69Å; Y296-V298 VanDerWaalsContact C-N 3.32Å; Y296-V298 PolarHBondContact O-N 3.1Å; Y296-F299 PolarHBondContact O-N 3.3Å; Y296-E300 WeakPolarHBondContact O-CG 3.42Å; Y296-E300 PolarHBondContact O-N 2.75Å
297	M	90.6	Very high	90	Very high	102 Å²	102	76.1 Å²	76.1	50%	0.502	42%	0.417	S	S	.	.	H	α-helix	trans	-59.4	-41.4	176.6	-75.5	-171	-69.1	0	0	112.3	D293 L294 E300 M301	D293-M297 WeakPolarHBondContact O-CG 3.39Å; D293-M297 PolarHBondContact O-N 3.02Å; L294-M297 HydrophobicContact CB-CE 4.38Å; L294-M297 HydrophobicContact CD1-CE 3.86Å; L294-M297 PolarHBondContact O-N 2.8Å; M297-E300 PolarHBondContact O-N 2.84Å; M297-M301 WeakPolarHBondContact O-CG 3.32Å; M297-M301 PolarHBondContact O-N 3.49Å
298	V	92.2	Very high	89.4	Confident	60 Å²	60	84.5 Å²	84.5	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-62.1	-46.4	176.3	170.9	0	0	0	0	110.8	L294 E295 Y296 E300 M301 E302	L294-V298 WeakPolarHBondContact O-CG2 3.27Å; L294-V298 PolarHBondContact O-N 3.29Å; E295-V298 PolarHBondContact O-N 3.13Å; Y296-V298 VanDerWaalsContact C-N 3.32Å; Y296-V298 PolarHBondContact O-N 3.1Å; V298-E300 PolarHBondContact O-N 3.01Å; V298-M301 HydrophobicContact CG2-CE 4.14Å; V298-M301 PolarHBondContact O-N 3.44Å; V298-E302 WeakPolarHBondContact O-CG 3.38Å; V298-E302 PolarHBondContact O-N 2.94Å
299	F	91.2	Very high	88.7	Confident	39 Å²	39	87.7 Å²	87.7	17%	0.171	46%	0.464	C	S	.	.	H	α-helix	trans	-59.8	-44.4	177.4	174.4	-104.1	0	0	0	112.4	V226 F229 E295 Y296 M301 E302 L303	V226-F299 HydrophobicContact CB-CE1 4.5Å; V226-F299 HydrophobicContact CG2-CD1 4.46Å; V226-F299 HydrophobicContact CG2-CE1 4.12Å; F229-F299 HydrophobicContact CB-CD1 4.03Å; F229-F299 HydrophobicContact CB-CD2 3.88Å; F229-F299 HydrophobicContact CB-CE1 3.97Å; F229-F299 HydrophobicContact CB-CE2 3.82Å; F229-F299 HydrophobicContact CB-CG 3.97Å; F229-F299 HydrophobicContact CB-CZ 3.85Å; F229-F299 HydrophobicContact CD1-CB 4.39Å; F229-F299 HydrophobicContact CD1-CG 4.34Å; F229-F299 HydrophobicContact CD2-CB 4.05Å; F229-F299 AromaticContact CD2-CD2 3.64Å; F229-F299 HydrophobicContact CD2-CD2 3.64Å; F229-F299 HydrophobicContact CD2-CE2 4.28Å; F229-F299 AromaticContact CD2-CG 3.87Å; F229-F299 HydrophobicContact CD2-CG 3.87Å; F229-F299 HydrophobicContact CE2-CB 4.16Å; F229-F299 HydrophobicContact CE2-CD2 4.42Å; F229-F299 HydrophobicContact CE2-CG 4.47Å; F229-F299 HydrophobicContact CG-CB 4.17Å; F229-F299 HydrophobicContact CG-CD1 4.19Å; F229-F299 AromaticContact CG-CD2 3.88Å; F229-F299 HydrophobicContact CG-CD2 3.88Å; F229-F299 HydrophobicContact CG-CE2 4.33Å; F229-F299 AromaticContact CG-CG 3.79Å; F229-F299 HydrophobicContact CG-CG 3.79Å; F229-F299 HydrophobicContact CZ-CB 4.39Å; E295-F299 PolarHBondContact O-N 2.02Å; Y296-F299 PolarHBondContact O-N 3.3Å; F299-M301 VanDerWaalsContact C-N 3.35Å; F299-M301 PolarHBondContact O-N 3.1Å; F299-E302 PolarHBondContact O-N 3.43Å; F299-L303 HydrophobicContact CE1-CD1 4.15Å; F299-L303 HydrophobicContact CZ-CD1 3.99Å; F299-L303 WeakPolarHBondContact O-CB 3.34Å; F299-L303 PolarHBondContact O-N 3.03Å
300	E	90.9	Very high	87.7	Confident	118 Å²	118	91.5 Å²	91.5	55%	0.551	47%	0.468	S	S	*	.	H	α-helix	trans	-62.8	-40.4	177	-72.7	-171.8	167.6	0	0	112.4	Y296 M297 V298 L303 A304	Y296-E300 WeakPolarHBondContact O-CG 3.42Å; Y296-E300 PolarHBondContact O-N 2.75Å; M297-E300 PolarHBondContact O-N 2.84Å; V298-E300 PolarHBondContact O-N 3.01Å; E300-L303 PolarHBondContact O-N 2.03Å; E300-A304 WeakPolarHBondContact O-CB 3.48Å; E300-A304 PolarHBondContact O-N 3.42Å
301	M	91.2	Very high	86.2	Confident	112 Å²	112	96 Å²	96	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-62.7	-43.7	175.2	-74.8	-170.6	-66	0	0	112	M297 V298 F299 A304 L305	M297-M301 WeakPolarHBondContact O-CG 3.32Å; M297-M301 PolarHBondContact O-N 3.49Å; V298-M301 HydrophobicContact CG2-CE 4.14Å; V298-M301 PolarHBondContact O-N 3.44Å; F299-M301 VanDerWaalsContact C-N 3.35Å; F299-M301 PolarHBondContact O-N 3.1Å; M301-A304 PolarHBondContact O-N 3.46Å; M301-L305 WeakPolarHBondContact O-CB 3.5Å; M301-L305 VanDerWaalsContact O-CG 3.28Å; M301-L305 WeakPolarHBondContact O-CG 3.49Å; M301-L305 PolarHBondContact O-N 2.77Å
302	E	90.4	Very high	84.6	Confident	121 Å²	121	99.7 Å²	99.7	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-61.4	-43.6	176.6	-73.5	-177.1	172	0	0	111.7	V298 F299 L305 A306	V298-E302 WeakPolarHBondContact O-CG 3.38Å; V298-E302 PolarHBondContact O-N 2.94Å; F299-E302 PolarHBondContact O-N 3.43Å; E302-L305 PolarHBondContact O-N 3.38Å; E302-A306 WeakPolarHBondContact O-CB 3.39Å; E302-A306 PolarHBondContact O-N 3.36Å
303	L	88.4	Confident	82.8	Confident	95 Å²	95	104.3 Å²	104.3	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-42.5	177.8	-165	148.5	0	0	0	111.3	F299 E300 L305 A306 S307	F299-L303 HydrophobicContact CE1-CD1 4.15Å; F299-L303 HydrophobicContact CZ-CD1 3.99Å; F299-L303 WeakPolarHBondContact O-CB 3.34Å; F299-L303 PolarHBondContact O-N 3.03Å; E300-L303 PolarHBondContact O-N 2.03Å; L303-L305 PolarHBondContact O-N 3.46Å; L303-A306 PolarHBondContact O-N 3.32Å; L303-S307 PolarHBondContact O-N 2.86Å
304	A	87.8	Confident	81	Confident	40 Å²	40	107.3 Å²	107.3	33%	0.331	53%	0.527	S	S	.	.	H	α-helix	trans	-62.8	-41.4	174.9	0	0	0	0	0	112	E300 M301 S307 R308	E300-A304 WeakPolarHBondContact O-CB 3.48Å; E300-A304 PolarHBondContact O-N 3.42Å; M301-A304 PolarHBondContact O-N 3.46Å; A304-S307 PolarHBondContact O-N 2.99Å; A304-S307 PolarHBondContact O-OG 3.06Å; A304-R308 WeakPolarHBondContact O-CG 3.09Å; A304-R308 PolarHBondContact O-N 3.49Å
305	L	88.1	Confident	79.2	Confident	91 Å²	91	107.6 Å²	107.6	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-64.3	-46.1	175.8	-75.3	166.6	0	0	0	111.8	M301 E302 L303 S307 R308 M309	M301-L305 WeakPolarHBondContact O-CB 3.5Å; M301-L305 VanDerWaalsContact O-CG 3.28Å; M301-L305 WeakPolarHBondContact O-CG 3.49Å; M301-L305 PolarHBondContact O-N 2.77Å; E302-L305 PolarHBondContact O-N 3.38Å; L303-L305 PolarHBondContact O-N 3.46Å; L305-S307 VanDerWaalsContact C-N 3.32Å; L305-S307 PolarHBondContact O-N 2.97Å; L305-R308 PolarHBondContact O-N 3.39Å; L305-R308 VanDerWaalsContact O-N 3.1Å; L305-M309 HydrophobicContact CB-CE 4.31Å; L305-M309 WeakPolarHBondContact O-CG 3.47Å; L305-M309 PolarHBondContact O-N 3.14Å
306	A	85.8	Confident	77	Confident	51 Å²	51	110.2 Å²	110.2	42%	0.421	54%	0.543	S	S	.	.	H	α-helix	trans	-58.5	-43.6	177.4	0	0	0	0	0	111.8	E302 L303 R308 M309 Q310	E302-A306 WeakPolarHBondContact O-CB 3.39Å; E302-A306 PolarHBondContact O-N 3.36Å; L303-A306 PolarHBondContact O-N 3.32Å; A306-R308 VanDerWaalsContact C-N 3.26Å; A306-R308 PolarHBondContact O-N 3.27Å; A306-M309 PolarHBondContact O-N 2.83Å; A306-Q310 PolarHBondContact O-N 3.32Å; A306-Q310 VanDerWaalsContact O-N 3.12Å
307	S	84.3	Confident	75.2	Confident	64 Å²	64	114.4 Å²	114.4	45%	0.448	57%	0.572	S	S	.	*	H	α-helix	trans	-63.4	-29.9	177.4	78.7	0	0	0	0	113.5	L303 A304 L305	L303-S307 PolarHBondContact O-N 2.86Å; A304-S307 PolarHBondContact O-N 2.99Å; A304-S307 PolarHBondContact O-OG 3.06Å; L305-S307 VanDerWaalsContact C-N 3.32Å; L305-S307 PolarHBondContact O-N 2.97Å
308	R	79.2	Confident	73.4	Confident	184 Å²	184	112 Å²	112	69%	0.694	57%	0.573	S	S	*	*	H	α-helix	trans	-77.6	-38.9	176.8	-72	178.4	-174.8	-177.8	3.6	111.9	A304 L305 A306 Q310	A304-R308 WeakPolarHBondContact O-CG 3.09Å; A304-R308 PolarHBondContact O-N 3.49Å; L305-R308 PolarHBondContact O-N 3.39Å; L305-R308 VanDerWaalsContact O-N 3.1Å; A306-R308 VanDerWaalsContact C-N 3.26Å; A306-R308 PolarHBondContact O-N 3.27Å; R308-Q310 VanDerWaalsContact C-N 3.32Å
309	M	77.6	Confident	71.4	Confident	155 Å²	155	115.3 Å²	115.3	76%	0.764	59%	0.588	S	S	*	*	H	α-helix	trans	-68.8	-30.8	178.3	-65.7	-169.5	-143	0	0	112.7	L305 A306	L305-M309 HydrophobicContact CB-CE 4.31Å; L305-M309 WeakPolarHBondContact O-CG 3.47Å; L305-M309 PolarHBondContact O-N 3.14Å; A306-M309 PolarHBondContact O-N 2.83Å
310	Q	68.1	Low	69.9	Low	164 Å²	164	119 Å²	119	77%	0.766	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-7.8	-179.2	-84.1	-174.1	-15.4	0	0	115.5	A306 R308 P312	A306-Q310 PolarHBondContact O-N 3.32Å; A306-Q310 VanDerWaalsContact O-N 3.12Å; R308-Q310 VanDerWaalsContact C-N 3.32Å; Q310-P312 WeakPolarHBondContact O-CD 3.41Å; Q310-P312 VanDerWaalsContact O-N 3.08Å
311	R	56.3	Low	68.3	Low	197 Å²	197	115.6 Å²	115.6	74%	0.743	61%	0.611	S	S	*	*	S	Bend	trans	-64.7	113.3	174.3	-73.8	-173.2	179.6	-174.4	-0.5	108.5	L313	R311-L313 PolarHBondContact O-N 3.17Å
312	P	56.3	Low	67.1	Low	83 Å²	83	111.9 Å²	111.9	54%	0.539	60%	0.601	S	S	.	*			trans	-64.2	112.5	173.9	27.4	-32.1	0	0	0	107.2	Q310 Y314	Q310-P312 WeakPolarHBondContact O-CD 3.41Å; Q310-P312 VanDerWaalsContact O-N 3.08Å; P312-Y314 HydrophobicContact CB-CD2 3.79Å; P312-Y314 HydrophobicContact CB-CE2 3.48Å; P312-Y314 VanDerWaalsContact CB-CE2 3.48Å; P312-Y314 HydrophobicContact CG-CD2 3.76Å; P312-Y314 HydrophobicContact CG-CE2 3.32Å; P312-Y314 PolarHBondContact O-N 3.36Å
313	L	53.7	Low	66.1	Low	153 Å²	153	110.8 Å²	110.8	80%	0.801	60%	0.598	S	S	*	*			trans	-67.1	80.5	163.3	-112.2	110.9	0	0	0	106.8	R311 I315	R311-L313 PolarHBondContact O-N 3.17Å; L313-I315 HydrophobicContact CD2-CD1 4.3Å; L313-I315 HydrophobicContact CD2-CG1 3.89Å; L313-I315 PolarHBondContact O-N 3.5Å
314	Y	53.5	Low	65.4	Low	195 Å²	195	108.4 Å²	108.4	77%	0.765	60%	0.596	S	S	*	*			trans	-69	85.9	158.9	-66.6	-74.2	0	0	0	106.2	P312 I316	P312-Y314 HydrophobicContact CB-CD2 3.79Å; P312-Y314 HydrophobicContact CB-CE2 3.48Å; P312-Y314 VanDerWaalsContact CB-CE2 3.48Å; P312-Y314 HydrophobicContact CG-CD2 3.76Å; P312-Y314 HydrophobicContact CG-CE2 3.32Å; P312-Y314 PolarHBondContact O-N 3.36Å; Y314-I316 PolarHBondContact O-N 2.84Å
315	I	53.8	Low	64.9	Low	119 Å²	119	111.5 Å²	111.5	61%	0.61	61%	0.611	S	S	*	*			trans	-64.6	107.4	164	-53.2	175.8	0	0	0	104.5	L313 T317	L313-I315 HydrophobicContact CD2-CD1 4.3Å; L313-I315 HydrophobicContact CD2-CG1 3.89Å; L313-I315 PolarHBondContact O-N 3.5Å; I315-T317 HydrophobicContact CB-CG2 4.1Å; I315-T317 HydrophobicContact CG2-CG2 3.38Å; I315-T317 PolarHBondContact O-N 2.99Å
316	I	46.3	Very low	64.4	Low	137 Å²	137	112.6 Å²	112.6	70%	0.703	62%	0.616	S	S	*	*			trans	-68.6	75.7	169	-59.2	174.5	0	0	0	106.5	Y314 G318	Y314-I316 PolarHBondContact O-N 2.84Å; I316-G318 PolarHBondContact O-N 3.41Å; I316-G318 VanDerWaalsContact O-N 3.07Å
317	T	53.4	Low	64.1	Low	123 Å²	123	114.2 Å²	114.2	76%	0.755	62%	0.621	S	S	*	*			trans	-80.3	73.2	166.7	55.6	0	0	0	0	107.5	I315	I315-T317 HydrophobicContact CB-CG2 4.1Å; I315-T317 HydrophobicContact CG2-CG2 3.38Å; I315-T317 PolarHBondContact O-N 2.99Å
318	G	52.8	Low	64	Low	50 Å²	50	116.7 Å²	116.7	52%	0.515	63%	0.628	S	S	.	*	S	Bend	trans	-147.7	-52.9	178.9	0	0	0	0	0	112.9	I316	I316-G318 PolarHBondContact O-N 3.41Å; I316-G318 VanDerWaalsContact O-N 3.07Å
319	L	50	Low	64	Low	131 Å²	131	109.9 Å²	109.9	69%	0.686	61%	0.611	S	S	*	*	H	α-helix	trans	-88	-42.9	-171.5	-142.5	88.9	0	0	0	113.6	I323	L319-I323 WeakPolarHBondContact O-CD1 3.32Å; L319-I323 VanDerWaalsContact O-CG1 3.3Å; L319-I323 WeakPolarHBondContact O-CG1 3.26Å; L319-I323 PolarHBondContact O-N 3.37Å
320	T	60.5	Low	64.1	Low	115 Å²	115	106.4 Å²	106.4	71%	0.706	60%	0.599	S	S	*	*	H	α-helix	trans	-79.6	-37.4	-174.1	47.7	0	0	0	0	113	G324	T320-G324 PolarHBondContact O-N 3.19Å
321	G	57.4	Low	64.6	Low	47 Å²	47	102.3 Å²	102.3	49%	0.485	59%	0.588	S	S	.	*	H	α-helix	trans	-66.8	-41	176	0	0	0	0	0	113	G324 V325	G321-G324 PolarHBondContact O-N 3.03Å; G321-V325 WeakPolarHBondContact O-CG2 3.19Å; G321-V325 PolarHBondContact O-N 3.33Å
322	G	66.5	Low	65.6	Low	35 Å²	35	97.4 Å²	97.4	36%	0.361	58%	0.576	S	S	.	*	H	α-helix	trans	-65.2	-43	179.8	0	0	0	0	0	113.1	G324 V325 I326	G322-G324 PolarHBondContact O-N 3.15Å; G322-V325 PolarHBondContact O-N 3.45Å; G322-I326 VanDerWaalsContact O-CG1 3.3Å; G322-I326 WeakPolarHBondContact O-CG1 3.19Å; G322-I326 PolarHBondContact O-N 3.1Å; G322-I326 VanDerWaalsContact O-N 3.16Å
323	I	69.4	Low	66.6	Low	98 Å²	98	101.2 Å²	101.2	50%	0.503	58%	0.584	S	S	.	*	H	α-helix	trans	-64.8	-41	178.6	-64.9	169.7	0	0	0	110.9	L319 V325 I326 V327	L319-I323 WeakPolarHBondContact O-CD1 3.32Å; L319-I323 VanDerWaalsContact O-CG1 3.3Å; L319-I323 WeakPolarHBondContact O-CG1 3.26Å; L319-I323 PolarHBondContact O-N 3.37Å; I323-V325 VanDerWaalsContact C-N 3.34Å; I323-V325 PolarHBondContact O-N 2.87Å; I323-I326 PolarHBondContact O-N 3.03Å; I323-V327 HydrophobicContact CG2-CG2 4.32Å; I323-V327 WeakPolarHBondContact O-CG2 3.38Å; I323-V327 PolarHBondContact O-N 2.9Å
324	G	72.1	Confident	67.3	Low	44 Å²	44	104.2 Å²	104.2	45%	0.454	59%	0.585	S	S	.	*	H	α-helix	trans	-60.1	-41	178.3	0	0	0	0	0	113.3	T320 G321 G322 L328	T320-G324 PolarHBondContact O-N 3.19Å; G321-G324 PolarHBondContact O-N 3.03Å; G322-G324 PolarHBondContact O-N 3.15Å; G324-L328 PolarHBondContact O-N 3.09Å; G324-L328 VanDerWaalsContact O-N 3.1Å
325	V	77.5	Confident	67.8	Low	106 Å²	106	97.9 Å²	97.9	64%	0.642	58%	0.579	S	S	*	*	H	α-helix	trans	-69.6	-38.2	178.2	178.7	0	0	0	0	111.6	G321 G322 I323 L328 A329	G321-V325 WeakPolarHBondContact O-CG2 3.19Å; G321-V325 PolarHBondContact O-N 3.33Å; G322-V325 PolarHBondContact O-N 3.45Å; I323-V325 VanDerWaalsContact C-N 3.34Å; I323-V325 PolarHBondContact O-N 2.87Å; V325-L328 PolarHBondContact O-N 3.25Å; V325-A329 PolarHBondContact O-N 3.22Å; V325-A329 VanDerWaalsContact O-N 3.08Å
326	I	78	Confident	67.8	Low	113 Å²	113	99 Å²	99	58%	0.579	59%	0.585	S	S	*	*	H	α-helix	trans	-64.5	-44.9	176.8	-66.2	165.7	0	0	0	110.8	G322 I323 A329 V330	G322-I326 VanDerWaalsContact O-CG1 3.3Å; G322-I326 WeakPolarHBondContact O-CG1 3.19Å; G322-I326 PolarHBondContact O-N 3.1Å; G322-I326 VanDerWaalsContact O-N 3.16Å; I323-I326 PolarHBondContact O-N 3.03Å; I326-A329 PolarHBondContact O-N 2.77Å; I326-V330 WeakPolarHBondContact O-CG2 3.06Å; I326-V330 PolarHBondContact O-N 3.49Å; I326-V330 VanDerWaalsContact O-N 3.11Å
327	V	79.8	Confident	67.9	Low	85 Å²	85	102 Å²	102	52%	0.515	59%	0.593	S	S	.	*	H	α-helix	trans	-62.4	-44.8	178.4	172.6	0	0	0	0	111.2	I323 A329 V330 S331	I323-V327 HydrophobicContact CG2-CG2 4.32Å; I323-V327 WeakPolarHBondContact O-CG2 3.38Å; I323-V327 PolarHBondContact O-N 2.9Å; V327-A329 VanDerWaalsContact C-N 3.33Å; V327-A329 PolarHBondContact O-N 3.27Å; V327-V330 PolarHBondContact O-N 3.37Å; V327-S331 PolarHBondContact O-N 3.23Å; V327-S331 PolarHBondContact O-OG 3.21Å
328	L	81.7	Confident	67.6	Low	116 Å²	116	98.5 Å²	98.5	61%	0.607	58%	0.582	S	S	*	*	H	α-helix	trans	-59.7	-43.8	178.2	-166.1	95	0	0	0	111.8	G324 V325 V330 S331 I332	G324-L328 PolarHBondContact O-N 3.09Å; G324-L328 VanDerWaalsContact O-N 3.1Å; V325-L328 PolarHBondContact O-N 3.25Å; L328-V330 PolarHBondContact O-N 3.4Å; L328-S331 PolarHBondContact O-N 3.34Å; L328-I332 HydrophobicContact CD2-CD1 4.29Å; L328-I332 HydrophobicContact CG-CD1 4.33Å; L328-I332 WeakPolarHBondContact O-CG1 3.29Å; L328-I332 PolarHBondContact O-N 2.78Å; L328-I332 VanDerWaalsContact O-N 3.15Å
329	A	80.3	Confident	67.2	Low	41 Å²	41	104.4 Å²	104.4	34%	0.339	60%	0.602	S	S	.	*	H	α-helix	trans	-62.2	-43.7	178.9	0	0	0	0	0	111.5	V325 I326 V327 S331 I332 F333	V325-A329 PolarHBondContact O-N 3.22Å; V325-A329 VanDerWaalsContact O-N 3.08Å; I326-A329 PolarHBondContact O-N 2.77Å; V327-A329 VanDerWaalsContact C-N 3.33Å; V327-A329 PolarHBondContact O-N 3.27Å; A329-S331 VanDerWaalsContact C-N 3.34Å; A329-S331 PolarHBondContact O-N 3.25Å; A329-I332 PolarHBondContact O-N 2.83Å; A329-F333 VanDerWaalsContact O-CD2 3.24Å; A329-F333 WeakPolarHBondContact O-CD2 3.39Å; A329-F333 PolarHBondContact O-N 3.08Å; A329-F333 VanDerWaalsContact O-N 3.08Å
330	V	79.3	Confident	66.8	Low	82 Å²	82	102.7 Å²	102.7	50%	0.497	61%	0.606	S	S	.	*	H	α-helix	trans	-61.6	-42.3	177.1	175.1	0	0	0	0	111.1	I326 V327 L328 I332 F333 W334	I326-V330 WeakPolarHBondContact O-CG2 3.06Å; I326-V330 PolarHBondContact O-N 3.49Å; I326-V330 VanDerWaalsContact O-N 3.11Å; V327-V330 PolarHBondContact O-N 3.37Å; L328-V330 PolarHBondContact O-N 3.4Å; V330-I332 PolarHBondContact O-N 3.18Å; V330-F333 PolarHBondContact O-N 3.2Å; V330-W334 WeakPolarHBondContact O-CB 3.24Å; V330-W334 PolarHBondContact O-N 2.99Å
331	S	77.7	Confident	65.8	Low	79 Å²	79	106.4 Å²	106.4	55%	0.552	61%	0.613	S	S	*	*	H	α-helix	trans	-62.7	-37.7	178.4	-62.5	0	0	0	0	113.4	V327 L328 A329 G335	V327-S331 PolarHBondContact O-N 3.23Å; V327-S331 PolarHBondContact O-OG 3.21Å; L328-S331 PolarHBondContact O-N 3.34Å; A329-S331 VanDerWaalsContact C-N 3.34Å; A329-S331 PolarHBondContact O-N 3.25Å; S331-G335 WeakPolarHBondContact O-CA 3.41Å; S331-G335 PolarHBondContact O-N 3.07Å
332	I	77.3	Confident	64.9	Low	94 Å²	94	110.6 Å²	110.6	48%	0.482	63%	0.629	S	S	.	*	H	α-helix	trans	-70.5	-46.4	178.1	-65.1	167.7	0	0	0	110.5	L328 A329 V330 L336	L328-I332 HydrophobicContact CD2-CD1 4.29Å; L328-I332 HydrophobicContact CG-CD1 4.33Å; L328-I332 WeakPolarHBondContact O-CG1 3.29Å; L328-I332 PolarHBondContact O-N 2.78Å; L328-I332 VanDerWaalsContact O-N 3.15Å; A329-I332 PolarHBondContact O-N 2.83Å; V330-I332 PolarHBondContact O-N 3.18Å; I332-L336 HydrophobicContact CG2-CD1 4.23Å; I332-L336 PolarHBondContact O-N 3.37Å
333	F	77.4	Confident	63.8	Low	162 Å²	162	115.6 Å²	115.6	71%	0.711	65%	0.653	S	S	*	*	H	α-helix	trans	-72	-30.4	-178.3	-77.7	-70	0	0	0	113.4	A329 V330	A329-F333 VanDerWaalsContact O-CD2 3.24Å; A329-F333 WeakPolarHBondContact O-CD2 3.39Å; A329-F333 PolarHBondContact O-N 3.08Å; A329-F333 VanDerWaalsContact O-N 3.08Å; V330-F333 PolarHBondContact O-N 3.2Å
334	W	69.5	Low	62.5	Low	217 Å²	217	116.4 Å²	116.4	82%	0.822	67%	0.665	S	S	*	*	H	α-helix	trans	-80.7	-37.8	172.4	-97	36.8	0	0	0	113.3	V330 L336 K337	V330-W334 WeakPolarHBondContact O-CB 3.24Å; V330-W334 PolarHBondContact O-N 2.99Å; W334-L336 PolarHBondContact O-N 3.28Å; W334-K337 PolarHBondContact O-N 2.76Å
335	G	62.5	Low	60.9	Low	62 Å²	62	122.7 Å²	122.7	64%	0.639	69%	0.687	S	S	*	*	H	α-helix	trans	-65.1	-20.4	-178.2	0	0	0	0	0	114.6	S331	S331-G335 WeakPolarHBondContact O-CA 3.41Å; S331-G335 PolarHBondContact O-N 3.07Å
336	L	53.9	Low	59.3	Low	141 Å²	141	126.4 Å²	126.4	74%	0.738	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-9.2	-180	-84.2	158.9	0	0	0	114.7	I332 W334	I332-L336 HydrophobicContact CG2-CD1 4.23Å; I332-L336 PolarHBondContact O-N 3.37Å; W334-L336 PolarHBondContact O-N 3.28Å
337	K	50	Low	57.6	Low	200 Å²	200	127 Å²	127	87%	0.87	71%	0.708	S	S	*	*	S	Bend	trans	-102.9	70.5	173.4	-78.6	-163.7	174.9	-175.1	0	111.2	W334	W334-K337 PolarHBondContact O-N 2.76Å
338	G	45.2	Very low	55.5	Low	51 Å²	51	130.6 Å²	130.6	53%	0.526	72%	0.724	S	S	.	*	S	Bend	trans	179.4	79.1	173.9	0	0	0	0	0	116.1	A340	G338-A340 PolarHBondContact O-N 3.2Å; G338-A340 VanDerWaalsContact O-N 3.16Å
339	N	45.8	Very low	53.4	Low	174 Å²	174	132.9 Å²	132.9	93%	0.93	74%	0.736	S	S	*	*			trans	53.2	37.1	139.5	-63.7	-0.8	0	0	0	121.6
340	A	41.7	Very low	51.7	Low	94 Å²	94	136.5 Å²	136.5	78%	0.777	76%	0.756	S	S	*	*			trans	-94.4	-1.9	171.3	0	0	0	0	0	115.4	G338	G338-A340 PolarHBondContact O-N 3.2Å; G338-A340 VanDerWaalsContact O-N 3.16Å
341	F	40	Very low	49.9	Very low	194 Å²	194	146 Å²	146	85%	0.851	79%	0.79	S	S	*	*			trans	-100.2	91.7	175.8	-64.9	-79.2	0	0	0	110.2
342	T	36.7	Very low	48.5	Very low	134 Å²	134	149.4 Å²	149.4	82%	0.822	80%	0.802	S	S	*	*			trans	170.6	90.3	136.4	50.8	0	0	0	0	108.9
343	V	45	Very low	46.9	Very low	140 Å²	140	152.3 Å²	152.3	85%	0.848	82%	0.819	S	S	*	*			trans	-122.6	109.9	151.2	-176.3	0	0	0	0	106.3	L345	V343-L345 PolarHBondContact O-N 3.32Å
344	P	41.5	Very low	45.3	Very low	116 Å²	116	151.8 Å²	151.8	75%	0.753	83%	0.825	S	S	*	*			trans	-71.8	127.7	-177.1	27.4	-31.2	0	0	0	110.5	Q346	P344-Q346 PolarHBondContact O-N 2.95Å
345	L	39.2	Very low	43.8	Very low	175 Å²	175	147.9 Å²	147.9	92%	0.916	83%	0.825	S	S	*	*			trans	-64.2	115.1	171.7	-85.1	131.8	0	0	0	110	V343	V343-L345 PolarHBondContact O-N 3.32Å
346	Q	43	Very low	42.7	Very low	185 Å²	185	153.3 Å²	153.3	86%	0.864	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-82.1	140.5	164.7	-96.9	177.6	-23.4	0	0	110.5	P344	P344-Q346 PolarHBondContact O-N 2.95Å
347	P	41.5	Very low	41.9	Very low	125 Å²	125	154.1 Å²	154.1	81%	0.812	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-84	148.8	-163.9	-3.8	22.7	0	0	0	114.3
348	L	37.2	Very low	41.3	Very low	161 Å²	161	150.9 Å²	150.9	84%	0.843	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-50.8	138.7	168.2	-60.5	155.5	0	0	0	113.4
349	L	37.2	Very low	41	Very low	164 Å²	164	158.5 Å²	158.5	86%	0.859	87%	0.866	S	S	*	*				166.2	124.1	117.8	-89.9	156.1	0	0	0	112.1
350	P	45	Very low	40.7	Very low	116 Å²	116	157.3 Å²	157.3	75%	0.753	86%	0.861	S	S	*	*			trans	-85.4	154.6	167.7	33.7	-29.3	0	0	0	111.7
351	K	39.9	Very low	40.6	Very low	283 Å²	283	163 Å²	163	100%	1.23	87%	0.868	S	S	*	*			trans	-67.4	0	171.6	-83.5	-175.6	176.8	178.5	0	112.5

Retrieved 351 of 351 residues in 208.5 ms (Link to these results)

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