A0A093JMQ8_STRCA Loading...

Polycomb protein EED

AlphaFold DB , UniProt , Accession A0A093JMQ8, Species STRCA (Struthio camelus australis), Gene n/a, Length 403 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	D	37.3	Very low	30.2	Very low	205 Å²	205	137.4 Å²	137.4	100%	1.096	83%	0.828	S	S	*	*				0	99.4	0	-51.7	-7.4	0	0	0	106.3
2	D	33.1	Very low	30.1	Very low	157 Å²	157	136.7 Å²	136.7	84%	0.84	83%	0.825	S	S	*	*			cis	-140.3	138.7	25.6	-75.9	-42.2	0	0	0	111.8
3	A	27.8	Very low	30.1	Very low	97 Å²	97	140.4 Å²	140.4	80%	0.802	83%	0.828	S	S	*	*			trans	-83.8	137.9	169.2	0	0	0	0	0	109.3
4	V	32.9	Very low	30.4	Very low	133 Å²	133	147 Å²	147	81%	0.806	83%	0.832	S	S	*	*			trans	-118.2	100.7	163.7	-178.2	0	0	0	0	108.4	I6	V4-I6 HydrophobicContact CG1-CG1 4.37Å
5	S	28.6	Very low	30.6	Very low	104 Å²	104	145.2 Å²	145.2	73%	0.727	83%	0.828	S	S	*	*			trans	-70.1	134.6	162.8	47.5	0	0	0	0	110.7
6	I	30.8	Very low	30.7	Very low	160 Å²	160	146.4 Å²	146.4	82%	0.821	83%	0.831	S	S	*	*			trans	-130.9	112.6	158.1	-61.2	179.8	0	0	0	107.8	V4	V4-I6 HydrophobicContact CG1-CG1 4.37Å
7	E	27.7	Very low	30.9	Very low	178 Å²	178	145.4 Å²	145.4	83%	0.832	83%	0.829	S	S	*	*			trans	-77.8	162.5	175	-82.2	-176.7	155.2	0	0	113
8	S	29.4	Very low	31	Very low	119 Å²	119	143.9 Å²	143.9	83%	0.832	83%	0.826	S	S	*	*			trans	-44.9	150.7	174.8	51.5	0	0	0	0	119.6
9	G	25.9	Very low	31.2	Very low	67 Å²	67	143.5 Å²	143.5	69%	0.691	83%	0.826	S	S	*	*			trans	157.4	133.6	157.4	0	0	0	0	0	108.5
10	T	28.2	Very low	31.2	Very low	133 Å²	133	144.3 Å²	144.3	82%	0.816	83%	0.827	S	S	*	*			cis	-165.7	144.3	16.9	34.7	0	0	0	0	107.8	T12	T10-T12 PolarHBondContact O-N 3.33Å
11	N	30.1	Very low	31.3	Very low	158 Å²	158	143.9 Å²	143.9	85%	0.845	83%	0.828	S	S	*	*			trans	-54.2	129.3	167.2	-77.5	-26.9	0	0	0	111.5
12	T	29.5	Very low	31.1	Very low	129 Å²	129	140 Å²	140	79%	0.791	81%	0.814	S	S	*	*			trans	-116.6	93.7	159.3	47.9	0	0	0	0	109	T10	T10-T12 PolarHBondContact O-N 3.33Å
13	E	30.5	Very low	31.1	Very low	185 Å²	185	140.7 Å²	140.7	86%	0.864	82%	0.817	S	S	*	*			trans	-64.6	138	159.1	-68.3	179.1	164.3	0	0	109
14	R	33.4	Very low	31.3	Very low	233 Å²	233	140.6 Å²	140.6	88%	0.879	82%	0.817	S	S	*	*			trans	-131.7	147.8	168.2	-85.7	-170.7	179.5	-176.7	1.6	109.9
15	P	33.6	Very low	31.4	Very low	120 Å²	120	140.4 Å²	140.4	78%	0.779	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-89.2	156.9	-140.1	32.8	-34.2	0	0	0	114.7
16	D	33.2	Very low	31.7	Very low	164 Å²	164	139.2 Å²	139.2	88%	0.877	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-50.3	134.9	172.7	-70.7	-48.1	0	0	0	113.1
17	T	33.2	Very low	31.8	Very low	130 Å²	130	143.6 Å²	143.6	80%	0.798	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-85.8	131.4	173.6	-46.8	0	0	0	0	109.4	T19	T17-T19 PolarHBondContact O-N 3.44Å
18	P	32.8	Very low	32	Very low	119 Å²	119	144.4 Å²	144.4	77%	0.773	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-75.1	125.2	-173.1	-8.4	23.8	0	0	0	112
19	T	35.1	Very low	32	Very low	136 Å²	136	144.4 Å²	144.4	83%	0.834	83%	0.829	S	S	*	*			trans	-80	115	165.6	30.2	0	0	0	0	110.1	T17	T17-T19 PolarHBondContact O-N 3.44Å
20	N	30.2	Very low	32.3	Very low	158 Å²	158	152.8 Å²	152.8	85%	0.845	84%	0.84	S	S	*	*			trans	-149.9	106.2	162.1	-104.5	-20.5	0	0	0	110.1
21	T	34.4	Very low	32.4	Very low	137 Å²	137	149.9 Å²	149.9	84%	0.84	84%	0.837	S	S	*	*			trans	-128.6	134	161.6	38.9	0	0	0	0	109.6
22	P	33.6	Very low	32.8	Very low	122 Å²	122	152.4 Å²	152.4	79%	0.792	84%	0.84	S	S	*	*			trans	-83.6	144.9	-172.8	30.4	-30.9	0	0	0	113.5
23	N	31.5	Very low	33	Very low	172 Å²	172	149 Å²	149	92%	0.92	83%	0.831	S	S	*	*			trans	-6.8	120.6	165	-69	-28	0	0	0	118.4
24	A	33.7	Very low	33.2	Very low	95 Å²	95	149.8 Å²	149.8	79%	0.785	83%	0.831	S	S	*	*			trans	-113.4	142.2	159.7	0	0	0	0	0	110.7
25	P	33	Very low	33.2	Very low	129 Å²	129	150.5 Å²	150.5	84%	0.838	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-77.3	155.3	-168.6	31	-34.2	0	0	0	113.8
26	G	34.9	Very low	33.4	Very low	80 Å²	80	154 Å²	154	83%	0.825	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-60.9	138.9	-158.2	0	0	0	0	0	117.4
27	R	33.7	Very low	34.1	Very low	252 Å²	252	151.3 Å²	151.3	95%	0.951	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-91.7	128.1	164.9	-83.6	-178.5	172	-178.8	-1.8	110.5
28	K	31.1	Very low	35.2	Very low	195 Å²	195	153 Å²	153	85%	0.848	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-53.8	132.1	178.4	-66.2	175.7	177.2	177.6	0	111.5	W30	K28-W30 PolarHBondContact O-N 3.02Å; K28-W30 VanDerWaalsContact O-N 3.13Å
29	S	30.4	Very low	36.6	Very low	118 Å²	118	156.4 Å²	156.4	83%	0.825	83%	0.83	S	S	*	*			trans	-56.5	107.5	172.3	153.6	0	0	0	0	111
30	W	31.6	Very low	38.4	Very low	244 Å²	244	150.6 Å²	150.6	92%	0.924	80%	0.795	S	S	*	*			trans	-89.1	134.3	160	-91.1	42.9	0	0	0	109.3	K28	K28-W30 PolarHBondContact O-N 3.02Å; K28-W30 VanDerWaalsContact O-N 3.13Å
31	G	31.3	Very low	40.9	Very low	72 Å²	72	148.7 Å²	148.7	74%	0.742	78%	0.779	S	S	*	*			trans	-52	135.9	-166.7	0	0	0	0	0	114.2	G33	G31-G33 PolarHBondContact O-N 3.06Å
32	K	37.2	Very low	43.5	Very low	211 Å²	211	143.2 Å²	143.2	92%	0.917	74%	0.743	S	S	*	*			trans	-66.2	81.3	167.9	-69.1	-176.4	178.8	179.2	0	109.3	K34	K32-K34 PolarHBondContact O-N 3.21Å; K32-K34 VanDerWaalsContact O-N 3.11Å
33	G	33.5	Very low	46.3	Very low	57 Å²	57	140 Å²	140	59%	0.588	72%	0.724	S	S	*	*			trans	-59.3	112.1	158.8	0	0	0	0	0	107.4	G31 W35	G31-G33 PolarHBondContact O-N 3.06Å; G33-W35 VanDerWaalsContact C-N 3.26Å; G33-W35 PolarHBondContact O-N 3.3Å
34	K	36	Very low	49.5	Very low	202 Å²	202	132.5 Å²	132.5	88%	0.878	68%	0.683	S	S	*	*			trans	-62	91	172.4	-78.5	-177.6	177	177.1	0	108.2	K32 K36	K32-K34 PolarHBondContact O-N 3.21Å; K32-K34 VanDerWaalsContact O-N 3.11Å; K34-K36 VanDerWaalsContact C-N 3.34Å; K34-K36 PolarHBondContact O-N 3.07Å
35	W	33.8	Very low	52.5	Low	248 Å²	248	134.2 Å²	134.2	94%	0.939	67%	0.673	S	S	*	*			trans	-67.5	98.9	164.5	-84.9	31.1	0	0	0	107	G33 S37	G33-W35 VanDerWaalsContact C-N 3.26Å; G33-W35 PolarHBondContact O-N 3.3Å; W35-S37 PolarHBondContact O-N 3.31Å
36	K	37.5	Very low	55.6	Low	193 Å²	193	129.5 Å²	129.5	84%	0.839	64%	0.643	S	S	*	*			trans	-63	103	167.2	-74.4	-175.2	178	180	0	106.7	K34 K38	K34-K36 VanDerWaalsContact C-N 3.34Å; K34-K36 PolarHBondContact O-N 3.07Å; K36-K38 PolarHBondContact O-N 3.24Å
37	S	47.7	Very low	58.7	Low	108 Å²	108	128.2 Å²	128.2	76%	0.755	62%	0.618	S	S	*	*			trans	-56.6	105.5	168.1	-179.3	0	0	0	0	107.8	W35 K39	W35-S37 PolarHBondContact O-N 3.31Å; S37-K39 PolarHBondContact O-N 2.75Å
38	K	56	Low	61.8	Low	165 Å²	165	118.9 Å²	118.9	72%	0.717	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-65.8	131.7	172.7	-71.7	-178	178.4	-179.7	0	106.8	K36 K362	K36-K38 PolarHBondContact O-N 3.24Å; K38-K362 WeakPolarHBondContact O-CD 3.19Å; K38-K362 WeakPolarHBondContact O-CE 3.49Å; K38-K362 PolarHBondContact O-NZ 3.34Å
39	K	62.8	Low	65	Low	190 Å²	190	112 Å²	112	83%	0.826	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-68.3	166.7	176.7	-66.4	-177	177.4	-177.1	0	111.6	S37 K41 K362	S37-K39 PolarHBondContact O-N 2.75Å; K39-K41 PolarHBondContact O-N 2.77Å; K39-K362 WeakPolarHBondContact O-CD 3.47Å
40	C	72	Confident	68.2	Low	15 Å²	15	108.7 Å²	108.7	10%	0.101	54%	0.537	C	S	.	.	P	Polyproline II helix	trans	-52.8	135.9	164.4	178.9	0	0	0	0	108.1	Y42 K362 T364	C40-Y42 VanDerWaalsContact C-N 3.29Å; C40-K362 HydrophobicContact CB-CB 3.58Å; C40-K362 WeakPolarHBondContact CB-O 3.5Å; C40-T364 VanDerWaalsContact CB-OG1 3.27Å; C40-T364 WeakPolarHBondContact CB-OG1 3.36Å
41	K	82.8	Confident	71.4	Confident	117 Å²	117	102.8 Å²	102.8	51%	0.509	52%	0.517	S	S	.	.	S	Bend	trans	-76.5	-21.7	-175.8	71.8	-167.1	-176.2	-134.4	0	112.3	K39 D352 E354	K39-K41 PolarHBondContact O-N 2.77Å; K41-D352 WeakPolarHBondContact CD-OD2 3.37Å; K41-D352 VanDerWaalsContact CE-OD2 3.27Å; K41-D352 WeakPolarHBondContact CE-OD2 3.16Å; K41-D352 IonicContact NZ-OD1 2.78Å; K41-D352 PolarHBondContact NZ-OD1 2.96Å; K41-D352 IonicContact NZ-OD2 2.83Å; K41-D352 PolarHBondContact NZ-OD2 2.85Å; K41-E354 IonicContact NZ-OE2 3.89Å; K41-E354 PolarHBondContact NZ-OE2 2.92Å
42	Y	90	Very high	74.6	Confident	23 Å²	23	99.9 Å²	99.9	9%	0.09	49%	0.485	C	S	.	.			trans	-83.1	125.8	-179.1	-54.5	-58.8	0	0	0	110.9	C40 M338 D352 E354 T364	C40-Y42 VanDerWaalsContact C-N 3.29Å; Y42-M338 HydrophobicContact CD1-CG 4.41Å; Y42-M338 HydrophobicContact CD1-SD 3.72Å; Y42-M338 HydrophobicContact CD2-CG 3.58Å; Y42-M338 HydrophobicContact CD2-SD 3.77Å; Y42-M338 HydrophobicContact CE1-CG 4.25Å; Y42-M338 HydrophobicContact CE1-SD 3.95Å; Y42-M338 HydrophobicContact CE2-CG 3.38Å; Y42-M338 HydrophobicContact CE2-SD 3.99Å; Y42-M338 HydrophobicContact CG-CG 4.09Å; Y42-M338 HydrophobicContact CG-SD 3.61Å; Y42-D352 HydrophobicContact CD2-CB 3.92Å; Y42-D352 HydrophobicContact CE2-CB 3.7Å; Y42-D352 VanDerWaalsContact CE2-CG 3.46Å; Y42-D352 WeakPolarHBondContact CE2-OD1 3.18Å; Y42-E354 PolarHBondContact OH-OE2 2.83Å; Y42-T364 PolarHBondContact O-OG1 3.16Å
43	S	92.9	Very high	77.5	Confident	55 Å²	55	96.3 Å²	96.3	39%	0.385	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.6	173.7	-172.5	0	0	0	0	109.1	L402	S43-L402 PolarHBondContact O-N 2.72Å
44	F	97.1	Very high	80.6	Confident	13 Å²	13	95 Å²	95	6%	0.057	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	154.1	177.6	-66.4	-102.5	0	0	0	109.8	M338 V350 L366 F380 L387 W399 D400 R401	F44-M338 HydrophobicContact CE2-SD 4.21Å; F44-M338 HydrophobicContact CZ-CE 4.28Å; F44-M338 HydrophobicContact CZ-SD 3.86Å; F44-V350 HydrophobicContact CE2-CG1 4.16Å; F44-L366 HydrophobicContact CB-CD1 3.74Å; F44-L366 HydrophobicContact CB-CD2 3.84Å; F44-L366 HydrophobicContact CB-CG 4.46Å; F44-L366 HydrophobicContact CD2-CD1 4.09Å; F44-L366 HydrophobicContact CD2-CD2 4.47Å; F44-L366 HydrophobicContact CG-CD1 4.01Å; F44-F380 HydrophobicContact CE1-CE1 4.37Å; F44-F380 AromaticContact CZ-CE1 3.97Å; F44-F380 HydrophobicContact CZ-CE1 3.97Å; F44-L387 HydrophobicContact CD1-CB 4.27Å; F44-L387 HydrophobicContact CE1-CB 4.01Å; F44-W399 HydrophobicContact CB-CB 4.15Å; F44-W399 HydrophobicContact CB-CE3 4.46Å; F44-W399 HydrophobicContact CD1-CB 4.26Å; F44-D400 CarbonylContact C-O 3.58Å; F44-D400 VanDerWaalsContact CA-O 3.29Å; F44-D400 WeakPolarHBondContact CA-O 2.9Å; F44-R401 HydrophobicContact CD1-CB 3.82Å; F44-R401 HydrophobicContact CD1-CG 4.3Å; F44-R401 HydrophobicContact CE1-CB 3.53Å; F44-R401 HydrophobicContact CE1-CG 3.88Å; F44-R401 HydrophobicContact CE2-CG 4.31Å; F44-R401 HydrophobicContact CZ-CB 4.06Å; F44-R401 HydrophobicContact CZ-CG 3.87Å
45	K	98	Very high	83.5	Confident	132 Å²	132	87.1 Å²	87.1	57%	0.574	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	130.5	173.9	-177.3	-178.7	176.7	-173.7	0	109.1	V47 W399 D400 L402	K45-V47 PolarHBondContact O-N 3.5Å; K45-W399 CarbonylContact O-C 3.58Å; K45-W399 WeakPolarHBondContact O-CA 3.32Å; K45-D400 PolarHBondContact N-O 3.09Å; K45-D400 PolarHBondContact O-N 3.37Å; K45-L402 HydrophobicContact CB-CD2 3.99Å; K45-L402 HydrophobicContact CB-CG 4.4Å
46	C	98.4	Very high	86.6	Confident	30 Å²	30	79.9 Å²	79.9	20%	0.203	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	120.4	168.6	-175.7	0	0	0	0	108.4	R398 W399	C46-R398 WeakPolarHBondContact CA-O 3.45Å; C46-W399 HydrophobicContact CB-CD2 4.17Å; C46-W399 HydrophobicContact CB-CE3 3.77Å; C46-W399 HydrophobicContact CB-CH2 3.81Å; C46-W399 HydrophobicContact CB-CZ2 4.22Å; C46-W399 HydrophobicContact CB-CZ3 3.58Å; C46-W399 VanDerWaalsContact N-CE3 3.32Å
47	V	98.4	Very high	89.6	Confident	52 Å²	52	72.5 Å²	72.5	32%	0.315	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-24.4	-178.3	-66	0	0	0	0	112.8	K45 R398 D400	K45-V47 PolarHBondContact O-N 3.5Å; V47-R398 HydrophobicContact CG2-CB 4.17Å; V47-R398 HydrophobicContact CG2-CG 3.63Å; V47-R398 PolarHBondContact N-O 3.33Å; V47-D400 HydrophobicContact CG1-CB 3.9Å; V47-D400 HydrophobicContact CG2-CB 4.27Å; V47-D400 WeakPolarHBondContact CG2-OD1 3.27Å
48	N	98.7	Very high	92	Very high	56 Å²	56	67.3 Å²	67.3	30%	0.299	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	160.2	179.6	-159.5	-2	0	0	0	111.6	G92 I94 R398	N48-G92 WeakPolarHBondContact CB-O 3.16Å; N48-G92 PolarHBondContact ND2-O 2.69Å; N48-I94 HydrophobicContact CB-CD1 4.18Å; N48-I94 HydrophobicContact CB-CG1 4.36Å; N48-R398 HydrophobicContact CB-CB 4.43Å; N48-R398 PolarHBondContact O-N 2.79Å
49	S	98.6	Very high	94	Very high	51 Å²	51	60.9 Å²	60.9	36%	0.357	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	143.3	170.3	62.3	0	0	0	0	110	I396	S49-I396 CarbonylContact C-O 3.33Å; S49-I396 WeakPolarHBondContact CA-O 3.46Å
50	L	98.6	Very high	95.8	Very high	48 Å²	48	51.8 Å²	51.8	25%	0.251	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	172.1	171.8	69.7	86.8	0	0	0	110.4	Y86 I94 S395 I396	L50-Y86 HydrophobicContact CD1-CE1 4.19Å; L50-Y86 HydrophobicContact CD2-CD1 4.42Å; L50-Y86 HydrophobicContact CD2-CE1 4.08Å; L50-I94 HydrophobicContact CD2-CB 3.81Å; L50-I94 HydrophobicContact CD2-CD1 4.19Å; L50-I94 HydrophobicContact CD2-CG2 3.64Å; L50-S395 CarbonylContact O-C 3.54Å; L50-S395 VanDerWaalsContact O-CA 3.3Å; L50-S395 WeakPolarHBondContact O-CA 3.18Å; L50-I396 HydrophobicContact CD1-CB 4.34Å; L50-I396 HydrophobicContact CD1-CD1 3.75Å; L50-I396 HydrophobicContact CD1-CG1 4.16Å; L50-I396 HydrophobicContact CG-CB 4.26Å; L50-I396 HydrophobicContact CG-CD1 4.39Å; L50-I396 PolarHBondContact N-O 3Å; L50-I396 PolarHBondContact O-N 2.96Å
51	K	98.7	Very high	97	Very high	120 Å²	120	51.1 Å²	51.1	52%	0.522	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	131.3	178	179.8	166.9	170	143.9	0	109.5	D393 A394	K51-D393 WeakPolarHBondContact CD-O 3.31Å; K51-D393 WeakPolarHBondContact CE-O 3.23Å; K51-D393 PolarHBondContact NZ-O 3.46Å; K51-A394 WeakPolarHBondContact CA-O 3.46Å; K51-A394 HydrophobicContact CG-CB 4.11Å
52	E	98.7	Very high	97.8	Very high	12 Å²	12	46.8 Å²	46.8	6%	0.056	25%	0.252	C	S	.	.			trans	-69.5	144.3	176	-62.1	-162.1	-149.9	0	0	110.8	H54 G55 L58 T77 T84 Y86 A394 I396	E52-H54 VanDerWaalsContact C-N 3.29Å; E52-H54 VanDerWaalsContact CB-CD2 3.45Å; E52-H54 WeakPolarHBondContact CB-CD2 3.5Å; E52-H54 VanDerWaalsContact CB-NE2 3.26Å; E52-H54 WeakPolarHBondContact CB-NE2 3.27Å; E52-H54 PolarHBondContact O-N 3.33Å; E52-H54 IonicContact OE2-CD2 2.77Å; E52-H54 IonicContact OE2-NE2 3.46Å; E52-H54 PolarHBondContact OE2-NE2 3.41Å; E52-H54 VanDerWaalsContact OE2-NE2 3.12Å; E52-G55 PolarHBondContact O-N 3.36Å; E52-L58 HydrophobicContact CG-CD1 4.29Å; E52-L58 WeakPolarHBondContact OE1-CD2 3.23Å; E52-T77 WeakPolarHBondContact OE1-CB 3.43Å; E52-T77 PolarHBondContact OE1-OG1 2.96Å; E52-T84 PolarHBondContact OE2-OG1 2.88Å; E52-Y86 VanDerWaalsContact CG-OH 3.28Å; E52-Y86 WeakPolarHBondContact CG-OH 3.49Å; E52-Y86 PolarHBondContact OE1-OH 2.7Å; E52-A394 HydrophobicContact CB-CB 4.27Å; E52-A394 PolarHBondContact N-O 3.04Å; E52-I396 HydrophobicContact CG-CD1 4.25Å
53	D	98.2	Very high	98.2	Very high	136 Å²	136	46 Å²	46	73%	0.727	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-28.8	-170.2	64.4	-12.2	0	0	0	113.7	G55 R82	D53-G55 PolarHBondContact O-N 3.1Å; D53-R82 IonicContact OD1-NH1 3.88Å
54	H	97.7	Very high	98.5	Very high	29 Å²	29	44.1 Å²	44.1	13%	0.134	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-17.2	-179.6	65	83.7	0	0	0	113.5	E52 Q56 R82	E52-H54 VanDerWaalsContact C-N 3.29Å; E52-H54 VanDerWaalsContact CB-CD2 3.45Å; E52-H54 WeakPolarHBondContact CB-CD2 3.5Å; E52-H54 VanDerWaalsContact CB-NE2 3.26Å; E52-H54 WeakPolarHBondContact CB-NE2 3.27Å; E52-H54 PolarHBondContact O-N 3.33Å; E52-H54 IonicContact OE2-CD2 2.77Å; E52-H54 IonicContact OE2-NE2 3.46Å; E52-H54 PolarHBondContact OE2-NE2 3.41Å; E52-H54 VanDerWaalsContact OE2-NE2 3.12Å; H54-Q56 PolarHBondContact CE1-O 2.58Å; H54-Q56 VanDerWaalsContact ND1-CB 3.31Å; H54-Q56 WeakPolarHBondContact ND1-CB 3.32Å; H54-Q56 PolarHBondContact ND1-N 3.22Å; H54-Q56 PolarHBondContact O-N 3.41Å; H54-Q56 PolarHBondContact O-NE2 3.24Å; H54-R82 VanDerWaalsContact CD2-CD 3.49Å; H54-R82 WeakPolarHBondContact CD2-CD 3.35Å
55	G	98	Very high	98.6	Very high	36 Å²	36	47 Å²	47	37%	0.371	25%	0.245	S	C	.	.			trans	62.8	15	173.8	0	0	0	0	0	115.7	E52 D53	E52-G55 PolarHBondContact O-N 3.36Å; D53-G55 PolarHBondContact O-N 3.1Å
56	Q	98.7	Very high	98.5	Very high	97 Å²	97	44.6 Å²	44.6	45%	0.453	24%	0.236	S	C	.	.			trans	-94.7	158.1	178.6	-55.8	-56.9	-50.7	0	0	111.3	H54 L58 A394	H54-Q56 PolarHBondContact CE1-O 2.58Å; H54-Q56 VanDerWaalsContact ND1-CB 3.31Å; H54-Q56 WeakPolarHBondContact ND1-CB 3.32Å; H54-Q56 PolarHBondContact ND1-N 3.22Å; H54-Q56 PolarHBondContact O-N 3.41Å; H54-Q56 PolarHBondContact O-NE2 3.24Å; Q56-L58 PolarHBondContact O-N 2.96Å; Q56-A394 WeakPolarHBondContact O-CA 3.2Å; Q56-A394 WeakPolarHBondContact O-CB 3.44Å
57	P	98.8	Very high	98.3	Very high	37 Å²	37	43.9 Å²	43.9	24%	0.24	23%	0.231	C	C	.	.			trans	-52.9	131.4	175.3	-28.6	36.4	0	0	0	113.5	F59 G79 D392	P57-F59 HydrophobicContact CB-CE1 4.23Å; P57-F59 HydrophobicContact CB-CE2 4.03Å; P57-F59 HydrophobicContact CB-CZ 3.82Å; P57-F59 HydrophobicContact CG-CZ 4.45Å; P57-G79 VanDerWaalsContact O-CA 3.32Å; P57-G79 WeakPolarHBondContact O-CA 3.33Å; P57-D392 VanDerWaalsContact CA-O 3.27Å; P57-D392 WeakPolarHBondContact CA-O 3.22Å; P57-D392 HydrophobicContact CB-CB 4.46Å; P57-D392 WeakPolarHBondContact CG-O 3.39Å
58	L	98.9	Very high	97.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.249	C	C	.	.			trans	-89.8	109.7	166.6	-68.1	176.4	0	0	0	108.4	E52 Q56 V78 R376 V390 C391 I396	E52-L58 HydrophobicContact CG-CD1 4.29Å; E52-L58 WeakPolarHBondContact OE1-CD2 3.23Å; Q56-L58 PolarHBondContact O-N 2.96Å; L58-V78 CarbonylContact C-O 3.53Å; L58-R376 WeakPolarHBondContact O-CB 3.26Å; L58-V390 HydrophobicContact CB-CB 3.72Å; L58-V390 HydrophobicContact CB-CG2 4Å; L58-V390 HydrophobicContact CD1-CB 4.01Å; L58-V390 HydrophobicContact CD1-CG1 4.12Å; L58-C391 PolarHBondContact N-O 3.17Å; L58-C391 VanDerWaalsContact N-O 3.1Å; L58-I396 HydrophobicContact CD1-CD1 4.18Å; L58-I396 HydrophobicContact CD1-CG1 3.64Å
59	F	98.8	Very high	97.4	Very high	29 Å²	29	55.9 Å²	55.9	13%	0.127	28%	0.28	C	S	.	.			trans	-80.4	-41.2	-178.1	-71.4	-67.3	0	0	0	111.5	P57 V78 N108 Y110 Y327 R329 R376	P57-F59 HydrophobicContact CB-CE1 4.23Å; P57-F59 HydrophobicContact CB-CE2 4.03Å; P57-F59 HydrophobicContact CB-CZ 3.82Å; P57-F59 HydrophobicContact CG-CZ 4.45Å; F59-V78 PolarHBondContact N-O 3.18Å; F59-N108 WeakPolarHBondContact CE2-OD1 3.45Å; F59-Y110 AromaticContact CD2-CD1 3.89Å; F59-Y110 HydrophobicContact CD2-CD1 3.89Å; F59-Y110 HydrophobicContact CD2-CE1 4.4Å; F59-Y110 HydrophobicContact CE2-CD1 4.18Å; F59-Y110 HydrophobicContact CE2-CE1 4.24Å; F59-Y110 HydrophobicContact CG-CD1 4.16Å; F59-Y327 HydrophobicContact CB-CE1 4.2Å; F59-Y327 AromaticContact CD1-CD1 3.9Å; F59-Y327 HydrophobicContact CD1-CD1 3.9Å; F59-Y327 HydrophobicContact CD1-CE1 4Å; F59-Y327 HydrophobicContact CG-CE1 4.39Å; F59-R329 PolarHBondContact O-NH2 2.99Å; F59-R376 HydrophobicContact CD1-CG 4.43Å; F59-R376 WeakPolarHBondContact O-CB 3.38Å
60	G	98.7	Very high	97	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	150.6	-170.4	0	0	0	0	0	115	T77 V78 R329	G60-T77 WeakPolarHBondContact O-CA 3.35Å; G60-V78 PolarHBondContact N-O 3.19Å; G60-V78 VanDerWaalsContact N-O 3.15Å; G60-V78 PolarHBondContact O-N 2.99Å; G60-R329 VanDerWaalsContact CA-NH2 3.35Å
61	V	98.9	Very high	96.8	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	134.7	173.4	61.6	0	0	0	0	111	F75 A76 T77 Q377 I388 V390	V61-F75 HydrophobicContact CG2-CD2 3.83Å; V61-F75 HydrophobicContact CG2-CE2 4.45Å; V61-A76 CarbonylContact C-O 3.43Å; V61-A76 VanDerWaalsContact CA-O 3.24Å; V61-A76 WeakPolarHBondContact CA-O 3.41Å; V61-T77 HydrophobicContact CG2-CG2 4.22Å; V61-Q377 HydrophobicContact CG1-CB 4.17Å; V61-Q377 HydrophobicContact CG1-CG 4.17Å; V61-Q377 WeakPolarHBondContact CG1-O 3.43Å; V61-Q377 PolarHBondContact O-OE1 2.94Å; V61-I388 HydrophobicContact CG2-CB 4.35Å; V61-I388 HydrophobicContact CG2-CG2 3.77Å; V61-V390 HydrophobicContact CB-CB 4.41Å; V61-V390 HydrophobicContact CB-CG1 3.66Å; V61-V390 HydrophobicContact CB-CG2 3.85Å; V61-V390 HydrophobicContact CG1-CB 4.46Å; V61-V390 HydrophobicContact CG1-CG1 4.02Å; V61-V390 HydrophobicContact CG1-CG2 3.74Å; V61-V390 HydrophobicContact CG2-CG1 3.98Å
62	Q	98.9	Very high	96.6	Very high	26 Å²	26	56 Å²	56	12%	0.121	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	126.3	175.9	-65.8	-60.3	-13.5	0	0	112.4	F75 A76 C112 W114	Q62-F75 CarbonylContact O-C 3.59Å; Q62-F75 VanDerWaalsContact O-CA 3.28Å; Q62-F75 WeakPolarHBondContact O-CA 3.42Å; Q62-A76 PolarHBondContact N-O 2.84Å; Q62-A76 PolarHBondContact O-N 3.16Å; Q62-C112 WeakPolarHBondContact CG-O 3.27Å; Q62-W114 PolarHBondContact O-NE1 2.9Å
63	F	98.9	Very high	96.6	Very high	6 Å²	6	57.2 Å²	57.2	3%	0.026	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	145.2	161.4	-83.8	-81.6	0	0	0	111.2	W65 L73 V74 F75 W114 S379 F380 S381 I386 I388	F63-W65 PolarHBondContact O-N 3.25Å; F63-L73 HydrophobicContact CD1-CB 4.48Å; F63-L73 HydrophobicContact CE1-CB 4.09Å; F63-V74 WeakPolarHBondContact CA-O 3.44Å; F63-V74 WeakPolarHBondContact CD1-O 3.47Å; F63-F75 HydrophobicContact CD1-CB 3.78Å; F63-F75 HydrophobicContact CD2-CB 4.3Å; F63-F75 HydrophobicContact CE1-CB 3.98Å; F63-F75 AromaticContact CE1-CD1 3.93Å; F63-F75 HydrophobicContact CE1-CD1 3.93Å; F63-F75 HydrophobicContact CE1-CG 4.38Å; F63-F75 HydrophobicContact CG-CB 3.95Å; F63-F75 HydrophobicContact CZ-CB 4.36Å; F63-F75 HydrophobicContact CZ-CD1 4.08Å; F63-W114 VanDerWaalsContact O-CD1 3.27Å; F63-S379 WeakPolarHBondContact CE2-O 3.42Å; F63-S379 PolarHBondContact N-OG 2.66Å; F63-F380 VanDerWaalsContact CD2-O 3.27Å; F63-F380 WeakPolarHBondContact CD2-O 3.36Å; F63-S381 VanDerWaalsContact CD2-N 3.32Å; F63-I386 HydrophobicContact CE2-CG2 4.47Å; F63-I386 HydrophobicContact CZ-CB 4.17Å; F63-I386 HydrophobicContact CZ-CG2 3.89Å; F63-I388 HydrophobicContact CE2-CB 4.01Å; F63-I388 HydrophobicContact CE2-CG1 3.4Å; F63-I388 HydrophobicContact CZ-CB 4.49Å; F63-I388 HydrophobicContact CZ-CD1 4.35Å; F63-I388 HydrophobicContact CZ-CG1 3.41Å; F63-I388 VanDerWaalsContact CZ-CG1 3.41Å
64	N	98.6	Very high	96.6	Very high	17 Å²	17	51.9 Å²	51.9	9%	0.091	28%	0.283	C	S	.	.			trans	-76.8	100.7	168.3	-178	10	0	0	0	109.6	H66 S67 V74 W114	N64-H66 VanDerWaalsContact C-N 3.25Å; N64-H66 PolarHBondContact O-N 3.34Å; N64-H66 WeakPolarHBondContact OD1-CB 3.5Å; N64-H66 PolarHBondContact OD1-N 3.32Å; N64-S67 PolarHBondContact O-OG 3.37Å; N64-V74 PolarHBondContact N-O 3.07Å; N64-W114 HydrophobicContact CB-CD2 3.68Å; N64-W114 HydrophobicContact CB-CE3 3.98Å; N64-W114 HydrophobicContact CB-CG 4.07Å; N64-W114 HydrophobicContact CB-CH2 4.32Å; N64-W114 HydrophobicContact CB-CZ2 4.05Å; N64-W114 HydrophobicContact CB-CZ3 4.29Å
65	W	98.4	Very high	96.7	Very high	73 Å²	73	50.5 Å²	50.5	28%	0.277	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-2.2	175.4	-67.7	-7.6	0	0	0	114	F63 F334 F380 R382	F63-W65 PolarHBondContact O-N 3.25Å; W65-F334 HydrophobicContact CD2-CD2 4.33Å; W65-F334 HydrophobicContact CE3-CB 4.42Å; W65-F334 AromaticContact CE3-CD2 3.83Å; W65-F334 HydrophobicContact CE3-CD2 3.83Å; W65-F334 HydrophobicContact CH2-CB 4.42Å; W65-F334 HydrophobicContact CZ3-CB 4.38Å; W65-F334 HydrophobicContact CZ3-CD2 4.22Å; W65-F380 PolarHBondContact NE1-O 3.02Å; W65-R382 HydrophobicContact CB-CB 4.46Å; W65-R382 HydrophobicContact CB-CG 4.24Å; W65-R382 HydrophobicContact CG-CB 4.17Å; W65-R382 HydrophobicContact CG-CG 4.24Å; W65-R382 WeakPolarHBondContact O-CD 3.45Å; W65-R382 PolarHBondContact O-NE 3.04Å; W65-R382 PolarHBondContact O-NH1 3.17Å
66	H	97.3	Very high	96.7	Very high	81 Å²	81	48.8 Å²	48.8	38%	0.375	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-4.3	175.7	-55.3	-65.4	0	0	0	112.8	N64 W114 Y116	N64-H66 VanDerWaalsContact C-N 3.25Å; N64-H66 PolarHBondContact O-N 3.34Å; N64-H66 WeakPolarHBondContact OD1-CB 3.5Å; N64-H66 PolarHBondContact OD1-N 3.32Å; H66-W114 PolarHBondContact NE2-O 2.85Å; H66-Y116 HydrophobicContact CB-CD1 4.04Å; H66-Y116 AromaticContact CE1-CE1 3.98Å; H66-Y116 AromaticContact CG-CD1 3.69Å; H66-Y116 AromaticContact ND1-CD1 3.58Å; H66-Y116 AromaticContact ND1-CE1 3.61Å
67	S	93.1	Very high	96.7	Very high	16 Å²	16	44.2 Å²	44.2	11%	0.112	24%	0.238	C	C	.	.	S	Bend	trans	-62.5	146.6	171.8	64.7	0	0	0	0	111.1	N64 R382	N64-S67 PolarHBondContact O-OG 3.37Å; S67-R382 PolarHBondContact O-NH1 3.12Å
68	K	90.9	Very high	96.7	Very high	157 Å²	157	42.4 Å²	42.4	68%	0.683	23%	0.226	S	C	*	.	P	Polyproline II helix	trans	-79.4	159.7	179.4	-61.4	-177.5	-177.4	-176	0	110	G70 D71	K68-G70 PolarHBondContact O-N 2.94Å; K68-D71 WeakPolarHBondContact CB-OD2 3.2Å; K68-D71 PolarHBondContact N-OD2 2.8Å; K68-D71 VanDerWaalsContact O-CB 3.32Å; K68-D71 WeakPolarHBondContact O-CB 3.31Å; K68-D71 PolarHBondContact O-N 2.89Å
69	E	87.8	Confident	96.7	Very high	203 Å²	203	42.5 Å²	42.5	95%	0.949	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	128.3	173.6	-171.1	175.4	-177.8	0	0	109.9
70	G	89.9	Confident	96.7	Very high	79 Å²	79	42.3 Å²	42.3	81%	0.814	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.8	-17.6	-174.4	0	0	0	0	0	114.6	K68	K68-G70 PolarHBondContact O-N 2.94Å
71	D	94.3	Very high	96.7	Very high	81 Å²	81	43.2 Å²	43.2	43%	0.433	23%	0.234	S	C	.	.	S	Bend	trans	-68.6	151.2	170.3	-68.3	-17.4	0	0	0	110.3	K68	K68-D71 WeakPolarHBondContact CB-OD2 3.2Å; K68-D71 PolarHBondContact N-OD2 2.8Å; K68-D71 VanDerWaalsContact O-CB 3.32Å; K68-D71 WeakPolarHBondContact O-CB 3.31Å; K68-D71 PolarHBondContact O-N 2.89Å
72	P	95.4	Very high	96.7	Very high	62 Å²	62	46.1 Å²	46.1	40%	0.403	25%	0.245	S	C	.	.			trans	-58.9	148.4	174.7	-23.3	33.2	0	0	0	113.7	V74 E87	P72-V74 PolarHBondContact O-N 2.98Å; P72-V74 VanDerWaalsContact O-N 3.17Å; P72-E87 HydrophobicContact CB-CG 3.59Å; P72-E87 WeakPolarHBondContact CB-OE1 3.44Å; P72-E87 WeakPolarHBondContact CG-OE1 3.39Å
73	L	98.1	Very high	96.7	Very high	36 Å²	36	44.9 Å²	44.9	19%	0.188	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	101	176.6	-63.7	178.7	0	0	0	109.5	F63 C88 I386	F63-L73 HydrophobicContact CD1-CB 4.48Å; F63-L73 HydrophobicContact CE1-CB 4.09Å; L73-C88 HydrophobicContact CB-CB 4.1Å; L73-C88 PolarHBondContact O-N 3.44Å; L73-I386 HydrophobicContact CD1-CD1 3.65Å; L73-I386 HydrophobicContact CD1-CG1 4.21Å
74	V	98.6	Very high	96.7	Very high	25 Å²	25	44.8 Å²	44.8	15%	0.152	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.5	179.4	177.2	0	0	0	0	110.7	F63 N64 P72 Y86 E87 L97 W114	F63-V74 WeakPolarHBondContact CA-O 3.44Å; F63-V74 WeakPolarHBondContact CD1-O 3.47Å; N64-V74 PolarHBondContact N-O 3.07Å; P72-V74 PolarHBondContact O-N 2.98Å; P72-V74 VanDerWaalsContact O-N 3.17Å; V74-Y86 CarbonylContact C-O 3.5Å; V74-Y86 VanDerWaalsContact CA-O 3.24Å; V74-Y86 WeakPolarHBondContact CA-O 3.35Å; V74-Y86 WeakPolarHBondContact CG1-O 3.26Å; V74-E87 HydrophobicContact CG2-CG 4.37Å; V74-L97 HydrophobicContact CG1-CD1 4.1Å; V74-L97 HydrophobicContact CG2-CD1 4.02Å; V74-W114 HydrophobicContact CG1-CH2 4.4Å; V74-W114 HydrophobicContact CG1-CZ2 4.41Å
75	F	98.9	Very high	96.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.4	170.9	69.5	-88.9	0	0	0	112.1	V61 Q62 F63 T77 L85 Y86 I94 I388 I396	V61-F75 HydrophobicContact CG2-CD2 3.83Å; V61-F75 HydrophobicContact CG2-CE2 4.45Å; Q62-F75 CarbonylContact O-C 3.59Å; Q62-F75 VanDerWaalsContact O-CA 3.28Å; Q62-F75 WeakPolarHBondContact O-CA 3.42Å; F63-F75 HydrophobicContact CD1-CB 3.78Å; F63-F75 HydrophobicContact CD2-CB 4.3Å; F63-F75 HydrophobicContact CE1-CB 3.98Å; F63-F75 AromaticContact CE1-CD1 3.93Å; F63-F75 HydrophobicContact CE1-CD1 3.93Å; F63-F75 HydrophobicContact CE1-CG 4.38Å; F63-F75 HydrophobicContact CG-CB 3.95Å; F63-F75 HydrophobicContact CZ-CB 4.36Å; F63-F75 HydrophobicContact CZ-CD1 4.08Å; F75-T77 HydrophobicContact CD2-CG2 4.07Å; F75-T77 HydrophobicContact CE2-CG2 3.83Å; F75-L85 WeakPolarHBondContact O-CA 3.38Å; F75-Y86 HydrophobicContact CD2-CD2 4.11Å; F75-Y86 VanDerWaalsContact CE1-CB 3.45Å; F75-Y86 HydrophobicContact CE1-CG 4.29Å; F75-Y86 AromaticContact CE2-CD2 3.45Å; F75-Y86 HydrophobicContact CE2-CD2 3.45Å; F75-Y86 VanDerWaalsContact CE2-CD2 3.45Å; F75-Y86 HydrophobicContact CE2-CE2 4.31Å; F75-Y86 AromaticContact CE2-CG 3.87Å; F75-Y86 HydrophobicContact CE2-CG 3.87Å; F75-Y86 AromaticContact CZ-CD2 3.78Å; F75-Y86 HydrophobicContact CZ-CD2 3.78Å; F75-Y86 AromaticContact CZ-CG 3.69Å; F75-Y86 HydrophobicContact CZ-CG 3.69Å; F75-Y86 PolarHBondContact N-O 2.82Å; F75-Y86 PolarHBondContact O-N 2.95Å; F75-I94 HydrophobicContact CE1-CG2 3.98Å; F75-I94 HydrophobicContact CZ-CG2 3.77Å; F75-I388 HydrophobicContact CD1-CD1 4.36Å; F75-I388 HydrophobicContact CD1-CG1 4.1Å; F75-I388 HydrophobicContact CD2-CG2 4.32Å; F75-I388 HydrophobicContact CE1-CD1 3.83Å; F75-I388 HydrophobicContact CE1-CG1 4.06Å; F75-I388 HydrophobicContact CE2-CG2 4.03Å; F75-I388 HydrophobicContact CG-CG1 4.39Å; F75-I388 HydrophobicContact CZ-CD1 4.01Å; F75-I388 HydrophobicContact CZ-CG1 4.31Å; F75-I388 HydrophobicContact CZ-CG2 4.3Å; F75-I396 HydrophobicContact CE2-CD1 4.46Å; F75-I396 HydrophobicContact CE2-CG2 4.08Å; F75-I396 HydrophobicContact CZ-CG2 4.06Å
76	A	98.9	Very high	96.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	142.9	173.5	0	0	0	0	0	110.4	V61 Q62 T84 L85 W114 L125	V61-A76 CarbonylContact C-O 3.43Å; V61-A76 VanDerWaalsContact CA-O 3.24Å; V61-A76 WeakPolarHBondContact CA-O 3.41Å; Q62-A76 PolarHBondContact N-O 2.84Å; Q62-A76 PolarHBondContact O-N 3.16Å; A76-T84 CarbonylContact C-O 3.6Å; A76-T84 VanDerWaalsContact CA-O 3.32Å; A76-T84 WeakPolarHBondContact CA-O 3.45Å; A76-L85 HydrophobicContact CB-CD2 3.42Å; A76-L85 VanDerWaalsContact CB-CD2 3.42Å; A76-W114 HydrophobicContact CB-CZ2 3.84Å; A76-L125 HydrophobicContact CB-CD1 4.22Å; A76-L125 HydrophobicContact CB-CD2 3.69Å
77	T	98.9	Very high	96.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	151.2	164.9	58.3	0	0	0	0	110.4	E52 G60 V61 F75 V83 T84 Y86 V390 I396	E52-T77 WeakPolarHBondContact OE1-CB 3.43Å; E52-T77 PolarHBondContact OE1-OG1 2.96Å; G60-T77 WeakPolarHBondContact O-CA 3.35Å; V61-T77 HydrophobicContact CG2-CG2 4.22Å; F75-T77 HydrophobicContact CD2-CG2 4.07Å; F75-T77 HydrophobicContact CE2-CG2 3.83Å; T77-V83 WeakPolarHBondContact O-CA 3.2Å; T77-T84 PolarHBondContact N-O 2.96Å; T77-T84 PolarHBondContact O-N 3.39Å; T77-T84 PolarHBondContact OG1-O 3.35Å; T77-Y86 HydrophobicContact CG2-CD2 4.24Å; T77-Y86 HydrophobicContact CG2-CE2 4Å; T77-V390 HydrophobicContact CG2-CG1 3.84Å; T77-I396 HydrophobicContact CG2-CD1 3.74Å; T77-I396 HydrophobicContact CG2-CG1 4.4Å
78	V	98.9	Very high	97	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	137.9	173.4	-64.5	0	0	0	0	111.6	L58 F59 G60 V83 F109 C112 V127	L58-V78 CarbonylContact C-O 3.53Å; F59-V78 PolarHBondContact N-O 3.18Å; G60-V78 PolarHBondContact N-O 3.19Å; G60-V78 VanDerWaalsContact N-O 3.15Å; G60-V78 PolarHBondContact O-N 2.99Å; V78-V83 HydrophobicContact CG1-CB 4.31Å; V78-V83 HydrophobicContact CG1-CG1 3.99Å; V78-V83 HydrophobicContact CG1-CG2 3.96Å; V78-F109 HydrophobicContact CB-CB 3.84Å; V78-F109 HydrophobicContact CG1-CB 4.39Å; V78-F109 HydrophobicContact CG2-CB 4.47Å; V78-C112 HydrophobicContact CG1-CB 3.69Å; V78-C112 HydrophobicContact CG2-CB 4.36Å; V78-V127 HydrophobicContact CG1-CG1 4.06Å
79	G	98.5	Very high	97.3	Very high	1 Å²	1	33 Å²	33	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.6	149.7	177.5	0	0	0	0	0	109.7	P57 R82	P57-G79 VanDerWaalsContact O-CA 3.32Å; P57-G79 WeakPolarHBondContact O-CA 3.33Å; G79-R82 PolarHBondContact N-O 2.61Å; G79-R82 WeakPolarHBondContact O-CB 3.3Å; G79-R82 PolarHBondContact O-N 3.02Å
80	S	98.6	Very high	97.6	Very high	26 Å²	26	27.8 Å²	27.8	18%	0.182	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	-157.8	-164.6	-165.5	0	0	0	0	110.1	R82 E107 N108 F109	S80-R82 PolarHBondContact O-N 2.88Å; S80-R82 VanDerWaalsContact O-N 3.14Å; S80-E107 CarbonylContact C-O 3.52Å; S80-N108 WeakPolarHBondContact CA-OD1 3.41Å; S80-N108 PolarHBondContact N-OD1 3.17Å; S80-N108 VanDerWaalsContact N-OD1 3.14Å; S80-N108 CarbonylContact O-C 3.52Å; S80-N108 WeakPolarHBondContact O-CA 3Å; S80-F109 PolarHBondContact O-N 2.8Å
81	N	98.7	Very high	97.7	Very high	19 Å²	19	33.5 Å²	33.5	10%	0.102	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	25.8	167.3	70.1	-31.8	0	0	0	113.6	V101 D102 D104 E107	N81-V101 WeakPolarHBondContact ND2-CG1 3.04Å; N81-D102 HydrophobicContact CB-CB 3.98Å; N81-D102 PolarHBondContact ND2-O 2.98Å; N81-D102 VanDerWaalsContact ND2-O 3.16Å; N81-D102 PolarHBondContact O-N 2.9Å; N81-D104 WeakPolarHBondContact CB-O 3.41Å; N81-E107 WeakPolarHBondContact CA-O 3.28Å; N81-E107 HydrophobicContact CB-CB 4.11Å; N81-E107 WeakPolarHBondContact CB-O 3.48Å; N81-E107 PolarHBondContact N-O 3.17Å
82	R	98.6	Very high	97.8	Very high	61 Å²	61	29.7 Å²	29.7	23%	0.23	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	146.8	-173.5	-64.8	-176.2	178.3	-117.5	7.2	114	D53 H54 G79 S80 Y100 V101	D53-R82 IonicContact OD1-NH1 3.88Å; H54-R82 VanDerWaalsContact CD2-CD 3.49Å; H54-R82 WeakPolarHBondContact CD2-CD 3.35Å; G79-R82 PolarHBondContact N-O 2.61Å; G79-R82 WeakPolarHBondContact O-CB 3.3Å; G79-R82 PolarHBondContact O-N 3.02Å; S80-R82 PolarHBondContact O-N 2.88Å; S80-R82 VanDerWaalsContact O-N 3.14Å; R82-Y100 WeakPolarHBondContact CA-O 3.15Å; R82-V101 HydrophobicContact CG-CG2 4.28Å
83	V	98.8	Very high	97.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	117.8	170.7	-174.7	0	0	0	0	107.7	T77 V78 S99 Y100 F109 L125 V127 I137	T77-V83 WeakPolarHBondContact O-CA 3.2Å; V78-V83 HydrophobicContact CG1-CB 4.31Å; V78-V83 HydrophobicContact CG1-CG1 3.99Å; V78-V83 HydrophobicContact CG1-CG2 3.96Å; V83-S99 WeakPolarHBondContact O-CA 3.44Å; V83-Y100 HydrophobicContact CB-CD1 4.26Å; V83-Y100 HydrophobicContact CG2-CD1 3.94Å; V83-Y100 PolarHBondContact N-O 3.14Å; V83-Y100 PolarHBondContact O-N 3.46Å; V83-F109 HydrophobicContact CG2-CD2 3.76Å; V83-F109 HydrophobicContact CG2-CE2 3.77Å; V83-F109 HydrophobicContact CG2-CG 4.46Å; V83-F109 HydrophobicContact CG2-CZ 4.5Å; V83-L125 HydrophobicContact CG1-CD2 3.55Å; V83-V127 HydrophobicContact CG1-CG1 4.03Å; V83-V127 HydrophobicContact CG2-CB 4.21Å; V83-V127 HydrophobicContact CG2-CG1 3.77Å; V83-V127 HydrophobicContact CG2-CG2 4.06Å; V83-I137 HydrophobicContact CB-CD1 4.3Å; V83-I137 HydrophobicContact CG1-CD1 4.42Å; V83-I137 HydrophobicContact CG2-CD1 3.93Å
84	T	98.9	Very high	98	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.018	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.6	-173.9	-52.6	0	0	0	0	110.6	E52 A76 T77 Y86 L96 S99	E52-T84 PolarHBondContact OE2-OG1 2.88Å; A76-T84 CarbonylContact C-O 3.6Å; A76-T84 VanDerWaalsContact CA-O 3.32Å; A76-T84 WeakPolarHBondContact CA-O 3.45Å; T77-T84 PolarHBondContact N-O 2.96Å; T77-T84 PolarHBondContact O-N 3.39Å; T77-T84 PolarHBondContact OG1-O 3.35Å; T84-Y86 HydrophobicContact CG2-CD2 4.27Å; T84-Y86 HydrophobicContact CG2-CE1 4.2Å; T84-Y86 HydrophobicContact CG2-CE2 3.48Å; T84-Y86 VanDerWaalsContact CG2-CE2 3.48Å; T84-Y86 VanDerWaalsContact CG2-CZ 3.44Å; T84-Y86 WeakPolarHBondContact CG2-OH 3.28Å; T84-L96 HydrophobicContact CG2-CD1 3.19Å; T84-S99 PolarHBondContact OG1-OG 3.01Å
85	L	98.8	Very high	98	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.026	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.7	176.9	-67.3	-165.4	0	0	0	111.7	F75 A76 L97 Q98 W114 L125 P139 M142	F75-L85 WeakPolarHBondContact O-CA 3.38Å; A76-L85 HydrophobicContact CB-CD2 3.42Å; A76-L85 VanDerWaalsContact CB-CD2 3.42Å; L85-L97 HydrophobicContact CB-CB 4.15Å; L85-L97 PolarHBondContact O-N 3.48Å; L85-Q98 PolarHBondContact N-O 2.91Å; L85-W114 HydrophobicContact CD1-CH2 3.99Å; L85-W114 HydrophobicContact CD2-CH2 3.75Å; L85-W114 HydrophobicContact CD2-CZ2 3.63Å; L85-L125 HydrophobicContact CD2-CD2 4.15Å; L85-P139 HydrophobicContact CD1-CB 3.7Å; L85-M142 HydrophobicContact CB-CE 4.25Å; L85-M142 HydrophobicContact CD1-CE 3.13Å; L85-M142 HydrophobicContact CD2-CE 4.42Å; L85-M142 HydrophobicContact CG-CE 3.33Å
86	Y	98.9	Very high	97.9	Very high	11 Å²	11	38.6 Å²	38.6	4%	0.043	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.4	179	-62.6	-84.7	0	0	0	111.5	L50 E52 V74 F75 T77 T84 I94 R95 L96 I396	L50-Y86 HydrophobicContact CD1-CE1 4.19Å; L50-Y86 HydrophobicContact CD2-CD1 4.42Å; L50-Y86 HydrophobicContact CD2-CE1 4.08Å; E52-Y86 VanDerWaalsContact CG-OH 3.28Å; E52-Y86 WeakPolarHBondContact CG-OH 3.49Å; E52-Y86 PolarHBondContact OE1-OH 2.7Å; V74-Y86 CarbonylContact C-O 3.5Å; V74-Y86 VanDerWaalsContact CA-O 3.24Å; V74-Y86 WeakPolarHBondContact CA-O 3.35Å; V74-Y86 WeakPolarHBondContact CG1-O 3.26Å; F75-Y86 HydrophobicContact CD2-CD2 4.11Å; F75-Y86 VanDerWaalsContact CE1-CB 3.45Å; F75-Y86 HydrophobicContact CE1-CG 4.29Å; F75-Y86 AromaticContact CE2-CD2 3.45Å; F75-Y86 HydrophobicContact CE2-CD2 3.45Å; F75-Y86 VanDerWaalsContact CE2-CD2 3.45Å; F75-Y86 HydrophobicContact CE2-CE2 4.31Å; F75-Y86 AromaticContact CE2-CG 3.87Å; F75-Y86 HydrophobicContact CE2-CG 3.87Å; F75-Y86 AromaticContact CZ-CD2 3.78Å; F75-Y86 HydrophobicContact CZ-CD2 3.78Å; F75-Y86 AromaticContact CZ-CG 3.69Å; F75-Y86 HydrophobicContact CZ-CG 3.69Å; F75-Y86 PolarHBondContact N-O 2.82Å; F75-Y86 PolarHBondContact O-N 2.95Å; T77-Y86 HydrophobicContact CG2-CD2 4.24Å; T77-Y86 HydrophobicContact CG2-CE2 4Å; T84-Y86 HydrophobicContact CG2-CD2 4.27Å; T84-Y86 HydrophobicContact CG2-CE1 4.2Å; T84-Y86 HydrophobicContact CG2-CE2 3.48Å; T84-Y86 VanDerWaalsContact CG2-CE2 3.48Å; T84-Y86 VanDerWaalsContact CG2-CZ 3.44Å; T84-Y86 WeakPolarHBondContact CG2-OH 3.28Å; Y86-I94 HydrophobicContact CD1-CG2 3.66Å; Y86-I94 HydrophobicContact CG-CG2 3.94Å; Y86-R95 CarbonylContact C-O 3.49Å; Y86-R95 VanDerWaalsContact CA-O 3.22Å; Y86-R95 WeakPolarHBondContact CA-O 3.43Å; Y86-L96 HydrophobicContact CD1-CB 4.35Å; Y86-L96 HydrophobicContact CD1-CD1 4.33Å; Y86-L96 HydrophobicContact CE1-CB 4.21Å; Y86-L96 HydrophobicContact CE1-CD1 3.87Å; Y86-I396 HydrophobicContact CD2-CD1 4.19Å; Y86-I396 HydrophobicContact CE1-CD1 4.44Å; Y86-I396 HydrophobicContact CE2-CD1 3.49Å; Y86-I396 VanDerWaalsContact CE2-CD1 3.49Å
87	E	98.6	Very high	97.9	Very high	29 Å²	29	42 Å²	42	14%	0.136	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.8	172.6	-168.5	-179.6	165.7	0	0	110	P72 V74 H89 R95 L97	P72-E87 HydrophobicContact CB-CG 3.59Å; P72-E87 WeakPolarHBondContact CB-OE1 3.44Å; P72-E87 WeakPolarHBondContact CG-OE1 3.39Å; V74-E87 HydrophobicContact CG2-CG 4.37Å; E87-H89 VanDerWaalsContact CD-NE2 3.27Å; E87-H89 IonicContact OE1-CE1 2.88Å; E87-H89 PolarHBondContact OE1-CE1 3.22Å; E87-H89 IonicContact OE1-ND1 2.78Å; E87-H89 IonicContact OE1-NE2 3.82Å; E87-H89 PolarHBondContact OE1-NE2 2.91Å; E87-H89 IonicContact OE2-CE1 2.93Å; E87-H89 IonicContact OE2-NE2 2.72Å; E87-R95 HydrophobicContact CB-CB 4.43Å; E87-R95 PolarHBondContact N-O 3.03Å; E87-R95 PolarHBondContact O-N 2.88Å; E87-L97 HydrophobicContact CB-CD1 4.04Å; E87-L97 HydrophobicContact CB-CD2 4.04Å; E87-L97 HydrophobicContact CB-CG 3.98Å; E87-L97 WeakPolarHBondContact OE2-CD2 3.45Å
88	C	98.4	Very high	97.6	Very high	11 Å²	11	45.5 Å²	45.5	7%	0.074	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.2	174.1	-75.4	0	0	0	0	110.6	L73 I386	L73-C88 HydrophobicContact CB-CB 4.1Å; L73-C88 PolarHBondContact O-N 3.44Å; C88-I386 HydrophobicContact CB-CD1 3.62Å
89	H	96.7	Very high	97.4	Very high	42 Å²	42	47.9 Å²	47.9	19%	0.194	24%	0.242	C	C	.	.			trans	-107.8	-179.2	175	-67.8	-80.3	0	0	0	112.5	E87 E93 R95 R398	E87-H89 VanDerWaalsContact CD-NE2 3.27Å; E87-H89 IonicContact OE1-CE1 2.88Å; E87-H89 PolarHBondContact OE1-CE1 3.22Å; E87-H89 IonicContact OE1-ND1 2.78Å; E87-H89 IonicContact OE1-NE2 3.82Å; E87-H89 PolarHBondContact OE1-NE2 2.91Å; E87-H89 IonicContact OE2-CE1 2.93Å; E87-H89 IonicContact OE2-NE2 2.72Å; H89-E93 HydrophobicContact CB-CB 4.06Å; H89-E93 HydrophobicContact CB-CG 4.41Å; H89-E93 PolarHBondContact N-O 3.07Å; H89-R95 PolarHBondContact CE1-NH1 2.74Å; H89-R95 PolarHBondContact NE2-NE 3.22Å; H89-R95 PolarHBondContact NE2-NH1 3Å; H89-R398 PolarHBondContact O-NH1 3.31Å; H89-R398 PolarHBondContact O-NH2 2.93Å
90	S	93.2	Very high	97.4	Very high	93 Å²	93	49 Å²	49	65%	0.65	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-62	164.9	171.8	60.1	0	0	0	0	111.5	G92 E93	S90-G92 PolarHBondContact O-N 3.12Å; S90-E93 PolarHBondContact O-N 3.26Å
91	Q	93.2	Very high	97.4	Very high	198 Å²	198	51.1 Å²	51.1	93%	0.925	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	59.1	16	179.9	-55	176.6	-8.9	0	0	115.1
92	G	96.2	Very high	97.4	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.01	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	86.8	0.3	177.9	0	0	0	0	0	115	N48 S90 I94 R398	N48-G92 WeakPolarHBondContact CB-O 3.16Å; N48-G92 PolarHBondContact ND2-O 2.69Å; S90-G92 PolarHBondContact O-N 3.12Å; G92-I94 PolarHBondContact O-N 3Å; G92-R398 VanDerWaalsContact C-NH1 3.28Å; G92-R398 PolarHBondContact O-NH1 3.17Å
93	E	98.3	Very high	97.3	Very high	81 Å²	81	52.5 Å²	52.5	38%	0.379	29%	0.285	S	S	.	.			trans	-59.3	133.7	-179	175.4	-169.9	176.4	0	0	111.4	H89 S90 R95 R398	H89-E93 HydrophobicContact CB-CB 4.06Å; H89-E93 HydrophobicContact CB-CG 4.41Å; H89-E93 PolarHBondContact N-O 3.07Å; S90-E93 PolarHBondContact O-N 3.26Å; E93-R95 IonicContact OE1-CZ 3.53Å; E93-R95 IonicContact OE1-NE 2.79Å; E93-R95 PolarHBondContact OE1-NE 3.21Å; E93-R95 IonicContact OE1-NH2 3.41Å; E93-R95 PolarHBondContact OE1-NH2 3.34Å; E93-R95 IonicContact OE2-NH2 3.66Å; E93-R95 PolarHBondContact OE2-NH2 2.86Å; E93-R398 PolarHBondContact O-NH1 3.29Å
94	I	98.7	Very high	97.2	Very high	16 Å²	16	54.2 Å²	54.2	8%	0.082	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	106.4	171.1	-55.5	171.1	0	0	0	105.8	N48 L50 F75 Y86 G92 R398	N48-I94 HydrophobicContact CB-CD1 4.18Å; N48-I94 HydrophobicContact CB-CG1 4.36Å; L50-I94 HydrophobicContact CD2-CB 3.81Å; L50-I94 HydrophobicContact CD2-CD1 4.19Å; L50-I94 HydrophobicContact CD2-CG2 3.64Å; F75-I94 HydrophobicContact CE1-CG2 3.98Å; F75-I94 HydrophobicContact CZ-CG2 3.77Å; Y86-I94 HydrophobicContact CD1-CG2 3.66Å; Y86-I94 HydrophobicContact CG-CG2 3.94Å; G92-I94 PolarHBondContact O-N 3Å; I94-R398 HydrophobicContact CD1-CB 3.73Å; I94-R398 HydrophobicContact CG1-CB 4.27Å
95	R	98.6	Very high	97.2	Very high	108 Å²	108	57.7 Å²	57.7	41%	0.408	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.5	-177.3	-177.9	176.6	-62.7	163.9	5.6	110	Y86 E87 H89 E93 L97	Y86-R95 CarbonylContact C-O 3.49Å; Y86-R95 VanDerWaalsContact CA-O 3.22Å; Y86-R95 WeakPolarHBondContact CA-O 3.43Å; E87-R95 HydrophobicContact CB-CB 4.43Å; E87-R95 PolarHBondContact N-O 3.03Å; E87-R95 PolarHBondContact O-N 2.88Å; H89-R95 PolarHBondContact CE1-NH1 2.74Å; H89-R95 PolarHBondContact NE2-NE 3.22Å; H89-R95 PolarHBondContact NE2-NH1 3Å; E93-R95 IonicContact OE1-CZ 3.53Å; E93-R95 IonicContact OE1-NE 2.79Å; E93-R95 PolarHBondContact OE1-NE 3.21Å; E93-R95 IonicContact OE1-NH2 3.41Å; E93-R95 PolarHBondContact OE1-NH2 3.34Å; E93-R95 IonicContact OE2-NH2 3.66Å; E93-R95 PolarHBondContact OE2-NH2 2.86Å; R95-L97 PolarHBondContact O-N 3.3Å
96	L	98.3	Very high	97.1	Very high	105 Å²	105	64.1 Å²	64.1	55%	0.55	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	125.8	169.9	176	65.5	0	0	0	109.5	T84 Y86	T84-L96 HydrophobicContact CG2-CD1 3.19Å; Y86-L96 HydrophobicContact CD1-CB 4.35Å; Y86-L96 HydrophobicContact CD1-CD1 4.33Å; Y86-L96 HydrophobicContact CE1-CB 4.21Å; Y86-L96 HydrophobicContact CE1-CD1 3.87Å
97	L	97.3	Very high	97.1	Very high	72 Å²	72	63.8 Å²	63.8	38%	0.377	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-64.2	175.2	-69.3	-178.8	0	0	0	111	V74 L85 E87 R95	V74-L97 HydrophobicContact CG1-CD1 4.1Å; V74-L97 HydrophobicContact CG2-CD1 4.02Å; L85-L97 HydrophobicContact CB-CB 4.15Å; L85-L97 PolarHBondContact O-N 3.48Å; E87-L97 HydrophobicContact CB-CD1 4.04Å; E87-L97 HydrophobicContact CB-CD2 4.04Å; E87-L97 HydrophobicContact CB-CG 3.98Å; E87-L97 WeakPolarHBondContact OE2-CD2 3.45Å; R95-L97 PolarHBondContact O-N 3.3Å
98	Q	93.5	Very high	97.1	Very high	73 Å²	73	64.6 Å²	64.6	34%	0.341	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	159.1	-178	-67.5	-173	-12.3	0	0	109.8	L85 I140 M142	L85-Q98 PolarHBondContact N-O 2.91Å; Q98-I140 PolarHBondContact NE2-O 3.09Å; Q98-I140 PolarHBondContact OE1-O 3.09Å; Q98-I140 VanDerWaalsContact OE1-O 3.07Å; Q98-M142 HydrophobicContact CB-CE 4.07Å; Q98-M142 HydrophobicContact CB-CG 3.48Å; Q98-M142 VanDerWaalsContact CB-CG 3.48Å; Q98-M142 HydrophobicContact CG-CG 4.37Å
99	S	95.3	Very high	97.2	Very high	50 Å²	50	64 Å²	64	35%	0.35	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	129.4	174.3	-171.8	0	0	0	0	109	V83 T84	V83-S99 WeakPolarHBondContact O-CA 3.44Å; T84-S99 PolarHBondContact OG1-OG 3.01Å
100	Y	97.9	Very high	97.3	Very high	26 Å²	26	64 Å²	64	10%	0.102	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	134.3	170.4	170.1	-97.1	0	0	0	109	R82 V83 D102 F109 I137 M142 C144	R82-Y100 WeakPolarHBondContact CA-O 3.15Å; V83-Y100 HydrophobicContact CB-CD1 4.26Å; V83-Y100 HydrophobicContact CG2-CD1 3.94Å; V83-Y100 PolarHBondContact N-O 3.14Å; V83-Y100 PolarHBondContact O-N 3.46Å; Y100-D102 HydrophobicContact CE1-CB 4.06Å; Y100-D102 PolarHBondContact OH-OD2 2.95Å; Y100-D102 VanDerWaalsContact OH-OD2 3.06Å; Y100-F109 HydrophobicContact CD1-CE2 4.47Å; Y100-F109 HydrophobicContact CE1-CE2 4.22Å; Y100-F109 HydrophobicContact CE1-CZ 4.2Å; Y100-I137 HydrophobicContact CD1-CD1 3.67Å; Y100-I137 HydrophobicContact CE1-CD1 3.96Å; Y100-I137 HydrophobicContact CG-CD1 3.97Å; Y100-M142 VanDerWaalsContact CD2-O 3.3Å; Y100-M142 WeakPolarHBondContact CD2-O 3.48Å; Y100-C144 HydrophobicContact CE2-CB 4.39Å
101	V	98.3	Very high	97.5	Very high	69 Å²	69	59.6 Å²	59.6	42%	0.418	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.3	173.3	-174.1	0	0	0	0	107.1	N81 R82	N81-V101 WeakPolarHBondContact ND2-CG1 3.04Å; R82-V101 HydrophobicContact CG-CG2 4.28Å
102	D	98.4	Very high	97.8	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.032	28%	0.281	C	S	.	.			trans	-65.3	145.1	177.4	-150.6	-74.4	0	0	0	110.7	N81 Y100 D104 F109 R135	N81-D102 HydrophobicContact CB-CB 3.98Å; N81-D102 PolarHBondContact ND2-O 2.98Å; N81-D102 VanDerWaalsContact ND2-O 3.16Å; N81-D102 PolarHBondContact O-N 2.9Å; Y100-D102 HydrophobicContact CE1-CB 4.06Å; Y100-D102 PolarHBondContact OH-OD2 2.95Å; Y100-D102 VanDerWaalsContact OH-OD2 3.06Å; D102-D104 PolarHBondContact O-N 2.96Å; D102-D104 PolarHBondContact OD1-N 2.83Å; D102-F109 HydrophobicContact CB-CE2 4.18Å; D102-F109 HydrophobicContact CB-CZ 4.15Å; D102-F109 WeakPolarHBondContact OD2-CZ 3.1Å; D102-R135 VanDerWaalsContact CG-NH2 3.31Å; D102-R135 IonicContact OD1-CZ 2.69Å; D102-R135 IonicContact OD1-NE 3.01Å; D102-R135 IonicContact OD1-NH1 3.39Å; D102-R135 PolarHBondContact OD1-NH1 2.94Å; D102-R135 IonicContact OD1-NH2 3.54Å; D102-R135 PolarHBondContact OD1-NH2 3.17Å; D102-R135 WeakPolarHBondContact OD2-CD 3.32Å; D102-R135 IonicContact OD2-CZ 3.5Å; D102-R135 IonicContact OD2-NE 2.88Å; D102-R135 PolarHBondContact OD2-NE 3.44Å; D102-R135 IonicContact OD2-NH1 3.39Å; D102-R135 PolarHBondContact OD2-NH1 3.4Å; D102-R135 VanDerWaalsContact OD2-NH1 3.11Å; D102-R135 IonicContact OD2-NH2 3.12Å; D102-R135 PolarHBondContact OD2-NH2 3.27Å
103	A	97.3	Very high	97.9	Very high	104 Å²	104	50.7 Å²	50.7	86%	0.86	29%	0.285	S	S	*	.	S	Bend	trans	-67.7	-27.5	174.7	0	0	0	0	0	111.8	A105	A103-A105 PolarHBondContact O-N 3.14Å
104	D	97.6	Very high	98	Very high	36 Å²	36	47.7 Å²	47.7	19%	0.193	27%	0.27	C	S	.	.			trans	-80.1	104.4	169.9	-168.7	-11.4	0	0	0	109.2	N81 D102 D106 E107 R131	N81-D104 WeakPolarHBondContact CB-O 3.41Å; D102-D104 PolarHBondContact O-N 2.96Å; D102-D104 PolarHBondContact OD1-N 2.83Å; D104-D106 PolarHBondContact O-N 3.34Å; D104-D106 PolarHBondContact OD1-N 3.15Å; D104-E107 HydrophobicContact CB-CB 4.31Å; D104-E107 WeakPolarHBondContact O-CB 3.33Å; D104-E107 PolarHBondContact O-N 2.94Å; D104-R131 WeakPolarHBondContact OD2-CD 3.44Å; D104-R131 IonicContact OD2-CZ 3.37Å; D104-R131 IonicContact OD2-NH1 3.52Å; D104-R131 PolarHBondContact OD2-NH1 3.2Å
105	A	97.8	Very high	98	Very high	75 Å²	75	47 Å²	47	62%	0.62	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.5	179.7	0	0	0	0	0	113.1	A103 E107	A103-A105 PolarHBondContact O-N 3.14Å; A105-E107 VanDerWaalsContact C-N 3.33Å
106	D	97.9	Very high	98	Very high	140 Å²	140	45.8 Å²	45.8	75%	0.749	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.1	178.7	-61.9	-39.1	0	0	0	112.1	D104	D104-D106 PolarHBondContact O-N 3.34Å; D104-D106 PolarHBondContact OD1-N 3.15Å
107	E	98.6	Very high	97.9	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.019	25%	0.249	C	C	.	.			trans	-66.1	144.2	170.6	-179.7	64.5	-81.6	0	0	111	S80 N81 D104 A105 F109 S130 R131	S80-E107 CarbonylContact C-O 3.52Å; N81-E107 WeakPolarHBondContact CA-O 3.28Å; N81-E107 HydrophobicContact CB-CB 4.11Å; N81-E107 WeakPolarHBondContact CB-O 3.48Å; N81-E107 PolarHBondContact N-O 3.17Å; D104-E107 HydrophobicContact CB-CB 4.31Å; D104-E107 WeakPolarHBondContact O-CB 3.33Å; D104-E107 PolarHBondContact O-N 2.94Å; A105-E107 VanDerWaalsContact C-N 3.33Å; E107-F109 HydrophobicContact CG-CD1 3.94Å; E107-F109 HydrophobicContact CG-CD2 4.42Å; E107-F109 HydrophobicContact CG-CE1 3.64Å; E107-F109 HydrophobicContact CG-CE2 4.17Å; E107-F109 HydrophobicContact CG-CG 4.31Å; E107-F109 HydrophobicContact CG-CZ 3.78Å; E107-S130 PolarHBondContact OE1-N 2.87Å; E107-S130 VanDerWaalsContact OE1-N 3.09Å; E107-S130 PolarHBondContact OE1-OG 2.82Å; E107-R131 HydrophobicContact CB-CG 4.12Å; E107-R131 VanDerWaalsContact CD-CG 3.47Å; E107-R131 HydrophobicContact CG-CG 4.37Å; E107-R131 PolarHBondContact OE1-N 2.94Å; E107-R131 WeakPolarHBondContact OE2-CB 3.34Å; E107-R131 VanDerWaalsContact OE2-CG 3.29Å; E107-R131 WeakPolarHBondContact OE2-CG 3.49Å
108	N	98.8	Very high	97.9	Very high	46 Å²	46	41.8 Å²	41.8	25%	0.246	25%	0.245	C	C	.	.			trans	-137.5	101.4	173	-167.4	6.9	0	0	0	109	F59 S80 Y110 G129 S130	F59-N108 WeakPolarHBondContact CE2-OD1 3.45Å; S80-N108 WeakPolarHBondContact CA-OD1 3.41Å; S80-N108 PolarHBondContact N-OD1 3.17Å; S80-N108 VanDerWaalsContact N-OD1 3.14Å; S80-N108 CarbonylContact O-C 3.52Å; S80-N108 WeakPolarHBondContact O-CA 3Å; N108-Y110 HydrophobicContact CB-CE1 4.11Å; N108-Y110 WeakPolarHBondContact O-CD1 3.46Å; N108-Y110 PolarHBondContact O-N 2.83Å; N108-G129 CarbonylContact O-C 3.53Å; N108-G129 VanDerWaalsContact O-CA 3.27Å; N108-G129 WeakPolarHBondContact O-CA 3.48Å; N108-S130 PolarHBondContact N-OG 2.84Å; N108-S130 PolarHBondContact O-N 3.07Å
109	F	98.9	Very high	98	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	124.8	-179.3	-66.7	-56.6	0	0	0	111	V78 S80 V83 Y100 D102 E107 V127	V78-F109 HydrophobicContact CB-CB 3.84Å; V78-F109 HydrophobicContact CG1-CB 4.39Å; V78-F109 HydrophobicContact CG2-CB 4.47Å; S80-F109 PolarHBondContact O-N 2.8Å; V83-F109 HydrophobicContact CG2-CD2 3.76Å; V83-F109 HydrophobicContact CG2-CE2 3.77Å; V83-F109 HydrophobicContact CG2-CG 4.46Å; V83-F109 HydrophobicContact CG2-CZ 4.5Å; Y100-F109 HydrophobicContact CD1-CE2 4.47Å; Y100-F109 HydrophobicContact CE1-CE2 4.22Å; Y100-F109 HydrophobicContact CE1-CZ 4.2Å; D102-F109 HydrophobicContact CB-CE2 4.18Å; D102-F109 HydrophobicContact CB-CZ 4.15Å; D102-F109 WeakPolarHBondContact OD2-CZ 3.1Å; E107-F109 HydrophobicContact CG-CD1 3.94Å; E107-F109 HydrophobicContact CG-CD2 4.42Å; E107-F109 HydrophobicContact CG-CE1 3.64Å; E107-F109 HydrophobicContact CG-CE2 4.17Å; E107-F109 HydrophobicContact CG-CG 4.31Å; E107-F109 HydrophobicContact CG-CZ 3.78Å; F109-V127 HydrophobicContact CD1-CB 4.12Å; F109-V127 HydrophobicContact CD1-CG2 4Å; F109-V127 HydrophobicContact CE1-CB 4.25Å; F109-V127 HydrophobicContact CE1-CG2 3.62Å; F109-V127 HydrophobicContact CZ-CG2 3.9Å
110	Y	98.9	Very high	98	Very high	42 Å²	42	45.1 Å²	45.1	17%	0.165	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-27.1	179.5	-59.5	-32	0	0	0	112.2	F59 N108 A128 A154 I155 Y327 R329	F59-Y110 AromaticContact CD2-CD1 3.89Å; F59-Y110 HydrophobicContact CD2-CD1 3.89Å; F59-Y110 HydrophobicContact CD2-CE1 4.4Å; F59-Y110 HydrophobicContact CE2-CD1 4.18Å; F59-Y110 HydrophobicContact CE2-CE1 4.24Å; F59-Y110 HydrophobicContact CG-CD1 4.16Å; N108-Y110 HydrophobicContact CB-CE1 4.11Å; N108-Y110 WeakPolarHBondContact O-CD1 3.46Å; N108-Y110 PolarHBondContact O-N 2.83Å; Y110-A128 PolarHBondContact N-O 3.11Å; Y110-A154 HydrophobicContact CE2-CB 4Å; Y110-I155 WeakPolarHBondContact CD2-O 3.36Å; Y110-Y327 WeakPolarHBondContact CB-OH 3.42Å; Y110-Y327 PolarHBondContact O-OH 2.85Å; Y110-R329 PolarHBondContact O-NH2 3.43Å
111	T	98.9	Very high	97.9	Very high	0 Å²	0	48 Å²	48	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	153.7	-170.4	-166.2	0	0	0	0	112.9	V127 A128 E157 L158	T111-V127 WeakPolarHBondContact O-CA 3.29Å; T111-A128 HydrophobicContact CG2-CB 4.47Å; T111-A128 PolarHBondContact N-O 3.49Å; T111-A128 PolarHBondContact O-N 3.27Å; T111-A128 VanDerWaalsContact O-N 3.17Å; T111-E157 PolarHBondContact OG1-OE1 3.42Å; T111-L158 HydrophobicContact CG2-CB 3.99Å; T111-L158 HydrophobicContact CG2-CD1 4.08Å; T111-L158 HydrophobicContact CG2-CG 3.68Å
112	C	98.9	Very high	97.7	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.007	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156.5	168.8	65	0	0	0	0	111.3	Q62 V78 L125 A126 V127	Q62-C112 WeakPolarHBondContact CG-O 3.27Å; V78-C112 HydrophobicContact CG1-CB 3.69Å; V78-C112 HydrophobicContact CG2-CB 4.36Å; C112-L125 HydrophobicContact CB-CD1 3.96Å; C112-L125 HydrophobicContact CB-CG 4.48Å; C112-A126 CarbonylContact C-O 3.55Å; C112-A126 WeakPolarHBondContact CA-O 3.19Å; C112-V127 HydrophobicContact CB-CG1 3.77Å
113	A	98.9	Very high	97.7	Very high	10 Å²	10	50.9 Å²	50.9	8%	0.083	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	135.1	176	0	0	0	0	0	110.8	A126 L158 F160	A113-A126 PolarHBondContact N-O 2.8Å; A113-A126 PolarHBondContact O-N 2.81Å; A113-L158 HydrophobicContact CB-CB 4.06Å; A113-F160 HydrophobicContact CB-CD2 3.76Å; A113-F160 HydrophobicContact CB-CE2 4.07Å; A113-F160 WeakPolarHBondContact O-CE2 3.47Å
114	W	98.9	Very high	97.8	Very high	18 Å²	18	46.6 Å²	46.6	7%	0.068	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	141.2	178.7	-70.3	96.1	0	0	0	111.9	Q62 F63 N64 H66 V74 A76 L85 P123 L125 P139 F160	Q62-W114 PolarHBondContact O-NE1 2.9Å; F63-W114 VanDerWaalsContact O-CD1 3.27Å; N64-W114 HydrophobicContact CB-CD2 3.68Å; N64-W114 HydrophobicContact CB-CE3 3.98Å; N64-W114 HydrophobicContact CB-CG 4.07Å; N64-W114 HydrophobicContact CB-CH2 4.32Å; N64-W114 HydrophobicContact CB-CZ2 4.05Å; N64-W114 HydrophobicContact CB-CZ3 4.29Å; H66-W114 PolarHBondContact NE2-O 2.85Å; V74-W114 HydrophobicContact CG1-CH2 4.4Å; V74-W114 HydrophobicContact CG1-CZ2 4.41Å; A76-W114 HydrophobicContact CB-CZ2 3.84Å; L85-W114 HydrophobicContact CD1-CH2 3.99Å; L85-W114 HydrophobicContact CD2-CH2 3.75Å; L85-W114 HydrophobicContact CD2-CZ2 3.63Å; W114-P123 HydrophobicContact CE3-CB 4.35Å; W114-P123 HydrophobicContact CZ3-CB 4.19Å; W114-L125 HydrophobicContact CD2-CD1 3.77Å; W114-L125 HydrophobicContact CE3-CB 4.35Å; W114-L125 HydrophobicContact CE3-CD1 4.27Å; W114-L125 HydrophobicContact CG-CD1 4.01Å; W114-L125 HydrophobicContact CZ2-CD1 4.28Å; W114-L125 HydrophobicContact CZ2-CD2 4.49Å; W114-L125 HydrophobicContact CZ3-CB 4.36Å; W114-P139 HydrophobicContact CH2-CB 3.98Å; W114-P139 HydrophobicContact CZ3-CB 3.81Å; W114-P139 HydrophobicContact CZ3-CG 3.96Å; W114-F160 WeakPolarHBondContact O-CD2 3.36Å
115	T	98.8	Very high	97.8	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	-170	165.2	-163.6	0	0	0	0	109.6	P123 L124 F160 P165 I182	T115-P123 WeakPolarHBondContact O-CA 3.41Å; T115-L124 HydrophobicContact CG2-CB 3.72Å; T115-L124 HydrophobicContact CG2-CD1 4.32Å; T115-L124 PolarHBondContact N-O 3.45Å; T115-L124 PolarHBondContact O-N 3.39Å; T115-L124 VanDerWaalsContact O-O 3.09Å; T115-F160 HydrophobicContact CG2-CD1 4.06Å; T115-F160 HydrophobicContact CG2-CD2 4.26Å; T115-F160 HydrophobicContact CG2-CE1 3.46Å; T115-F160 VanDerWaalsContact CG2-CE1 3.46Å; T115-F160 HydrophobicContact CG2-CE2 3.68Å; T115-F160 HydrophobicContact CG2-CG 4.42Å; T115-F160 HydrophobicContact CG2-CZ 3.24Å; T115-P165 VanDerWaalsContact OG1-CA 3.3Å; T115-P165 WeakPolarHBondContact OG1-CA 3.36Å; T115-P165 VanDerWaalsContact OG1-CB 3.22Å; T115-P165 WeakPolarHBondContact OG1-CB 3.49Å; T115-P165 PolarHBondContact OG1-O 3.06Å; T115-I182 HydrophobicContact CG2-CD1 3.95Å
116	Y	98.4	Very high	97.9	Very high	84 Å²	84	41.3 Å²	41.3	33%	0.329	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	151.7	169.2	56.5	-87.7	0	0	0	110.1	H66 S118 H122 P165	H66-Y116 HydrophobicContact CB-CD1 4.04Å; H66-Y116 AromaticContact CE1-CE1 3.98Å; H66-Y116 AromaticContact CG-CD1 3.69Å; H66-Y116 AromaticContact ND1-CD1 3.58Å; H66-Y116 AromaticContact ND1-CE1 3.61Å; Y116-S118 PolarHBondContact O-N 3.04Å; Y116-H122 CarbonylContact C-O 3.59Å; Y116-H122 WeakPolarHBondContact CA-O 3.07Å; Y116-H122 WeakPolarHBondContact CB-O 3.46Å; Y116-P165 HydrophobicContact CD1-CB 4.17Å; Y116-P165 HydrophobicContact CD2-CB 4.2Å; Y116-P165 HydrophobicContact CD2-CG 4.29Å; Y116-P165 HydrophobicContact CE1-CB 3.89Å; Y116-P165 HydrophobicContact CE1-CG 4.44Å; Y116-P165 HydrophobicContact CE2-CB 3.92Å; Y116-P165 HydrophobicContact CE2-CG 3.71Å; Y116-P165 HydrophobicContact CG-CB 4.32Å; Y116-P165 WeakPolarHBondContact O-CB 3.4Å
117	D	97.6	Very high	97.9	Very high	48 Å²	48	34.7 Å²	34.7	26%	0.257	19%	0.188	S	C	.	.			trans	-67	122.9	170.7	179.7	-71.2	0	0	0	109.2	N119 T120 S121 H122 L124	D117-N119 PolarHBondContact O-N 2.8Å; D117-N119 WeakPolarHBondContact OD1-CA 3.35Å; D117-N119 WeakPolarHBondContact OD1-CB 3.43Å; D117-N119 PolarHBondContact OD1-N 2.95Å; D117-T120 VanDerWaalsContact CB-OG1 3.31Å; D117-T120 WeakPolarHBondContact CB-OG1 3.44Å; D117-T120 VanDerWaalsContact CG-OG1 3.27Å; D117-T120 PolarHBondContact O-N 2.86Å; D117-T120 PolarHBondContact OD1-N 3.26Å; D117-T120 PolarHBondContact OD1-OG1 2.9Å; D117-S121 WeakPolarHBondContact O-CA 3.13Å; D117-S121 PolarHBondContact O-N 2.96Å; D117-H122 PolarHBondContact N-O 3.41Å; D117-L124 HydrophobicContact CB-CD1 4.08Å; D117-L124 HydrophobicContact CB-CG 4.48Å
118	S	95.9	Very high	98	Very high	44 Å²	44	34.5 Å²	34.5	31%	0.308	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.4	-174.7	60.5	0	0	0	0	113.9	Y116 Q183	Y116-S118 PolarHBondContact O-N 3.04Å; S118-Q183 PolarHBondContact OG-OE1 3.09Å; S118-Q183 VanDerWaalsContact OG-OE1 3.05Å
119	N	95.9	Very high	98	Very high	122 Å²	122	32.3 Å²	32.3	65%	0.652	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-37.1	-177.3	-55.8	-62.8	0	0	0	112	D117	D117-N119 PolarHBondContact O-N 2.8Å; D117-N119 WeakPolarHBondContact OD1-CA 3.35Å; D117-N119 WeakPolarHBondContact OD1-CB 3.43Å; D117-N119 PolarHBondContact OD1-N 2.95Å
120	T	96	Very high	98	Very high	72 Å²	72	33.9 Å²	33.9	44%	0.442	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-12	-173.8	61.1	0	0	0	0	113.7	D117 H122	D117-T120 VanDerWaalsContact CB-OG1 3.31Å; D117-T120 WeakPolarHBondContact CB-OG1 3.44Å; D117-T120 VanDerWaalsContact CG-OG1 3.27Å; D117-T120 PolarHBondContact O-N 2.86Å; D117-T120 PolarHBondContact OD1-N 3.26Å; D117-T120 PolarHBondContact OD1-OG1 2.9Å; T120-H122 VanDerWaalsContact CB-CD2 3.43Å; T120-H122 WeakPolarHBondContact CB-CD2 3.38Å; T120-H122 PolarHBondContact O-N 2.89Å; T120-H122 VanDerWaalsContact O-N 3.16Å; T120-H122 PolarHBondContact OG1-CD2 2.87Å; T120-H122 VanDerWaalsContact OG1-CD2 3.29Å; T120-H122 PolarHBondContact OG1-N 2.87Å
121	S	95.2	Very high	97.9	Very high	85 Å²	85	37.8 Å²	37.8	59%	0.594	20%	0.201	S	C	*	.			trans	58.8	14.1	-171.1	-53.9	0	0	0	0	114.4	D117	D117-S121 WeakPolarHBondContact O-CA 3.13Å; D117-S121 PolarHBondContact O-N 2.96Å
122	H	95.3	Very high	97.9	Very high	102 Å²	102	37.9 Å²	37.9	47%	0.472	20%	0.202	S	C	.	.			trans	-72.9	135.2	175.6	-72.2	-47.5	0	0	0	110.5	Y116 D117 T120	Y116-H122 CarbonylContact C-O 3.59Å; Y116-H122 WeakPolarHBondContact CA-O 3.07Å; Y116-H122 WeakPolarHBondContact CB-O 3.46Å; D117-H122 PolarHBondContact N-O 3.41Å; T120-H122 VanDerWaalsContact CB-CD2 3.43Å; T120-H122 WeakPolarHBondContact CB-CD2 3.38Å; T120-H122 PolarHBondContact O-N 2.89Å; T120-H122 VanDerWaalsContact O-N 3.16Å; T120-H122 PolarHBondContact OG1-CD2 2.87Å; T120-H122 VanDerWaalsContact OG1-CD2 3.29Å; T120-H122 PolarHBondContact OG1-N 2.87Å
123	P	97.6	Very high	97.9	Very high	35 Å²	35	39.2 Å²	39.2	23%	0.227	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	147.1	177.5	27.1	-33.3	0	0	0	110.5	W114 T115 P139	W114-P123 HydrophobicContact CE3-CB 4.35Å; W114-P123 HydrophobicContact CZ3-CB 4.19Å; T115-P123 WeakPolarHBondContact O-CA 3.41Å; P123-P139 HydrophobicContact CB-CG 4.01Å; P123-P139 HydrophobicContact CG-CG 3.78Å; P123-P139 WeakPolarHBondContact O-CD 3.35Å; P123-P139 WeakPolarHBondContact O-CG 3.22Å
124	L	98.6	Very high	97.9	Very high	14 Å²	14	38.8 Å²	38.8	7%	0.073	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	147.6	174.8	-65.8	176.7	0	0	0	108.8	T115 D117 I136 I145 I182	T115-L124 HydrophobicContact CG2-CB 3.72Å; T115-L124 HydrophobicContact CG2-CD1 4.32Å; T115-L124 PolarHBondContact N-O 3.45Å; T115-L124 PolarHBondContact O-N 3.39Å; T115-L124 VanDerWaalsContact O-O 3.09Å; D117-L124 HydrophobicContact CB-CD1 4.08Å; D117-L124 HydrophobicContact CB-CG 4.48Å; L124-I136 HydrophobicContact CB-CG2 4.23Å; L124-I136 HydrophobicContact CD1-CG2 4.17Å; L124-I136 HydrophobicContact CD2-CG2 4.3Å; L124-I136 HydrophobicContact CG-CG2 4.49Å; L124-I145 HydrophobicContact CD2-CD1 3.6Å; L124-I182 HydrophobicContact CD1-CD1 4.39Å
125	L	98.8	Very high	97.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	117	177.2	-175.4	63.4	0	0	0	109.6	A76 V83 L85 C112 W114 V127 I137	A76-L125 HydrophobicContact CB-CD1 4.22Å; A76-L125 HydrophobicContact CB-CD2 3.69Å; V83-L125 HydrophobicContact CG1-CD2 3.55Å; L85-L125 HydrophobicContact CD2-CD2 4.15Å; C112-L125 HydrophobicContact CB-CD1 3.96Å; C112-L125 HydrophobicContact CB-CG 4.48Å; W114-L125 HydrophobicContact CD2-CD1 3.77Å; W114-L125 HydrophobicContact CE3-CB 4.35Å; W114-L125 HydrophobicContact CE3-CD1 4.27Å; W114-L125 HydrophobicContact CG-CD1 4.01Å; W114-L125 HydrophobicContact CZ2-CD1 4.28Å; W114-L125 HydrophobicContact CZ2-CD2 4.49Å; W114-L125 HydrophobicContact CZ3-CB 4.36Å; L125-V127 HydrophobicContact CD2-CG1 4.24Å; L125-V127 HydrophobicContact CG-CG1 4.02Å; L125-I137 PolarHBondContact N-O 2.93Å; L125-I137 PolarHBondContact O-N 2.74Å
126	A	98.9	Very high	97.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	133.5	170.1	0	0	0	0	0	109.6	C112 A113 R135 I136 L158 F160 L168	C112-A126 CarbonylContact C-O 3.55Å; C112-A126 WeakPolarHBondContact CA-O 3.19Å; A113-A126 PolarHBondContact N-O 2.8Å; A113-A126 PolarHBondContact O-N 2.81Å; A126-R135 CarbonylContact C-O 3.59Å; A126-R135 WeakPolarHBondContact CA-O 3.39Å; A126-I136 HydrophobicContact CB-CD1 3.64Å; A126-L158 HydrophobicContact CB-CD1 3.99Å; A126-F160 HydrophobicContact CB-CE2 3.62Å; A126-F160 HydrophobicContact CB-CZ 3.82Å; A126-L168 HydrophobicContact CB-CD1 4.43Å; A126-L168 HydrophobicContact CB-CD2 4.01Å
127	V	98.9	Very high	97.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	148	175.6	-56.9	0	0	0	0	110.6	V78 V83 F109 T111 C112 L125 R135 I137	V78-V127 HydrophobicContact CG1-CG1 4.06Å; V83-V127 HydrophobicContact CG1-CG1 4.03Å; V83-V127 HydrophobicContact CG2-CB 4.21Å; V83-V127 HydrophobicContact CG2-CG1 3.77Å; V83-V127 HydrophobicContact CG2-CG2 4.06Å; F109-V127 HydrophobicContact CD1-CB 4.12Å; F109-V127 HydrophobicContact CD1-CG2 4Å; F109-V127 HydrophobicContact CE1-CB 4.25Å; F109-V127 HydrophobicContact CE1-CG2 3.62Å; F109-V127 HydrophobicContact CZ-CG2 3.9Å; T111-V127 WeakPolarHBondContact O-CA 3.29Å; C112-V127 HydrophobicContact CB-CG1 3.77Å; L125-V127 HydrophobicContact CD2-CG1 4.24Å; L125-V127 HydrophobicContact CG-CG1 4.02Å; V127-R135 HydrophobicContact CG2-CB 3.86Å; V127-R135 PolarHBondContact N-O 3.42Å; V127-R135 PolarHBondContact O-N 3Å; V127-I137 HydrophobicContact CG1-CD1 4.2Å; V127-I137 HydrophobicContact CG2-CD1 3.68Å; V127-I137 HydrophobicContact CG2-CG1 4.37Å
128	A	98.9	Very high	97.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	163.5	175.9	0	0	0	0	0	111.3	Y110 T111 I134 I155 L158	Y110-A128 PolarHBondContact N-O 3.11Å; T111-A128 HydrophobicContact CG2-CB 4.47Å; T111-A128 PolarHBondContact N-O 3.49Å; T111-A128 PolarHBondContact O-N 3.27Å; T111-A128 VanDerWaalsContact O-N 3.17Å; A128-I134 HydrophobicContact CB-CG1 4.37Å; A128-I155 HydrophobicContact CB-CB 3.78Å; A128-I155 HydrophobicContact CB-CD1 3.91Å; A128-I155 HydrophobicContact CB-CG1 4.47Å; A128-I155 HydrophobicContact CB-CG2 3.64Å; A128-L158 HydrophobicContact CB-CD1 3.74Å; A128-L158 HydrophobicContact CB-CD2 4.38Å; A128-L158 HydrophobicContact CB-CG 4.13Å
129	G	98.8	Very high	98	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	-133.6	178.9	0	0	0	0	0	113.1	N108 R131 G132 A154 I155	N108-G129 CarbonylContact O-C 3.53Å; N108-G129 VanDerWaalsContact O-CA 3.27Å; N108-G129 WeakPolarHBondContact O-CA 3.48Å; G129-R131 VanDerWaalsContact C-N 3.3Å; G129-R131 PolarHBondContact O-N 3.28Å; G129-G132 PolarHBondContact O-N 3.44Å; G129-A154 WeakPolarHBondContact O-CA 3.36Å; G129-I155 PolarHBondContact O-N 3.26Å
130	S	98.8	Very high	97.9	Very high	34 Å²	34	32.5 Å²	32.5	24%	0.238	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-37	-171.1	69.9	0	0	0	0	114.8	E107 N108 G132 A154	E107-S130 PolarHBondContact OE1-N 2.87Å; E107-S130 VanDerWaalsContact OE1-N 3.09Å; E107-S130 PolarHBondContact OE1-OG 2.82Å; N108-S130 PolarHBondContact N-OG 2.84Å; N108-S130 PolarHBondContact O-N 3.07Å; S130-G132 VanDerWaalsContact C-N 3.26Å; S130-G132 PolarHBondContact O-N 3.44Å; S130-A154 WeakPolarHBondContact O-CA 3.4Å; S130-A154 WeakPolarHBondContact O-CB 3.47Å
131	R	98.5	Very high	97.9	Very high	123 Å²	123	32.2 Å²	32.2	46%	0.464	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-12.1	-175.9	-66.5	-56.4	-32	-102.8	-2.2	114.7	D104 E107 G129 I133	D104-R131 WeakPolarHBondContact OD2-CD 3.44Å; D104-R131 IonicContact OD2-CZ 3.37Å; D104-R131 IonicContact OD2-NH1 3.52Å; D104-R131 PolarHBondContact OD2-NH1 3.2Å; E107-R131 HydrophobicContact CB-CG 4.12Å; E107-R131 VanDerWaalsContact CD-CG 3.47Å; E107-R131 HydrophobicContact CG-CG 4.37Å; E107-R131 PolarHBondContact OE1-N 2.94Å; E107-R131 WeakPolarHBondContact OE2-CB 3.34Å; E107-R131 VanDerWaalsContact OE2-CG 3.29Å; E107-R131 WeakPolarHBondContact OE2-CG 3.49Å; G129-R131 VanDerWaalsContact C-N 3.3Å; G129-R131 PolarHBondContact O-N 3.28Å; R131-I133 HydrophobicContact CB-CD1 4.26Å; R131-I133 HydrophobicContact CB-CG1 4.12Å; R131-I133 PolarHBondContact O-N 2.88Å
132	G	98.4	Very high	97.8	Very high	2 Å²	2	29 Å²	29	2%	0.021	15%	0.146	C	C	.	.			trans	71.4	20	-175.4	0	0	0	0	0	113.8	G129 S130 N153	G129-G132 PolarHBondContact O-N 3.44Å; S130-G132 VanDerWaalsContact C-N 3.26Å; S130-G132 PolarHBondContact O-N 3.44Å; G132-N153 VanDerWaalsContact CA-O 3.31Å; G132-N153 WeakPolarHBondContact CA-O 3.5Å
133	I	98.8	Very high	97.9	Very high	29 Å²	29	30.1 Å²	30.1	15%	0.149	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129	178.3	-54.1	178.6	0	0	0	108.5	R131 R135 H147 V149	R131-I133 HydrophobicContact CB-CD1 4.26Å; R131-I133 HydrophobicContact CB-CG1 4.12Å; R131-I133 PolarHBondContact O-N 2.88Å; I133-R135 HydrophobicContact CG2-CG 4.23Å; I133-H147 HydrophobicContact CG2-CB 4.03Å; I133-V149 HydrophobicContact CD1-CG2 4.47Å; I133-V149 HydrophobicContact CG1-CG2 4.16Å; I133-V149 HydrophobicContact CG2-CG2 4.25Å
134	I	98.9	Very high	97.9	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	130.6	169	-57	174.6	0	0	0	107.7	A128 I136 H147 Y148 I155 L158 L168 W180	A128-I134 HydrophobicContact CB-CG1 4.37Å; I134-I136 HydrophobicContact CG2-CD1 4.09Å; I134-H147 CarbonylContact O-C 3.53Å; I134-H147 WeakPolarHBondContact O-CA 3.4Å; I134-H147 WeakPolarHBondContact O-CB 3.25Å; I134-Y148 HydrophobicContact CB-CD2 4.06Å; I134-Y148 HydrophobicContact CG2-CD2 3.97Å; I134-Y148 PolarHBondContact N-O 2.93Å; I134-Y148 PolarHBondContact O-N 2.7Å; I134-I155 HydrophobicContact CD1-CD1 4.3Å; I134-I155 HydrophobicContact CG1-CD1 3.53Å; I134-L158 HydrophobicContact CD1-CD2 4.06Å; I134-L158 HydrophobicContact CG1-CD2 4.17Å; I134-L168 HydrophobicContact CD1-CD2 4.15Å; I134-L168 HydrophobicContact CG2-CD2 3.68Å; I134-W180 HydrophobicContact CD1-CG 4.41Å; I134-W180 HydrophobicContact CD1-CZ2 4.47Å
135	R	98.9	Very high	97.9	Very high	35 Å²	35	33.8 Å²	33.8	13%	0.132	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.8	174.4	-63.9	169.6	-173.5	-102.2	15.6	109.3	D102 A126 V127 I133 H147	D102-R135 VanDerWaalsContact CG-NH2 3.31Å; D102-R135 IonicContact OD1-CZ 2.69Å; D102-R135 IonicContact OD1-NE 3.01Å; D102-R135 IonicContact OD1-NH1 3.39Å; D102-R135 PolarHBondContact OD1-NH1 2.94Å; D102-R135 IonicContact OD1-NH2 3.54Å; D102-R135 PolarHBondContact OD1-NH2 3.17Å; D102-R135 WeakPolarHBondContact OD2-CD 3.32Å; D102-R135 IonicContact OD2-CZ 3.5Å; D102-R135 IonicContact OD2-NE 2.88Å; D102-R135 PolarHBondContact OD2-NE 3.44Å; D102-R135 IonicContact OD2-NH1 3.39Å; D102-R135 PolarHBondContact OD2-NH1 3.4Å; D102-R135 VanDerWaalsContact OD2-NH1 3.11Å; D102-R135 IonicContact OD2-NH2 3.12Å; D102-R135 PolarHBondContact OD2-NH2 3.27Å; A126-R135 CarbonylContact C-O 3.59Å; A126-R135 WeakPolarHBondContact CA-O 3.39Å; V127-R135 HydrophobicContact CG2-CB 3.86Å; V127-R135 PolarHBondContact N-O 3.42Å; V127-R135 PolarHBondContact O-N 3Å; I133-R135 HydrophobicContact CG2-CG 4.23Å; R135-H147 HydrophobicContact CG-CB 4.48Å
136	I	98.8	Very high	97.8	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.01	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	115.7	173.3	-51.9	-57	0	0	0	107.4	L124 A126 I134 C144 I145 K146 Y148 L168 I182	L124-I136 HydrophobicContact CB-CG2 4.23Å; L124-I136 HydrophobicContact CD1-CG2 4.17Å; L124-I136 HydrophobicContact CD2-CG2 4.3Å; L124-I136 HydrophobicContact CG-CG2 4.49Å; A126-I136 HydrophobicContact CB-CD1 3.64Å; I134-I136 HydrophobicContact CG2-CD1 4.09Å; I136-C144 CarbonylContact O-C 3.55Å; I136-C144 WeakPolarHBondContact O-CA 3.38Å; I136-I145 HydrophobicContact CB-CG1 4.11Å; I136-I145 HydrophobicContact CG2-CD1 3.91Å; I136-I145 HydrophobicContact CG2-CG1 3.86Å; I136-I145 VanDerWaalsContact O-CG1 3.23Å; I136-I145 WeakPolarHBondContact O-CG1 3.3Å; I136-I145 PolarHBondContact O-N 2.99Å; I136-K146 HydrophobicContact CB-CB 4.15Å; I136-K146 HydrophobicContact CG1-CB 4.17Å; I136-K146 PolarHBondContact N-O 3.5Å; I136-Y148 HydrophobicContact CD1-CE2 4.03Å; I136-Y148 HydrophobicContact CG1-CD2 4.44Å; I136-Y148 HydrophobicContact CG1-CE2 3.67Å; I136-L168 HydrophobicContact CD1-CD2 4.25Å; I136-I182 HydrophobicContact CD1-CG2 4.48Å
137	I	98.6	Very high	97.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.1	-177.1	-60.9	174.2	0	0	0	108.9	V83 Y100 L125 V127 P139 M142 Q143	V83-I137 HydrophobicContact CB-CD1 4.3Å; V83-I137 HydrophobicContact CG1-CD1 4.42Å; V83-I137 HydrophobicContact CG2-CD1 3.93Å; Y100-I137 HydrophobicContact CD1-CD1 3.67Å; Y100-I137 HydrophobicContact CE1-CD1 3.96Å; Y100-I137 HydrophobicContact CG-CD1 3.97Å; L125-I137 PolarHBondContact N-O 2.93Å; L125-I137 PolarHBondContact O-N 2.74Å; V127-I137 HydrophobicContact CG1-CD1 4.2Å; V127-I137 HydrophobicContact CG2-CD1 3.68Å; V127-I137 HydrophobicContact CG2-CG1 4.37Å; I137-P139 WeakPolarHBondContact O-CD 3.28Å; I137-M142 HydrophobicContact CG2-SD 3.93Å; I137-Q143 WeakPolarHBondContact CA-O 3.43Å
138	N	97.8	Very high	97.8	Very high	38 Å²	38	43 Å²	43	20%	0.203	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	113.8	163.1	-179.5	-30.3	0	0	0	108.4	I140 T141 M142 Q143 I145	N138-I140 PolarHBondContact O-N 3.26Å; N138-I140 WeakPolarHBondContact OD1-CB 3.47Å; N138-I140 PolarHBondContact OD1-N 3.25Å; N138-T141 WeakPolarHBondContact CB-OG1 3.3Å; N138-T141 PolarHBondContact O-N 2.88Å; N138-T141 PolarHBondContact OD1-N 3.19Å; N138-M142 VanDerWaalsContact O-CA 3.3Å; N138-M142 WeakPolarHBondContact O-CA 3.46Å; N138-M142 PolarHBondContact O-N 3.36Å; N138-Q143 PolarHBondContact N-O 3.22Å; N138-I145 HydrophobicContact CB-CG2 3.92Å
139	P	96.7	Very high	97.7	Very high	12 Å²	12	47.5 Å²	47.5	8%	0.078	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-9.5	-173.3	32.5	-38.1	0	0	0	114	L85 W114 P123 I137 M142	L85-P139 HydrophobicContact CD1-CB 3.7Å; W114-P139 HydrophobicContact CH2-CB 3.98Å; W114-P139 HydrophobicContact CZ3-CB 3.81Å; W114-P139 HydrophobicContact CZ3-CG 3.96Å; P123-P139 HydrophobicContact CB-CG 4.01Å; P123-P139 HydrophobicContact CG-CG 3.78Å; P123-P139 WeakPolarHBondContact O-CD 3.35Å; P123-P139 WeakPolarHBondContact O-CG 3.22Å; I137-P139 WeakPolarHBondContact O-CD 3.28Å; P139-M142 HydrophobicContact CB-CE 4.3Å; P139-M142 VanDerWaalsContact O-CE 3.28Å; P139-M142 WeakPolarHBondContact O-CE 3.5Å
140	I	94.4	Very high	97.7	Very high	98 Å²	98	49.2 Å²	49.2	50%	0.503	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-36.9	177.9	-57.3	171.9	0	0	0	110.5	Q98 N138	Q98-I140 PolarHBondContact NE2-O 3.09Å; Q98-I140 PolarHBondContact OE1-O 3.09Å; Q98-I140 VanDerWaalsContact OE1-O 3.07Å; N138-I140 PolarHBondContact O-N 3.26Å; N138-I140 WeakPolarHBondContact OD1-CB 3.47Å; N138-I140 PolarHBondContact OD1-N 3.25Å
141	T	95.7	Very high	97.6	Very high	66 Å²	66	48.3 Å²	48.3	41%	0.405	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-9.3	-177.9	61.5	0	0	0	0	113.5	N138 Q143	N138-T141 WeakPolarHBondContact CB-OG1 3.3Å; N138-T141 PolarHBondContact O-N 2.88Å; N138-T141 PolarHBondContact OD1-N 3.19Å; T141-Q143 PolarHBondContact O-N 2.84Å; T141-Q143 PolarHBondContact OG1-N 3.44Å
142	M	94.6	Very high	97.6	Very high	19 Å²	19	45.9 Å²	45.9	9%	0.094	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	38.2	-166.9	-80.3	-53.6	133.9	0	0	113.4	L85 Q98 Y100 I137 N138 P139	L85-M142 HydrophobicContact CB-CE 4.25Å; L85-M142 HydrophobicContact CD1-CE 3.13Å; L85-M142 HydrophobicContact CD2-CE 4.42Å; L85-M142 HydrophobicContact CG-CE 3.33Å; Q98-M142 HydrophobicContact CB-CE 4.07Å; Q98-M142 HydrophobicContact CB-CG 3.48Å; Q98-M142 VanDerWaalsContact CB-CG 3.48Å; Q98-M142 HydrophobicContact CG-CG 4.37Å; Y100-M142 VanDerWaalsContact CD2-O 3.3Å; Y100-M142 WeakPolarHBondContact CD2-O 3.48Å; I137-M142 HydrophobicContact CG2-SD 3.93Å; N138-M142 VanDerWaalsContact O-CA 3.3Å; N138-M142 WeakPolarHBondContact O-CA 3.46Å; N138-M142 PolarHBondContact O-N 3.36Å; P139-M142 HydrophobicContact CB-CE 4.3Å; P139-M142 VanDerWaalsContact O-CE 3.28Å; P139-M142 WeakPolarHBondContact O-CE 3.5Å
143	Q	96.3	Very high	97.6	Very high	124 Å²	124	49.5 Å²	49.5	58%	0.579	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.8	175.7	-68.1	179.7	-7.9	0	0	110.8	I137 N138 T141 I145	I137-Q143 WeakPolarHBondContact CA-O 3.43Å; N138-Q143 PolarHBondContact N-O 3.22Å; T141-Q143 PolarHBondContact O-N 2.84Å; T141-Q143 PolarHBondContact OG1-N 3.44Å; Q143-I145 PolarHBondContact O-N 3.24Å
144	C	97.8	Very high	97.6	Very high	45 Å²	45	48.2 Å²	48.2	30%	0.304	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	107.5	168.3	179.9	0	0	0	0	108.8	Y100 I136 K146	Y100-C144 HydrophobicContact CE2-CB 4.39Å; I136-C144 CarbonylContact O-C 3.55Å; I136-C144 WeakPolarHBondContact O-CA 3.38Å; C144-K146 PolarHBondContact SG-O 3.48Å; C144-K146 VanDerWaalsContact SG-O 3.38Å
145	I	97.7	Very high	97.6	Very high	81 Å²	81	48.2 Å²	48.2	42%	0.415	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-28.9	-176.4	57.3	166.1	0	0	0	112.9	L124 I136 N138 Q143	L124-I145 HydrophobicContact CD2-CD1 3.6Å; I136-I145 HydrophobicContact CB-CG1 4.11Å; I136-I145 HydrophobicContact CG2-CD1 3.91Å; I136-I145 HydrophobicContact CG2-CG1 3.86Å; I136-I145 VanDerWaalsContact O-CG1 3.23Å; I136-I145 WeakPolarHBondContact O-CG1 3.3Å; I136-I145 PolarHBondContact O-N 2.99Å; N138-I145 HydrophobicContact CB-CG2 3.92Å; Q143-I145 PolarHBondContact O-N 3.24Å
146	K	97.3	Very high	97.6	Very high	63 Å²	63	46.5 Å²	46.5	27%	0.274	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	155.5	179.6	-59.9	-175	174.9	-163.6	0	109.9	I136 C144 Y148 I182 D185	I136-K146 HydrophobicContact CB-CB 4.15Å; I136-K146 HydrophobicContact CG1-CB 4.17Å; I136-K146 PolarHBondContact N-O 3.5Å; C144-K146 PolarHBondContact SG-O 3.48Å; C144-K146 VanDerWaalsContact SG-O 3.38Å; K146-Y148 WeakPolarHBondContact CD-OH 3.23Å; K146-I182 PolarHBondContact NZ-O 2.93Å; K146-D185 VanDerWaalsContact CD-OD1 3.29Å; K146-D185 WeakPolarHBondContact CD-OD1 3.32Å; K146-D185 WeakPolarHBondContact CE-OD1 3.42Å; K146-D185 VanDerWaalsContact NZ-CG 3.34Å; K146-D185 IonicContact NZ-OD1 3.6Å; K146-D185 PolarHBondContact NZ-OD1 3.11Å; K146-D185 IonicContact NZ-OD2 2.66Å; K146-D185 PolarHBondContact NZ-OD2 3.44Å
147	H	98.6	Very high	97.6	Very high	117 Å²	117	46.6 Å²	46.6	54%	0.542	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	150.6	169.1	66.2	-88	0	0	0	111	I133 I134 R135	I133-H147 HydrophobicContact CG2-CB 4.03Å; I134-H147 CarbonylContact O-C 3.53Å; I134-H147 WeakPolarHBondContact O-CA 3.4Å; I134-H147 WeakPolarHBondContact O-CB 3.25Å; R135-H147 HydrophobicContact CG-CB 4.48Å
148	Y	98.8	Very high	97.6	Very high	14 Å²	14	46.6 Å²	46.6	6%	0.055	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.4	176.6	-51.2	-72.5	0	0	0	110.1	I134 I136 K146 W180 I182 D185	I134-Y148 HydrophobicContact CB-CD2 4.06Å; I134-Y148 HydrophobicContact CG2-CD2 3.97Å; I134-Y148 PolarHBondContact N-O 2.93Å; I134-Y148 PolarHBondContact O-N 2.7Å; I136-Y148 HydrophobicContact CD1-CE2 4.03Å; I136-Y148 HydrophobicContact CG1-CD2 4.44Å; I136-Y148 HydrophobicContact CG1-CE2 3.67Å; K146-Y148 WeakPolarHBondContact CD-OH 3.23Å; Y148-W180 HydrophobicContact CD1-CE3 4.4Å; Y148-W180 HydrophobicContact CG-CE3 4.32Å; Y148-I182 HydrophobicContact CE2-CB 4.18Å; Y148-I182 HydrophobicContact CE2-CG2 3.62Å; Y148-I182 WeakPolarHBondContact OH-CA 3.1Å; Y148-I182 VanDerWaalsContact OH-CB 3.29Å; Y148-I182 WeakPolarHBondContact OH-CB 3.49Å; Y148-I182 PolarHBondContact OH-O 2.94Å; Y148-D185 HydrophobicContact CE1-CB 4.04Å; Y148-D185 PolarHBondContact OH-OD1 2.91Å
149	V	98.6	Very high	97.7	Very high	95 Å²	95	45.8 Å²	45.8	58%	0.576	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	137.8	171.9	-174.8	0	0	0	0	108.1	I133	I133-V149 HydrophobicContact CD1-CG2 4.47Å; I133-V149 HydrophobicContact CG1-CG2 4.16Å; I133-V149 HydrophobicContact CG2-CG2 4.25Å
150	G	96.9	Very high	97.8	Very high	35 Å²	35	46.5 Å²	46.5	36%	0.361	27%	0.266	S	S	.	.			trans	171.3	-20.5	173.4	0	0	0	0	0	114.2	R178	G150-R178 PolarHBondContact O-NE 2.83Å; G150-R178 PolarHBondContact O-NH2 3.34Å
151	H	98.3	Very high	98	Very high	15 Å²	15	43 Å²	43	7%	0.069	25%	0.247	C	C	.	.			trans	-68.7	141.4	163.8	-80.5	-78.6	0	0	0	110.4	N153 I155 S170 S172 D174 A176 R178	H151-N153 VanDerWaalsContact C-N 3.3Å; H151-I155 HydrophobicContact CB-CG1 4.27Å; H151-S170 PolarHBondContact CD2-OG 3.19Å; H151-S170 PolarHBondContact NE2-OG 2.82Å; H151-S172 WeakPolarHBondContact CE1-CB 3.28Å; H151-S172 WeakPolarHBondContact ND1-CB 3.32Å; H151-S172 PolarHBondContact ND1-OG 3.21Å; H151-D174 VanDerWaalsContact CA-OD2 3.3Å; H151-D174 WeakPolarHBondContact CA-OD2 3.48Å; H151-D174 IonicContact CE1-OD1 3.22Å; H151-D174 IonicContact CG-OD2 3.66Å; H151-D174 VanDerWaalsContact ND1-CG 3.34Å; H151-D174 IonicContact ND1-OD1 2.69Å; H151-D174 PolarHBondContact ND1-OD1 2.88Å; H151-D174 IonicContact ND1-OD2 3.25Å; H151-D174 PolarHBondContact ND1-OD2 2.94Å; H151-D174 VanDerWaalsContact ND1-OD2 3.13Å; H151-A176 PolarHBondContact CE1-O 3.34Å; H151-R178 PolarHBondContact CE1-NH1 3.46Å; H151-R178 PolarHBondContact ND1-NH1 3.19Å
152	G	97.4	Very high	98.1	Very high	72 Å²	72	43.1 Å²	43.1	74%	0.742	25%	0.25	S	C	*	.	S	Bend	trans	-84.2	-4.1	177.6	0	0	0	0	0	114	D174	G152-D174 PolarHBondContact N-OD2 3.47Å
153	N	98.6	Very high	98.3	Very high	78 Å²	78	49.5 Å²	49.5	42%	0.417	27%	0.273	S	S	.	.	S	Bend	trans	-157.3	-179.8	-174.6	-154.8	-20.1	0	0	0	110	G132 H151 S172 K173 D174	G132-N153 VanDerWaalsContact CA-O 3.31Å; G132-N153 WeakPolarHBondContact CA-O 3.5Å; H151-N153 VanDerWaalsContact C-N 3.3Å; N153-S172 PolarHBondContact O-OG 2.88Å; N153-K173 HydrophobicContact CB-CB 3.82Å; N153-D174 HydrophobicContact CB-CB 4.06Å
154	A	98.8	Very high	98.4	Very high	3 Å²	3	44.9 Å²	44.9	3%	0.025	25%	0.252	C	S	.	.			trans	-54.8	150.7	-175.8	0	0	0	0	0	113.6	Y110 G129 S130 S172 K173	Y110-A154 HydrophobicContact CE2-CB 4Å; G129-A154 WeakPolarHBondContact O-CA 3.36Å; S130-A154 WeakPolarHBondContact O-CA 3.4Å; S130-A154 WeakPolarHBondContact O-CB 3.47Å; A154-S172 VanDerWaalsContact O-CA 3.23Å; A154-S172 WeakPolarHBondContact O-CA 3.31Å; A154-S172 VanDerWaalsContact O-CB 3.25Å; A154-S172 WeakPolarHBondContact O-CB 3.49Å; A154-S172 PolarHBondContact O-OG 3.45Å; A154-K173 HydrophobicContact CB-CD 3.7Å; A154-K173 HydrophobicContact CB-CG 4.02Å; A154-K173 PolarHBondContact O-N 2.91Å
155	I	98.9	Very high	98.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.5	176.4	-67.4	164.4	0	0	0	108.6	Y110 A128 G129 I134 H151 L158 V171	Y110-I155 WeakPolarHBondContact CD2-O 3.36Å; A128-I155 HydrophobicContact CB-CB 3.78Å; A128-I155 HydrophobicContact CB-CD1 3.91Å; A128-I155 HydrophobicContact CB-CG1 4.47Å; A128-I155 HydrophobicContact CB-CG2 3.64Å; G129-I155 PolarHBondContact O-N 3.26Å; I134-I155 HydrophobicContact CD1-CD1 4.3Å; I134-I155 HydrophobicContact CG1-CD1 3.53Å; H151-I155 HydrophobicContact CB-CG1 4.27Å; I155-L158 HydrophobicContact CG2-CD2 4.01Å; I155-L158 HydrophobicContact CG2-CG 4.29Å; I155-V171 CarbonylContact C-O 3.46Å; I155-V171 WeakPolarHBondContact CA-O 3.34Å
156	N	98.9	Very high	98.5	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-30.8	-174.2	-68.6	-33.4	0	0	0	112.8	V171 V201 Y327	N156-V171 HydrophobicContact CB-CG2 4.37Å; N156-V171 PolarHBondContact N-O 3.48Å; N156-V201 PolarHBondContact ND2-O 2.92Å; N156-Y327 HydrophobicContact CB-CE2 4.45Å; N156-Y327 PolarHBondContact O-OH 3.43Å
157	E	98.9	Very high	98.5	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.014	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	145.7	-178.1	-167.4	73.1	-135.3	0	0	110.6	T111 K159 V171 R329	T111-E157 PolarHBondContact OG1-OE1 3.42Å; E157-K159 IonicContact OE1-NZ 3.04Å; E157-K159 PolarHBondContact OE1-NZ 2.81Å; E157-V171 HydrophobicContact CB-CG2 3.6Å; E157-V171 PolarHBondContact O-N 2.62Å; E157-V171 VanDerWaalsContact O-N 3.09Å; E157-R329 IonicContact OE1-NH1 3.62Å; E157-R329 WeakPolarHBondContact OE2-CD 3.43Å; E157-R329 IonicContact OE2-CZ 3.22Å; E157-R329 IonicContact OE2-NE 3.17Å; E157-R329 IonicContact OE2-NH1 2.8Å; E157-R329 PolarHBondContact OE2-NH1 3.42Å
158	L	98.9	Very high	98.6	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139	173.8	-71.1	177.6	0	0	0	109.8	T111 A113 A126 A128 I134 I155 L168 L169	T111-L158 HydrophobicContact CG2-CB 3.99Å; T111-L158 HydrophobicContact CG2-CD1 4.08Å; T111-L158 HydrophobicContact CG2-CG 3.68Å; A113-L158 HydrophobicContact CB-CB 4.06Å; A126-L158 HydrophobicContact CB-CD1 3.99Å; A128-L158 HydrophobicContact CB-CD1 3.74Å; A128-L158 HydrophobicContact CB-CD2 4.38Å; A128-L158 HydrophobicContact CB-CG 4.13Å; I134-L158 HydrophobicContact CD1-CD2 4.06Å; I134-L158 HydrophobicContact CG1-CD2 4.17Å; I155-L158 HydrophobicContact CG2-CD2 4.01Å; I155-L158 HydrophobicContact CG2-CG 4.29Å; L158-L168 HydrophobicContact CB-CD1 4.25Å; L158-L168 HydrophobicContact CD2-CD1 4.14Å; L158-L168 HydrophobicContact CD2-CD2 4.43Å; L158-L168 HydrophobicContact CD2-CG 4.39Å; L158-L169 WeakPolarHBondContact CA-O 3.49Å
159	K	98.9	Very high	98.6	Very high	21 Å²	21	31 Å²	31	9%	0.091	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	129.6	173.7	-64.3	-65.3	-179.9	-133.9	0	110.8	E157 L169 A204 Y206 R275	E157-K159 IonicContact OE1-NZ 3.04Å; E157-K159 PolarHBondContact OE1-NZ 2.81Å; K159-L169 HydrophobicContact CB-CB 4.39Å; K159-L169 PolarHBondContact N-O 2.87Å; K159-L169 WeakPolarHBondContact O-CB 3.46Å; K159-L169 PolarHBondContact O-N 2.89Å; K159-A204 WeakPolarHBondContact CE-O 3.18Å; K159-A204 WeakPolarHBondContact CG-O 3.41Å; K159-Y206 HydrophobicContact CB-CD2 3.98Å; K159-Y206 HydrophobicContact CB-CE2 3.99Å; K159-R275 VanDerWaalsContact CE-NH1 3.25Å; K159-R275 VanDerWaalsContact NZ-NH2 3.12Å
160	F	98.9	Very high	98.6	Very high	27 Å²	27	26.4 Å²	26.4	12%	0.118	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	146.2	164.8	-79.4	-79.4	0	0	0	110.6	A113 W114 T115 A126 P165 L167 L168 I182	A113-F160 HydrophobicContact CB-CD2 3.76Å; A113-F160 HydrophobicContact CB-CE2 4.07Å; A113-F160 WeakPolarHBondContact O-CE2 3.47Å; W114-F160 WeakPolarHBondContact O-CD2 3.36Å; T115-F160 HydrophobicContact CG2-CD1 4.06Å; T115-F160 HydrophobicContact CG2-CD2 4.26Å; T115-F160 HydrophobicContact CG2-CE1 3.46Å; T115-F160 VanDerWaalsContact CG2-CE1 3.46Å; T115-F160 HydrophobicContact CG2-CE2 3.68Å; T115-F160 HydrophobicContact CG2-CG 4.42Å; T115-F160 HydrophobicContact CG2-CZ 3.24Å; A126-F160 HydrophobicContact CB-CE2 3.62Å; A126-F160 HydrophobicContact CB-CZ 3.82Å; F160-P165 VanDerWaalsContact CD1-O 3.23Å; F160-P165 WeakPolarHBondContact CD1-O 3.24Å; F160-P165 WeakPolarHBondContact CE1-O 3.12Å; F160-L167 WeakPolarHBondContact CA-O 3.29Å; F160-L168 HydrophobicContact CD1-CB 4.12Å; F160-L168 HydrophobicContact CD1-CD1 4.19Å; F160-L168 HydrophobicContact CD2-CD1 4.04Å; F160-L168 HydrophobicContact CE1-CB 3.74Å; F160-L168 HydrophobicContact CE1-CD1 3.99Å; F160-L168 HydrophobicContact CE1-CD2 4.47Å; F160-L168 HydrophobicContact CE1-CG 4.28Å; F160-L168 HydrophobicContact CE2-CD1 3.84Å; F160-L168 HydrophobicContact CG-CD1 4.21Å; F160-L168 HydrophobicContact CZ-CB 4.23Å; F160-L168 HydrophobicContact CZ-CD1 3.81Å; F160-L168 HydrophobicContact CZ-CD2 4.15Å; F160-L168 HydrophobicContact CZ-CG 4.29Å; F160-I182 HydrophobicContact CE1-CD1 3.82Å; F160-I182 HydrophobicContact CE1-CG1 4.38Å; F160-I182 HydrophobicContact CZ-CD1 4.14Å
161	H	98.8	Very high	98.7	Very high	23 Å²	23	24.9 Å²	24.9	11%	0.106	14%	0.14	C	C	.	.			trans	-65.1	136.7	173.7	-179.4	-88.8	0	0	0	110.2	R163 D164 L167 Y206 G210	H161-R163 VanDerWaalsContact C-N 3.26Å; H161-R163 PolarHBondContact ND1-N 2.76Å; H161-R163 PolarHBondContact O-N 2.97Å; H161-D164 HydrophobicContact CB-CB 4.43Å; H161-D164 PolarHBondContact ND1-N 3.17Å; H161-D164 PolarHBondContact O-N 2.65Å; H161-L167 HydrophobicContact CB-CB 3.64Å; H161-L167 PolarHBondContact N-O 2.95Å; H161-Y206 HydrophobicContact CB-CE1 4.43Å; H161-Y206 HydrophobicContact CB-CE2 4.3Å; H161-Y206 AromaticContact CD2-CE1 3.77Å; H161-G210 WeakPolarHBondContact NE2-CA 3.15Å; H161-G210 PolarHBondContact NE2-O 3.38Å
162	P	98.1	Very high	98.7	Very high	70 Å²	70	24.1 Å²	24.1	46%	0.455	14%	0.137	S	C	.	.	S	Bend	trans	-68.6	-20.8	-169.7	26.6	-36.5	0	0	0	114.5	L208	P162-L208 WeakPolarHBondContact CG-O 3.39Å
163	R	98.1	Very high	98.8	Very high	152 Å²	152	22.3 Å²	22.3	57%	0.574	11%	0.108	S	C	*	.	S	Bend	trans	-113.2	-11.2	179.6	-59.5	-165.1	-71.2	-170.9	-9.3	115	H161 L209 E211	H161-R163 VanDerWaalsContact C-N 3.26Å; H161-R163 PolarHBondContact ND1-N 2.76Å; H161-R163 PolarHBondContact O-N 2.97Å; R163-L209 PolarHBondContact NE-O 2.67Å; R163-L209 PolarHBondContact NH2-O 2.84Å; R163-E211 IonicContact NH2-OE1 2.72Å
164	D	98.4	Very high	98.8	Very high	27 Å²	27	20.3 Å²	20.3	14%	0.144	10%	0.098	C	C	.	.			trans	-131	105.4	-176.2	-173.7	-23.5	0	0	0	108	H161 N166 L167 Y240	H161-D164 HydrophobicContact CB-CB 4.43Å; H161-D164 PolarHBondContact ND1-N 3.17Å; H161-D164 PolarHBondContact O-N 2.65Å; D164-N166 PolarHBondContact O-N 3.17Å; D164-N166 VanDerWaalsContact O-N 3.12Å; D164-N166 WeakPolarHBondContact OD1-CB 3.45Å; D164-N166 PolarHBondContact OD1-N 3.41Å; D164-N166 PolarHBondContact OD1-ND2 2.95Å; D164-L167 HydrophobicContact CB-CB 4.36Å; D164-L167 HydrophobicContact CB-CD1 4.04Å; D164-L167 HydrophobicContact CB-CG 4.07Å; D164-L167 PolarHBondContact O-N 2.89Å; D164-Y240 PolarHBondContact OD1-OH 2.78Å; D164-Y240 PolarHBondContact OD2-OH 2.88Å
165	P	98.6	Very high	98.8	Very high	14 Å²	14	24 Å²	24	9%	0.091	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-14	-174.5	30.8	-37.5	0	0	0	113	T115 Y116 F160	T115-P165 VanDerWaalsContact OG1-CA 3.3Å; T115-P165 WeakPolarHBondContact OG1-CA 3.36Å; T115-P165 VanDerWaalsContact OG1-CB 3.22Å; T115-P165 WeakPolarHBondContact OG1-CB 3.49Å; T115-P165 PolarHBondContact OG1-O 3.06Å; Y116-P165 HydrophobicContact CD1-CB 4.17Å; Y116-P165 HydrophobicContact CD2-CB 4.2Å; Y116-P165 HydrophobicContact CD2-CG 4.29Å; Y116-P165 HydrophobicContact CE1-CB 3.89Å; Y116-P165 HydrophobicContact CE1-CG 4.44Å; Y116-P165 HydrophobicContact CE2-CB 3.92Å; Y116-P165 HydrophobicContact CE2-CG 3.71Å; Y116-P165 HydrophobicContact CG-CB 4.32Å; Y116-P165 WeakPolarHBondContact O-CB 3.4Å; F160-P165 VanDerWaalsContact CD1-O 3.23Å; F160-P165 WeakPolarHBondContact CD1-O 3.24Å; F160-P165 WeakPolarHBondContact CE1-O 3.12Å
166	N	98.8	Very high	98.8	Very high	10 Å²	10	24.4 Å²	24.4	5%	0.053	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-14	-177	-47.2	-62.4	0	0	0	112.7	D164 L168 N181 I182 Q183 Y240	D164-N166 PolarHBondContact O-N 3.17Å; D164-N166 VanDerWaalsContact O-N 3.12Å; D164-N166 WeakPolarHBondContact OD1-CB 3.45Å; D164-N166 PolarHBondContact OD1-N 3.41Å; D164-N166 PolarHBondContact OD1-ND2 2.95Å; N166-L168 PolarHBondContact O-N 2.85Å; N166-N181 CarbonylContact O-C 3.46Å; N166-N181 WeakPolarHBondContact O-CA 2.96Å; N166-I182 HydrophobicContact CB-CG1 4.2Å; N166-I182 WeakPolarHBondContact O-CG1 3.45Å; N166-I182 PolarHBondContact O-N 3.3Å; N166-Q183 HydrophobicContact CB-CB 3.96Å; N166-Q183 PolarHBondContact ND2-OE1 2.99Å; N166-Y240 HydrophobicContact CB-CE1 4.49Å; N166-Y240 WeakPolarHBondContact CB-OH 3.34Å; N166-Y240 PolarHBondContact ND2-OH 2.9Å
167	L	98.9	Very high	98.8	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.016	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	109.4	180	-67.9	-175.7	0	0	0	110.6	F160 H161 D164 L179 W180 N181 V188 I236	F160-L167 WeakPolarHBondContact CA-O 3.29Å; H161-L167 HydrophobicContact CB-CB 3.64Å; H161-L167 PolarHBondContact N-O 2.95Å; D164-L167 HydrophobicContact CB-CB 4.36Å; D164-L167 HydrophobicContact CB-CD1 4.04Å; D164-L167 HydrophobicContact CB-CG 4.07Å; D164-L167 PolarHBondContact O-N 2.89Å; L167-L179 HydrophobicContact CB-CD1 4.16Å; L167-W180 WeakPolarHBondContact CA-O 3.42Å; L167-N181 HydrophobicContact CD2-CB 4.25Å; L167-V188 HydrophobicContact CD2-CG2 4.38Å; L167-I236 HydrophobicContact CD1-CD1 3.96Å; L167-I236 HydrophobicContact CD1-CG1 4.27Å; L167-I236 HydrophobicContact CD1-CG2 4.09Å; L167-I236 HydrophobicContact CD2-CG2 4.37Å
168	L	98.9	Very high	98.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.3	179.1	177.8	59	0	0	0	110.1	A126 I134 I136 L158 F160 N166 L179 W180 I182	A126-L168 HydrophobicContact CB-CD1 4.43Å; A126-L168 HydrophobicContact CB-CD2 4.01Å; I134-L168 HydrophobicContact CD1-CD2 4.15Å; I134-L168 HydrophobicContact CG2-CD2 3.68Å; I136-L168 HydrophobicContact CD1-CD2 4.25Å; L158-L168 HydrophobicContact CB-CD1 4.25Å; L158-L168 HydrophobicContact CD2-CD1 4.14Å; L158-L168 HydrophobicContact CD2-CD2 4.43Å; L158-L168 HydrophobicContact CD2-CG 4.39Å; F160-L168 HydrophobicContact CD1-CB 4.12Å; F160-L168 HydrophobicContact CD1-CD1 4.19Å; F160-L168 HydrophobicContact CD2-CD1 4.04Å; F160-L168 HydrophobicContact CE1-CB 3.74Å; F160-L168 HydrophobicContact CE1-CD1 3.99Å; F160-L168 HydrophobicContact CE1-CD2 4.47Å; F160-L168 HydrophobicContact CE1-CG 4.28Å; F160-L168 HydrophobicContact CE2-CD1 3.84Å; F160-L168 HydrophobicContact CG-CD1 4.21Å; F160-L168 HydrophobicContact CZ-CB 4.23Å; F160-L168 HydrophobicContact CZ-CD1 3.81Å; F160-L168 HydrophobicContact CZ-CD2 4.15Å; F160-L168 HydrophobicContact CZ-CG 4.29Å; N166-L168 PolarHBondContact O-N 2.85Å; L168-L179 WeakPolarHBondContact O-CA 3.41Å; L168-W180 HydrophobicContact CB-CB 4.35Å; L168-W180 PolarHBondContact N-O 3.32Å; L168-W180 VanDerWaalsContact O-CD1 3.31Å; L168-W180 PolarHBondContact O-N 2.93Å; L168-I182 HydrophobicContact CB-CG2 3.9Å; L168-I182 HydrophobicContact CD2-CG2 4.12Å
169	L	98.9	Very high	98.8	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133.9	168.8	-174.7	67.8	0	0	0	109.9	L158 K159 L177 R178 A204 Y206 I213	L158-L169 WeakPolarHBondContact CA-O 3.49Å; K159-L169 HydrophobicContact CB-CB 4.39Å; K159-L169 PolarHBondContact N-O 2.87Å; K159-L169 WeakPolarHBondContact O-CB 3.46Å; K159-L169 PolarHBondContact O-N 2.89Å; L169-L177 HydrophobicContact CD1-CB 4.08Å; L169-L177 HydrophobicContact CD1-CD2 4.28Å; L169-L177 HydrophobicContact CD2-CD2 4.35Å; L169-R178 WeakPolarHBondContact CA-O 3.46Å; L169-A204 HydrophobicContact CD2-CB 3.85Å; L169-Y206 HydrophobicContact CB-CE2 3.73Å; L169-Y206 WeakPolarHBondContact CB-OH 3.22Å; L169-Y206 HydrophobicContact CD2-CE2 4.14Å; L169-I213 HydrophobicContact CD1-CD1 4.04Å; L169-I213 HydrophobicContact CD2-CD1 4.04Å; L169-I213 HydrophobicContact CD2-CG1 4.31Å; L169-I213 HydrophobicContact CD2-CG2 3.72Å
170	S	98.9	Very high	98.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.3	168.3	59	0	0	0	0	111	H151 L177 R178 W180	H151-S170 PolarHBondContact CD2-OG 3.19Å; H151-S170 PolarHBondContact NE2-OG 2.82Å; S170-L177 CarbonylContact O-C 3.54Å; S170-L177 VanDerWaalsContact O-CA 3.26Å; S170-L177 WeakPolarHBondContact O-CA 3.23Å; S170-R178 PolarHBondContact N-O 2.6Å; S170-R178 PolarHBondContact O-N 3.19Å; S170-R178 PolarHBondContact OG-O 3.28Å; S170-W180 PolarHBondContact OG-NE1 2.86Å
171	V	98.9	Very high	98.8	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.012	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	144.3	175	-47.7	0	0	0	0	110.4	I155 N156 E157 L177 V201 A204	I155-V171 CarbonylContact C-O 3.46Å; I155-V171 WeakPolarHBondContact CA-O 3.34Å; N156-V171 HydrophobicContact CB-CG2 4.37Å; N156-V171 PolarHBondContact N-O 3.48Å; E157-V171 HydrophobicContact CB-CG2 3.6Å; E157-V171 PolarHBondContact O-N 2.62Å; E157-V171 VanDerWaalsContact O-N 3.09Å; V171-L177 HydrophobicContact CB-CD2 4.48Å; V171-L177 HydrophobicContact CB-CG 4.23Å; V171-L177 HydrophobicContact CG1-CB 4.27Å; V171-L177 HydrophobicContact CG1-CD2 3.42Å; V171-L177 VanDerWaalsContact CG1-CD2 3.42Å; V171-L177 HydrophobicContact CG1-CG 3.62Å; V171-V201 HydrophobicContact CB-CB 4.03Å; V171-V201 HydrophobicContact CB-CG1 3.72Å; V171-V201 HydrophobicContact CG1-CG1 4.19Å; V171-V201 HydrophobicContact CG2-CG1 4.25Å; V171-A204 HydrophobicContact CG1-CB 3.53Å
172	S	98.9	Very high	98.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	160.3	-164.1	173.4	0	0	0	0	114.1	H151 N153 A154 D174 H175 A176 V201	H151-S172 WeakPolarHBondContact CE1-CB 3.28Å; H151-S172 WeakPolarHBondContact ND1-CB 3.32Å; H151-S172 PolarHBondContact ND1-OG 3.21Å; N153-S172 PolarHBondContact O-OG 2.88Å; A154-S172 VanDerWaalsContact O-CA 3.23Å; A154-S172 WeakPolarHBondContact O-CA 3.31Å; A154-S172 VanDerWaalsContact O-CB 3.25Å; A154-S172 WeakPolarHBondContact O-CB 3.49Å; A154-S172 PolarHBondContact O-OG 3.45Å; S172-D174 VanDerWaalsContact CB-OD1 3.27Å; S172-D174 WeakPolarHBondContact CB-OD1 3.35Å; S172-D174 PolarHBondContact O-N 2.79Å; S172-D174 VanDerWaalsContact O-N 3.16Å; S172-D174 PolarHBondContact OG-N 2.93Å; S172-D174 PolarHBondContact OG-OD1 2.92Å; S172-H175 PolarHBondContact O-N 3.23Å; S172-A176 PolarHBondContact N-O 2.8Å; S172-V201 PolarHBondContact O-N 2.9Å
173	K	98.8	Very high	98.8	Very high	34 Å²	34	23.3 Å²	23.3	15%	0.148	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-10.8	165.3	-61	-168.8	171.6	-97.8	0	114.1	N153 A154 H175 E200	N153-K173 HydrophobicContact CB-CB 3.82Å; A154-K173 HydrophobicContact CB-CD 3.7Å; A154-K173 HydrophobicContact CB-CG 4.02Å; A154-K173 PolarHBondContact O-N 2.91Å; K173-H175 PolarHBondContact O-CD2 3.34Å; K173-H175 PolarHBondContact O-N 3.26Å; K173-E200 HydrophobicContact CB-CB 4.36Å; K173-E200 HydrophobicContact CB-CG 3.86Å; K173-E200 WeakPolarHBondContact CD-OE1 2.92Å; K173-E200 HydrophobicContact CG-CB 4.35Å; K173-E200 VanDerWaalsContact CG-CD 3.45Å; K173-E200 HydrophobicContact CG-CG 4Å; K173-E200 WeakPolarHBondContact CG-OE2 3.3Å; K173-E200 IonicContact NZ-OE1 2.73Å; K173-E200 PolarHBondContact NZ-OE1 2.72Å; K173-E200 IonicContact NZ-OE2 3.25Å; K173-E200 PolarHBondContact NZ-OE2 2.9Å
174	D	98.7	Very high	98.8	Very high	36 Å²	36	17.3 Å²	17.3	19%	0.193	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	14.5	175	79.2	-8.9	0	0	0	114.4	H151 G152 N153 S172 A176 R178	H151-D174 VanDerWaalsContact CA-OD2 3.3Å; H151-D174 WeakPolarHBondContact CA-OD2 3.48Å; H151-D174 IonicContact CE1-OD1 3.22Å; H151-D174 IonicContact CG-OD2 3.66Å; H151-D174 VanDerWaalsContact ND1-CG 3.34Å; H151-D174 IonicContact ND1-OD1 2.69Å; H151-D174 PolarHBondContact ND1-OD1 2.88Å; H151-D174 IonicContact ND1-OD2 3.25Å; H151-D174 PolarHBondContact ND1-OD2 2.94Å; H151-D174 VanDerWaalsContact ND1-OD2 3.13Å; G152-D174 PolarHBondContact N-OD2 3.47Å; N153-D174 HydrophobicContact CB-CB 4.06Å; S172-D174 VanDerWaalsContact CB-OD1 3.27Å; S172-D174 WeakPolarHBondContact CB-OD1 3.35Å; S172-D174 PolarHBondContact O-N 2.79Å; S172-D174 VanDerWaalsContact O-N 3.16Å; S172-D174 PolarHBondContact OG-N 2.93Å; S172-D174 PolarHBondContact OG-OD1 2.92Å; D174-A176 PolarHBondContact O-N 3.17Å; D174-A176 PolarHBondContact OD1-N 3.41Å; D174-R178 IonicContact OD1-NH1 3.92Å; D174-R178 PolarHBondContact OD1-NH1 2.79Å; D174-R178 IonicContact OD2-CZ 3.7Å; D174-R178 VanDerWaalsContact OD2-CZ 3.25Å; D174-R178 IonicContact OD2-NH1 3.95Å; D174-R178 PolarHBondContact OD2-NH1 3.39Å; D174-R178 IonicContact OD2-NH2 3.12Å; D174-R178 PolarHBondContact OD2-NH2 2.93Å
175	H	98.8	Very high	98.8	Very high	80 Å²	80	20.2 Å²	20.2	37%	0.37	10%	0.101	S	C	.	.	S	Bend	trans	69.3	7.7	176.8	-39.1	164.7	0	0	0	114.4	S172 K173 D199	S172-H175 PolarHBondContact O-N 3.23Å; K173-H175 PolarHBondContact O-CD2 3.34Å; K173-H175 PolarHBondContact O-N 3.26Å; H175-D199 PolarHBondContact CD2-O 3.06Å
176	A	98.8	Very high	98.8	Very high	9 Å²	9	19.8 Å²	19.8	7%	0.074	10%	0.098	C	C	.	.			trans	-120.8	156.2	-178.9	0	0	0	0	0	112.5	H151 S172 D174 I190 F191	H151-A176 PolarHBondContact CE1-O 3.34Å; S172-A176 PolarHBondContact N-O 2.8Å; D174-A176 PolarHBondContact O-N 3.17Å; D174-A176 PolarHBondContact OD1-N 3.41Å; A176-I190 HydrophobicContact CB-CG2 4.1Å; A176-F191 VanDerWaalsContact CA-O 3.31Å; A176-F191 WeakPolarHBondContact CA-O 3.44Å
177	L	98.9	Very high	98.8	Very high	1 Å²	1	21 Å²	21	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	146.5	161.8	-53.9	83.9	0	0	0	108.8	L169 S170 V171 I190 F191 V201 A204 I213 W225	L169-L177 HydrophobicContact CD1-CB 4.08Å; L169-L177 HydrophobicContact CD1-CD2 4.28Å; L169-L177 HydrophobicContact CD2-CD2 4.35Å; S170-L177 CarbonylContact O-C 3.54Å; S170-L177 VanDerWaalsContact O-CA 3.26Å; S170-L177 WeakPolarHBondContact O-CA 3.23Å; V171-L177 HydrophobicContact CB-CD2 4.48Å; V171-L177 HydrophobicContact CB-CG 4.23Å; V171-L177 HydrophobicContact CG1-CB 4.27Å; V171-L177 HydrophobicContact CG1-CD2 3.42Å; V171-L177 VanDerWaalsContact CG1-CD2 3.42Å; V171-L177 HydrophobicContact CG1-CG 3.62Å; L177-I190 WeakPolarHBondContact O-CA 3.49Å; L177-F191 HydrophobicContact CB-CB 4.13Å; L177-F191 HydrophobicContact CB-CD2 4.09Å; L177-F191 HydrophobicContact CD1-CB 4.3Å; L177-F191 PolarHBondContact N-O 3.31Å; L177-F191 PolarHBondContact O-N 3.05Å; L177-V201 HydrophobicContact CD1-CG1 4.1Å; L177-V201 HydrophobicContact CD1-CG2 4.24Å; L177-V201 HydrophobicContact CG-CG1 4.2Å; L177-A204 HydrophobicContact CD2-CB 3.72Å; L177-I213 HydrophobicContact CD2-CG2 4.34Å; L177-W225 HydrophobicContact CD1-CZ2 4.39Å
178	R	98.9	Very high	98.8	Very high	26 Å²	26	20.9 Å²	20.9	10%	0.098	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.8	175	-71.1	-178.9	178.7	67.7	-14.9	110.5	G150 H151 L169 S170 D174 W180 L187 A189 I190	G150-R178 PolarHBondContact O-NE 2.83Å; G150-R178 PolarHBondContact O-NH2 3.34Å; H151-R178 PolarHBondContact CE1-NH1 3.46Å; H151-R178 PolarHBondContact ND1-NH1 3.19Å; L169-R178 WeakPolarHBondContact CA-O 3.46Å; S170-R178 PolarHBondContact N-O 2.6Å; S170-R178 PolarHBondContact O-N 3.19Å; S170-R178 PolarHBondContact OG-O 3.28Å; D174-R178 IonicContact OD1-NH1 3.92Å; D174-R178 PolarHBondContact OD1-NH1 2.79Å; D174-R178 IonicContact OD2-CZ 3.7Å; D174-R178 VanDerWaalsContact OD2-CZ 3.25Å; D174-R178 IonicContact OD2-NH1 3.95Å; D174-R178 PolarHBondContact OD2-NH1 3.39Å; D174-R178 IonicContact OD2-NH2 3.12Å; D174-R178 PolarHBondContact OD2-NH2 2.93Å; R178-W180 HydrophobicContact CB-CZ2 3.92Å; R178-W180 HydrophobicContact CG-CZ2 4.36Å; R178-L187 HydrophobicContact CB-CD1 3.72Å; R178-L187 HydrophobicContact CG-CD1 3.96Å; R178-A189 WeakPolarHBondContact CA-O 3.4Å; R178-I190 HydrophobicContact CG-CG1 4.28Å; R178-I190 HydrophobicContact CG-CG2 4.36Å
179	L	98.9	Very high	98.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.7	173.6	-179.6	66	0	0	0	109	L167 L168 V188 A189 F191 Y206 M232 I236	L167-L179 HydrophobicContact CB-CD1 4.16Å; L168-L179 WeakPolarHBondContact O-CA 3.41Å; L179-V188 HydrophobicContact CB-CB 4.38Å; L179-V188 HydrophobicContact CD2-CB 4.18Å; L179-V188 HydrophobicContact CD2-CG1 4.11Å; L179-V188 HydrophobicContact CG-CB 4.11Å; L179-V188 HydrophobicContact CG-CG2 4.48Å; L179-V188 WeakPolarHBondContact O-CA 3.42Å; L179-V188 WeakPolarHBondContact O-CB 3.24Å; L179-V188 PolarHBondContact O-N 3.13Å; L179-A189 HydrophobicContact CB-CB 4.39Å; L179-A189 PolarHBondContact N-O 3.26Å; L179-A189 PolarHBondContact O-N 3.28Å; L179-F191 HydrophobicContact CB-CE2 3.91Å; L179-Y206 WeakPolarHBondContact CD1-OH 3.27Å; L179-M232 HydrophobicContact CD2-CE 3.89Å; L179-I236 HydrophobicContact CD2-CD1 4.48Å; L179-I236 HydrophobicContact CD2-CG1 4.42Å
180	W	98.9	Very high	98.8	Very high	13 Å²	13	22.9 Å²	22.9	5%	0.049	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	143.2	-177.6	-50.8	89.1	0	0	0	109.9	I134 Y148 L167 L168 S170 R178 T186 L187	I134-W180 HydrophobicContact CD1-CG 4.41Å; I134-W180 HydrophobicContact CD1-CZ2 4.47Å; Y148-W180 HydrophobicContact CD1-CE3 4.4Å; Y148-W180 HydrophobicContact CG-CE3 4.32Å; L167-W180 WeakPolarHBondContact CA-O 3.42Å; L168-W180 HydrophobicContact CB-CB 4.35Å; L168-W180 PolarHBondContact N-O 3.32Å; L168-W180 VanDerWaalsContact O-CD1 3.31Å; L168-W180 PolarHBondContact O-N 2.93Å; S170-W180 PolarHBondContact OG-NE1 2.86Å; R178-W180 HydrophobicContact CB-CZ2 3.92Å; R178-W180 HydrophobicContact CG-CZ2 4.36Å; W180-T186 CarbonylContact C-O 3.57Å; W180-T186 WeakPolarHBondContact CA-O 3.47Å; W180-L187 HydrophobicContact CD2-CD1 3.98Å; W180-L187 HydrophobicContact CE3-CB 3.92Å; W180-L187 HydrophobicContact CE3-CD1 3.92Å; W180-L187 HydrophobicContact CE3-CG 4.48Å; W180-L187 HydrophobicContact CH2-CD1 4.08Å; W180-L187 HydrophobicContact CH2-CD2 4.42Å; W180-L187 HydrophobicContact CZ2-CD1 4.12Å; W180-L187 HydrophobicContact CZ3-CB 3.8Å; W180-L187 HydrophobicContact CZ3-CD1 3.97Å; W180-L187 HydrophobicContact CZ3-CD2 4.45Å; W180-L187 HydrophobicContact CZ3-CG 4.28Å
181	N	98.8	Very high	98.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	107.7	162.3	-178.6	-19.3	0	0	0	107.9	N166 L167 Q183 T184 D185 T186 V188 S239	N166-N181 CarbonylContact O-C 3.46Å; N166-N181 WeakPolarHBondContact O-CA 2.96Å; L167-N181 HydrophobicContact CD2-CB 4.25Å; N181-Q183 VanDerWaalsContact C-N 3.26Å; N181-Q183 PolarHBondContact O-N 3.35Å; N181-Q183 WeakPolarHBondContact OD1-CB 3.32Å; N181-Q183 PolarHBondContact OD1-N 2.72Å; N181-T184 PolarHBondContact ND2-OG1 2.9Å; N181-T184 PolarHBondContact OD1-N 2.96Å; N181-D185 WeakPolarHBondContact O-CA 3.14Å; N181-D185 PolarHBondContact O-N 2.97Å; N181-T186 PolarHBondContact N-O 2.93Å; N181-T186 PolarHBondContact O-N 2.96Å; N181-T186 VanDerWaalsContact O-N 3.11Å; N181-V188 HydrophobicContact CB-CG2 3.82Å; N181-S239 PolarHBondContact ND2-OG 2.85Å
182	I	98.7	Very high	98.7	Very high	9 Å²	9	23.1 Å²	23.1	5%	0.046	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.8	-175.4	68.6	154.8	0	0	0	113.7	T115 L124 I136 K146 Y148 F160 N166 L168	T115-I182 HydrophobicContact CG2-CD1 3.95Å; L124-I182 HydrophobicContact CD1-CD1 4.39Å; I136-I182 HydrophobicContact CD1-CG2 4.48Å; K146-I182 PolarHBondContact NZ-O 2.93Å; Y148-I182 HydrophobicContact CE2-CB 4.18Å; Y148-I182 HydrophobicContact CE2-CG2 3.62Å; Y148-I182 WeakPolarHBondContact OH-CA 3.1Å; Y148-I182 VanDerWaalsContact OH-CB 3.29Å; Y148-I182 WeakPolarHBondContact OH-CB 3.49Å; Y148-I182 PolarHBondContact OH-O 2.94Å; F160-I182 HydrophobicContact CE1-CD1 3.82Å; F160-I182 HydrophobicContact CE1-CG1 4.38Å; F160-I182 HydrophobicContact CZ-CD1 4.14Å; N166-I182 HydrophobicContact CB-CG1 4.2Å; N166-I182 WeakPolarHBondContact O-CG1 3.45Å; N166-I182 PolarHBondContact O-N 3.3Å; L168-I182 HydrophobicContact CB-CG2 3.9Å; L168-I182 HydrophobicContact CD2-CG2 4.12Å
183	Q	98.3	Very high	98.6	Very high	73 Å²	73	25.3 Å²	25.3	34%	0.341	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-42.8	175	179.8	169.8	-22.1	0	0	110.8	S118 N166 N181 Y240	S118-Q183 PolarHBondContact OG-OE1 3.09Å; S118-Q183 VanDerWaalsContact OG-OE1 3.05Å; N166-Q183 HydrophobicContact CB-CB 3.96Å; N166-Q183 PolarHBondContact ND2-OE1 2.99Å; N181-Q183 VanDerWaalsContact C-N 3.26Å; N181-Q183 PolarHBondContact O-N 3.35Å; N181-Q183 WeakPolarHBondContact OD1-CB 3.32Å; N181-Q183 PolarHBondContact OD1-N 2.72Å; Q183-Y240 HydrophobicContact CB-CE1 4.33Å
184	T	98.3	Very high	98.5	Very high	26 Å²	26	27.2 Å²	27.2	16%	0.16	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	2.9	-178.9	60.3	0	0	0	0	114	N181 T186 S239	N181-T184 PolarHBondContact ND2-OG1 2.9Å; N181-T184 PolarHBondContact OD1-N 2.96Å; T184-T186 VanDerWaalsContact C-N 3.33Å; T184-T186 PolarHBondContact O-N 2.93Å; T184-T186 PolarHBondContact OG1-OG1 2.73Å; T184-S239 VanDerWaalsContact CB-O 3.27Å; T184-S239 WeakPolarHBondContact CB-O 2.91Å; T184-S239 VanDerWaalsContact CG2-O 3.3Å; T184-S239 WeakPolarHBondContact CG2-O 3.42Å; T184-S239 PolarHBondContact OG1-O 2.73Å
185	D	98.5	Very high	98.5	Very high	87 Å²	87	29.8 Å²	29.8	47%	0.465	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	39.9	178.4	-53.5	-40.1	0	0	0	113.1	K146 Y148 N181	K146-D185 VanDerWaalsContact CD-OD1 3.29Å; K146-D185 WeakPolarHBondContact CD-OD1 3.32Å; K146-D185 WeakPolarHBondContact CE-OD1 3.42Å; K146-D185 VanDerWaalsContact NZ-CG 3.34Å; K146-D185 IonicContact NZ-OD1 3.6Å; K146-D185 PolarHBondContact NZ-OD1 3.11Å; K146-D185 IonicContact NZ-OD2 2.66Å; K146-D185 PolarHBondContact NZ-OD2 3.44Å; Y148-D185 HydrophobicContact CE1-CB 4.04Å; Y148-D185 PolarHBondContact OH-OD1 2.91Å; N181-D185 WeakPolarHBondContact O-CA 3.14Å; N181-D185 PolarHBondContact O-N 2.97Å
186	T	98.6	Very high	98.5	Very high	5 Å²	5	26 Å²	26	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	146.5	-175.5	53	0	0	0	0	113.3	W180 N181 T184 S239 Y242 F251	W180-T186 CarbonylContact C-O 3.57Å; W180-T186 WeakPolarHBondContact CA-O 3.47Å; N181-T186 PolarHBondContact N-O 2.93Å; N181-T186 PolarHBondContact O-N 2.96Å; N181-T186 VanDerWaalsContact O-N 3.11Å; T184-T186 VanDerWaalsContact C-N 3.33Å; T184-T186 PolarHBondContact O-N 2.93Å; T184-T186 PolarHBondContact OG1-OG1 2.73Å; T186-S239 WeakPolarHBondContact OG1-CB 3.18Å; T186-Y242 HydrophobicContact CG2-CD1 3.28Å; T186-Y242 HydrophobicContact CG2-CE1 3.87Å; T186-Y242 HydrophobicContact CG2-CG 3.94Å; T186-F251 HydrophobicContact CG2-CB 3.91Å; T186-F251 HydrophobicContact CG2-CD1 4.24Å; T186-F251 HydrophobicContact CG2-CD2 4.18Å; T186-F251 HydrophobicContact CG2-CG 3.82Å
187	L	98.9	Very high	98.5	Very high	36 Å²	36	25.8 Å²	25.8	19%	0.188	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	101.7	168.8	175.9	58.8	0	0	0	109.3	R178 W180 I190 F251 S253	R178-L187 HydrophobicContact CB-CD1 3.72Å; R178-L187 HydrophobicContact CG-CD1 3.96Å; W180-L187 HydrophobicContact CD2-CD1 3.98Å; W180-L187 HydrophobicContact CE3-CB 3.92Å; W180-L187 HydrophobicContact CE3-CD1 3.92Å; W180-L187 HydrophobicContact CE3-CG 4.48Å; W180-L187 HydrophobicContact CH2-CD1 4.08Å; W180-L187 HydrophobicContact CH2-CD2 4.42Å; W180-L187 HydrophobicContact CZ2-CD1 4.12Å; W180-L187 HydrophobicContact CZ3-CB 3.8Å; W180-L187 HydrophobicContact CZ3-CD1 3.97Å; W180-L187 HydrophobicContact CZ3-CD2 4.45Å; W180-L187 HydrophobicContact CZ3-CG 4.28Å; L187-I190 HydrophobicContact CD1-CG1 4.36Å; L187-I190 HydrophobicContact CD2-CD1 3.86Å; L187-I190 HydrophobicContact CD2-CG1 3.85Å; L187-I190 HydrophobicContact CG-CG1 4.27Å; L187-F251 WeakPolarHBondContact O-CD1 3.4Å; L187-F251 WeakPolarHBondContact O-CE1 3.41Å; L187-S253 WeakPolarHBondContact O-CA 3.14Å; L187-S253 WeakPolarHBondContact O-CB 3.45Å
188	V	98.8	Very high	98.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	-50.4	-175.8	-175.3	0	0	0	0	111.4	L167 L179 N181 A235 I236 Q254	L167-V188 HydrophobicContact CD2-CG2 4.38Å; L179-V188 HydrophobicContact CB-CB 4.38Å; L179-V188 HydrophobicContact CD2-CB 4.18Å; L179-V188 HydrophobicContact CD2-CG1 4.11Å; L179-V188 HydrophobicContact CG-CB 4.11Å; L179-V188 HydrophobicContact CG-CG2 4.48Å; L179-V188 WeakPolarHBondContact O-CA 3.42Å; L179-V188 WeakPolarHBondContact O-CB 3.24Å; L179-V188 PolarHBondContact O-N 3.13Å; N181-V188 HydrophobicContact CB-CG2 3.82Å; V188-A235 HydrophobicContact CG1-CB 4.14Å; V188-I236 HydrophobicContact CG1-CG1 3.87Å; V188-Q254 PolarHBondContact O-N 3.23Å
189	A	98.9	Very high	98.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	152.7	-175.7	0	0	0	0	0	113.1	R178 L179 F191 M232 Q254 I256	R178-A189 WeakPolarHBondContact CA-O 3.4Å; L179-A189 HydrophobicContact CB-CB 4.39Å; L179-A189 PolarHBondContact N-O 3.26Å; L179-A189 PolarHBondContact O-N 3.28Å; A189-F191 HydrophobicContact CB-CE2 3.86Å; A189-F191 HydrophobicContact CB-CZ 3.95Å; A189-M232 HydrophobicContact CB-CE 3.7Å; A189-M232 HydrophobicContact CB-SD 4.02Å; A189-Q254 CarbonylContact C-O 3.37Å; A189-Q254 VanDerWaalsContact CA-O 3.26Å; A189-Q254 WeakPolarHBondContact CA-O 3.27Å; A189-Q254 HydrophobicContact CB-CB 4.11Å; A189-I256 HydrophobicContact CB-CG1 4.4Å
190	I	98.9	Very high	98.4	Very high	44 Å²	44	37.3 Å²	37.3	23%	0.226	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.4	171	-50.6	177.8	0	0	0	107.4	A176 L177 R178 L187 Q254 I256	A176-I190 HydrophobicContact CB-CG2 4.1Å; L177-I190 WeakPolarHBondContact O-CA 3.49Å; R178-I190 HydrophobicContact CG-CG1 4.28Å; R178-I190 HydrophobicContact CG-CG2 4.36Å; L187-I190 HydrophobicContact CD1-CG1 4.36Å; L187-I190 HydrophobicContact CD2-CD1 3.86Å; L187-I190 HydrophobicContact CD2-CG1 3.85Å; L187-I190 HydrophobicContact CG-CG1 4.27Å; I190-Q254 PolarHBondContact N-O 3.23Å; I190-I256 PolarHBondContact O-N 2.98Å
191	F	98.9	Very high	98.4	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.009	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.4	176.1	-50.3	-99.2	0	0	0	108.4	A176 L177 L179 A189 I213 W225 I227 M232 I256	A176-F191 VanDerWaalsContact CA-O 3.31Å; A176-F191 WeakPolarHBondContact CA-O 3.44Å; L177-F191 HydrophobicContact CB-CB 4.13Å; L177-F191 HydrophobicContact CB-CD2 4.09Å; L177-F191 HydrophobicContact CD1-CB 4.3Å; L177-F191 PolarHBondContact N-O 3.31Å; L177-F191 PolarHBondContact O-N 3.05Å; L179-F191 HydrophobicContact CB-CE2 3.91Å; A189-F191 HydrophobicContact CB-CE2 3.86Å; A189-F191 HydrophobicContact CB-CZ 3.95Å; F191-I213 HydrophobicContact CZ-CD1 4.48Å; F191-W225 HydrophobicContact CB-CD2 4.04Å; F191-W225 HydrophobicContact CB-CE3 3.98Å; F191-W225 HydrophobicContact CB-CH2 4.23Å; F191-W225 HydrophobicContact CB-CZ2 4.32Å; F191-W225 HydrophobicContact CB-CZ3 4.07Å; F191-W225 HydrophobicContact CD1-CB 3.91Å; F191-W225 AromaticContact CD1-CD2 3.89Å; F191-W225 HydrophobicContact CD1-CD2 3.89Å; F191-W225 AromaticContact CD1-CE3 3.72Å; F191-W225 HydrophobicContact CD1-CE3 3.72Å; F191-W225 HydrophobicContact CD1-CG 4Å; F191-W225 HydrophobicContact CD1-CZ3 4.47Å; F191-W225 HydrophobicContact CE1-CB 4.05Å; F191-W225 HydrophobicContact CG-CD2 4.32Å; F191-W225 HydrophobicContact CG-CE3 4.32Å; F191-I227 HydrophobicContact CE1-CG2 4.13Å; F191-I227 HydrophobicContact CZ-CG2 3.89Å; F191-M232 HydrophobicContact CE1-CE 4.44Å; F191-M232 HydrophobicContact CE1-SD 4.44Å; F191-M232 HydrophobicContact CZ-CE 3.85Å; F191-M232 HydrophobicContact CZ-SD 4.37Å; F191-I256 WeakPolarHBondContact CA-O 3.31Å; F191-I256 HydrophobicContact CD1-CB 3.68Å; F191-I256 HydrophobicContact CD1-CG1 3.95Å; F191-I256 HydrophobicContact CD1-CG2 3.79Å; F191-I256 HydrophobicContact CE1-CB 4.16Å; F191-I256 HydrophobicContact CE1-CG1 3.92Å; F191-I256 HydrophobicContact CE1-CG2 4.23Å; F191-I256 HydrophobicContact CG-CB 4.32Å
192	G	97.9	Very high	98.4	Very high	4 Å²	4	36.7 Å²	36.7	4%	0.041	19%	0.193	C	C	.	.			trans	158.1	-170.3	-172.8	0	0	0	0	0	112.1	I256 H257	G192-I256 PolarHBondContact N-O 3.16Å; G192-H257 VanDerWaalsContact O-CA 3.25Å; G192-H257 WeakPolarHBondContact O-CA 3.2Å; G192-H257 PolarHBondContact O-ND1 3.27Å
193	G	95.9	Very high	98.4	Very high	47 Å²	47	36.3 Å²	36.3	49%	0.485	19%	0.191	S	C	.	.	S	Bend	trans	96.8	-142.5	-178.1	0	0	0	0	0	112	E195 G196	G193-E195 PolarHBondContact O-N 3.17Å; G193-G196 PolarHBondContact O-N 2.8Å; G193-G196 VanDerWaalsContact O-N 3.13Å
194	V	97.1	Very high	98.5	Very high	74 Å²	74	32.9 Å²	32.9	45%	0.448	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-43	-164.3	66	0	0	0	0	113.9	R198 H257 F258	V194-R198 PolarHBondContact O-NE 2.84Å; V194-R198 PolarHBondContact O-NH2 3.09Å; V194-H257 HydrophobicContact CG1-CB 4.31Å; V194-F258 HydrophobicContact CG1-CE1 3.84Å; V194-F258 HydrophobicContact CG1-CE2 4.42Å; V194-F258 HydrophobicContact CG1-CZ 3.69Å
195	E	98.1	Very high	98.5	Very high	89 Å²	89	32.3 Å²	32.3	42%	0.416	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	14.1	175.6	-64.3	-54.2	140.5	0	0	112.7	G193 K223 H257 F258 P259	G193-E195 PolarHBondContact O-N 3.17Å; E195-K223 PolarHBondContact O-NZ 2.84Å; E195-H257 CarbonylContact C-O 3.6Å; E195-H257 WeakPolarHBondContact CB-O 3.45Å; E195-H257 PolarHBondContact N-O 3.31Å; E195-H257 VanDerWaalsContact N-O 3.13Å; E195-F258 HydrophobicContact CB-CD1 3.77Å; E195-F258 HydrophobicContact CB-CE1 4.26Å; E195-F258 HydrophobicContact CG-CD1 3.48Å; E195-F258 VanDerWaalsContact CG-CD1 3.48Å; E195-F258 HydrophobicContact CG-CE1 3.57Å; E195-P259 VanDerWaalsContact O-CD 3.25Å; E195-P259 WeakPolarHBondContact O-CD 3.3Å
196	G	98.6	Very high	98.5	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.01	15%	0.151	C	C	.	.	S	Bend	trans	-69.7	-173	172.9	0	0	0	0	0	113.6	G193 K223	G193-G196 PolarHBondContact O-N 2.8Å; G193-G196 VanDerWaalsContact O-N 3.13Å; G196-K223 VanDerWaalsContact C-CE 3.48Å; G196-K223 WeakPolarHBondContact O-CE 3.27Å; G196-K223 PolarHBondContact O-NZ 3.25Å
197	H	98.8	Very high	98.5	Very high	5 Å²	5	28.9 Å²	28.9	2%	0.023	15%	0.151	C	C	.	.			trans	-62	142.7	168.8	-76.7	-74	0	0	0	110.1	V201 S215 D219 S221	H197-V201 HydrophobicContact CB-CG2 3.75Å; H197-S215 PolarHBondContact NE2-OG 3.4Å; H197-D219 VanDerWaalsContact CA-OD2 3.23Å; H197-D219 WeakPolarHBondContact CA-OD2 3.4Å; H197-D219 IonicContact CE1-OD1 2.88Å; H197-D219 IonicContact CG-OD2 2.7Å; H197-D219 IonicContact ND1-OD1 3.33Å; H197-D219 PolarHBondContact ND1-OD1 3.12Å; H197-D219 IonicContact ND1-OD2 3.97Å; H197-D219 PolarHBondContact ND1-OD2 3.31Å; H197-D219 VanDerWaalsContact ND1-OD2 3.12Å; H197-S221 PolarHBondContact CE1-OG 3.42Å; H197-S221 VanDerWaalsContact CE1-OG 3.27Å; H197-S221 PolarHBondContact ND1-OG 2.73Å; H197-S221 VanDerWaalsContact ND1-OG 3.13Å
198	R	98.6	Very high	98.4	Very high	162 Å²	162	32.9 Å²	32.9	61%	0.611	17%	0.173	S	C	*	.	S	Bend	trans	-101.4	-3.5	-178	-63.3	-61	-169.3	147.1	7	113	V194 D219	V194-R198 PolarHBondContact O-NE 2.84Å; V194-R198 PolarHBondContact O-NH2 3.09Å; R198-D219 HydrophobicContact CB-CB 4.37Å; R198-D219 PolarHBondContact N-OD2 2.81Å
199	D	98.7	Very high	98.3	Very high	70 Å²	70	36.9 Å²	36.9	37%	0.374	19%	0.193	S	C	.	.	S	Bend	trans	-149.2	-177.1	179.8	-152.5	-32	0	0	0	108.6	H175 V201 M218 D219	H175-D199 PolarHBondContact CD2-O 3.06Å; D199-V201 PolarHBondContact O-N 2.9Å; D199-M218 HydrophobicContact CB-CB 3.8Å; D199-D219 HydrophobicContact CB-CB 3.95Å
200	E	98.8	Very high	98.3	Very high	36 Å²	36	37 Å²	37	17%	0.168	20%	0.195	C	C	.	.			trans	-51.5	128.7	-176.5	-56.1	-170.8	170.6	0	0	112.4	K173 L202 G217 M218	K173-E200 HydrophobicContact CB-CB 4.36Å; K173-E200 HydrophobicContact CB-CG 3.86Å; K173-E200 WeakPolarHBondContact CD-OE1 2.92Å; K173-E200 HydrophobicContact CG-CB 4.35Å; K173-E200 VanDerWaalsContact CG-CD 3.45Å; K173-E200 HydrophobicContact CG-CG 4Å; K173-E200 WeakPolarHBondContact CG-OE2 3.3Å; K173-E200 IonicContact NZ-OE1 2.73Å; K173-E200 PolarHBondContact NZ-OE1 2.72Å; K173-E200 IonicContact NZ-OE2 3.25Å; K173-E200 PolarHBondContact NZ-OE2 2.9Å; E200-L202 HydrophobicContact CB-CD2 4.38Å; E200-G217 CarbonylContact O-C 3.59Å; E200-G217 WeakPolarHBondContact O-CA 3.28Å; E200-M218 HydrophobicContact CB-CB 4.37Å; E200-M218 HydrophobicContact CB-CG 3.83Å; E200-M218 HydrophobicContact CG-CG 4.41Å; E200-M218 PolarHBondContact O-N 3.47Å
201	V	98.9	Very high	98.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	121.7	172.7	-166.3	0	0	0	0	108.3	N156 V171 S172 L177 H197 D199 C216	N156-V201 PolarHBondContact ND2-O 2.92Å; V171-V201 HydrophobicContact CB-CB 4.03Å; V171-V201 HydrophobicContact CB-CG1 3.72Å; V171-V201 HydrophobicContact CG1-CG1 4.19Å; V171-V201 HydrophobicContact CG2-CG1 4.25Å; S172-V201 PolarHBondContact O-N 2.9Å; L177-V201 HydrophobicContact CD1-CG1 4.1Å; L177-V201 HydrophobicContact CD1-CG2 4.24Å; L177-V201 HydrophobicContact CG-CG1 4.2Å; H197-V201 HydrophobicContact CB-CG2 3.75Å; D199-V201 PolarHBondContact O-N 2.9Å; V201-C216 WeakPolarHBondContact CG1-O 3.27Å
202	L	98.9	Very high	98.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-36.9	-170.2	-63	-179	0	0	0	112.8	E200 C216 M218 Y270 D272 W326	E200-L202 HydrophobicContact CB-CD2 4.38Å; L202-C216 PolarHBondContact N-O 3.36Å; L202-M218 HydrophobicContact CD1-CE 4.41Å; L202-M218 HydrophobicContact CD1-CG 4.03Å; L202-M218 HydrophobicContact CD1-SD 3.87Å; L202-M218 HydrophobicContact CD2-CE 4.19Å; L202-M218 HydrophobicContact CD2-CG 4.09Å; L202-M218 HydrophobicContact CD2-SD 4.47Å; L202-M218 HydrophobicContact CG-CG 4.19Å; L202-Y270 HydrophobicContact CD1-CD2 4.42Å; L202-D272 HydrophobicContact CD1-CB 3.96Å; L202-W326 HydrophobicContact CD2-CZ2 3.53Å
203	S	98.9	Very high	98.3	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	154.9	-177.7	178.7	0	0	0	0	110.8	S215 C216 V274	S203-S215 WeakPolarHBondContact O-CA 3.33Å; S203-C216 PolarHBondContact N-O 2.95Å; S203-C216 PolarHBondContact O-N 2.86Å; S203-V274 PolarHBondContact OG-N 2.65Å
204	A	98.9	Very high	98.4	Very high	1 Å²	1	35 Å²	35	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	159.7	164.4	0	0	0	0	0	110.9	K159 L169 V171 L177 I213 M214	K159-A204 WeakPolarHBondContact CE-O 3.18Å; K159-A204 WeakPolarHBondContact CG-O 3.41Å; L169-A204 HydrophobicContact CD2-CB 3.85Å; V171-A204 HydrophobicContact CG1-CB 3.53Å; L177-A204 HydrophobicContact CD2-CB 3.72Å; A204-I213 HydrophobicContact CB-CG2 4.07Å; A204-M214 CarbonylContact C-O 3.54Å; A204-M214 WeakPolarHBondContact CA-O 3.08Å; A204-M214 WeakPolarHBondContact CB-O 3.41Å
205	D	98.9	Very high	98.5	Very high	14 Å²	14	31.4 Å²	31.4	8%	0.075	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	143.1	178.6	-158.3	43.1	0	0	0	111.5	I213 M214 R275 W276	D205-I213 WeakPolarHBondContact O-CA 3.19Å; D205-M214 PolarHBondContact N-O 2.99Å; D205-M214 PolarHBondContact O-N 2.82Å; D205-R275 WeakPolarHBondContact OD1-CD 3.45Å; D205-R275 IonicContact OD1-CZ 3.11Å; D205-R275 IonicContact OD1-NE 3.43Å; D205-R275 IonicContact OD1-NH1 3.93Å; D205-R275 PolarHBondContact OD1-NH1 2.86Å; D205-R275 VanDerWaalsContact OD2-CA 3.25Å; D205-R275 WeakPolarHBondContact OD2-CA 3.24Å; D205-R275 WeakPolarHBondContact OD2-CD 3.34Å; D205-R275 IonicContact OD2-NH1 2.71Å; D205-W276 PolarHBondContact O-NE1 2.83Å; D205-W276 PolarHBondContact OD2-N 2.84Å
206	Y	98.9	Very high	98.6	Very high	13 Å²	13	27.2 Å²	27.2	5%	0.051	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	147	167.7	-72	-79	0	0	0	109.6	K159 H161 L169 L179 I213 I227 W276	K159-Y206 HydrophobicContact CB-CD2 3.98Å; K159-Y206 HydrophobicContact CB-CE2 3.99Å; H161-Y206 HydrophobicContact CB-CE1 4.43Å; H161-Y206 HydrophobicContact CB-CE2 4.3Å; H161-Y206 AromaticContact CD2-CE1 3.77Å; L169-Y206 HydrophobicContact CB-CE2 3.73Å; L169-Y206 WeakPolarHBondContact CB-OH 3.22Å; L169-Y206 HydrophobicContact CD2-CE2 4.14Å; L179-Y206 WeakPolarHBondContact CD1-OH 3.27Å; Y206-I213 HydrophobicContact CD1-CD1 4.26Å; Y206-I213 HydrophobicContact CD1-CG1 3.56Å; Y206-I213 HydrophobicContact CE1-CD1 3.63Å; Y206-I213 HydrophobicContact CE1-CG1 3.46Å; Y206-I213 VanDerWaalsContact CE1-CG1 3.46Å; Y206-I213 HydrophobicContact CG-CG1 4.4Å; Y206-I227 HydrophobicContact CD1-CD1 4.09Å; Y206-I227 HydrophobicContact CE1-CD1 3.58Å; Y206-W276 VanDerWaalsContact O-CD1 3.27Å
207	D	98.6	Very high	98.6	Very high	7 Å²	7	27.1 Å²	27.1	4%	0.037	13%	0.129	C	C	.	.			trans	-68.6	170.4	162.6	76.6	-31.4	0	0	0	110.8	L209 G210 E211 K212 W276	D207-L209 PolarHBondContact O-N 2.99Å; D207-L209 VanDerWaalsContact O-N 3.11Å; D207-G210 PolarHBondContact O-N 2.86Å; D207-G210 WeakPolarHBondContact OD1-CA 3.37Å; D207-G210 PolarHBondContact OD1-N 2.99Å; D207-E211 PolarHBondContact OD1-N 2.79Å; D207-K212 HydrophobicContact CB-CG 3.85Å; D207-K212 VanDerWaalsContact CG-CG 3.44Å; D207-K212 PolarHBondContact N-O 2.87Å; D207-K212 PolarHBondContact OD1-N 2.89Å; D207-K212 VanDerWaalsContact OD1-N 3.14Å; D207-K212 WeakPolarHBondContact OD2-CG 3.18Å; D207-K212 IonicContact OD2-NZ 3.44Å; D207-K212 PolarHBondContact OD2-NZ 3.22Å; D207-W276 HydrophobicContact CB-CD2 3.88Å; D207-W276 HydrophobicContact CB-CE3 4.35Å; D207-W276 HydrophobicContact CB-CG 3.96Å; D207-W276 VanDerWaalsContact N-CD1 3.34Å
208	L	97	Very high	98.5	Very high	121 Å²	121	29.2 Å²	29.2	63%	0.634	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.9	-171.4	-169	65.2	0	0	0	113.5	P162	P162-L208 WeakPolarHBondContact CG-O 3.39Å
209	L	96.5	Very high	98.5	Very high	83 Å²	83	22.3 Å²	22.3	44%	0.435	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-8.5	179.5	-61.4	-180	0	0	0	113.4	R163 D207 E211	R163-L209 PolarHBondContact NE-O 2.67Å; R163-L209 PolarHBondContact NH2-O 2.84Å; D207-L209 PolarHBondContact O-N 2.99Å; D207-L209 VanDerWaalsContact O-N 3.11Å; L209-E211 VanDerWaalsContact C-N 3.33Å; L209-E211 HydrophobicContact CB-CG 3.9Å
210	G	98.2	Very high	98.5	Very high	4 Å²	4	21.5 Å²	21.5	4%	0.041	11%	0.108	C	C	.	.	S	Bend	trans	69	30.3	-176.2	0	0	0	0	0	113.1	H161 D207 I227	H161-G210 WeakPolarHBondContact NE2-CA 3.15Å; H161-G210 PolarHBondContact NE2-O 3.38Å; D207-G210 PolarHBondContact O-N 2.86Å; D207-G210 WeakPolarHBondContact OD1-CA 3.37Å; D207-G210 PolarHBondContact OD1-N 2.99Å; G210-I227 WeakPolarHBondContact O-CD1 3.28Å; G210-I227 WeakPolarHBondContact O-CG1 3.21Å
211	E	98.4	Very high	98.5	Very high	48 Å²	48	19.9 Å²	19.9	22%	0.224	10%	0.101	C	C	.	.	S	Bend	trans	-89.7	-24.8	179.1	-65.9	-170.4	-177.1	0	0	112.4	R163 D207 L209 I227 N228	R163-E211 IonicContact NH2-OE1 2.72Å; D207-E211 PolarHBondContact OD1-N 2.79Å; L209-E211 VanDerWaalsContact C-N 3.33Å; L209-E211 HydrophobicContact CB-CG 3.9Å; E211-I227 WeakPolarHBondContact O-CG1 3.23Å; E211-I227 PolarHBondContact O-N 3.38Å; E211-N228 HydrophobicContact CB-CB 3.91Å; E211-N228 HydrophobicContact CG-CB 4.15Å; E211-N228 PolarHBondContact O-N 3.3Å; E211-N228 PolarHBondContact OE2-ND2 3.22Å
212	K	98.4	Very high	98.5	Very high	5 Å²	5	19.9 Å²	19.9	2%	0.022	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	150	-175	50.5	-172.4	-178.2	-74.8	0	111.6	D207 L224 W225 W276 I302 D303	D207-K212 HydrophobicContact CB-CG 3.85Å; D207-K212 VanDerWaalsContact CG-CG 3.44Å; D207-K212 PolarHBondContact N-O 2.87Å; D207-K212 PolarHBondContact OD1-N 2.89Å; D207-K212 VanDerWaalsContact OD1-N 3.14Å; D207-K212 WeakPolarHBondContact OD2-CG 3.18Å; D207-K212 IonicContact OD2-NZ 3.44Å; D207-K212 PolarHBondContact OD2-NZ 3.22Å; K212-L224 HydrophobicContact CB-CD1 3.92Å; K212-L224 HydrophobicContact CD-CD1 4.25Å; K212-L224 HydrophobicContact CG-CD1 4.41Å; K212-W225 CarbonylContact C-O 3.55Å; K212-W225 WeakPolarHBondContact CA-O 2.96Å; K212-W276 HydrophobicContact CB-CZ2 4.46Å; K212-W276 HydrophobicContact CD-CH2 3.67Å; K212-W276 HydrophobicContact CD-CZ2 3.99Å; K212-W276 HydrophobicContact CD-CZ3 4.34Å; K212-W276 HydrophobicContact CG-CH2 4.1Å; K212-W276 HydrophobicContact CG-CZ2 3.88Å; K212-I302 HydrophobicContact CD-CG1 4.41Å; K212-D303 IonicContact NZ-OD1 2.94Å
213	I	98.9	Very high	98.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	134	179.3	-61.6	163.7	0	0	0	107.9	L169 L177 F191 A204 D205 Y206 L224 W225 I227	L169-I213 HydrophobicContact CD1-CD1 4.04Å; L169-I213 HydrophobicContact CD2-CD1 4.04Å; L169-I213 HydrophobicContact CD2-CG1 4.31Å; L169-I213 HydrophobicContact CD2-CG2 3.72Å; L177-I213 HydrophobicContact CD2-CG2 4.34Å; F191-I213 HydrophobicContact CZ-CD1 4.48Å; A204-I213 HydrophobicContact CB-CG2 4.07Å; D205-I213 WeakPolarHBondContact O-CA 3.19Å; Y206-I213 HydrophobicContact CD1-CD1 4.26Å; Y206-I213 HydrophobicContact CD1-CG1 3.56Å; Y206-I213 HydrophobicContact CE1-CD1 3.63Å; Y206-I213 HydrophobicContact CE1-CG1 3.46Å; Y206-I213 VanDerWaalsContact CE1-CG1 3.46Å; Y206-I213 HydrophobicContact CG-CG1 4.4Å; I213-L224 CarbonylContact O-C 3.53Å; I213-L224 WeakPolarHBondContact O-CA 3.25Å; I213-W225 HydrophobicContact CB-CB 4.31Å; I213-W225 PolarHBondContact N-O 2.97Å; I213-W225 PolarHBondContact O-N 3.2Å; I213-I227 HydrophobicContact CD1-CD1 4.5Å; I213-I227 HydrophobicContact CD1-CG2 3.75Å; I213-I227 HydrophobicContact CG1-CG2 4.41Å
214	M	98.9	Very high	98.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129	163.7	-173	63.6	66	0	0	108.7	A204 D205 L222 K223 L224 V274 W276 I281 W293	A204-M214 CarbonylContact C-O 3.54Å; A204-M214 WeakPolarHBondContact CA-O 3.08Å; A204-M214 WeakPolarHBondContact CB-O 3.41Å; D205-M214 PolarHBondContact N-O 2.99Å; D205-M214 PolarHBondContact O-N 2.82Å; M214-L222 HydrophobicContact SD-CB 4.01Å; M214-K223 WeakPolarHBondContact CA-O 3.31Å; M214-L224 HydrophobicContact CE-CB 3.97Å; M214-L224 HydrophobicContact CE-CD1 4.01Å; M214-L224 HydrophobicContact SD-CB 4.5Å; M214-V274 HydrophobicContact CB-CG2 4.25Å; M214-V274 HydrophobicContact CG-CG2 3.72Å; M214-W276 HydrophobicContact CB-CZ2 3.95Å; M214-W276 HydrophobicContact CE-CH2 4.38Å; M214-W276 HydrophobicContact CE-CZ2 4.25Å; M214-I281 HydrophobicContact CB-CD1 4.02Å; M214-I281 HydrophobicContact CE-CD1 3.56Å; M214-I281 HydrophobicContact CE-CG1 4.04Å; M214-I281 HydrophobicContact CG-CD1 3.92Å; M214-I281 HydrophobicContact CG-CG2 4.4Å; M214-W293 HydrophobicContact CE-CH2 4.39Å
215	S	98.9	Very high	98.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	154.5	176.7	67.4	0	0	0	0	111.8	H197 S203 L222 K223 W225	H197-S215 PolarHBondContact NE2-OG 3.4Å; S203-S215 WeakPolarHBondContact O-CA 3.33Å; S215-L222 CarbonylContact O-C 3.5Å; S215-L222 VanDerWaalsContact O-CA 3.24Å; S215-L222 WeakPolarHBondContact O-CA 3.38Å; S215-K223 PolarHBondContact N-O 2.96Å; S215-K223 PolarHBondContact O-N 3.31Å; S215-K223 PolarHBondContact OG-O 3.17Å; S215-W225 PolarHBondContact OG-NE1 3.19Å
216	C	98.9	Very high	98.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	157.6	179.3	71.1	0	0	0	0	112.2	V201 L202 S203 S221 L222 V271 V274	V201-C216 WeakPolarHBondContact CG1-O 3.27Å; L202-C216 PolarHBondContact N-O 3.36Å; S203-C216 PolarHBondContact N-O 2.95Å; S203-C216 PolarHBondContact O-N 2.86Å; C216-S221 VanDerWaalsContact CA-O 3.28Å; C216-S221 WeakPolarHBondContact CA-O 3.47Å; C216-L222 HydrophobicContact CB-CD2 4.01Å; C216-L222 HydrophobicContact CB-CG 3.85Å; C216-V271 HydrophobicContact CB-CB 3.76Å; C216-V271 HydrophobicContact CB-CG1 3.57Å; C216-V271 PolarHBondContact SG-O 3.03Å; C216-V274 HydrophobicContact CB-CB 4.29Å; C216-V274 HydrophobicContact CB-CG1 4.18Å; C216-V274 WeakPolarHBondContact SG-CG1 3.21Å
217	G	98.5	Very high	98.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	-170.5	-170.8	0	0	0	0	0	117	E200 D219 H220 S221 V271	E200-G217 CarbonylContact O-C 3.59Å; E200-G217 WeakPolarHBondContact O-CA 3.28Å; G217-D219 PolarHBondContact O-N 3.15Å; G217-H220 PolarHBondContact O-N 2.89Å; G217-S221 PolarHBondContact N-O 3.47Å; G217-V271 PolarHBondContact O-N 2.91Å
218	M	98.7	Very high	98.5	Very high	49 Å²	49	23.3 Å²	23.3	24%	0.241	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-19.3	176.5	-73.4	-64.6	-159.7	0	0	113.2	D199 E200 L202 H220 Y270 W326	D199-M218 HydrophobicContact CB-CB 3.8Å; E200-M218 HydrophobicContact CB-CB 4.37Å; E200-M218 HydrophobicContact CB-CG 3.83Å; E200-M218 HydrophobicContact CG-CG 4.41Å; E200-M218 PolarHBondContact O-N 3.47Å; L202-M218 HydrophobicContact CD1-CE 4.41Å; L202-M218 HydrophobicContact CD1-CG 4.03Å; L202-M218 HydrophobicContact CD1-SD 3.87Å; L202-M218 HydrophobicContact CD2-CE 4.19Å; L202-M218 HydrophobicContact CD2-CG 4.09Å; L202-M218 HydrophobicContact CD2-SD 4.47Å; L202-M218 HydrophobicContact CG-CG 4.19Å; M218-H220 PolarHBondContact O-CD2 2.83Å; M218-H220 PolarHBondContact O-N 2.81Å; M218-Y270 VanDerWaalsContact SD-CB 3.6Å; M218-Y270 HydrophobicContact SD-CG 4.29Å; M218-W326 HydrophobicContact CE-CD2 4.11Å; M218-W326 VanDerWaalsContact CE-CE2 3.43Å; M218-W326 HydrophobicContact CE-CG 4.35Å; M218-W326 HydrophobicContact CE-CZ2 3.76Å; M218-W326 VanDerWaalsContact CE-NE1 3.26Å
219	D	98.5	Very high	98.5	Very high	16 Å²	16	19.6 Å²	19.6	9%	0.086	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	7.7	176.7	62.9	10.9	0	0	0	114.2	H197 R198 D199 G217 S221 R264	H197-D219 VanDerWaalsContact CA-OD2 3.23Å; H197-D219 WeakPolarHBondContact CA-OD2 3.4Å; H197-D219 IonicContact CE1-OD1 2.88Å; H197-D219 IonicContact CG-OD2 2.7Å; H197-D219 IonicContact ND1-OD1 3.33Å; H197-D219 PolarHBondContact ND1-OD1 3.12Å; H197-D219 IonicContact ND1-OD2 3.97Å; H197-D219 PolarHBondContact ND1-OD2 3.31Å; H197-D219 VanDerWaalsContact ND1-OD2 3.12Å; R198-D219 HydrophobicContact CB-CB 4.37Å; R198-D219 PolarHBondContact N-OD2 2.81Å; D199-D219 HydrophobicContact CB-CB 3.95Å; G217-D219 PolarHBondContact O-N 3.15Å; D219-S221 PolarHBondContact O-N 2.57Å; D219-S221 VanDerWaalsContact OD1-CB 3.28Å; D219-S221 WeakPolarHBondContact OD1-CB 3.46Å; D219-S221 PolarHBondContact OD1-N 2.86Å; D219-S221 PolarHBondContact OD1-OG 3.15Å; D219-S221 PolarHBondContact OD2-OG 3Å; D219-R264 PolarHBondContact O-NE 2.97Å; D219-R264 PolarHBondContact O-NH2 3.21Å
220	H	98.4	Very high	98.6	Very high	53 Å²	53	24.4 Å²	24.4	25%	0.245	12%	0.119	C	C	.	.	S	Bend	trans	66	7	-177.3	-41.5	170.2	0	0	0	113.5	G217 M218 R268 N269 Y270	G217-H220 PolarHBondContact O-N 2.89Å; M218-H220 PolarHBondContact O-CD2 2.83Å; M218-H220 PolarHBondContact O-N 2.81Å; H220-R268 PolarHBondContact CE1-O 3.47Å; H220-R268 VanDerWaalsContact CE1-O 3.26Å; H220-R268 PolarHBondContact ND1-O 2.8Å; H220-N269 WeakPolarHBondContact CB-O 3.19Å; H220-N269 PolarHBondContact CD2-O 2.87Å; H220-N269 VanDerWaalsContact CD2-O 3.31Å; H220-N269 WeakPolarHBondContact NE2-CA 3.44Å; H220-Y270 PolarHBondContact CD2-N 3.2Å; H220-Y270 VanDerWaalsContact CD2-N 3.34Å
221	S	98.8	Very high	98.5	Very high	2 Å²	2	30 Å²	30	1%	0.014	14%	0.139	C	C	.	.			trans	-92	151.3	-174.5	76.3	0	0	0	0	112.6	H197 C216 G217 D219 K223 T263	H197-S221 PolarHBondContact CE1-OG 3.42Å; H197-S221 VanDerWaalsContact CE1-OG 3.27Å; H197-S221 PolarHBondContact ND1-OG 2.73Å; H197-S221 VanDerWaalsContact ND1-OG 3.13Å; C216-S221 VanDerWaalsContact CA-O 3.28Å; C216-S221 WeakPolarHBondContact CA-O 3.47Å; G217-S221 PolarHBondContact N-O 3.47Å; D219-S221 PolarHBondContact O-N 2.57Å; D219-S221 VanDerWaalsContact OD1-CB 3.28Å; D219-S221 WeakPolarHBondContact OD1-CB 3.46Å; D219-S221 PolarHBondContact OD1-N 2.86Å; D219-S221 PolarHBondContact OD1-OG 3.15Å; D219-S221 PolarHBondContact OD2-OG 3Å; S221-K223 WeakPolarHBondContact OG-CE 3.29Å; S221-T263 CarbonylContact C-O 3.48Å; S221-T263 WeakPolarHBondContact CA-O 3.48Å
222	L	98.9	Very high	98.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131	162	-64.6	99.2	0	0	0	109	M214 S215 C216 S262 T263 I266 V271 V274 I281 W293	M214-L222 HydrophobicContact SD-CB 4.01Å; S215-L222 CarbonylContact O-C 3.5Å; S215-L222 VanDerWaalsContact O-CA 3.24Å; S215-L222 WeakPolarHBondContact O-CA 3.38Å; C216-L222 HydrophobicContact CB-CD2 4.01Å; C216-L222 HydrophobicContact CB-CG 3.85Å; L222-S262 WeakPolarHBondContact O-CA 3.48Å; L222-T263 HydrophobicContact CB-CG2 4.27Å; L222-T263 PolarHBondContact N-O 2.66Å; L222-T263 PolarHBondContact O-N 3.37Å; L222-I266 HydrophobicContact CD1-CB 4.23Å; L222-I266 HydrophobicContact CD1-CG1 4.33Å; L222-V271 HydrophobicContact CD1-CG1 4.27Å; L222-V271 HydrophobicContact CD1-CG2 4.11Å; L222-V271 HydrophobicContact CD2-CG1 4.16Å; L222-V271 HydrophobicContact CG-CG1 4.29Å; L222-V274 HydrophobicContact CD2-CB 4.36Å; L222-V274 HydrophobicContact CD2-CG2 3.84Å; L222-I281 HydrophobicContact CD2-CG2 4.28Å; L222-W293 HydrophobicContact CB-CH2 4.17Å; L222-W293 HydrophobicContact CB-CZ2 3.86Å; L222-W293 HydrophobicContact CD1-CZ2 4.18Å; L222-W293 HydrophobicContact CD2-CZ2 3.61Å; L222-W293 HydrophobicContact CG-CZ2 4.07Å
223	K	98.9	Very high	98.6	Very high	12 Å²	12	31.9 Å²	31.9	5%	0.052	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	130.2	-173.4	-69.2	177.2	-175.5	-76.6	0	111.6	E195 G196 M214 S215 S221 W225 P259 F261 S262	E195-K223 PolarHBondContact O-NZ 2.84Å; G196-K223 VanDerWaalsContact C-CE 3.48Å; G196-K223 WeakPolarHBondContact O-CE 3.27Å; G196-K223 PolarHBondContact O-NZ 3.25Å; M214-K223 WeakPolarHBondContact CA-O 3.31Å; S215-K223 PolarHBondContact N-O 2.96Å; S215-K223 PolarHBondContact O-N 3.31Å; S215-K223 PolarHBondContact OG-O 3.17Å; S221-K223 WeakPolarHBondContact OG-CE 3.29Å; K223-W225 HydrophobicContact CB-CZ2 3.93Å; K223-W225 HydrophobicContact CD-CZ2 3.95Å; K223-W225 PolarHBondContact O-NE1 3.38Å; K223-P259 HydrophobicContact CB-CB 3.96Å; K223-P259 HydrophobicContact CB-CG 4.42Å; K223-P259 HydrophobicContact CD-CG 4.22Å; K223-P259 HydrophobicContact CG-CB 4.32Å; K223-P259 HydrophobicContact CG-CG 4.23Å; K223-F261 WeakPolarHBondContact CA-O 3.44Å; K223-S262 PolarHBondContact NZ-OG 3.12Å
224	L	98.9	Very high	98.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	138.3	176.8	-178	65.6	0	0	0	110.5	K212 I213 M214 P259 D260 F261 W276	K212-L224 HydrophobicContact CB-CD1 3.92Å; K212-L224 HydrophobicContact CD-CD1 4.25Å; K212-L224 HydrophobicContact CG-CD1 4.41Å; I213-L224 CarbonylContact O-C 3.53Å; I213-L224 WeakPolarHBondContact O-CA 3.25Å; M214-L224 HydrophobicContact CE-CB 3.97Å; M214-L224 HydrophobicContact CE-CD1 4.01Å; M214-L224 HydrophobicContact SD-CB 4.5Å; L224-P259 CarbonylContact O-C 3.58Å; L224-P259 VanDerWaalsContact O-CA 3.29Å; L224-P259 WeakPolarHBondContact O-CA 3.41Å; L224-P259 VanDerWaalsContact O-CB 3.23Å; L224-P259 WeakPolarHBondContact O-CB 3.47Å; L224-D260 HydrophobicContact CD2-CB 4.18Å; L224-D260 HydrophobicContact CG-CB 4.22Å; L224-D260 PolarHBondContact O-N 3.22Å; L224-F261 HydrophobicContact CB-CB 3.74Å; L224-F261 HydrophobicContact CD2-CB 4.01Å; L224-F261 PolarHBondContact N-O 2.85Å; L224-W276 HydrophobicContact CD1-CH2 3.82Å; L224-W276 HydrophobicContact CD1-CZ2 3.6Å
225	W	98.9	Very high	98.5	Very high	1 Å²	1	36.2 Å²	36.2	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	116.1	174.7	-42.9	87.6	0	0	0	109.9	L177 F191 K212 I213 S215 K223 I256 P259	L177-W225 HydrophobicContact CD1-CZ2 4.39Å; F191-W225 HydrophobicContact CB-CD2 4.04Å; F191-W225 HydrophobicContact CB-CE3 3.98Å; F191-W225 HydrophobicContact CB-CH2 4.23Å; F191-W225 HydrophobicContact CB-CZ2 4.32Å; F191-W225 HydrophobicContact CB-CZ3 4.07Å; F191-W225 HydrophobicContact CD1-CB 3.91Å; F191-W225 AromaticContact CD1-CD2 3.89Å; F191-W225 HydrophobicContact CD1-CD2 3.89Å; F191-W225 AromaticContact CD1-CE3 3.72Å; F191-W225 HydrophobicContact CD1-CE3 3.72Å; F191-W225 HydrophobicContact CD1-CG 4Å; F191-W225 HydrophobicContact CD1-CZ3 4.47Å; F191-W225 HydrophobicContact CE1-CB 4.05Å; F191-W225 HydrophobicContact CG-CD2 4.32Å; F191-W225 HydrophobicContact CG-CE3 4.32Å; K212-W225 CarbonylContact C-O 3.55Å; K212-W225 WeakPolarHBondContact CA-O 2.96Å; I213-W225 HydrophobicContact CB-CB 4.31Å; I213-W225 PolarHBondContact N-O 2.97Å; I213-W225 PolarHBondContact O-N 3.2Å; S215-W225 PolarHBondContact OG-NE1 3.19Å; K223-W225 HydrophobicContact CB-CZ2 3.93Å; K223-W225 HydrophobicContact CD-CZ2 3.95Å; K223-W225 PolarHBondContact O-NE1 3.38Å; W225-I256 HydrophobicContact CE3-CG2 4.01Å; W225-I256 HydrophobicContact CZ3-CG2 4.22Å; W225-P259 HydrophobicContact CD2-CB 4.15Å; W225-P259 HydrophobicContact CE3-CB 3.93Å; W225-P259 HydrophobicContact CH2-CB 3.9Å; W225-P259 HydrophobicContact CH2-CG 4.33Å; W225-P259 HydrophobicContact CZ2-CB 4.09Å; W225-P259 HydrophobicContact CZ3-CB 3.81Å; W225-P259 HydrophobicContact CZ3-CG 4.47Å
226	R	98.6	Very high	98.5	Very high	31 Å²	31	37.4 Å²	37.4	12%	0.117	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	116.2	178.9	-67.5	-178.3	-171.3	-77.6	-0.1	110.7	S229 D260 I302 D303	R226-S229 PolarHBondContact O-OG 2.87Å; R226-D260 WeakPolarHBondContact CB-OD2 3.41Å; R226-D260 HydrophobicContact CG-CB 3.97Å; R226-D260 PolarHBondContact N-OD2 2.69Å; R226-I302 PolarHBondContact NH2-O 3.25Å; R226-D303 IonicContact CZ-OD1 3.54Å; R226-D303 IonicContact NH1-OD1 3.77Å; R226-D303 PolarHBondContact NH1-OD1 2.6Å
227	I	98.4	Very high	98.5	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.021	20%	0.204	C	C	.	.	S	Bend	trans	-100.1	-7.1	177.9	61.6	158.7	0	0	0	113	F191 Y206 G210 E211 I213 S229 M232	F191-I227 HydrophobicContact CE1-CG2 4.13Å; F191-I227 HydrophobicContact CZ-CG2 3.89Å; Y206-I227 HydrophobicContact CD1-CD1 4.09Å; Y206-I227 HydrophobicContact CE1-CD1 3.58Å; G210-I227 WeakPolarHBondContact O-CD1 3.28Å; G210-I227 WeakPolarHBondContact O-CG1 3.21Å; E211-I227 WeakPolarHBondContact O-CG1 3.23Å; E211-I227 PolarHBondContact O-N 3.38Å; I213-I227 HydrophobicContact CD1-CD1 4.5Å; I213-I227 HydrophobicContact CD1-CG2 3.75Å; I213-I227 HydrophobicContact CG1-CG2 4.41Å; I227-S229 PolarHBondContact O-N 3.44Å; I227-M232 HydrophobicContact CB-CB 4.38Å; I227-M232 HydrophobicContact CG2-CE 4.16Å; I227-M232 WeakPolarHBondContact O-CB 3.48Å
228	N	98	Very high	98.5	Very high	60 Å²	60	47.7 Å²	47.7	32%	0.321	23%	0.225	S	C	.	.	S	Bend	trans	-80	4.7	166.5	71.2	-10.4	0	0	0	113.8	E211 I233	E211-N228 HydrophobicContact CB-CB 3.91Å; E211-N228 HydrophobicContact CG-CB 4.15Å; E211-N228 PolarHBondContact O-N 3.3Å; E211-N228 PolarHBondContact OE2-ND2 3.22Å; N228-I233 WeakPolarHBondContact O-CD1 3.46Å
229	S	97.4	Very high	98.5	Very high	44 Å²	44	45.4 Å²	45.4	31%	0.308	21%	0.214	S	C	.	.	S	Bend	trans	-68.4	148.8	174.3	68.8	0	0	0	0	111.2	R226 I227 R231 M232 I233	R226-S229 PolarHBondContact O-OG 2.87Å; I227-S229 PolarHBondContact O-N 3.44Å; S229-R231 PolarHBondContact O-N 3.05Å; S229-R231 VanDerWaalsContact O-N 3.11Å; S229-M232 PolarHBondContact O-N 2.79Å; S229-M232 WeakPolarHBondContact OG-CG 3.49Å; S229-M232 PolarHBondContact OG-N 3.02Å; S229-I233 WeakPolarHBondContact O-CG1 3.28Å; S229-I233 PolarHBondContact O-N 3.26Å
230	K	98.1	Very high	98.5	Very high	183 Å²	183	48.2 Å²	48.2	80%	0.796	22%	0.224	S	C	*	.	H	α-helix	trans	-51.7	-39.3	178.5	-68.9	-178.2	-179.9	178.1	0	112.7	N234	K230-N234 WeakPolarHBondContact O-CB 3.33Å; K230-N234 PolarHBondContact O-N 2.84Å; K230-N234 PolarHBondContact O-ND2 2.77Å
231	R	97.9	Very high	98.4	Very high	123 Å²	123	52 Å²	52	46%	0.464	24%	0.242	S	C	.	.	H	α-helix	trans	-60.9	-46.8	177.6	-178.2	178.8	179.3	-165.5	-5.7	111.7	S229 A235 K255	S229-R231 PolarHBondContact O-N 3.05Å; S229-R231 VanDerWaalsContact O-N 3.11Å; R231-A235 PolarHBondContact O-N 2.95Å; R231-A235 VanDerWaalsContact O-N 3.12Å; R231-K255 PolarHBondContact NH2-O 2.65Å
232	M	98.6	Very high	98.4	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-73.6	-40.9	-178.7	-74.4	-58	-53.5	0	0	112.3	L179 A189 F191 I227 S229 N234 A235 I236 I256	L179-M232 HydrophobicContact CD2-CE 3.89Å; A189-M232 HydrophobicContact CB-CE 3.7Å; A189-M232 HydrophobicContact CB-SD 4.02Å; F191-M232 HydrophobicContact CE1-CE 4.44Å; F191-M232 HydrophobicContact CE1-SD 4.44Å; F191-M232 HydrophobicContact CZ-CE 3.85Å; F191-M232 HydrophobicContact CZ-SD 4.37Å; I227-M232 HydrophobicContact CB-CB 4.38Å; I227-M232 HydrophobicContact CG2-CE 4.16Å; I227-M232 WeakPolarHBondContact O-CB 3.48Å; S229-M232 PolarHBondContact O-N 2.79Å; S229-M232 WeakPolarHBondContact OG-CG 3.49Å; S229-M232 PolarHBondContact OG-N 3.02Å; M232-N234 VanDerWaalsContact C-N 3.31Å; M232-N234 PolarHBondContact O-N 3.01Å; M232-A235 PolarHBondContact O-N 3.47Å; M232-I236 WeakPolarHBondContact O-CG1 3.04Å; M232-I236 PolarHBondContact O-N 3.47Å; M232-I256 HydrophobicContact SD-CD1 3.81Å; M232-I256 HydrophobicContact SD-CG1 3.93Å
233	I	98.4	Very high	98.3	Very high	89 Å²	89	57.3 Å²	57.3	46%	0.456	27%	0.266	S	S	.	.	H	α-helix	trans	-57.1	-46	174.2	-68.2	171.5	0	0	0	110.7	N228 S229 I236 K237	N228-I233 WeakPolarHBondContact O-CD1 3.46Å; S229-I233 WeakPolarHBondContact O-CG1 3.28Å; S229-I233 PolarHBondContact O-N 3.26Å; I233-I236 PolarHBondContact O-N 3.15Å; I233-K237 WeakPolarHBondContact O-CB 3.26Å; I233-K237 PolarHBondContact O-N 2.86Å
234	N	98.5	Very high	98.1	Very high	89 Å²	89	60.3 Å²	60.3	48%	0.476	29%	0.287	S	S	.	.	H	α-helix	trans	-64.2	-43.2	177.6	-72.3	-8.8	0	0	0	111.9	K230 M232 I236 K237 E238	K230-N234 WeakPolarHBondContact O-CB 3.33Å; K230-N234 PolarHBondContact O-N 2.84Å; K230-N234 PolarHBondContact O-ND2 2.77Å; M232-N234 VanDerWaalsContact C-N 3.31Å; M232-N234 PolarHBondContact O-N 3.01Å; N234-I236 PolarHBondContact O-N 2.96Å; N234-K237 WeakPolarHBondContact O-CB 3.26Å; N234-K237 PolarHBondContact O-N 2.74Å; N234-E238 WeakPolarHBondContact O-CB 3.31Å; N234-E238 WeakPolarHBondContact O-CG 3.41Å; N234-E238 PolarHBondContact O-N 3.07Å
235	A	98.7	Very high	98	Very high	2 Å²	2	67.5 Å²	67.5	2%	0.017	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-40	178.2	0	0	0	0	0	112.9	V188 R231 M232 E238 S239 Q254	V188-A235 HydrophobicContact CG1-CB 4.14Å; R231-A235 PolarHBondContact O-N 2.95Å; R231-A235 VanDerWaalsContact O-N 3.12Å; M232-A235 PolarHBondContact O-N 3.47Å; A235-E238 PolarHBondContact O-N 2.9Å; A235-S239 WeakPolarHBondContact O-CB 3.49Å; A235-S239 PolarHBondContact O-N 3.3Å; A235-Q254 HydrophobicContact CB-CG 3.37Å
236	I	98.7	Very high	97.9	Very high	25 Å²	25	76.1 Å²	76.1	13%	0.128	36%	0.363	C	S	.	.	H	α-helix	trans	-62.4	-47.1	173.5	-69	164.4	0	0	0	109.6	L167 L179 V188 M232 I233 N234 E238 S239 Y240	L167-I236 HydrophobicContact CD1-CD1 3.96Å; L167-I236 HydrophobicContact CD1-CG1 4.27Å; L167-I236 HydrophobicContact CD1-CG2 4.09Å; L167-I236 HydrophobicContact CD2-CG2 4.37Å; L179-I236 HydrophobicContact CD2-CD1 4.48Å; L179-I236 HydrophobicContact CD2-CG1 4.42Å; V188-I236 HydrophobicContact CG1-CG1 3.87Å; M232-I236 WeakPolarHBondContact O-CG1 3.04Å; M232-I236 PolarHBondContact O-N 3.47Å; I233-I236 PolarHBondContact O-N 3.15Å; N234-I236 PolarHBondContact O-N 2.96Å; I236-E238 PolarHBondContact O-N 2.72Å; I236-S239 WeakPolarHBondContact O-CB 3.43Å; I236-S239 PolarHBondContact O-N 2.89Å; I236-S239 VanDerWaalsContact O-N 3.16Å; I236-S239 PolarHBondContact O-OG 3.05Å; I236-Y240 HydrophobicContact CG2-CD2 4.22Å; I236-Y240 HydrophobicContact CG2-CE2 4.01Å; I236-Y240 WeakPolarHBondContact O-CD2 3.31Å; I236-Y240 PolarHBondContact O-N 3.48Å
237	K	98.6	Very high	97.7	Very high	122 Å²	122	77.2 Å²	77.2	53%	0.53	37%	0.373	S	S	.	.	H	α-helix	trans	-58.5	-49.3	176.9	-179.6	-178.2	169.4	-176.8	0	112.1	I233 N234 S239 Y240 E241	I233-K237 WeakPolarHBondContact O-CB 3.26Å; I233-K237 PolarHBondContact O-N 2.86Å; N234-K237 WeakPolarHBondContact O-CB 3.26Å; N234-K237 PolarHBondContact O-N 2.74Å; K237-S239 PolarHBondContact O-N 2.87Å; K237-Y240 PolarHBondContact O-N 3.45Å; K237-Y240 VanDerWaalsContact O-N 3.09Å; K237-E241 WeakPolarHBondContact CE-OE1 3.5Å; K237-E241 IonicContact NZ-OE1 3.82Å; K237-E241 PolarHBondContact O-N 2.94Å
238	E	98.4	Very high	97.5	Very high	95 Å²	95	85.2 Å²	85.2	44%	0.444	42%	0.416	S	S	.	.	H	α-helix	trans	-58.8	-35.3	177.1	-73.8	170.6	-165.9	0	0	111.7	N234 A235 I236 Y240 E241 Y242 F251	N234-E238 WeakPolarHBondContact O-CB 3.31Å; N234-E238 WeakPolarHBondContact O-CG 3.41Å; N234-E238 PolarHBondContact O-N 3.07Å; A235-E238 PolarHBondContact O-N 2.9Å; I236-E238 PolarHBondContact O-N 2.72Å; E238-Y240 VanDerWaalsContact C-N 3.29Å; E238-Y240 PolarHBondContact O-N 2.95Å; E238-E241 PolarHBondContact O-N 3.5Å; E238-Y242 PolarHBondContact O-N 3.46Å; E238-F251 HydrophobicContact CB-CE2 4.17Å
239	S	98.6	Very high	97.4	Very high	0 Å²	0	92 Å²	92	0%	0	44%	0.437	C	S	.	.	H	α-helix	trans	-63.7	-32.8	177.3	83.3	0	0	0	0	113	N181 T184 T186 A235 I236 K237 F251	N181-S239 PolarHBondContact ND2-OG 2.85Å; T184-S239 VanDerWaalsContact CB-O 3.27Å; T184-S239 WeakPolarHBondContact CB-O 2.91Å; T184-S239 VanDerWaalsContact CG2-O 3.3Å; T184-S239 WeakPolarHBondContact CG2-O 3.42Å; T184-S239 PolarHBondContact OG1-O 2.73Å; T186-S239 WeakPolarHBondContact OG1-CB 3.18Å; A235-S239 WeakPolarHBondContact O-CB 3.49Å; A235-S239 PolarHBondContact O-N 3.3Å; I236-S239 WeakPolarHBondContact O-CB 3.43Å; I236-S239 PolarHBondContact O-N 2.89Å; I236-S239 VanDerWaalsContact O-N 3.16Å; I236-S239 PolarHBondContact O-OG 3.05Å; K237-S239 PolarHBondContact O-N 2.87Å; S239-F251 VanDerWaalsContact CA-CE2 3.47Å
240	Y	98.4	Very high	97.3	Very high	75 Å²	75	94.6 Å²	94.6	29%	0.294	45%	0.453	S	S	.	.	H	α-helix	trans	-77.3	-30.1	175.8	-82.9	-73.4	0	0	0	113.2	D164 N166 Q183 I236 K237 E238 Y242	D164-Y240 PolarHBondContact OD1-OH 2.78Å; D164-Y240 PolarHBondContact OD2-OH 2.88Å; N166-Y240 HydrophobicContact CB-CE1 4.49Å; N166-Y240 WeakPolarHBondContact CB-OH 3.34Å; N166-Y240 PolarHBondContact ND2-OH 2.9Å; Q183-Y240 HydrophobicContact CB-CE1 4.33Å; I236-Y240 HydrophobicContact CG2-CD2 4.22Å; I236-Y240 HydrophobicContact CG2-CE2 4.01Å; I236-Y240 WeakPolarHBondContact O-CD2 3.31Å; I236-Y240 PolarHBondContact O-N 3.48Å; K237-Y240 PolarHBondContact O-N 3.45Å; K237-Y240 VanDerWaalsContact O-N 3.09Å; E238-Y240 VanDerWaalsContact C-N 3.29Å; E238-Y240 PolarHBondContact O-N 2.95Å; Y240-Y242 VanDerWaalsContact C-N 3.31Å
241	E	97.6	Very high	97.3	Very high	133 Å²	133	87.9 Å²	87.9	62%	0.621	42%	0.424	S	S	*	.	H	α-helix	trans	-79	-18.5	177.6	-66.4	174.7	-178.6	0	0	112.2	K237 E238 N243	K237-E241 WeakPolarHBondContact CE-OE1 3.5Å; K237-E241 IonicContact NZ-OE1 3.82Å; K237-E241 PolarHBondContact O-N 2.94Å; E238-E241 PolarHBondContact O-N 3.5Å; E241-N243 PolarHBondContact O-N 3.21Å
242	Y	98	Very high	97.3	Very high	54 Å²	54	88.4 Å²	88.4	21%	0.212	43%	0.434	C	S	.	.			trans	-66.7	129.3	-179.8	-176.3	-100.7	0	0	0	112.4	T186 E238 Y240 P244 T247 R249 F251	T186-Y242 HydrophobicContact CG2-CD1 3.28Å; T186-Y242 HydrophobicContact CG2-CE1 3.87Å; T186-Y242 HydrophobicContact CG2-CG 3.94Å; E238-Y242 PolarHBondContact O-N 3.46Å; Y240-Y242 VanDerWaalsContact C-N 3.31Å; Y242-P244 HydrophobicContact CE1-CB 4.21Å; Y242-P244 HydrophobicContact CE1-CG 4.38Å; Y242-T247 HydrophobicContact CD2-CG2 4.25Å; Y242-T247 HydrophobicContact CE2-CG2 3.81Å; Y242-R249 WeakPolarHBondContact CE2-O 3.38Å; Y242-F251 HydrophobicContact CD1-CB 4.16Å; Y242-F251 HydrophobicContact CD2-CB 3.84Å; Y242-F251 AromaticContact CD2-CD2 3.9Å; Y242-F251 HydrophobicContact CD2-CD2 3.9Å; Y242-F251 HydrophobicContact CD2-CG 4.38Å; Y242-F251 HydrophobicContact CE1-CB 4.07Å; Y242-F251 HydrophobicContact CE2-CB 3.76Å; Y242-F251 HydrophobicContact CG-CB 4.03Å; Y242-F251 AromaticContact CG-CD2 3.86Å; Y242-F251 HydrophobicContact CG-CD2 3.86Å; Y242-F251 HydrophobicContact CG-CG 4.35Å; Y242-F251 PolarHBondContact OH-N 2.8Å
243	N	96.6	Very high	97.3	Very high	59 Å²	59	89.6 Å²	89.6	32%	0.316	44%	0.443	S	S	.	.			trans	-143	112.1	173	-175.3	-32.8	0	0	0	109.7	E241 N245 K246 T247	E241-N243 PolarHBondContact O-N 3.21Å; N243-N245 PolarHBondContact O-N 2.85Å; N243-N245 VanDerWaalsContact O-N 3.12Å; N243-N245 WeakPolarHBondContact OD1-CB 3.4Å; N243-N245 PolarHBondContact OD1-N 3.28Å; N243-K246 HydrophobicContact CB-CB 4.4Å; N243-K246 HydrophobicContact CB-CD 4.31Å; N243-K246 HydrophobicContact CB-CG 4.31Å; N243-K246 PolarHBondContact O-N 3.36Å; N243-T247 PolarHBondContact O-N 2.93Å
244	P	95.2	Very high	97.3	Very high	75 Å²	75	87.4 Å²	87.4	49%	0.487	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-20	-175.6	26.4	-34.6	0	0	0	113.5	Y242 K246	Y242-P244 HydrophobicContact CE1-CB 4.21Å; Y242-P244 HydrophobicContact CE1-CG 4.38Å; P244-K246 PolarHBondContact O-N 2.76Å
245	N	96.4	Very high	97.3	Very high	152 Å²	152	89.3 Å²	89.3	81%	0.813	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.4	175.9	-60	-36.1	0	0	0	113	N243	N243-N245 PolarHBondContact O-N 2.85Å; N243-N245 VanDerWaalsContact O-N 3.12Å; N243-N245 WeakPolarHBondContact OD1-CB 3.4Å; N243-N245 PolarHBondContact OD1-N 3.28Å
246	K	95.7	Very high	97.3	Very high	182 Å²	182	90 Å²	90	79%	0.791	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-5.2	-178.3	-62.5	-175	-179.1	179.9	0	113.5	N243 P244	N243-K246 HydrophobicContact CB-CB 4.4Å; N243-K246 HydrophobicContact CB-CD 4.31Å; N243-K246 HydrophobicContact CB-CG 4.31Å; N243-K246 PolarHBondContact O-N 3.36Å; P244-K246 PolarHBondContact O-N 2.76Å
247	T	95.1	Very high	97.3	Very high	53 Å²	53	92.5 Å²	92.5	33%	0.325	45%	0.449	S	S	.	.			trans	-147.3	142.8	-178.6	-179.8	0	0	0	0	111.6	Y242 N243 R249	Y242-T247 HydrophobicContact CD2-CG2 4.25Å; Y242-T247 HydrophobicContact CE2-CG2 3.81Å; N243-T247 PolarHBondContact O-N 2.93Å; T247-R249 PolarHBondContact OG1-N 3.05Å; T247-R249 VanDerWaalsContact OG1-N 3.16Å
248	N	94.3	Very high	97.3	Very high	173 Å²	173	93 Å²	93	93%	0.925	45%	0.451	S	S	*	.	S	Bend	trans	-89.6	-3.2	174.3	-63.2	-11	0	0	0	112.7
249	R	95.3	Very high	97.3	Very high	202 Å²	202	89 Å²	89	76%	0.762	43%	0.434	S	S	*	.	S	Bend	trans	-91.6	134.9	179.3	-66	-177.7	179.8	171.8	0.5	109.9	Y242 T247	Y242-R249 WeakPolarHBondContact CE2-O 3.38Å; T247-R249 PolarHBondContact OG1-N 3.05Å; T247-R249 VanDerWaalsContact OG1-N 3.16Å
250	P	96.7	Very high	97.3	Very high	99 Å²	99	91 Å²	91	64%	0.643	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-66.7	152	173.8	29.9	-34.9	0	0	0	110.8	I252	P250-I252 PolarHBondContact O-N 2.88Å
251	F	97.9	Very high	97.4	Very high	41 Å²	41	87.5 Å²	87.5	18%	0.18	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-62.4	133.2	169.5	-174.7	-96.7	0	0	0	110.3	T186 L187 E238 S239 Y242	T186-F251 HydrophobicContact CG2-CB 3.91Å; T186-F251 HydrophobicContact CG2-CD1 4.24Å; T186-F251 HydrophobicContact CG2-CD2 4.18Å; T186-F251 HydrophobicContact CG2-CG 3.82Å; L187-F251 WeakPolarHBondContact O-CD1 3.4Å; L187-F251 WeakPolarHBondContact O-CE1 3.41Å; E238-F251 HydrophobicContact CB-CE2 4.17Å; S239-F251 VanDerWaalsContact CA-CE2 3.47Å; Y242-F251 HydrophobicContact CD1-CB 4.16Å; Y242-F251 HydrophobicContact CD2-CB 3.84Å; Y242-F251 AromaticContact CD2-CD2 3.9Å; Y242-F251 HydrophobicContact CD2-CD2 3.9Å; Y242-F251 HydrophobicContact CD2-CG 4.38Å; Y242-F251 HydrophobicContact CE1-CB 4.07Å; Y242-F251 HydrophobicContact CE2-CB 3.76Å; Y242-F251 HydrophobicContact CG-CB 4.03Å; Y242-F251 AromaticContact CG-CD2 3.86Å; Y242-F251 HydrophobicContact CG-CD2 3.86Å; Y242-F251 HydrophobicContact CG-CG 4.35Å; Y242-F251 PolarHBondContact OH-N 2.8Å
252	I	98.2	Very high	97.4	Very high	134 Å²	134	83.4 Å²	83.4	69%	0.687	42%	0.417	S	S	*	.			trans	-101	106.9	-177.6	-56.1	177.7	0	0	0	109	P250	P250-I252 PolarHBondContact O-N 2.88Å
253	S	98.5	Very high	97.5	Very high	27 Å²	27	81.1 Å²	81.1	19%	0.189	41%	0.409	C	S	.	.			trans	-66.1	142.1	176.8	64.7	0	0	0	0	112.2	L187	L187-S253 WeakPolarHBondContact O-CA 3.14Å; L187-S253 WeakPolarHBondContact O-CB 3.45Å
254	Q	98.7	Very high	97.6	Very high	44 Å²	44	85.6 Å²	85.6	21%	0.206	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	130.9	170.7	-66.1	-59.2	-41.3	0	0	111.6	V188 A189 I190 A235 I256	V188-Q254 PolarHBondContact O-N 3.23Å; A189-Q254 CarbonylContact C-O 3.37Å; A189-Q254 VanDerWaalsContact CA-O 3.26Å; A189-Q254 WeakPolarHBondContact CA-O 3.27Å; A189-Q254 HydrophobicContact CB-CB 4.11Å; I190-Q254 PolarHBondContact N-O 3.23Å; A235-Q254 HydrophobicContact CB-CG 3.37Å; Q254-I256 HydrophobicContact CB-CD1 4.01Å; Q254-I256 HydrophobicContact CB-CG1 4.5Å
255	K	98.6	Very high	97.7	Very high	128 Å²	128	87.5 Å²	87.5	56%	0.557	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	109.3	171.6	-56.5	-176.8	-177.4	-171.7	0	109.4	R231	R231-K255 PolarHBondContact NH2-O 2.65Å
256	I	98.6	Very high	97.8	Very high	18 Å²	18	80.6 Å²	80.6	9%	0.092	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	98.8	-178.3	-50.4	-56.1	0	0	0	108.3	A189 I190 F191 G192 W225 M232 Q254	A189-I256 HydrophobicContact CB-CG1 4.4Å; I190-I256 PolarHBondContact O-N 2.98Å; F191-I256 WeakPolarHBondContact CA-O 3.31Å; F191-I256 HydrophobicContact CD1-CB 3.68Å; F191-I256 HydrophobicContact CD1-CG1 3.95Å; F191-I256 HydrophobicContact CD1-CG2 3.79Å; F191-I256 HydrophobicContact CE1-CB 4.16Å; F191-I256 HydrophobicContact CE1-CG1 3.92Å; F191-I256 HydrophobicContact CE1-CG2 4.23Å; F191-I256 HydrophobicContact CG-CB 4.32Å; G192-I256 PolarHBondContact N-O 3.16Å; W225-I256 HydrophobicContact CE3-CG2 4.01Å; W225-I256 HydrophobicContact CZ3-CG2 4.22Å; M232-I256 HydrophobicContact SD-CD1 3.81Å; M232-I256 HydrophobicContact SD-CG1 3.93Å; Q254-I256 HydrophobicContact CB-CD1 4.01Å; Q254-I256 HydrophobicContact CB-CG1 4.5Å
257	H	98.6	Very high	98	Very high	76 Å²	76	72.1 Å²	72.1	35%	0.352	35%	0.353	S	S	.	.			trans	-89.3	-17.5	-171.8	-68.6	-47.4	0	0	0	115.7	G192 V194 E195	G192-H257 VanDerWaalsContact O-CA 3.25Å; G192-H257 WeakPolarHBondContact O-CA 3.2Å; G192-H257 PolarHBondContact O-ND1 3.27Å; V194-H257 HydrophobicContact CG1-CB 4.31Å; E195-H257 CarbonylContact C-O 3.6Å; E195-H257 WeakPolarHBondContact CB-O 3.45Å; E195-H257 PolarHBondContact N-O 3.31Å; E195-H257 VanDerWaalsContact N-O 3.13Å
258	F	98.6	Very high	98.1	Very high	133 Å²	133	80.1 Å²	80.1	58%	0.583	38%	0.378	S	S	*	.	S	Bend	trans	-126.8	121.8	-170.8	-60.1	-83.5	0	0	0	109	V194 E195	V194-F258 HydrophobicContact CG1-CE1 3.84Å; V194-F258 HydrophobicContact CG1-CE2 4.42Å; V194-F258 HydrophobicContact CG1-CZ 3.69Å; E195-F258 HydrophobicContact CB-CD1 3.77Å; E195-F258 HydrophobicContact CB-CE1 4.26Å; E195-F258 HydrophobicContact CG-CD1 3.48Å; E195-F258 VanDerWaalsContact CG-CD1 3.48Å; E195-F258 HydrophobicContact CG-CE1 3.57Å
259	P	98.7	Very high	98.3	Very high	12 Å²	12	75 Å²	75	8%	0.078	35%	0.35	C	S	.	.			trans	-72.7	156	170.1	32	-34.7	0	0	0	110.6	E195 K223 L224 W225 F261	E195-P259 VanDerWaalsContact O-CD 3.25Å; E195-P259 WeakPolarHBondContact O-CD 3.3Å; K223-P259 HydrophobicContact CB-CB 3.96Å; K223-P259 HydrophobicContact CB-CG 4.42Å; K223-P259 HydrophobicContact CD-CG 4.22Å; K223-P259 HydrophobicContact CG-CB 4.32Å; K223-P259 HydrophobicContact CG-CG 4.23Å; L224-P259 CarbonylContact O-C 3.58Å; L224-P259 VanDerWaalsContact O-CA 3.29Å; L224-P259 WeakPolarHBondContact O-CA 3.41Å; L224-P259 VanDerWaalsContact O-CB 3.23Å; L224-P259 WeakPolarHBondContact O-CB 3.47Å; W225-P259 HydrophobicContact CD2-CB 4.15Å; W225-P259 HydrophobicContact CE3-CB 3.93Å; W225-P259 HydrophobicContact CH2-CB 3.9Å; W225-P259 HydrophobicContact CH2-CG 4.33Å; W225-P259 HydrophobicContact CZ2-CB 4.09Å; W225-P259 HydrophobicContact CZ3-CB 3.81Å; W225-P259 HydrophobicContact CZ3-CG 4.47Å; P259-F261 VanDerWaalsContact C-N 3.27Å
260	D	98.6	Very high	98.4	Very high	42 Å²	42	66.5 Å²	66.5	23%	0.225	32%	0.318	C	S	.	.	S	Bend	trans	-80.8	-9	178.4	-62.7	-85.2	0	0	0	113.3	L224 R226 K306 P307	L224-D260 HydrophobicContact CD2-CB 4.18Å; L224-D260 HydrophobicContact CG-CB 4.22Å; L224-D260 PolarHBondContact O-N 3.22Å; R226-D260 WeakPolarHBondContact CB-OD2 3.41Å; R226-D260 HydrophobicContact CG-CB 3.97Å; R226-D260 PolarHBondContact N-OD2 2.69Å; D260-K306 CarbonylContact O-C 3.53Å; D260-P307 VanDerWaalsContact O-CA 3.23Å; D260-P307 WeakPolarHBondContact O-CA 3.39Å
261	F	98.8	Very high	98.5	Very high	1 Å²	1	61.8 Å²	61.8	0%	0.004	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	147.6	170.3	169.9	-98.3	0	0	0	108.6	K223 L224 P259 T263 W293 P295 I305 E309 V312	K223-F261 WeakPolarHBondContact CA-O 3.44Å; L224-F261 HydrophobicContact CB-CB 3.74Å; L224-F261 HydrophobicContact CD2-CB 4.01Å; L224-F261 PolarHBondContact N-O 2.85Å; P259-F261 VanDerWaalsContact C-N 3.27Å; F261-T263 HydrophobicContact CE1-CG2 3.62Å; F261-T263 HydrophobicContact CZ-CG2 3.9Å; F261-W293 AromaticContact CE1-CH2 3.81Å; F261-W293 HydrophobicContact CE1-CH2 3.81Å; F261-W293 AromaticContact CE1-CZ3 3.75Å; F261-W293 HydrophobicContact CE1-CZ3 3.75Å; F261-W293 HydrophobicContact CZ-CZ3 4.19Å; F261-P295 HydrophobicContact CD1-CB 3.93Å; F261-P295 HydrophobicContact CD1-CG 3.77Å; F261-P295 HydrophobicContact CD2-CB 3.94Å; F261-P295 HydrophobicContact CE1-CB 3.8Å; F261-P295 HydrophobicContact CE1-CG 3.74Å; F261-P295 HydrophobicContact CE2-CB 3.81Å; F261-P295 HydrophobicContact CG-CB 3.99Å; F261-P295 HydrophobicContact CG-CG 4.25Å; F261-P295 HydrophobicContact CZ-CB 3.74Å; F261-P295 HydrophobicContact CZ-CG 4.18Å; F261-I305 HydrophobicContact CB-CG2 4.1Å; F261-I305 HydrophobicContact CD2-CG2 3.9Å; F261-I305 HydrophobicContact CG-CG2 4.26Å; F261-E309 HydrophobicContact CD2-CB 4.1Å; F261-E309 HydrophobicContact CD2-CG 4.45Å; F261-E309 HydrophobicContact CE2-CB 4.31Å; F261-E309 HydrophobicContact CE2-CG 4.26Å; F261-V312 HydrophobicContact CZ-CG1 3.71Å
262	S	98.8	Very high	98.5	Very high	46 Å²	46	59.9 Å²	59.9	32%	0.322	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	133.9	176.1	-175.2	0	0	0	0	110.2	L222 K223	L222-S262 WeakPolarHBondContact O-CA 3.48Å; K223-S262 PolarHBondContact NZ-OG 3.12Å
263	T	98.8	Very high	98.5	Very high	7 Å²	7	53.6 Å²	53.6	4%	0.043	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	152.3	173.6	-176.3	0	0	0	0	111.3	S221 L222 F261 D265 I266 W293 V312	S221-T263 CarbonylContact C-O 3.48Å; S221-T263 WeakPolarHBondContact CA-O 3.48Å; L222-T263 HydrophobicContact CB-CG2 4.27Å; L222-T263 PolarHBondContact N-O 2.66Å; L222-T263 PolarHBondContact O-N 3.37Å; F261-T263 HydrophobicContact CE1-CG2 3.62Å; F261-T263 HydrophobicContact CZ-CG2 3.9Å; T263-D265 PolarHBondContact OG1-N 3.06Å; T263-D265 VanDerWaalsContact OG1-N 3.08Å; T263-I266 HydrophobicContact CG2-CG1 3.92Å; T263-W293 HydrophobicContact CG2-CH2 3.7Å; T263-W293 HydrophobicContact CG2-CZ2 4.4Å; T263-W293 HydrophobicContact CG2-CZ3 3.91Å; T263-V312 HydrophobicContact CG2-CG1 4.03Å
264	R	98.8	Very high	98.6	Very high	152 Å²	152	52.3 Å²	52.3	57%	0.574	24%	0.238	S	C	*	.			trans	-125.1	13.2	168.5	-63.9	176.2	74.5	-160	-0.5	111.4	D219	D219-R264 PolarHBondContact O-NE 2.97Å; D219-R264 PolarHBondContact O-NH2 3.21Å
265	D	98.6	Very high	98.6	Very high	115 Å²	115	52.1 Å²	52.1	62%	0.615	24%	0.236	S	C	*	.	S	Bend	trans	-96	-0.6	-169.3	-59.1	-37.7	0	0	0	113.2	T263 V312	T263-D265 PolarHBondContact OG1-N 3.06Å; T263-D265 VanDerWaalsContact OG1-N 3.08Å; D265-V312 HydrophobicContact CB-CG2 4.09Å
266	I	98.7	Very high	98.6	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.041	21%	0.21	C	C	.	.	S	Bend	trans	-86.5	-47.4	-178	-53	-59	0	0	0	111.8	L222 T263 V291 W293 V312 I314	L222-I266 HydrophobicContact CD1-CB 4.23Å; L222-I266 HydrophobicContact CD1-CG1 4.33Å; T263-I266 HydrophobicContact CG2-CG1 3.92Å; I266-V291 HydrophobicContact CG2-CB 4.11Å; I266-V291 HydrophobicContact CG2-CG1 3.89Å; I266-W293 HydrophobicContact CD1-CB 4.04Å; I266-W293 HydrophobicContact CD1-CD2 3.49Å; I266-W293 VanDerWaalsContact CD1-CD2 3.49Å; I266-W293 HydrophobicContact CD1-CE3 3.55Å; I266-W293 HydrophobicContact CD1-CG 3.7Å; I266-W293 HydrophobicContact CD1-CZ3 4.27Å; I266-W293 HydrophobicContact CG1-CD2 3.68Å; I266-W293 HydrophobicContact CG1-CE3 3.95Å; I266-W293 HydrophobicContact CG1-CG 4.11Å; I266-W293 HydrophobicContact CG1-CH2 4.45Å; I266-W293 HydrophobicContact CG1-CZ2 4.19Å; I266-W293 HydrophobicContact CG1-CZ3 4.32Å; I266-W293 HydrophobicContact CG2-CD2 4.47Å; I266-W293 HydrophobicContact CG2-CG 4.12Å; I266-V312 HydrophobicContact CD1-CB 3.82Å; I266-V312 HydrophobicContact CD1-CG1 4.03Å; I266-V312 HydrophobicContact CD1-CG2 3.8Å; I266-I314 HydrophobicContact CD1-CG1 4.34Å
267	H	98.6	Very high	98.5	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.019	21%	0.214	C	C	.	.			trans	-126.7	150.2	-175.2	-57.7	-79.4	0	0	0	110.2	V271 S283	H267-V271 HydrophobicContact CB-CG2 3.91Å; H267-S283 PolarHBondContact CE1-O 2.88Å; H267-S283 VanDerWaalsContact CE1-O 3.3Å; H267-S283 WeakPolarHBondContact NE2-CB 3.37Å; H267-S283 PolarHBondContact NE2-OG 2.87Å
268	R	97.1	Very high	98.3	Very high	221 Å²	221	45.3 Å²	45.3	83%	0.834	22%	0.218	S	C	*	.	S	Bend	trans	-96.1	-0.9	-179.7	-62.3	-178.1	176.1	177.3	-0.6	114.2	H220 E287	H220-R268 PolarHBondContact CE1-O 3.47Å; H220-R268 VanDerWaalsContact CE1-O 3.26Å; H220-R268 PolarHBondContact ND1-O 2.8Å; R268-E287 PolarHBondContact N-OE1 3.04Å; R268-E287 VanDerWaalsContact N-OE1 3.17Å
269	N	98.3	Very high	98.1	Very high	65 Å²	65	43.3 Å²	43.3	35%	0.348	21%	0.213	S	C	.	.	S	Bend	trans	-140.6	-171.9	-178.5	-152.3	-30.3	0	0	0	110	H220 C286	H220-N269 WeakPolarHBondContact CB-O 3.19Å; H220-N269 PolarHBondContact CD2-O 2.87Å; H220-N269 VanDerWaalsContact CD2-O 3.31Å; H220-N269 WeakPolarHBondContact NE2-CA 3.44Å; N269-C286 PolarHBondContact ND2-SG 3.04Å; N269-C286 VanDerWaalsContact ND2-SG 3.4Å
270	Y	98.1	Very high	98.1	Very high	24 Å²	24	45 Å²	45	9%	0.094	22%	0.222	C	C	.	.			trans	-47.4	146	177.3	65.6	-104	0	0	0	111.9	L202 M218 H220 D272 S285 C286 D324 I325 W326	L202-Y270 HydrophobicContact CD1-CD2 4.42Å; M218-Y270 VanDerWaalsContact SD-CB 3.6Å; M218-Y270 HydrophobicContact SD-CG 4.29Å; H220-Y270 PolarHBondContact CD2-N 3.2Å; H220-Y270 VanDerWaalsContact CD2-N 3.34Å; Y270-D272 HydrophobicContact CD2-CB 3.8Å; Y270-D272 HydrophobicContact CE2-CB 3.92Å; Y270-S285 WeakPolarHBondContact O-CA 3.4Å; Y270-S285 WeakPolarHBondContact O-CB 3.42Å; Y270-S285 PolarHBondContact O-OG 2.81Å; Y270-C286 HydrophobicContact CE1-CB 4.04Å; Y270-C286 HydrophobicContact CE2-CB 4.49Å; Y270-C286 WeakPolarHBondContact OH-CB 3.3Å; Y270-D324 PolarHBondContact OH-O 3.28Å; Y270-I325 PolarHBondContact OH-O 3.3Å; Y270-W326 AromaticContact CD2-CD1 3.89Å; Y270-W326 HydrophobicContact CE1-CB 4.5Å; Y270-W326 AromaticContact CE2-CD1 3.89Å; Y270-W326 WeakPolarHBondContact OH-CA 3.42Å; Y270-W326 PolarHBondContact OH-N 2.66Å
271	V	98.8	Very high	98.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.			trans	-114.6	101.6	175.2	-171.3	0	0	0	0	107.5	C216 G217 L222 H267 K284	C216-V271 HydrophobicContact CB-CB 3.76Å; C216-V271 HydrophobicContact CB-CG1 3.57Å; C216-V271 PolarHBondContact SG-O 3.03Å; G217-V271 PolarHBondContact O-N 2.91Å; L222-V271 HydrophobicContact CD1-CG1 4.27Å; L222-V271 HydrophobicContact CD1-CG2 4.11Å; L222-V271 HydrophobicContact CD2-CG1 4.16Å; L222-V271 HydrophobicContact CG-CG1 4.29Å; H267-V271 HydrophobicContact CB-CG2 3.91Å; V271-K284 WeakPolarHBondContact CA-O 3.46Å; V271-K284 WeakPolarHBondContact CG1-O 3.46Å
272	D	98.4	Very high	98.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.			trans	-96.6	-8.9	-168.5	67.3	-25.8	0	0	0	114.3	L202 Y270 K284 Y327 M328	L202-D272 HydrophobicContact CD1-CB 3.96Å; Y270-D272 HydrophobicContact CD2-CB 3.8Å; Y270-D272 HydrophobicContact CE2-CB 3.92Å; D272-K284 PolarHBondContact N-O 3.13Å; D272-K284 IonicContact OD1-NZ 2.9Å; D272-K284 PolarHBondContact OD1-NZ 3.29Å; D272-K284 IonicContact OD2-NZ 3.13Å; D272-K284 PolarHBondContact OD2-NZ 3.45Å; D272-Y327 PolarHBondContact OD2-N 2.95Å; D272-M328 PolarHBondContact OD2-N 3.16Å; D272-M328 VanDerWaalsContact OD2-N 3.09Å
273	C	98.9	Very high	98.1	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.02	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	133.2	174.9	-160.7	0	0	0	0	111.1	S283 K284 F330	C273-S283 VanDerWaalsContact O-CA 3.26Å; C273-S283 WeakPolarHBondContact O-CA 3.35Å; C273-K284 HydrophobicContact CB-CD 4.34Å; C273-K284 HydrophobicContact CB-CG 3.89Å; C273-K284 PolarHBondContact O-N 3.27Å; C273-F330 HydrophobicContact CB-CD1 3.78Å; C273-F330 HydrophobicContact CB-CE1 3.7Å
274	V	98.9	Very high	98.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	141.4	176.7	64.6	0	0	0	0	110.1	S203 M214 C216 L222 I281 L282	S203-V274 PolarHBondContact OG-N 2.65Å; M214-V274 HydrophobicContact CB-CG2 4.25Å; M214-V274 HydrophobicContact CG-CG2 3.72Å; C216-V274 HydrophobicContact CB-CB 4.29Å; C216-V274 HydrophobicContact CB-CG1 4.18Å; C216-V274 WeakPolarHBondContact SG-CG1 3.21Å; L222-V274 HydrophobicContact CD2-CB 4.36Å; L222-V274 HydrophobicContact CD2-CG2 3.84Å; V274-I281 HydrophobicContact CG2-CG2 3.55Å; V274-L282 CarbonylContact C-O 3.5Å; V274-L282 VanDerWaalsContact CA-O 3.31Å; V274-L282 WeakPolarHBondContact CA-O 3.29Å
275	R	98.9	Very high	98.1	Very high	40 Å²	40	33.2 Å²	33.2	15%	0.151	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	151.5	172.3	-66.5	-64.8	-169.5	155.6	10.8	111.6	K159 D205 L282 F330 M332	K159-R275 VanDerWaalsContact CE-NH1 3.25Å; K159-R275 VanDerWaalsContact NZ-NH2 3.12Å; D205-R275 WeakPolarHBondContact OD1-CD 3.45Å; D205-R275 IonicContact OD1-CZ 3.11Å; D205-R275 IonicContact OD1-NE 3.43Å; D205-R275 IonicContact OD1-NH1 3.93Å; D205-R275 PolarHBondContact OD1-NH1 2.86Å; D205-R275 VanDerWaalsContact OD2-CA 3.25Å; D205-R275 WeakPolarHBondContact OD2-CA 3.24Å; D205-R275 WeakPolarHBondContact OD2-CD 3.34Å; D205-R275 IonicContact OD2-NH1 2.71Å; R275-L282 PolarHBondContact N-O 3.08Å; R275-L282 PolarHBondContact O-N 2.87Å; R275-F330 HydrophobicContact CB-CE2 3.66Å; R275-F330 HydrophobicContact CB-CZ 4Å; R275-F330 HydrophobicContact CG-CD2 4.19Å; R275-F330 HydrophobicContact CG-CE2 3.4Å; R275-F330 VanDerWaalsContact CG-CE2 3.4Å; R275-F330 HydrophobicContact CG-CZ 3.87Å; R275-M332 HydrophobicContact CB-CE 3.58Å; R275-M332 HydrophobicContact CG-CE 4.13Å
276	W	98.7	Very high	98	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.008	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	140.6	168.6	-72.6	92.1	0	0	0	111.7	D205 Y206 D207 K212 M214 L224 I281 I302 M332 Q336	D205-W276 PolarHBondContact O-NE1 2.83Å; D205-W276 PolarHBondContact OD2-N 2.84Å; Y206-W276 VanDerWaalsContact O-CD1 3.27Å; D207-W276 HydrophobicContact CB-CD2 3.88Å; D207-W276 HydrophobicContact CB-CE3 4.35Å; D207-W276 HydrophobicContact CB-CG 3.96Å; D207-W276 VanDerWaalsContact N-CD1 3.34Å; K212-W276 HydrophobicContact CB-CZ2 4.46Å; K212-W276 HydrophobicContact CD-CH2 3.67Å; K212-W276 HydrophobicContact CD-CZ2 3.99Å; K212-W276 HydrophobicContact CD-CZ3 4.34Å; K212-W276 HydrophobicContact CG-CH2 4.1Å; K212-W276 HydrophobicContact CG-CZ2 3.88Å; M214-W276 HydrophobicContact CB-CZ2 3.95Å; M214-W276 HydrophobicContact CE-CH2 4.38Å; M214-W276 HydrophobicContact CE-CZ2 4.25Å; L224-W276 HydrophobicContact CD1-CH2 3.82Å; L224-W276 HydrophobicContact CD1-CZ2 3.6Å; W276-I281 HydrophobicContact CD2-CD1 3.73Å; W276-I281 HydrophobicContact CE3-CD1 3.58Å; W276-I281 HydrophobicContact CH2-CD1 3.71Å; W276-I281 HydrophobicContact CZ2-CD1 3.85Å; W276-I281 HydrophobicContact CZ3-CD1 3.57Å; W276-I302 HydrophobicContact CH2-CD1 4.3Å; W276-I302 HydrophobicContact CH2-CG1 4.12Å; W276-I302 HydrophobicContact CZ3-CD1 4.39Å; W276-I302 HydrophobicContact CZ3-CG1 4.11Å; W276-M332 VanDerWaalsContact O-CE 3.3Å; W276-M332 WeakPolarHBondContact O-CE 3.37Å; W276-Q336 PolarHBondContact O-NE2 3.34Å
277	L	96.9	Very high	98	Very high	34 Å²	34	32.1 Å²	32.1	18%	0.178	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	89.4	168.7	177.5	63.8	0	0	0	108	D279 L280 L282 M332 Q336 L353	L277-D279 PolarHBondContact O-N 3.41Å; L277-L280 HydrophobicContact CB-CB 4.43Å; L277-L280 PolarHBondContact N-O 3.13Å; L277-L280 WeakPolarHBondContact O-CB 3.23Å; L277-L280 PolarHBondContact O-N 3.34Å; L277-L282 HydrophobicContact CB-CD1 4.4Å; L277-L282 HydrophobicContact CB-CG 4.16Å; L277-L282 HydrophobicContact CD2-CD1 4.3Å; L277-L282 HydrophobicContact CD2-CD2 4.32Å; L277-L282 HydrophobicContact CD2-CG 4.38Å; L277-M332 HydrophobicContact CD1-SD 4.38Å; L277-Q336 HydrophobicContact CD1-CB 3.98Å; L277-L353 HydrophobicContact CD1-CD1 4.09Å
278	G	94.3	Very high	97.9	Very high	43 Å²	43	33.8 Å²	33.8	44%	0.443	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	-122.2	-163	0	0	0	0	0	110.7
279	D	95.6	Very high	97.9	Very high	90 Å²	90	23.4 Å²	23.4	48%	0.481	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.5	175.3	-64.1	-29.8	0	0	0	113.7	L277 I302	L277-D279 PolarHBondContact O-N 3.41Å; D279-I302 HydrophobicContact CB-CB 4.24Å; D279-I302 HydrophobicContact CB-CG2 3.95Å
280	L	97.1	Very high	97.9	Very high	49 Å²	49	20.3 Å²	20.3	26%	0.257	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	161.5	177.2	-50.4	-177.8	0	0	0	110.8	L277 K294 L315	L277-L280 HydrophobicContact CB-CB 4.43Å; L277-L280 PolarHBondContact N-O 3.13Å; L277-L280 WeakPolarHBondContact O-CB 3.23Å; L277-L280 PolarHBondContact O-N 3.34Å; L280-K294 HydrophobicContact CD2-CB 4.04Å; L280-K294 HydrophobicContact CD2-CD 4.27Å; L280-L315 HydrophobicContact CD1-CD1 3.6Å; L280-L315 HydrophobicContact CD2-CD1 3.39Å; L280-L315 HydrophobicContact CG-CD1 4.05Å
281	I	98.7	Very high	98	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.5	175.6	-51.3	-68.2	0	0	0	109.1	M214 L222 V274 W276 C292 W293	M214-I281 HydrophobicContact CB-CD1 4.02Å; M214-I281 HydrophobicContact CE-CD1 3.56Å; M214-I281 HydrophobicContact CE-CG1 4.04Å; M214-I281 HydrophobicContact CG-CD1 3.92Å; M214-I281 HydrophobicContact CG-CG2 4.4Å; L222-I281 HydrophobicContact CD2-CG2 4.28Å; V274-I281 HydrophobicContact CG2-CG2 3.55Å; W276-I281 HydrophobicContact CD2-CD1 3.73Å; W276-I281 HydrophobicContact CE3-CD1 3.58Å; W276-I281 HydrophobicContact CH2-CD1 3.71Å; W276-I281 HydrophobicContact CZ2-CD1 3.85Å; W276-I281 HydrophobicContact CZ3-CD1 3.57Å; I281-C292 WeakPolarHBondContact O-CA 3.38Å; I281-W293 HydrophobicContact CB-CD2 4.14Å; I281-W293 HydrophobicContact CB-CG 4.42Å; I281-W293 HydrophobicContact CB-CZ2 3.82Å; I281-W293 HydrophobicContact CG1-CH2 4.18Å; I281-W293 HydrophobicContact CG1-CZ2 3.87Å; I281-W293 HydrophobicContact CG2-CZ2 3.67Å; I281-W293 PolarHBondContact N-O 2.82Å; I281-W293 PolarHBondContact O-N 3.26Å
282	L	98.8	Very high	97.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	131.5	161.1	-61.3	-175.2	0	0	0	108.5	V274 R275 L277 I290 V291 C292 F318 F330 M332 L339	V274-L282 CarbonylContact C-O 3.5Å; V274-L282 VanDerWaalsContact CA-O 3.31Å; V274-L282 WeakPolarHBondContact CA-O 3.29Å; R275-L282 PolarHBondContact N-O 3.08Å; R275-L282 PolarHBondContact O-N 2.87Å; L277-L282 HydrophobicContact CB-CD1 4.4Å; L277-L282 HydrophobicContact CB-CG 4.16Å; L277-L282 HydrophobicContact CD2-CD1 4.3Å; L277-L282 HydrophobicContact CD2-CD2 4.32Å; L277-L282 HydrophobicContact CD2-CG 4.38Å; L282-I290 HydrophobicContact CB-CG2 3.97Å; L282-I290 HydrophobicContact CD2-CG2 4.32Å; L282-V291 WeakPolarHBondContact CA-O 3.42Å; L282-C292 HydrophobicContact CD2-CB 3.62Å; L282-F318 HydrophobicContact CD2-CD2 4.47Å; L282-F318 HydrophobicContact CD2-CE2 3.73Å; L282-F330 HydrophobicContact CB-CE2 3.97Å; L282-F330 HydrophobicContact CB-CZ 3.79Å; L282-F330 HydrophobicContact CD1-CE2 4.45Å; L282-M332 HydrophobicContact CD1-SD 3.9Å; L282-L339 HydrophobicContact CD1-CD1 4.25Å; L282-L339 HydrophobicContact CD1-CD2 4.3Å
283	S	98.9	Very high	97.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	150.7	176.4	54.3	0	0	0	0	111.4	H267 C273 I290 V291 W293	H267-S283 PolarHBondContact CE1-O 2.88Å; H267-S283 VanDerWaalsContact CE1-O 3.3Å; H267-S283 WeakPolarHBondContact NE2-CB 3.37Å; H267-S283 PolarHBondContact NE2-OG 2.87Å; C273-S283 VanDerWaalsContact O-CA 3.26Å; C273-S283 WeakPolarHBondContact O-CA 3.35Å; S283-I290 CarbonylContact O-C 3.59Å; S283-V291 PolarHBondContact N-O 3.03Å; S283-V291 PolarHBondContact O-N 2.92Å; S283-W293 PolarHBondContact OG-NE1 3.04Å
284	K	98.8	Very high	97.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	159	177	63.6	167.4	-74.6	-72.1	0	113.1	V271 D272 C273 A289 I290 Y320 M328 F330 L341	V271-K284 WeakPolarHBondContact CA-O 3.46Å; V271-K284 WeakPolarHBondContact CG1-O 3.46Å; D272-K284 PolarHBondContact N-O 3.13Å; D272-K284 IonicContact OD1-NZ 2.9Å; D272-K284 PolarHBondContact OD1-NZ 3.29Å; D272-K284 IonicContact OD2-NZ 3.13Å; D272-K284 PolarHBondContact OD2-NZ 3.45Å; C273-K284 HydrophobicContact CB-CD 4.34Å; C273-K284 HydrophobicContact CB-CG 3.89Å; C273-K284 PolarHBondContact O-N 3.27Å; K284-A289 WeakPolarHBondContact CB-O 3.48Å; K284-I290 HydrophobicContact CB-CG1 3.86Å; K284-I290 HydrophobicContact CD-CG1 4.33Å; K284-I290 HydrophobicContact CG-CG1 4.41Å; K284-Y320 VanDerWaalsContact CE-OH 3.27Å; K284-Y320 WeakPolarHBondContact CE-OH 3.22Å; K284-M328 PolarHBondContact NZ-O 3.32Å; K284-F330 HydrophobicContact CD-CD1 3.86Å; K284-F330 HydrophobicContact CG-CD1 3.84Å; K284-F330 HydrophobicContact CG-CE1 3.99Å; K284-L341 HydrophobicContact CD-CD1 4.3Å; K284-L341 HydrophobicContact CD-CD2 4.24Å
285	S	98.7	Very high	97.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.114	C	C	.	.			trans	-130.3	-154.2	173.4	-172.2	0	0	0	0	108.9	Y270 E287	Y270-S285 WeakPolarHBondContact O-CA 3.4Å; Y270-S285 WeakPolarHBondContact O-CB 3.42Å; Y270-S285 PolarHBondContact O-OG 2.81Å; S285-E287 VanDerWaalsContact C-N 3.29Å
286	C	97.7	Very high	97.8	Very high	31 Å²	31	18.4 Å²	18.4	21%	0.209	11%	0.107	C	C	.	.	S	Bend	trans	-86.3	8	175.7	66.2	0	0	0	0	113.8	N269 Y270 N288 D324	N269-C286 PolarHBondContact ND2-SG 3.04Å; N269-C286 VanDerWaalsContact ND2-SG 3.4Å; Y270-C286 HydrophobicContact CE1-CB 4.04Å; Y270-C286 HydrophobicContact CE2-CB 4.49Å; Y270-C286 WeakPolarHBondContact OH-CB 3.3Å; C286-N288 PolarHBondContact O-N 3.11Å; C286-D324 HydrophobicContact CB-CB 4.41Å; C286-D324 WeakPolarHBondContact O-CB 2.98Å
287	E	97.4	Very high	97.8	Very high	68 Å²	68	23.3 Å²	23.3	32%	0.318	13%	0.129	S	C	.	.	S	Bend	trans	-83.5	10.2	-173	-58.4	177.4	171	0	0	113.5	R268 S285 A289	R268-E287 PolarHBondContact N-OE1 3.04Å; R268-E287 VanDerWaalsContact N-OE1 3.17Å; S285-E287 VanDerWaalsContact C-N 3.29Å; E287-A289 PolarHBondContact O-N 2.9Å
288	N	97.8	Very high	97.7	Very high	39 Å²	39	27.3 Å²	27.3	21%	0.209	15%	0.148	C	C	.	.	S	Bend	trans	55.7	31.6	-175.4	-68.1	-69.4	0	0	0	114.7	C286 Y320 Q322 C323	C286-N288 PolarHBondContact O-N 3.11Å; N288-Y320 VanDerWaalsContact C-CE2 3.45Å; N288-Y320 VanDerWaalsContact C-CZ 3.49Å; N288-Y320 VanDerWaalsContact CA-CE2 3.47Å; N288-Y320 HydrophobicContact CB-CD2 4.24Å; N288-Y320 HydrophobicContact CB-CE2 4.3Å; N288-Y320 PolarHBondContact O-N 2.75Å; N288-Q322 PolarHBondContact OD1-N 2.88Å; N288-C323 PolarHBondContact OD1-N 3.31Å
289	A	97.3	Very high	97.8	Very high	3 Å²	3	32.2 Å²	32.2	3%	0.025	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	143.7	175.9	0	0	0	0	0	111.3	K284 E287 R317 F318 D319 Y320	K284-A289 WeakPolarHBondContact CB-O 3.48Å; E287-A289 PolarHBondContact O-N 2.9Å; A289-R317 HydrophobicContact CB-CB 4.44Å; A289-F318 WeakPolarHBondContact CA-O 3.45Å; A289-D319 WeakPolarHBondContact CB-OD1 3.38Å; A289-Y320 VanDerWaalsContact C-CE1 3.45Å; A289-Y320 VanDerWaalsContact C-OH 3.23Å; A289-Y320 PolarHBondContact N-OH 2.92Å; A289-Y320 PolarHBondContact O-OH 2.88Å; A289-Y320 VanDerWaalsContact O-OH 3.11Å
290	I	98.4	Very high	97.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	121.8	161.7	-69.4	153	0	0	0	106.1	L282 S283 K284 R317 F318 Y320 F330 L339 L341 W351	L282-I290 HydrophobicContact CB-CG2 3.97Å; L282-I290 HydrophobicContact CD2-CG2 4.32Å; S283-I290 CarbonylContact O-C 3.59Å; K284-I290 HydrophobicContact CB-CG1 3.86Å; K284-I290 HydrophobicContact CD-CG1 4.33Å; K284-I290 HydrophobicContact CG-CG1 4.41Å; I290-R317 CarbonylContact O-C 3.57Å; I290-R317 WeakPolarHBondContact O-CA 3.21Å; I290-F318 HydrophobicContact CB-CB 4.24Å; I290-F318 HydrophobicContact CB-CD2 4.24Å; I290-F318 HydrophobicContact CG2-CD2 4.11Å; I290-F318 PolarHBondContact N-O 2.87Å; I290-F318 PolarHBondContact O-N 2.92Å; I290-Y320 HydrophobicContact CB-CE1 4.32Å; I290-Y320 HydrophobicContact CD1-CE1 3.95Å; I290-Y320 HydrophobicContact CG1-CE1 3.72Å; I290-Y320 VanDerWaalsContact N-CE1 3.32Å; I290-F330 HydrophobicContact CD1-CB 3.88Å; I290-F330 HydrophobicContact CD1-CD1 3.94Å; I290-F330 HydrophobicContact CD1-CG 3.91Å; I290-F330 HydrophobicContact CG1-CD1 3.94Å; I290-F330 HydrophobicContact CG1-CE1 4.32Å; I290-F330 HydrophobicContact CG1-CG 4.41Å; I290-F330 HydrophobicContact CG2-CE1 4.41Å; I290-L339 HydrophobicContact CD1-CD1 4.39Å; I290-L339 HydrophobicContact CD1-CD2 3.98Å; I290-L339 HydrophobicContact CD1-CG 4.4Å; I290-L341 HydrophobicContact CD1-CB 4.33Å; I290-L341 HydrophobicContact CD1-CD2 4Å; I290-L341 HydrophobicContact CG1-CD2 4.48Å; I290-W351 HydrophobicContact CD1-CZ3 4.45Å
291	V	98.3	Very high	97.8	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	126.4	-179.5	-175.1	0	0	0	0	109	I266 L282 S283 W293 I314 R317	I266-V291 HydrophobicContact CG2-CB 4.11Å; I266-V291 HydrophobicContact CG2-CG1 3.89Å; L282-V291 WeakPolarHBondContact CA-O 3.42Å; S283-V291 PolarHBondContact N-O 3.03Å; S283-V291 PolarHBondContact O-N 2.92Å; V291-W293 HydrophobicContact CG1-CB 4.38Å; V291-I314 HydrophobicContact CG1-CD1 4.49Å; V291-I314 HydrophobicContact CG1-CG1 4.29Å; V291-I314 HydrophobicContact CG1-CG2 3.86Å; V291-R317 HydrophobicContact CG2-CG 4.34Å
292	C	97.8	Very high	97.7	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.007	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	121.8	168.4	-175.4	0	0	0	0	109.3	I281 L282 L315 G316 F318 P358	I281-C292 WeakPolarHBondContact O-CA 3.38Å; L282-C292 HydrophobicContact CD2-CB 3.62Å; C292-L315 PolarHBondContact O-N 2.85Å; C292-G316 PolarHBondContact N-O 2.85Å; C292-G316 PolarHBondContact O-N 2.7Å; C292-F318 HydrophobicContact CB-CE2 4.15Å; C292-P358 HydrophobicContact CB-CG 4.24Å
293	W	98.3	Very high	97.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	170.5	-174.7	67.6	-80.8	0	0	0	111.6	M214 L222 F261 T263 I266 I281 S283 V291 P295 V312 T313 I314	M214-W293 HydrophobicContact CE-CH2 4.39Å; L222-W293 HydrophobicContact CB-CH2 4.17Å; L222-W293 HydrophobicContact CB-CZ2 3.86Å; L222-W293 HydrophobicContact CD1-CZ2 4.18Å; L222-W293 HydrophobicContact CD2-CZ2 3.61Å; L222-W293 HydrophobicContact CG-CZ2 4.07Å; F261-W293 AromaticContact CE1-CH2 3.81Å; F261-W293 HydrophobicContact CE1-CH2 3.81Å; F261-W293 AromaticContact CE1-CZ3 3.75Å; F261-W293 HydrophobicContact CE1-CZ3 3.75Å; F261-W293 HydrophobicContact CZ-CZ3 4.19Å; T263-W293 HydrophobicContact CG2-CH2 3.7Å; T263-W293 HydrophobicContact CG2-CZ2 4.4Å; T263-W293 HydrophobicContact CG2-CZ3 3.91Å; I266-W293 HydrophobicContact CD1-CB 4.04Å; I266-W293 HydrophobicContact CD1-CD2 3.49Å; I266-W293 VanDerWaalsContact CD1-CD2 3.49Å; I266-W293 HydrophobicContact CD1-CE3 3.55Å; I266-W293 HydrophobicContact CD1-CG 3.7Å; I266-W293 HydrophobicContact CD1-CZ3 4.27Å; I266-W293 HydrophobicContact CG1-CD2 3.68Å; I266-W293 HydrophobicContact CG1-CE3 3.95Å; I266-W293 HydrophobicContact CG1-CG 4.11Å; I266-W293 HydrophobicContact CG1-CH2 4.45Å; I266-W293 HydrophobicContact CG1-CZ2 4.19Å; I266-W293 HydrophobicContact CG1-CZ3 4.32Å; I266-W293 HydrophobicContact CG2-CD2 4.47Å; I266-W293 HydrophobicContact CG2-CG 4.12Å; I281-W293 HydrophobicContact CB-CD2 4.14Å; I281-W293 HydrophobicContact CB-CG 4.42Å; I281-W293 HydrophobicContact CB-CZ2 3.82Å; I281-W293 HydrophobicContact CG1-CH2 4.18Å; I281-W293 HydrophobicContact CG1-CZ2 3.87Å; I281-W293 HydrophobicContact CG2-CZ2 3.67Å; I281-W293 PolarHBondContact N-O 2.82Å; I281-W293 PolarHBondContact O-N 3.26Å; S283-W293 PolarHBondContact OG-NE1 3.04Å; V291-W293 HydrophobicContact CG1-CB 4.38Å; W293-P295 HydrophobicContact CH2-CG 4.33Å; W293-P295 HydrophobicContact CZ3-CG 3.88Å; W293-V312 HydrophobicContact CE3-CB 4.36Å; W293-V312 HydrophobicContact CE3-CG1 4.11Å; W293-V312 HydrophobicContact CZ3-CG1 3.97Å; W293-T313 CarbonylContact C-O 3.54Å; W293-T313 WeakPolarHBondContact CA-O 3.36Å; W293-T313 WeakPolarHBondContact CB-O 3.19Å; W293-I314 HydrophobicContact CB-CG1 4.31Å
294	K	98.1	Very high	97.4	Very high	27 Å²	27	42.2 Å²	42.2	12%	0.117	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	150.5	171.5	61.6	178.6	-69.4	179.5	0	112.1	L280 K297 M298 D300 T313	L280-K294 HydrophobicContact CD2-CB 4.04Å; L280-K294 HydrophobicContact CD2-CD 4.27Å; K294-K297 WeakPolarHBondContact CE-O 3.31Å; K294-M298 PolarHBondContact NZ-O 2.95Å; K294-D300 WeakPolarHBondContact CE-O 3.48Å; K294-D300 PolarHBondContact NZ-O 3.27Å; K294-T313 PolarHBondContact N-O 2.92Å; K294-T313 PolarHBondContact O-N 2.84Å
295	P	98.5	Very high	97.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	144.6	165.5	-22.8	34.6	0	0	0	111.8	F261 W293 I302 I305	F261-P295 HydrophobicContact CD1-CB 3.93Å; F261-P295 HydrophobicContact CD1-CG 3.77Å; F261-P295 HydrophobicContact CD2-CB 3.94Å; F261-P295 HydrophobicContact CE1-CB 3.8Å; F261-P295 HydrophobicContact CE1-CG 3.74Å; F261-P295 HydrophobicContact CE2-CB 3.81Å; F261-P295 HydrophobicContact CG-CB 3.99Å; F261-P295 HydrophobicContact CG-CG 4.25Å; F261-P295 HydrophobicContact CZ-CB 3.74Å; F261-P295 HydrophobicContact CZ-CG 4.18Å; W293-P295 HydrophobicContact CH2-CG 4.33Å; W293-P295 HydrophobicContact CZ3-CG 3.88Å; P295-I302 HydrophobicContact CB-CD1 4.21Å; P295-I302 HydrophobicContact CG-CD1 3.67Å; P295-I305 HydrophobicContact CB-CD1 4.25Å; P295-I305 HydrophobicContact CB-CG1 4.13Å; P295-I305 HydrophobicContact CB-CG2 4.17Å
296	G	98.2	Very high	97.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	75.1	-165.5	-178.6	0	0	0	0	0	113.9	D300 N311 V312 T313	G296-D300 WeakPolarHBondContact CA-OD2 3.19Å; G296-N311 WeakPolarHBondContact CA-O 3.2Å; G296-N311 PolarHBondContact N-O 2.93Å; G296-V312 CarbonylContact O-C 3.53Å; G296-T313 PolarHBondContact O-N 2.83Å; G296-T313 PolarHBondContact O-OG1 3.18Å
297	K	97.9	Very high	97.3	Very high	105 Å²	105	52.2 Å²	52.2	46%	0.457	26%	0.255	S	S	.	.			trans	-78.3	173.1	175.6	-61	178.4	-177.7	176.5	0	111.4	K294 E299 D300 N311 T313	K294-K297 WeakPolarHBondContact CE-O 3.31Å; K297-E299 VanDerWaalsContact C-N 3.28Å; K297-E299 PolarHBondContact O-N 2.99Å; K297-D300 WeakPolarHBondContact CB-OD2 3.32Å; K297-D300 PolarHBondContact N-OD2 2.82Å; K297-D300 PolarHBondContact O-N 3.07Å; K297-N311 HydrophobicContact CG-CB 4.49Å; K297-T313 VanDerWaalsContact C-OG1 3.27Å; K297-T313 VanDerWaalsContact CA-OG1 3.31Å; K297-T313 WeakPolarHBondContact CA-OG1 3.25Å
298	M	95	Very high	97.2	Very high	118 Å²	118	53.9 Å²	53.9	58%	0.581	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-43.9	-177.1	-176	60.9	115.3	0	0	112.2	K294 T313 L315	K294-M298 PolarHBondContact NZ-O 2.95Å; M298-T313 HydrophobicContact CB-CG2 4.45Å; M298-T313 PolarHBondContact N-OG1 2.97Å; M298-T313 HydrophobicContact SD-CG2 4.34Å; M298-L315 HydrophobicContact CE-CD2 3.54Å; M298-L315 HydrophobicContact SD-CD2 3.48Å; M298-L315 WeakPolarHBondContact SD-CD2 3.36Å
299	E	96.2	Very high	97.2	Very high	146 Å²	146	54.1 Å²	54.1	68%	0.682	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-9.9	-177.5	62.1	-88.2	-156.6	0	0	114.9	K297	K297-E299 VanDerWaalsContact C-N 3.28Å; K297-E299 PolarHBondContact O-N 2.99Å
300	D	97.3	Very high	97.2	Very high	49 Å²	49	58.2 Å²	58.2	26%	0.262	30%	0.302	S	S	.	.			trans	-71.9	136.7	-173.8	-72.8	-26.6	0	0	0	111.6	K294 G296 K297 I305	K294-D300 WeakPolarHBondContact CE-O 3.48Å; K294-D300 PolarHBondContact NZ-O 3.27Å; G296-D300 WeakPolarHBondContact CA-OD2 3.19Å; K297-D300 WeakPolarHBondContact CB-OD2 3.32Å; K297-D300 PolarHBondContact N-OD2 2.82Å; K297-D300 PolarHBondContact O-N 3.07Å; D300-I305 HydrophobicContact CB-CD1 3.89Å
301	D	96.3	Very high	97.2	Very high	64 Å²	64	61.5 Å²	61.5	34%	0.342	32%	0.32	S	S	.	.			trans	-82.4	128.5	175.3	179.6	-17.7	0	0	0	109.4	D303 K304 I305	D301-D303 PolarHBondContact O-N 2.79Å; D301-D303 VanDerWaalsContact O-N 3.09Å; D301-D303 PolarHBondContact OD1-N 2.98Å; D301-K304 HydrophobicContact CB-CB 4.2Å; D301-K304 HydrophobicContact CB-CD 4.08Å; D301-K304 HydrophobicContact CB-CG 3.99Å; D301-K304 PolarHBondContact O-N 3.02Å; D301-K304 IonicContact OD2-NZ 2.74Å; D301-K304 PolarHBondContact OD2-NZ 2.86Å; D301-I305 PolarHBondContact O-N 2.84Å
302	I	96.1	Very high	97.2	Very high	4 Å²	4	63.3 Å²	63.3	2%	0.021	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-55.2	-32.5	-176.5	-167.7	60.8	0	0	0	112	K212 R226 W276 D279 P295 K304 I305	K212-I302 HydrophobicContact CD-CG1 4.41Å; R226-I302 PolarHBondContact NH2-O 3.25Å; W276-I302 HydrophobicContact CH2-CD1 4.3Å; W276-I302 HydrophobicContact CH2-CG1 4.12Å; W276-I302 HydrophobicContact CZ3-CD1 4.39Å; W276-I302 HydrophobicContact CZ3-CG1 4.11Å; D279-I302 HydrophobicContact CB-CB 4.24Å; D279-I302 HydrophobicContact CB-CG2 3.95Å; P295-I302 HydrophobicContact CB-CD1 4.21Å; P295-I302 HydrophobicContact CG-CD1 3.67Å; I302-K304 VanDerWaalsContact C-N 3.34Å; I302-I305 HydrophobicContact CD1-CG1 4.37Å; I302-I305 WeakPolarHBondContact O-CG1 3.43Å
303	D	95.1	Very high	97.3	Very high	77 Å²	77	64.7 Å²	64.7	41%	0.412	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-83.5	-11.9	-178.1	-68.7	-35.5	0	0	0	113.8	K212 R226 D301	K212-D303 IonicContact NZ-OD1 2.94Å; R226-D303 IonicContact CZ-OD1 3.54Å; R226-D303 IonicContact NH1-OD1 3.77Å; R226-D303 PolarHBondContact NH1-OD1 2.6Å; D301-D303 PolarHBondContact O-N 2.79Å; D301-D303 VanDerWaalsContact O-N 3.09Å; D301-D303 PolarHBondContact OD1-N 2.98Å
304	K	96.6	Very high	97.2	Very high	154 Å²	154	68.3 Å²	68.3	67%	0.67	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-97.2	-6.5	174.6	-60.2	-172.7	-175.9	96.8	0	113.2	D301 I302 K306	D301-K304 HydrophobicContact CB-CB 4.2Å; D301-K304 HydrophobicContact CB-CD 4.08Å; D301-K304 HydrophobicContact CB-CG 3.99Å; D301-K304 PolarHBondContact O-N 3.02Å; D301-K304 IonicContact OD2-NZ 2.74Å; D301-K304 PolarHBondContact OD2-NZ 2.86Å; I302-K304 VanDerWaalsContact C-N 3.34Å; K304-K306 PolarHBondContact O-N 3.39Å
305	I	97.3	Very high	97	Very high	11 Å²	11	68.8 Å²	68.8	6%	0.056	36%	0.362	C	S	.	.			trans	-59.5	126.1	174.4	-61.4	-65.4	0	0	0	109.7	F261 P295 D300 D301 I302 E309	F261-I305 HydrophobicContact CB-CG2 4.1Å; F261-I305 HydrophobicContact CD2-CG2 3.9Å; F261-I305 HydrophobicContact CG-CG2 4.26Å; P295-I305 HydrophobicContact CB-CD1 4.25Å; P295-I305 HydrophobicContact CB-CG1 4.13Å; P295-I305 HydrophobicContact CB-CG2 4.17Å; D300-I305 HydrophobicContact CB-CD1 3.89Å; D301-I305 PolarHBondContact O-N 2.84Å; I302-I305 HydrophobicContact CD1-CG1 4.37Å; I302-I305 WeakPolarHBondContact O-CG1 3.43Å; I305-E309 HydrophobicContact CD1-CG 4.25Å; I305-E309 HydrophobicContact CG2-CB 3.85Å; I305-E309 HydrophobicContact CG2-CG 4.18Å
306	K	97.1	Very high	96.8	Very high	142 Å²	142	68.9 Å²	68.9	62%	0.617	36%	0.362	S	S	*	.			trans	-90.2	155	177.3	-65.4	-179.3	-177.9	175.6	0	110.4	D260 K304 S308 E309	D260-K306 CarbonylContact O-C 3.53Å; K304-K306 PolarHBondContact O-N 3.39Å; K306-S308 PolarHBondContact O-N 2.84Å; K306-E309 VanDerWaalsContact O-CB 3.22Å; K306-E309 WeakPolarHBondContact O-CB 3.22Å; K306-E309 PolarHBondContact O-N 2.87Å
307	P	97.4	Very high	96.6	Very high	88 Å²	88	73.7 Å²	73.7	57%	0.571	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-26	174.7	-25.8	34.3	0	0	0	114.9	D260 E309	D260-P307 VanDerWaalsContact O-CA 3.23Å; D260-P307 WeakPolarHBondContact O-CA 3.39Å; P307-E309 VanDerWaalsContact C-N 3.34Å
308	S	96.8	Very high	96.5	Very high	103 Å²	103	69 Å²	69	72%	0.72	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	3.5	178.1	65.4	0	0	0	0	114.2	K306 S310	K306-S308 PolarHBondContact O-N 2.84Å; S308-S310 PolarHBondContact O-N 3.4Å
309	E	98.2	Very high	96.5	Very high	44 Å²	44	68.3 Å²	68.3	21%	0.206	36%	0.359	C	S	.	.			trans	-63.3	128.6	179.6	-177.7	55.3	-125.9	0	0	110.4	F261 I305 K306 P307 N311	F261-E309 HydrophobicContact CD2-CB 4.1Å; F261-E309 HydrophobicContact CD2-CG 4.45Å; F261-E309 HydrophobicContact CE2-CB 4.31Å; F261-E309 HydrophobicContact CE2-CG 4.26Å; I305-E309 HydrophobicContact CD1-CG 4.25Å; I305-E309 HydrophobicContact CG2-CB 3.85Å; I305-E309 HydrophobicContact CG2-CG 4.18Å; K306-E309 VanDerWaalsContact O-CB 3.22Å; K306-E309 WeakPolarHBondContact O-CB 3.22Å; K306-E309 PolarHBondContact O-N 2.87Å; P307-E309 VanDerWaalsContact C-N 3.34Å; E309-N311 VanDerWaalsContact OE1-CB 3.24Å; E309-N311 WeakPolarHBondContact OE1-CB 3.25Å; E309-N311 PolarHBondContact OE1-N 2.91Å; E309-N311 PolarHBondContact OE1-ND2 2.86Å
310	S	97	Very high	96.5	Very high	89 Å²	89	62.3 Å²	62.3	62%	0.622	33%	0.33	S	S	*	.			trans	-109.4	-13.5	-176.4	64.4	0	0	0	0	113.2	S308	S308-S310 PolarHBondContact O-N 3.4Å
311	N	98.3	Very high	96.5	Very high	69 Å²	69	62.4 Å²	62.4	37%	0.369	33%	0.334	S	S	.	.			trans	-87.4	151.8	-178	-56	-68.5	0	0	0	111.2	G296 K297 E309	G296-N311 WeakPolarHBondContact CA-O 3.2Å; G296-N311 PolarHBondContact N-O 2.93Å; K297-N311 HydrophobicContact CG-CB 4.49Å; E309-N311 VanDerWaalsContact OE1-CB 3.24Å; E309-N311 WeakPolarHBondContact OE1-CB 3.25Å; E309-N311 PolarHBondContact OE1-N 2.91Å; E309-N311 PolarHBondContact OE1-ND2 2.86Å
312	V	98.5	Very high	96.5	Very high	38 Å²	38	63.2 Å²	63.2	23%	0.23	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	147.9	168.5	-70.4	0	0	0	0	109.1	F261 T263 D265 I266 W293 G296	F261-V312 HydrophobicContact CZ-CG1 3.71Å; T263-V312 HydrophobicContact CG2-CG1 4.03Å; D265-V312 HydrophobicContact CB-CG2 4.09Å; I266-V312 HydrophobicContact CD1-CB 3.82Å; I266-V312 HydrophobicContact CD1-CG1 4.03Å; I266-V312 HydrophobicContact CD1-CG2 3.8Å; W293-V312 HydrophobicContact CE3-CB 4.36Å; W293-V312 HydrophobicContact CE3-CG1 4.11Å; W293-V312 HydrophobicContact CZ3-CG1 3.97Å; G296-V312 CarbonylContact O-C 3.53Å
313	T	98.3	Very high	96.6	Very high	30 Å²	30	63 Å²	63	18%	0.184	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	116	175.8	-58.2	0	0	0	0	109.5	W293 K294 G296 K297 M298 L315	W293-T313 CarbonylContact C-O 3.54Å; W293-T313 WeakPolarHBondContact CA-O 3.36Å; W293-T313 WeakPolarHBondContact CB-O 3.19Å; K294-T313 PolarHBondContact N-O 2.92Å; K294-T313 PolarHBondContact O-N 2.84Å; G296-T313 PolarHBondContact O-N 2.83Å; G296-T313 PolarHBondContact O-OG1 3.18Å; K297-T313 VanDerWaalsContact C-OG1 3.27Å; K297-T313 VanDerWaalsContact CA-OG1 3.31Å; K297-T313 WeakPolarHBondContact CA-OG1 3.25Å; M298-T313 HydrophobicContact CB-CG2 4.45Å; M298-T313 PolarHBondContact N-OG1 2.97Å; M298-T313 HydrophobicContact SD-CG2 4.34Å; T313-L315 HydrophobicContact CG2-CD2 4.04Å
314	I	97.4	Very high	96.7	Very high	77 Å²	77	63 Å²	63	40%	0.395	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	124.2	171.7	-62.6	174.5	0	0	0	108.5	I266 V291 W293	I266-I314 HydrophobicContact CD1-CG1 4.34Å; V291-I314 HydrophobicContact CG1-CD1 4.49Å; V291-I314 HydrophobicContact CG1-CG1 4.29Å; V291-I314 HydrophobicContact CG1-CG2 3.86Å; W293-I314 HydrophobicContact CB-CG1 4.31Å
315	L	94.6	Very high	96.7	Very high	37 Å²	37	58.3 Å²	58.3	19%	0.194	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-30.7	-176.4	-61.3	170.9	0	0	0	112.1	L280 C292 M298 T313 H359	L280-L315 HydrophobicContact CD1-CD1 3.6Å; L280-L315 HydrophobicContact CD2-CD1 3.39Å; L280-L315 HydrophobicContact CG-CD1 4.05Å; C292-L315 PolarHBondContact O-N 2.85Å; M298-L315 HydrophobicContact CE-CD2 3.54Å; M298-L315 HydrophobicContact SD-CD2 3.48Å; M298-L315 WeakPolarHBondContact SD-CD2 3.36Å; T313-L315 HydrophobicContact CG2-CD2 4.04Å; L315-H359 PolarHBondContact O-CE1 3.5Å
316	G	93.4	Very high	96.1	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.3	-174.4	171.8	0	0	0	0	0	113.6	C292 H359	C292-G316 PolarHBondContact N-O 2.85Å; C292-G316 PolarHBondContact O-N 2.7Å; G316-H359 WeakPolarHBondContact CA-CE1 3.45Å
317	R	94.6	Very high	96	Very high	101 Å²	101	55.4 Å²	55.4	38%	0.381	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	143.6	-175.1	-62.2	-176.6	176.2	-163.4	-7.8	110.7	A289 I290 V291	A289-R317 HydrophobicContact CB-CB 4.44Å; I290-R317 CarbonylContact O-C 3.57Å; I290-R317 WeakPolarHBondContact O-CA 3.21Å; V291-R317 HydrophobicContact CG2-CG 4.34Å
318	F	95.3	Very high	96	Very high	6 Å²	6	51.2 Å²	51.2	3%	0.026	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	97.2	168.7	-54.3	-94.5	0	0	0	107.6	L282 A289 I290 C292 Y320 L339 W351 L353 P358 A361	L282-F318 HydrophobicContact CD2-CD2 4.47Å; L282-F318 HydrophobicContact CD2-CE2 3.73Å; A289-F318 WeakPolarHBondContact CA-O 3.45Å; I290-F318 HydrophobicContact CB-CB 4.24Å; I290-F318 HydrophobicContact CB-CD2 4.24Å; I290-F318 HydrophobicContact CG2-CD2 4.11Å; I290-F318 PolarHBondContact N-O 2.87Å; I290-F318 PolarHBondContact O-N 2.92Å; C292-F318 HydrophobicContact CB-CE2 4.15Å; F318-Y320 WeakPolarHBondContact O-CD1 3.24Å; F318-Y320 VanDerWaalsContact O-CE1 3.31Å; F318-Y320 WeakPolarHBondContact O-CE1 3.45Å; F318-L339 HydrophobicContact CB-CD2 4.49Å; F318-L339 HydrophobicContact CD1-CD2 4.18Å; F318-L339 HydrophobicContact CD2-CD2 4.09Å; F318-L339 HydrophobicContact CE1-CD2 4.39Å; F318-L339 HydrophobicContact CE2-CD2 4.33Å; F318-L339 HydrophobicContact CG-CD2 4.01Å; F318-L339 HydrophobicContact CZ-CD2 4.48Å; F318-W351 HydrophobicContact CB-CD2 4.26Å; F318-W351 HydrophobicContact CB-CZ2 4.16Å; F318-W351 HydrophobicContact CD1-CB 4.06Å; F318-W351 AromaticContact CD1-CD1 3.68Å; F318-W351 HydrophobicContact CD1-CD2 4.3Å; F318-W351 AromaticContact CD1-CG 3.77Å; F318-W351 HydrophobicContact CD1-CG 3.77Å; F318-W351 HydrophobicContact CE1-CB 4.33Å; F318-L353 HydrophobicContact CE1-CD2 3.7Å; F318-L353 HydrophobicContact CZ-CD2 3.58Å; F318-P358 HydrophobicContact CE1-CB 4.3Å; F318-P358 HydrophobicContact CE2-CB 4.1Å; F318-P358 HydrophobicContact CZ-CB 3.81Å; F318-P358 HydrophobicContact CZ-CG 4.46Å; F318-A361 HydrophobicContact CD1-CB 3.49Å; F318-A361 VanDerWaalsContact CD1-CB 3.49Å; F318-A361 HydrophobicContact CE1-CB 3.28Å; F318-A361 HydrophobicContact CZ-CB 4.46Å
319	D	94.5	Very high	96.1	Very high	105 Å²	105	46.4 Å²	46.4	56%	0.561	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	142.9	-175.5	-58.5	-40	0	0	0	111.6	A289	A289-D319 WeakPolarHBondContact CB-OD1 3.38Å
320	Y	95.7	Very high	96.1	Very high	20 Å²	20	44.3 Å²	44.3	8%	0.078	23%	0.23	C	C	.	.			trans	-144.7	-167	175.5	45.3	-90.9	0	0	0	109.3	K284 N288 A289 I290 F318 C323 L341 W351	K284-Y320 VanDerWaalsContact CE-OH 3.27Å; K284-Y320 WeakPolarHBondContact CE-OH 3.22Å; N288-Y320 VanDerWaalsContact C-CE2 3.45Å; N288-Y320 VanDerWaalsContact C-CZ 3.49Å; N288-Y320 VanDerWaalsContact CA-CE2 3.47Å; N288-Y320 HydrophobicContact CB-CD2 4.24Å; N288-Y320 HydrophobicContact CB-CE2 4.3Å; N288-Y320 PolarHBondContact O-N 2.75Å; A289-Y320 VanDerWaalsContact C-CE1 3.45Å; A289-Y320 VanDerWaalsContact C-OH 3.23Å; A289-Y320 PolarHBondContact N-OH 2.92Å; A289-Y320 PolarHBondContact O-OH 2.88Å; A289-Y320 VanDerWaalsContact O-OH 3.11Å; I290-Y320 HydrophobicContact CB-CE1 4.32Å; I290-Y320 HydrophobicContact CD1-CE1 3.95Å; I290-Y320 HydrophobicContact CG1-CE1 3.72Å; I290-Y320 VanDerWaalsContact N-CE1 3.32Å; F318-Y320 WeakPolarHBondContact O-CD1 3.24Å; F318-Y320 VanDerWaalsContact O-CE1 3.31Å; F318-Y320 WeakPolarHBondContact O-CE1 3.45Å; Y320-C323 HydrophobicContact CD2-CB 3.77Å; Y320-C323 HydrophobicContact CE2-CB 3.69Å; Y320-L341 HydrophobicContact CD1-CD2 3.78Å; Y320-L341 HydrophobicContact CD2-CD2 3.84Å; Y320-L341 HydrophobicContact CE1-CD2 3.38Å; Y320-L341 HydrophobicContact CE2-CD2 3.44Å; Y320-L341 VanDerWaalsContact CE2-CD2 3.44Å; Y320-L341 HydrophobicContact CG-CD2 3.99Å; Y320-W351 AromaticContact CD1-CH2 3.6Å; Y320-W351 HydrophobicContact CD1-CH2 3.6Å; Y320-W351 AromaticContact CD1-CZ2 3.85Å; Y320-W351 HydrophobicContact CD1-CZ2 3.85Å; Y320-W351 HydrophobicContact CE1-CH2 4.41Å; Y320-W351 HydrophobicContact CG-CH2 4.21Å; Y320-W351 HydrophobicContact CG-CZ2 4.48Å
321	S	97.4	Very high	96.2	Very high	50 Å²	50	40.4 Å²	40.4	35%	0.35	20%	0.203	S	C	.	.	S	Bend	trans	-147.5	156.2	-179.7	56.8	0	0	0	0	112.7	C323 N343 Y349	S321-C323 VanDerWaalsContact C-N 3.34Å; S321-C323 PolarHBondContact O-N 2.78Å; S321-N343 PolarHBondContact O-ND2 2.85Å; S321-Y349 PolarHBondContact N-OH 3.02Å; S321-Y349 PolarHBondContact O-OH 2.91Å; S321-Y349 PolarHBondContact OG-OH 3.21Å
322	Q	97.9	Very high	96.2	Very high	82 Å²	82	37.9 Å²	37.9	38%	0.383	19%	0.189	S	C	.	.	S	Bend	trans	58.3	43.2	175.8	-48.8	175.6	-96.4	0	0	112.4	N288 N343 Q344 V345	N288-Q322 PolarHBondContact OD1-N 2.88Å; Q322-N343 WeakPolarHBondContact O-CB 3.36Å; Q322-Q344 WeakPolarHBondContact O-CG 3.25Å; Q322-Q344 PolarHBondContact O-N 3.33Å; Q322-Q344 PolarHBondContact O-OE1 3.25Å; Q322-V345 HydrophobicContact CB-CG2 4.12Å
323	C	97.6	Very high	96.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.			trans	-138.6	60.5	175.6	-166.7	0	0	0	0	109.2	N288 Y320 S321 G342 N343	N288-C323 PolarHBondContact OD1-N 3.31Å; Y320-C323 HydrophobicContact CD2-CB 3.77Å; Y320-C323 HydrophobicContact CE2-CB 3.69Å; S321-C323 VanDerWaalsContact C-N 3.34Å; S321-C323 PolarHBondContact O-N 2.78Å; C323-G342 PolarHBondContact SG-O 2.95Å; C323-G342 VanDerWaalsContact SG-O 3.36Å; C323-N343 HydrophobicContact CB-CB 3.78Å
324	D	96	Very high	96.2	Very high	77 Å²	77	38.3 Å²	38.3	41%	0.412	19%	0.185	S	C	.	.			trans	-112.2	1.8	-177.2	54.4	1.7	0	0	0	113.2	Y270 C286 Q344	Y270-D324 PolarHBondContact OH-O 3.28Å; C286-D324 HydrophobicContact CB-CB 4.41Å; C286-D324 WeakPolarHBondContact O-CB 2.98Å; D324-Q344 PolarHBondContact OD1-NE2 3.07Å; D324-Q344 PolarHBondContact OD1-OE1 3Å
325	I	96.6	Very high	96.2	Very high	55 Å²	55	42 Å²	42	28%	0.282	20%	0.195	S	C	.	.	S	Bend	trans	-79.2	155.6	169	65.4	173.3	0	0	0	112.2	Y270 M328 Q344 A374	Y270-I325 PolarHBondContact OH-O 3.3Å; I325-M328 HydrophobicContact CD1-CG 4.35Å; I325-M328 HydrophobicContact CD1-SD 3.94Å; I325-M328 HydrophobicContact CG1-CG 3.72Å; I325-M328 HydrophobicContact CG1-SD 3.99Å; I325-Q344 HydrophobicContact CD1-CB 3.68Å; I325-Q344 HydrophobicContact CG1-CB 4.04Å; I325-A374 HydrophobicContact CD1-CB 4.04Å
326	W	86.2	Confident	96.3	Very high	85 Å²	85	42.5 Å²	42.5	32%	0.322	20%	0.196	S	C	.	.	S	Bend	trans	-69.1	151.7	178.8	-178.9	63	0	0	0	112.3	L202 M218 Y270 R376	L202-W326 HydrophobicContact CD2-CZ2 3.53Å; M218-W326 HydrophobicContact CE-CD2 4.11Å; M218-W326 VanDerWaalsContact CE-CE2 3.43Å; M218-W326 HydrophobicContact CE-CG 4.35Å; M218-W326 HydrophobicContact CE-CZ2 3.76Å; M218-W326 VanDerWaalsContact CE-NE1 3.26Å; Y270-W326 AromaticContact CD2-CD1 3.89Å; Y270-W326 HydrophobicContact CE1-CB 4.5Å; Y270-W326 AromaticContact CE2-CD1 3.89Å; Y270-W326 WeakPolarHBondContact OH-CA 3.42Å; Y270-W326 PolarHBondContact OH-N 2.66Å; W326-R376 PolarHBondContact O-NH1 3.43Å
327	Y	93.5	Very high	96.4	Very high	7 Å²	7	46.2 Å²	46.2	3%	0.027	21%	0.212	C	C	.	.	S	Bend	trans	65.5	55.6	172.9	-150.1	-113.4	0	0	0	113.5	F59 Y110 N156 D272 R329 R376	F59-Y327 HydrophobicContact CB-CE1 4.2Å; F59-Y327 AromaticContact CD1-CD1 3.9Å; F59-Y327 HydrophobicContact CD1-CD1 3.9Å; F59-Y327 HydrophobicContact CD1-CE1 4Å; F59-Y327 HydrophobicContact CG-CE1 4.39Å; Y110-Y327 WeakPolarHBondContact CB-OH 3.42Å; Y110-Y327 PolarHBondContact O-OH 2.85Å; N156-Y327 HydrophobicContact CB-CE2 4.45Å; N156-Y327 PolarHBondContact O-OH 3.43Å; D272-Y327 PolarHBondContact OD2-N 2.95Å; Y327-R329 PolarHBondContact OH-NH1 3.11Å; Y327-R376 VanDerWaalsContact O-CD 3.28Å; Y327-R376 WeakPolarHBondContact O-CD 3.32Å; Y327-R376 PolarHBondContact O-NH1 2.61Å; Y327-R376 VanDerWaalsContact O-NH1 3.12Å
328	M	98.6	Very high	96.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.193	C	C	.	.			trans	-121.1	111.7	175.6	-62.8	-68.1	-72.9	0	0	109.3	D272 K284 I325 G342 A374 I375	D272-M328 PolarHBondContact OD2-N 3.16Å; D272-M328 VanDerWaalsContact OD2-N 3.09Å; K284-M328 PolarHBondContact NZ-O 3.32Å; I325-M328 HydrophobicContact CD1-CG 4.35Å; I325-M328 HydrophobicContact CD1-SD 3.94Å; I325-M328 HydrophobicContact CG1-CG 3.72Å; I325-M328 HydrophobicContact CG1-SD 3.99Å; M328-G342 WeakPolarHBondContact CE-O 3.46Å; M328-A374 HydrophobicContact CE-CB 4.47Å; M328-A374 HydrophobicContact SD-CB 4.47Å; M328-I375 WeakPolarHBondContact CE-O 3.46Å
329	R	98.9	Very high	96.6	Very high	1 Å²	1	41.1 Å²	41.1	0%	0.004	19%	0.192	C	C	.	.			trans	-103.9	131.2	-168.3	-66	-179.6	-72.6	-169.6	-11.1	112.2	F59 G60 Y110 E157 Y327 R376 Q377	F59-R329 PolarHBondContact O-NH2 2.99Å; G60-R329 VanDerWaalsContact CA-NH2 3.35Å; Y110-R329 PolarHBondContact O-NH2 3.43Å; E157-R329 IonicContact OE1-NH1 3.62Å; E157-R329 WeakPolarHBondContact OE2-CD 3.43Å; E157-R329 IonicContact OE2-CZ 3.22Å; E157-R329 IonicContact OE2-NE 3.17Å; E157-R329 IonicContact OE2-NH1 2.8Å; E157-R329 PolarHBondContact OE2-NH1 3.42Å; Y327-R329 PolarHBondContact OH-NH1 3.11Å; R329-R376 PolarHBondContact N-O 2.85Å; R329-Q377 HydrophobicContact CB-CB 4.41Å; R329-Q377 HydrophobicContact CB-CG 4.24Å
330	F	98.9	Very high	96.8	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	157	167.4	68	-96.7	0	0	0	110.7	C273 R275 L282 K284 I290 L339 A340 L341	C273-F330 HydrophobicContact CB-CD1 3.78Å; C273-F330 HydrophobicContact CB-CE1 3.7Å; R275-F330 HydrophobicContact CB-CE2 3.66Å; R275-F330 HydrophobicContact CB-CZ 4Å; R275-F330 HydrophobicContact CG-CD2 4.19Å; R275-F330 HydrophobicContact CG-CE2 3.4Å; R275-F330 VanDerWaalsContact CG-CE2 3.4Å; R275-F330 HydrophobicContact CG-CZ 3.87Å; L282-F330 HydrophobicContact CB-CE2 3.97Å; L282-F330 HydrophobicContact CB-CZ 3.79Å; L282-F330 HydrophobicContact CD1-CE2 4.45Å; K284-F330 HydrophobicContact CD-CD1 3.86Å; K284-F330 HydrophobicContact CG-CD1 3.84Å; K284-F330 HydrophobicContact CG-CE1 3.99Å; I290-F330 HydrophobicContact CD1-CB 3.88Å; I290-F330 HydrophobicContact CD1-CD1 3.94Å; I290-F330 HydrophobicContact CD1-CG 3.91Å; I290-F330 HydrophobicContact CG1-CD1 3.94Å; I290-F330 HydrophobicContact CG1-CE1 4.32Å; I290-F330 HydrophobicContact CG1-CG 4.41Å; I290-F330 HydrophobicContact CG2-CE1 4.41Å; F330-L339 HydrophobicContact CB-CD1 4.15Å; F330-L339 HydrophobicContact CD2-CD1 3.39Å; F330-L339 HydrophobicContact CE2-CD1 4.06Å; F330-L339 HydrophobicContact CG-CD1 4.07Å; F330-A340 CarbonylContact C-O 3.53Å; F330-A340 WeakPolarHBondContact CA-O 3.14Å; F330-A340 VanDerWaalsContact CB-O 3.3Å; F330-A340 WeakPolarHBondContact CB-O 3.42Å; F330-L341 HydrophobicContact CB-CB 4.02Å; F330-L341 HydrophobicContact CB-CD1 4Å; F330-L341 HydrophobicContact CB-CG 4.48Å
331	S	98.8	Very high	96.9	Very high	6 Å²	6	35.1 Å²	35.1	4%	0.042	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	161.3	174.5	62.2	0	0	0	0	112.2	A340 T378	S331-A340 PolarHBondContact N-O 2.91Å; S331-A340 PolarHBondContact O-N 3.41Å; S331-T378 WeakPolarHBondContact CB-O 3.36Å; S331-T378 VanDerWaalsContact OG-C 3.28Å; S331-T378 PolarHBondContact OG-O 3.49Å; S331-T378 PolarHBondContact OG-OG1 3.5Å
332	M	98.6	Very high	97	Very high	16 Å²	16	32.8 Å²	32.8	8%	0.079	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	156.9	173.8	-69	-179.5	-68.1	0	0	109.7	R275 W276 L277 L282 Q336 M338 L339 L353	R275-M332 HydrophobicContact CB-CE 3.58Å; R275-M332 HydrophobicContact CG-CE 4.13Å; W276-M332 VanDerWaalsContact O-CE 3.3Å; W276-M332 WeakPolarHBondContact O-CE 3.37Å; L277-M332 HydrophobicContact CD1-SD 4.38Å; L282-M332 HydrophobicContact CD1-SD 3.9Å; M332-Q336 HydrophobicContact CE-CG 4.49Å; M332-Q336 HydrophobicContact SD-CB 4.43Å; M332-Q336 HydrophobicContact SD-CG 4.5Å; M332-M338 WeakPolarHBondContact CA-O 3.47Å; M332-L339 HydrophobicContact CG-CB 4.48Å; M332-L339 HydrophobicContact CG-CD1 3.88Å; M332-L353 HydrophobicContact CG-CD1 4.21Å; M332-L353 HydrophobicContact SD-CD1 3.7Å
333	D	98.4	Very high	97.1	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	13%	0.127	C	C	.	.			trans	-73.3	166.4	169.2	77.7	-45.1	0	0	0	111.3	W335 Q336 K337 M338 F380 S384	D333-W335 PolarHBondContact O-N 3.47Å; D333-W335 VanDerWaalsContact O-N 3.07Å; D333-Q336 PolarHBondContact O-N 3.19Å; D333-Q336 PolarHBondContact OD1-N 2.89Å; D333-K337 PolarHBondContact OD1-N 3.28Å; D333-M338 HydrophobicContact CB-CE 4.15Å; D333-M338 PolarHBondContact N-O 3.12Å; D333-M338 PolarHBondContact OD1-N 3.12Å; D333-F380 HydrophobicContact CB-CB 3.9Å; D333-F380 HydrophobicContact CB-CD1 4.3Å; D333-F380 HydrophobicContact CB-CD2 3.94Å; D333-F380 HydrophobicContact CB-CG 3.79Å; D333-S384 WeakPolarHBondContact CB-OG 3.08Å; D333-S384 WeakPolarHBondContact OD2-CB 3.09Å; D333-S384 PolarHBondContact OD2-OG 2.94Å
334	F	97.6	Very high	97.1	Very high	74 Å²	74	31.3 Å²	31.3	33%	0.325	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-33.9	-175.8	177.8	-97.8	0	0	0	113	W65 R382	W65-F334 HydrophobicContact CD2-CD2 4.33Å; W65-F334 HydrophobicContact CE3-CB 4.42Å; W65-F334 AromaticContact CE3-CD2 3.83Å; W65-F334 HydrophobicContact CE3-CD2 3.83Å; W65-F334 HydrophobicContact CH2-CB 4.42Å; W65-F334 HydrophobicContact CZ3-CB 4.38Å; W65-F334 HydrophobicContact CZ3-CD2 4.22Å; F334-R382 HydrophobicContact CB-CG 4.37Å; F334-R382 HydrophobicContact CD2-CG 4.4Å; F334-R382 HydrophobicContact CG-CG 4.24Å
335	W	97.1	Very high	97.2	Very high	156 Å²	156	30 Å²	30	59%	0.591	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	0	-178.2	-51.4	102	0	0	0	114.3	D333 K337	D333-W335 PolarHBondContact O-N 3.47Å; D333-W335 VanDerWaalsContact O-N 3.07Å; W335-K337 HydrophobicContact CB-CD 3.97Å; W335-K337 HydrophobicContact CB-CG 3.85Å; W335-K337 PolarHBondContact O-N 3.46Å
336	Q	96.7	Very high	97.3	Very high	47 Å²	47	27.5 Å²	27.5	22%	0.22	12%	0.121	C	C	.	.	S	Bend	trans	52.9	37.7	-174	-53.9	-167.7	-36.1	0	0	113.7	W276 L277 M332 D333 L353	W276-Q336 PolarHBondContact O-NE2 3.34Å; L277-Q336 HydrophobicContact CD1-CB 3.98Å; M332-Q336 HydrophobicContact CE-CG 4.49Å; M332-Q336 HydrophobicContact SD-CB 4.43Å; M332-Q336 HydrophobicContact SD-CG 4.5Å; D333-Q336 PolarHBondContact O-N 3.19Å; D333-Q336 PolarHBondContact OD1-N 2.89Å; Q336-L353 WeakPolarHBondContact O-CD1 3.46Å
337	K	95	Very high	97.9	Very high	78 Å²	78	26.6 Å²	26.6	34%	0.339	12%	0.119	S	C	.	.			trans	-98.1	-25.8	177.7	-65.4	-177.5	178.3	-139.2	0	112.6	D333 W335 L353 E354	D333-K337 PolarHBondContact OD1-N 3.28Å; W335-K337 HydrophobicContact CB-CD 3.97Å; W335-K337 HydrophobicContact CB-CG 3.85Å; W335-K337 PolarHBondContact O-N 3.46Å; K337-L353 PolarHBondContact O-N 2.82Å; K337-E354 HydrophobicContact CB-CG 3.98Å; K337-E354 HydrophobicContact CD-CG 4.18Å; K337-E354 WeakPolarHBondContact CD-OE1 3.14Å; K337-E354 WeakPolarHBondContact CE-OE1 3.33Å; K337-E354 HydrophobicContact CG-CG 3.79Å; K337-E354 IonicContact NZ-OE1 3.91Å; K337-E354 PolarHBondContact NZ-OE1 3.46Å
338	M	96.6	Very high	98.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	136.4	179.8	-66.2	-176.7	-62.6	0	0	110.2	Y42 F44 M332 D333 W351 F380	Y42-M338 HydrophobicContact CD1-CG 4.41Å; Y42-M338 HydrophobicContact CD1-SD 3.72Å; Y42-M338 HydrophobicContact CD2-CG 3.58Å; Y42-M338 HydrophobicContact CD2-SD 3.77Å; Y42-M338 HydrophobicContact CE1-CG 4.25Å; Y42-M338 HydrophobicContact CE1-SD 3.95Å; Y42-M338 HydrophobicContact CE2-CG 3.38Å; Y42-M338 HydrophobicContact CE2-SD 3.99Å; Y42-M338 HydrophobicContact CG-CG 4.09Å; Y42-M338 HydrophobicContact CG-SD 3.61Å; F44-M338 HydrophobicContact CE2-SD 4.21Å; F44-M338 HydrophobicContact CZ-CE 4.28Å; F44-M338 HydrophobicContact CZ-SD 3.86Å; M332-M338 WeakPolarHBondContact CA-O 3.47Å; D333-M338 HydrophobicContact CB-CE 4.15Å; D333-M338 PolarHBondContact N-O 3.12Å; D333-M338 PolarHBondContact OD1-N 3.12Å; M338-W351 WeakPolarHBondContact CA-O 3.46Å; M338-F380 HydrophobicContact CB-CE1 4.3Å; M338-F380 HydrophobicContact CB-CE2 4.34Å; M338-F380 HydrophobicContact CB-CZ 3.84Å; M338-F380 HydrophobicContact CE-CD1 4.02Å; M338-F380 HydrophobicContact CE-CE1 3.75Å; M338-F380 HydrophobicContact CE-CZ 4.41Å; M338-F380 HydrophobicContact SD-CE1 4.34Å
339	L	98	Very high	98.1	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.7	171.6	174.3	65.6	0	0	0	108.4	L282 I290 F318 F330 M332 V350 W351 L353	L282-L339 HydrophobicContact CD1-CD1 4.25Å; L282-L339 HydrophobicContact CD1-CD2 4.3Å; I290-L339 HydrophobicContact CD1-CD1 4.39Å; I290-L339 HydrophobicContact CD1-CD2 3.98Å; I290-L339 HydrophobicContact CD1-CG 4.4Å; F318-L339 HydrophobicContact CB-CD2 4.49Å; F318-L339 HydrophobicContact CD1-CD2 4.18Å; F318-L339 HydrophobicContact CD2-CD2 4.09Å; F318-L339 HydrophobicContact CE1-CD2 4.39Å; F318-L339 HydrophobicContact CE2-CD2 4.33Å; F318-L339 HydrophobicContact CG-CD2 4.01Å; F318-L339 HydrophobicContact CZ-CD2 4.48Å; F330-L339 HydrophobicContact CB-CD1 4.15Å; F330-L339 HydrophobicContact CD2-CD1 3.39Å; F330-L339 HydrophobicContact CE2-CD1 4.06Å; F330-L339 HydrophobicContact CG-CD1 4.07Å; M332-L339 HydrophobicContact CG-CB 4.48Å; M332-L339 HydrophobicContact CG-CD1 3.88Å; L339-V350 CarbonylContact O-C 3.6Å; L339-V350 VanDerWaalsContact O-CA 3.22Å; L339-V350 WeakPolarHBondContact O-CA 3.48Å; L339-W351 HydrophobicContact CB-CB 4.32Å; L339-W351 HydrophobicContact CB-CE3 4.34Å; L339-W351 HydrophobicContact CD2-CD2 4.45Å; L339-W351 HydrophobicContact CD2-CE3 3.98Å; L339-W351 HydrophobicContact CG-CE3 3.93Å; L339-W351 HydrophobicContact CG-CZ3 4.44Å; L339-W351 PolarHBondContact N-O 2.83Å; L339-W351 PolarHBondContact O-N 2.96Å; L339-L353 HydrophobicContact CB-CD1 4.01Å; L339-L353 HydrophobicContact CB-CD2 3.98Å; L339-L353 HydrophobicContact CB-CG 4.01Å; L339-L353 HydrophobicContact CD2-CD2 4.33Å
340	A	98.7	Very high	98.1	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.6	176.1	0	0	0	0	0	112	F330 S331 L348 Y349 V350 F380 L387	F330-A340 CarbonylContact C-O 3.53Å; F330-A340 WeakPolarHBondContact CA-O 3.14Å; F330-A340 VanDerWaalsContact CB-O 3.3Å; F330-A340 WeakPolarHBondContact CB-O 3.42Å; S331-A340 PolarHBondContact N-O 2.91Å; S331-A340 PolarHBondContact O-N 3.41Å; A340-L348 HydrophobicContact CB-CD1 4.4Å; A340-Y349 CarbonylContact C-O 3.47Å; A340-Y349 VanDerWaalsContact CA-O 3.24Å; A340-Y349 WeakPolarHBondContact CA-O 3.26Å; A340-V350 HydrophobicContact CB-CG2 4.32Å; A340-F380 HydrophobicContact CB-CE2 3.59Å; A340-F380 HydrophobicContact CB-CZ 3.68Å; A340-L387 HydrophobicContact CB-CD1 4.25Å; A340-L387 HydrophobicContact CB-CD2 4.24Å
341	L	98.8	Very high	97.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	125.8	172.6	175.8	63.6	0	0	0	110.5	K284 I290 Y320 F330 Y349 W351	K284-L341 HydrophobicContact CD-CD1 4.3Å; K284-L341 HydrophobicContact CD-CD2 4.24Å; I290-L341 HydrophobicContact CD1-CB 4.33Å; I290-L341 HydrophobicContact CD1-CD2 4Å; I290-L341 HydrophobicContact CG1-CD2 4.48Å; Y320-L341 HydrophobicContact CD1-CD2 3.78Å; Y320-L341 HydrophobicContact CD2-CD2 3.84Å; Y320-L341 HydrophobicContact CE1-CD2 3.38Å; Y320-L341 HydrophobicContact CE2-CD2 3.44Å; Y320-L341 VanDerWaalsContact CE2-CD2 3.44Å; Y320-L341 HydrophobicContact CG-CD2 3.99Å; F330-L341 HydrophobicContact CB-CB 4.02Å; F330-L341 HydrophobicContact CB-CD1 4Å; F330-L341 HydrophobicContact CB-CG 4.48Å; L341-Y349 PolarHBondContact N-O 3.44Å; L341-Y349 PolarHBondContact O-N 3.05Å; L341-W351 HydrophobicContact CB-CH2 4.27Å; L341-W351 HydrophobicContact CB-CZ3 3.92Å
342	G	98.8	Very high	97.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	152.8	167.2	0	0	0	0	0	112.5	C323 M328 K347	C323-G342 PolarHBondContact SG-O 2.95Å; C323-G342 VanDerWaalsContact SG-O 3.36Å; M328-G342 WeakPolarHBondContact CE-O 3.46Å; G342-K347 CarbonylContact C-O 3.59Å; G342-K347 WeakPolarHBondContact CA-O 3.46Å
343	N	98.8	Very high	97.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	12%	0.124	C	C	.	.			trans	-115	179.2	174.5	85.1	-7.5	0	0	0	112.6	S321 Q322 C323 V345 G346 K347 Y349 A374 I375	S321-N343 PolarHBondContact O-ND2 2.85Å; Q322-N343 WeakPolarHBondContact O-CB 3.36Å; C323-N343 HydrophobicContact CB-CB 3.78Å; N343-V345 WeakPolarHBondContact ND2-CG2 3.3Å; N343-V345 PolarHBondContact O-N 2.94Å; N343-V345 WeakPolarHBondContact OD1-CG2 3.49Å; N343-V345 PolarHBondContact OD1-N 3.23Å; N343-G346 PolarHBondContact OD1-N 2.78Å; N343-K347 PolarHBondContact N-O 3.13Å; N343-K347 WeakPolarHBondContact OD1-CB 3.34Å; N343-K347 PolarHBondContact OD1-N 2.98Å; N343-K347 PolarHBondContact OD1-O 2.91Å; N343-Y349 HydrophobicContact CB-CE2 3.87Å; N343-Y349 PolarHBondContact ND2-OH 2.95Å; N343-A374 WeakPolarHBondContact O-CA 3.48Å; N343-I375 PolarHBondContact O-N 3.05Å
344	Q	98.6	Very high	96.7	Very high	52 Å²	52	32.2 Å²	32.2	24%	0.243	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-0.7	-173.3	78.4	-141.9	21	0	0	115	Q322 D324 I325 A374	Q322-Q344 WeakPolarHBondContact O-CG 3.25Å; Q322-Q344 PolarHBondContact O-N 3.33Å; Q322-Q344 PolarHBondContact O-OE1 3.25Å; D324-Q344 PolarHBondContact OD1-NE2 3.07Å; D324-Q344 PolarHBondContact OD1-OE1 3Å; I325-Q344 HydrophobicContact CD1-CB 3.68Å; I325-Q344 HydrophobicContact CG1-CB 4.04Å; Q344-A374 HydrophobicContact CB-CB 4.09Å
345	V	98.6	Very high	95.7	Very high	50 Å²	50	31.3 Å²	31.3	30%	0.303	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.6	24.7	-178.7	-62.4	0	0	0	0	112.4	Q322 N343 K347 V372	Q322-V345 HydrophobicContact CB-CG2 4.12Å; N343-V345 WeakPolarHBondContact ND2-CG2 3.3Å; N343-V345 PolarHBondContact O-N 2.94Å; N343-V345 WeakPolarHBondContact OD1-CG2 3.49Å; N343-V345 PolarHBondContact OD1-N 3.23Å; V345-K347 HydrophobicContact CG2-CD 4.32Å; V345-K347 HydrophobicContact CG2-CG 4.25Å; V345-K347 PolarHBondContact O-N 3.48Å; V345-V372 CarbonylContact C-O 3.42Å; V345-V372 WeakPolarHBondContact CA-O 3.23Å
346	G	98.4	Very high	94.5	Very high	2 Å²	2	33.5 Å²	33.5	2%	0.021	16%	0.16	C	C	.	.	S	Bend	trans	77	14.3	172.8	0	0	0	0	0	115.9	N343 C371 A373	N343-G346 PolarHBondContact OD1-N 2.78Å; G346-C371 WeakPolarHBondContact CA-O 3.27Å; G346-C371 PolarHBondContact O-SG 3.16Å; G346-A373 WeakPolarHBondContact CA-O 3.29Å; G346-A373 PolarHBondContact N-O 3.24Å
347	K	98.7	Very high	93.3	Very high	65 Å²	65	33.4 Å²	33.4	28%	0.283	16%	0.161	S	C	.	.			trans	-89.8	140.1	170.8	-54.4	176.6	-177.3	162	0	110	G342 N343 V345 Y349 T365 T367	G342-K347 CarbonylContact C-O 3.59Å; G342-K347 WeakPolarHBondContact CA-O 3.46Å; N343-K347 PolarHBondContact N-O 3.13Å; N343-K347 WeakPolarHBondContact OD1-CB 3.34Å; N343-K347 PolarHBondContact OD1-N 2.98Å; N343-K347 PolarHBondContact OD1-O 2.91Å; V345-K347 HydrophobicContact CG2-CD 4.32Å; V345-K347 HydrophobicContact CG2-CG 4.25Å; V345-K347 PolarHBondContact O-N 3.48Å; K347-Y349 HydrophobicContact CB-CE2 3.98Å; K347-T365 HydrophobicContact CB-CG2 4.12Å; K347-T367 HydrophobicContact CB-CG2 4.3Å; K347-T367 HydrophobicContact CG-CG2 3.94Å
348	L	98.7	Very high	92.1	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	115.4	178.9	178	60.4	0	0	0	110	A340 T365 L366 I375 T378 L387 A389 W399	A340-L348 HydrophobicContact CB-CD1 4.4Å; L348-T365 CarbonylContact O-C 3.59Å; L348-T365 WeakPolarHBondContact O-CA 3.4Å; L348-L366 HydrophobicContact CB-CB 4.11Å; L348-L366 HydrophobicContact CD2-CD1 4.04Å; L348-L366 HydrophobicContact CG-CD1 4.3Å; L348-L366 PolarHBondContact N-O 3.39Å; L348-L366 PolarHBondContact O-N 3.13Å; L348-I375 HydrophobicContact CB-CD1 4.18Å; L348-T378 HydrophobicContact CD1-CG2 3.38Å; L348-T378 HydrophobicContact CD2-CG2 4.26Å; L348-T378 HydrophobicContact CG-CG2 4.47Å; L348-L387 HydrophobicContact CD2-CD2 3.63Å; L348-L387 HydrophobicContact CD2-CG 4.06Å; L348-L387 HydrophobicContact CG-CD2 4.31Å; L348-A389 HydrophobicContact CD2-CB 4.21Å; L348-W399 HydrophobicContact CD2-CG 4.5Å
349	Y	98.3	Very high	90.8	Very high	15 Å²	15	36.9 Å²	36.9	6%	0.059	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	134	-179.3	-61.4	-101.2	0	0	0	109.3	S321 A340 L341 N343 K347 W351 T365	S321-Y349 PolarHBondContact N-OH 3.02Å; S321-Y349 PolarHBondContact O-OH 2.91Å; S321-Y349 PolarHBondContact OG-OH 3.21Å; A340-Y349 CarbonylContact C-O 3.47Å; A340-Y349 VanDerWaalsContact CA-O 3.24Å; A340-Y349 WeakPolarHBondContact CA-O 3.26Å; L341-Y349 PolarHBondContact N-O 3.44Å; L341-Y349 PolarHBondContact O-N 3.05Å; N343-Y349 HydrophobicContact CB-CE2 3.87Å; N343-Y349 PolarHBondContact ND2-OH 2.95Å; K347-Y349 HydrophobicContact CB-CE2 3.98Å; Y349-W351 VanDerWaalsContact CB-CZ3 3.46Å; Y349-W351 HydrophobicContact CD1-CH2 4.43Å; Y349-W351 HydrophobicContact CD1-CZ2 4.35Å; Y349-W351 AromaticContact CG-CH2 3.96Å; Y349-W351 HydrophobicContact CG-CH2 3.96Å; Y349-W351 HydrophobicContact CG-CZ2 4.34Å; Y349-T365 HydrophobicContact CD1-CG2 4.43Å; Y349-T365 HydrophobicContact CE1-CG2 4.32Å
350	V	97.7	Very high	89.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	122.6	178.5	-176.3	0	0	0	0	110.1	F44 L339 A340 C363 T364 L366 L387	F44-V350 HydrophobicContact CE2-CG1 4.16Å; L339-V350 CarbonylContact O-C 3.6Å; L339-V350 VanDerWaalsContact O-CA 3.22Å; L339-V350 WeakPolarHBondContact O-CA 3.48Å; A340-V350 HydrophobicContact CB-CG2 4.32Å; V350-C363 CarbonylContact O-C 3.55Å; V350-C363 WeakPolarHBondContact O-CA 3.36Å; V350-T364 PolarHBondContact N-O 2.89Å; V350-T364 PolarHBondContact O-N 2.71Å; V350-L366 HydrophobicContact CG2-CD1 3.87Å; V350-L366 HydrophobicContact CG2-CG 4.3Å; V350-L387 HydrophobicContact CG2-CD2 3.95Å
351	W	95.9	Very high	88.8	Confident	5 Å²	5	44.1 Å²	44.1	2%	0.019	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	145.1	177.8	-61.2	-99.2	0	0	0	111.8	I290 F318 Y320 M338 L339 L341 Y349 A361 K362 C363	I290-W351 HydrophobicContact CD1-CZ3 4.45Å; F318-W351 HydrophobicContact CB-CD2 4.26Å; F318-W351 HydrophobicContact CB-CZ2 4.16Å; F318-W351 HydrophobicContact CD1-CB 4.06Å; F318-W351 AromaticContact CD1-CD1 3.68Å; F318-W351 HydrophobicContact CD1-CD2 4.3Å; F318-W351 AromaticContact CD1-CG 3.77Å; F318-W351 HydrophobicContact CD1-CG 3.77Å; F318-W351 HydrophobicContact CE1-CB 4.33Å; Y320-W351 AromaticContact CD1-CH2 3.6Å; Y320-W351 HydrophobicContact CD1-CH2 3.6Å; Y320-W351 AromaticContact CD1-CZ2 3.85Å; Y320-W351 HydrophobicContact CD1-CZ2 3.85Å; Y320-W351 HydrophobicContact CE1-CH2 4.41Å; Y320-W351 HydrophobicContact CG-CH2 4.21Å; Y320-W351 HydrophobicContact CG-CZ2 4.48Å; M338-W351 WeakPolarHBondContact CA-O 3.46Å; L339-W351 HydrophobicContact CB-CB 4.32Å; L339-W351 HydrophobicContact CB-CE3 4.34Å; L339-W351 HydrophobicContact CD2-CD2 4.45Å; L339-W351 HydrophobicContact CD2-CE3 3.98Å; L339-W351 HydrophobicContact CG-CE3 3.93Å; L339-W351 HydrophobicContact CG-CZ3 4.44Å; L339-W351 PolarHBondContact N-O 2.83Å; L339-W351 PolarHBondContact O-N 2.96Å; L341-W351 HydrophobicContact CB-CH2 4.27Å; L341-W351 HydrophobicContact CB-CZ3 3.92Å; Y349-W351 VanDerWaalsContact CB-CZ3 3.46Å; Y349-W351 HydrophobicContact CD1-CH2 4.43Å; Y349-W351 HydrophobicContact CD1-CZ2 4.35Å; Y349-W351 AromaticContact CG-CH2 3.96Å; Y349-W351 HydrophobicContact CG-CH2 3.96Å; Y349-W351 HydrophobicContact CG-CZ2 4.34Å; W351-A361 HydrophobicContact CB-CB 4.4Å; W351-K362 WeakPolarHBondContact CA-O 3.37Å; W351-C363 HydrophobicContact CG-CB 4.39Å
352	D	93.1	Very high	87.9	Confident	14 Å²	14	47.7 Å²	47.7	8%	0.075	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	120.6	166.7	-173.5	-5.1	0	0	0	109.3	K41 Y42 E354 K362	K41-D352 WeakPolarHBondContact CD-OD2 3.37Å; K41-D352 VanDerWaalsContact CE-OD2 3.27Å; K41-D352 WeakPolarHBondContact CE-OD2 3.16Å; K41-D352 IonicContact NZ-OD1 2.78Å; K41-D352 PolarHBondContact NZ-OD1 2.96Å; K41-D352 IonicContact NZ-OD2 2.83Å; K41-D352 PolarHBondContact NZ-OD2 2.85Å; Y42-D352 HydrophobicContact CD2-CB 3.92Å; Y42-D352 HydrophobicContact CE2-CB 3.7Å; Y42-D352 VanDerWaalsContact CE2-CG 3.46Å; Y42-D352 WeakPolarHBondContact CE2-OD1 3.18Å; D352-E354 WeakPolarHBondContact OD1-CB 3.38Å; D352-E354 PolarHBondContact OD1-N 2.96Å; D352-K362 PolarHBondContact N-O 2.98Å
353	L	91.8	Very high	87.4	Confident	22 Å²	22	50.1 Å²	50.1	12%	0.115	25%	0.246	C	C	.	.			trans	-93.8	-7.1	178.3	-62	-178.6	0	0	0	112.9	L277 F318 M332 Q336 K337 L339 I355	L277-L353 HydrophobicContact CD1-CD1 4.09Å; F318-L353 HydrophobicContact CE1-CD2 3.7Å; F318-L353 HydrophobicContact CZ-CD2 3.58Å; M332-L353 HydrophobicContact CG-CD1 4.21Å; M332-L353 HydrophobicContact SD-CD1 3.7Å; Q336-L353 WeakPolarHBondContact O-CD1 3.46Å; K337-L353 PolarHBondContact O-N 2.82Å; L339-L353 HydrophobicContact CB-CD1 4.01Å; L339-L353 HydrophobicContact CB-CD2 3.98Å; L339-L353 HydrophobicContact CB-CG 4.01Å; L339-L353 HydrophobicContact CD2-CD2 4.33Å; L353-I355 PolarHBondContact O-N 2.85Å
354	E	85.4	Confident	87.1	Confident	96 Å²	96	51.6 Å²	51.6	45%	0.449	26%	0.255	S	S	.	.			trans	-77.7	38.6	177.3	-62.7	-173.6	115.4	0	0	112.4	K41 Y42 K337 D352	K41-E354 IonicContact NZ-OE2 3.89Å; K41-E354 PolarHBondContact NZ-OE2 2.92Å; Y42-E354 PolarHBondContact OH-OE2 2.83Å; K337-E354 HydrophobicContact CB-CG 3.98Å; K337-E354 HydrophobicContact CD-CG 4.18Å; K337-E354 WeakPolarHBondContact CD-OE1 3.14Å; K337-E354 WeakPolarHBondContact CE-OE1 3.33Å; K337-E354 HydrophobicContact CG-CG 3.79Å; K337-E354 IonicContact NZ-OE1 3.91Å; K337-E354 PolarHBondContact NZ-OE1 3.46Å; D352-E354 WeakPolarHBondContact OD1-CB 3.38Å; D352-E354 PolarHBondContact OD1-N 2.96Å
355	I	76.8	Confident	87	Confident	55 Å²	55	52.3 Å²	52.3	28%	0.282	26%	0.264	S	S	.	.	S	Bend	trans	-128.5	150.5	-180	61.3	155.2	0	0	0	110.5	L353 D357 K360 A361	L353-I355 PolarHBondContact O-N 2.85Å; I355-D357 WeakPolarHBondContact CD1-O 3.47Å; I355-D357 PolarHBondContact O-N 2.99Å; I355-K360 HydrophobicContact CD1-CB 4.03Å; I355-K360 WeakPolarHBondContact CD1-O 3.42Å; I355-A361 HydrophobicContact CD1-CB 3.69Å
356	E	71.3	Confident	87	Confident	201 Å²	201	50.4 Å²	50.4	94%	0.939	25%	0.252	S	S	*	.	S	Bend	trans	-74.3	-25.2	-173.3	-65	174.2	174.9	0	0	114
357	D	71.7	Confident	86.9	Confident	45 Å²	45	54.5 Å²	54.5	24%	0.241	28%	0.276	C	S	.	.			trans	-128	113.2	-173.7	176.7	-0.2	0	0	0	110	I355 H359 K360	I355-D357 WeakPolarHBondContact CD1-O 3.47Å; I355-D357 PolarHBondContact O-N 2.99Å; D357-H359 PolarHBondContact O-N 2.71Å; D357-H359 WeakPolarHBondContact OD1-CB 3.36Å; D357-H359 IonicContact OD1-CG 3.98Å; D357-H359 PolarHBondContact OD1-N 3.26Å; D357-H359 IonicContact OD1-ND1 2.85Å; D357-H359 PolarHBondContact OD1-ND1 3.48Å; D357-K360 HydrophobicContact CB-CB 4.39Å; D357-K360 HydrophobicContact CB-CD 3.93Å; D357-K360 HydrophobicContact CB-CG 4.04Å; D357-K360 WeakPolarHBondContact O-CA 3.34Å; D357-K360 WeakPolarHBondContact O-CB 3.36Å; D357-K360 PolarHBondContact O-N 2.97Å; D357-K360 VanDerWaalsContact OD2-CE 3.26Å; D357-K360 WeakPolarHBondContact OD2-CE 3.46Å; D357-K360 IonicContact OD2-NZ 3.59Å
358	P	69.8	Low	86.9	Confident	25 Å²	25	54.2 Å²	54.2	16%	0.162	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-52.8	-29.2	178.9	-28.2	35.4	0	0	0	114.4	C292 F318 K360 A361	C292-P358 HydrophobicContact CB-CG 4.24Å; F318-P358 HydrophobicContact CE1-CB 4.3Å; F318-P358 HydrophobicContact CE2-CB 4.1Å; F318-P358 HydrophobicContact CZ-CB 3.81Å; F318-P358 HydrophobicContact CZ-CG 4.46Å; P358-K360 PolarHBondContact O-N 3.14Å; P358-A361 WeakPolarHBondContact O-CB 3.4Å; P358-A361 PolarHBondContact O-N 2.96Å
359	H	70	Confident	86.9	Confident	126 Å²	126	59.9 Å²	59.9	58%	0.583	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-68.8	-21	176.3	-60.6	88.6	0	0	0	112.9	L315 G316 D357 A361	L315-H359 PolarHBondContact O-CE1 3.5Å; G316-H359 WeakPolarHBondContact CA-CE1 3.45Å; D357-H359 PolarHBondContact O-N 2.71Å; D357-H359 WeakPolarHBondContact OD1-CB 3.36Å; D357-H359 IonicContact OD1-CG 3.98Å; D357-H359 PolarHBondContact OD1-N 3.26Å; D357-H359 IonicContact OD1-ND1 2.85Å; D357-H359 PolarHBondContact OD1-ND1 3.48Å; H359-A361 VanDerWaalsContact C-N 3.27Å
360	K	74.6	Confident	86.9	Confident	135 Å²	135	66.9 Å²	66.9	59%	0.587	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-88.9	2.3	173.3	-58.9	177.4	-168.1	150.7	0	111.4	I355 D357 P358 K362	I355-K360 HydrophobicContact CD1-CB 4.03Å; I355-K360 WeakPolarHBondContact CD1-O 3.42Å; D357-K360 HydrophobicContact CB-CB 4.39Å; D357-K360 HydrophobicContact CB-CD 3.93Å; D357-K360 HydrophobicContact CB-CG 4.04Å; D357-K360 WeakPolarHBondContact O-CA 3.34Å; D357-K360 WeakPolarHBondContact O-CB 3.36Å; D357-K360 PolarHBondContact O-N 2.97Å; D357-K360 VanDerWaalsContact OD2-CE 3.26Å; D357-K360 WeakPolarHBondContact OD2-CE 3.46Å; D357-K360 IonicContact OD2-NZ 3.59Å; P358-K360 PolarHBondContact O-N 3.14Å; K360-K362 WeakPolarHBondContact O-CG 3.34Å; K360-K362 PolarHBondContact O-N 2.86Å; K360-K362 VanDerWaalsContact O-N 3.15Å
361	A	78.2	Confident	86.9	Confident	17 Å²	17	67.1 Å²	67.1	14%	0.14	35%	0.345	C	S	.	.			trans	-64.1	115.3	179.9	0	0	0	0	0	109.4	F318 W351 I355 P358 H359 C363	F318-A361 HydrophobicContact CD1-CB 3.49Å; F318-A361 VanDerWaalsContact CD1-CB 3.49Å; F318-A361 HydrophobicContact CE1-CB 3.28Å; F318-A361 HydrophobicContact CZ-CB 4.46Å; W351-A361 HydrophobicContact CB-CB 4.4Å; I355-A361 HydrophobicContact CD1-CB 3.69Å; P358-A361 WeakPolarHBondContact O-CB 3.4Å; P358-A361 PolarHBondContact O-N 2.96Å; H359-A361 VanDerWaalsContact C-N 3.27Å; A361-C363 PolarHBondContact O-N 3.11Å
362	K	80.3	Confident	87	Confident	76 Å²	76	71.6 Å²	71.6	33%	0.33	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-85.6	122.9	-176.6	-62.5	170.4	-174.1	171.2	0	107.5	K38 K39 C40 W351 D352 K360	K38-K362 WeakPolarHBondContact O-CD 3.19Å; K38-K362 WeakPolarHBondContact O-CE 3.49Å; K38-K362 PolarHBondContact O-NZ 3.34Å; K39-K362 WeakPolarHBondContact O-CD 3.47Å; C40-K362 HydrophobicContact CB-CB 3.58Å; C40-K362 WeakPolarHBondContact CB-O 3.5Å; W351-K362 WeakPolarHBondContact CA-O 3.37Å; D352-K362 PolarHBondContact N-O 2.98Å; K360-K362 WeakPolarHBondContact O-CG 3.34Å; K360-K362 PolarHBondContact O-N 2.86Å; K360-K362 VanDerWaalsContact O-N 3.15Å
363	C	88	Confident	87.3	Confident	50 Å²	50	71.7 Å²	71.7	34%	0.338	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.6	173.6	-169.9	0	0	0	0	110.6	V350 W351 A361	V350-C363 CarbonylContact O-C 3.55Å; V350-C363 WeakPolarHBondContact O-CA 3.36Å; W351-C363 HydrophobicContact CG-CB 4.39Å; A361-C363 PolarHBondContact O-N 3.11Å
364	T	92.8	Very high	87.6	Confident	31 Å²	31	71 Å²	71	19%	0.19	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	129.2	156.9	-63.6	0	0	0	0	107.5	C40 Y42 V350 L366	C40-T364 VanDerWaalsContact CB-OG1 3.27Å; C40-T364 WeakPolarHBondContact CB-OG1 3.36Å; Y42-T364 PolarHBondContact O-OG1 3.16Å; V350-T364 PolarHBondContact N-O 2.89Å; V350-T364 PolarHBondContact O-N 2.71Å; T364-L366 HydrophobicContact CG2-CD2 3.84Å
365	T	96.8	Very high	88.3	Confident	68 Å²	68	66.5 Å²	66.5	42%	0.417	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.2	174.4	-49.4	0	0	0	0	109.3	K347 L348 Y349 T367	K347-T365 HydrophobicContact CB-CG2 4.12Å; L348-T365 CarbonylContact O-C 3.59Å; L348-T365 WeakPolarHBondContact O-CA 3.4Å; Y349-T365 HydrophobicContact CD1-CG2 4.43Å; Y349-T365 HydrophobicContact CE1-CG2 4.32Å; T365-T367 HydrophobicContact CG2-CG2 3.98Å
366	L	98.1	Very high	89.3	Confident	9 Å²	9	65.3 Å²	65.3	5%	0.047	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.9	176.5	-51.6	179.7	0	0	0	108.4	F44 L348 V350 T364 L387 W399	F44-L366 HydrophobicContact CB-CD1 3.74Å; F44-L366 HydrophobicContact CB-CD2 3.84Å; F44-L366 HydrophobicContact CB-CG 4.46Å; F44-L366 HydrophobicContact CD2-CD1 4.09Å; F44-L366 HydrophobicContact CD2-CD2 4.47Å; F44-L366 HydrophobicContact CG-CD1 4.01Å; L348-L366 HydrophobicContact CB-CB 4.11Å; L348-L366 HydrophobicContact CD2-CD1 4.04Å; L348-L366 HydrophobicContact CG-CD1 4.3Å; L348-L366 PolarHBondContact N-O 3.39Å; L348-L366 PolarHBondContact O-N 3.13Å; V350-L366 HydrophobicContact CG2-CD1 3.87Å; V350-L366 HydrophobicContact CG2-CG 4.3Å; T364-L366 HydrophobicContact CG2-CD2 3.84Å; L366-L387 HydrophobicContact CD1-CD2 4.19Å; L366-W399 HydrophobicContact CB-CD2 4.23Å; L366-W399 HydrophobicContact CB-CE3 3.87Å; L366-W399 HydrophobicContact CB-CH2 3.81Å; L366-W399 HydrophobicContact CB-CZ2 4.14Å; L366-W399 HydrophobicContact CB-CZ3 3.66Å; L366-W399 HydrophobicContact CD1-CB 4.47Å; L366-W399 HydrophobicContact CD1-CD2 4.02Å; L366-W399 HydrophobicContact CD1-CE3 3.95Å; L366-W399 HydrophobicContact CD1-CG 4.25Å; L366-W399 HydrophobicContact CD2-CE3 4.38Å; L366-W399 HydrophobicContact CD2-CZ3 4.46Å; L366-W399 HydrophobicContact CG-CE3 4.29Å; L366-W399 HydrophobicContact CG-CZ3 4.44Å
367	T	98.2	Very high	90.6	Very high	88 Å²	88	55.8 Å²	55.8	54%	0.54	30%	0.3	S	S	.	.			trans	-141.2	147.3	-178.7	61.9	0	0	0	0	110.4	K347 T365	K347-T367 HydrophobicContact CB-CG2 4.3Å; K347-T367 HydrophobicContact CG-CG2 3.94Å; T365-T367 HydrophobicContact CG2-CG2 3.98Å
368	H	98.5	Very high	91.9	Very high	59 Å²	59	53.7 Å²	53.7	27%	0.273	29%	0.288	S	S	.	.			trans	-138.1	136.4	172.2	-176.1	-90.8	0	0	0	108.6	K370 C371 W397 W399	H368-K370 PolarHBondContact ND1-N 3.31Å; H368-K370 PolarHBondContact O-N 3.09Å; H368-C371 HydrophobicContact CB-CB 3.95Å; H368-C371 PolarHBondContact O-N 3.28Å; H368-W397 HydrophobicContact CB-CE3 4.33Å; H368-W397 HydrophobicContact CB-CZ3 3.87Å; H368-W397 AromaticContact CE1-CZ3 3.82Å; H368-W397 AromaticContact CG-CZ3 3.53Å; H368-W397 AromaticContact ND1-CH2 3.38Å; H368-W397 WeakPolarHBondContact ND1-CH2 3.44Å; H368-W397 AromaticContact ND1-CZ3 3.2Å; H368-W397 WeakPolarHBondContact ND1-CZ3 3.44Å; H368-W399 HydrophobicContact CB-CH2 4.21Å; H368-W399 HydrophobicContact CB-CZ2 4.45Å
369	P	97.7	Very high	93.3	Very high	121 Å²	121	52.6 Å²	52.6	79%	0.786	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.2	-173.5	-27.1	35	0	0	0	115.3
370	K	98.3	Very high	94.7	Very high	161 Å²	161	46.6 Å²	46.6	70%	0.7	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-8.7	177.4	-60.1	-178.1	-177.9	-179.7	0	113.8	H368 V372 W397	H368-K370 PolarHBondContact ND1-N 3.31Å; H368-K370 PolarHBondContact O-N 3.09Å; K370-V372 PolarHBondContact O-N 2.66Å; K370-W397 HydrophobicContact CB-CH2 3.85Å; K370-W397 HydrophobicContact CB-CZ2 4.49Å; K370-W397 WeakPolarHBondContact O-CZ2 3.17Å
371	C	98.4	Very high	95.9	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.041	23%	0.226	C	C	.	.			trans	-91.9	94.3	176.4	-176	0	0	0	0	108.1	G346 H368 W397	G346-C371 WeakPolarHBondContact CA-O 3.27Å; G346-C371 PolarHBondContact O-SG 3.16Å; H368-C371 HydrophobicContact CB-CB 3.95Å; H368-C371 PolarHBondContact O-N 3.28Å; C371-W397 VanDerWaalsContact CA-CZ2 3.4Å; C371-W397 HydrophobicContact CB-CD2 3.8Å; C371-W397 VanDerWaalsContact CB-CE2 3.5Å; C371-W397 HydrophobicContact CB-CE3 4Å; C371-W397 HydrophobicContact CB-CH2 3.76Å; C371-W397 HydrophobicContact CB-CZ2 3.48Å; C371-W397 VanDerWaalsContact CB-CZ2 3.48Å; C371-W397 HydrophobicContact CB-CZ3 4Å
372	V	98.2	Very high	96.8	Very high	98 Å²	98	44 Å²	44	59%	0.594	24%	0.236	S	C	*	.			trans	-126.9	-9.9	-173.2	-62.3	0	0	0	0	113.7	V345 K370	V345-V372 CarbonylContact C-O 3.42Å; V345-V372 WeakPolarHBondContact CA-O 3.23Å; K370-V372 PolarHBondContact O-N 2.66Å
373	A	98.8	Very high	97.6	Very high	17 Å²	17	44.2 Å²	44.2	14%	0.14	24%	0.241	C	C	.	.	S	Bend	trans	-82.3	162.4	178.7	0	0	0	0	0	111.8	G346 I375 C391 D393	G346-A373 WeakPolarHBondContact CA-O 3.29Å; G346-A373 PolarHBondContact N-O 3.24Å; A373-I375 PolarHBondContact O-N 3.05Å; A373-C391 HydrophobicContact CB-CB 3.94Å; A373-D393 HydrophobicContact CB-CB 3.8Å; A373-D393 VanDerWaalsContact CB-CG 3.43Å; A373-D393 WeakPolarHBondContact CB-OD1 3.5Å
374	A	98.8	Very high	98	Very high	7 Å²	7	41.9 Å²	41.9	6%	0.058	23%	0.225	C	C	.	.			trans	-64.8	125.6	176.8	0	0	0	0	0	111.2	I325 M328 N343 Q344 C391 D392	I325-A374 HydrophobicContact CD1-CB 4.04Å; M328-A374 HydrophobicContact CE-CB 4.47Å; M328-A374 HydrophobicContact SD-CB 4.47Å; N343-A374 WeakPolarHBondContact O-CA 3.48Å; Q344-A374 HydrophobicContact CB-CB 4.09Å; A374-C391 CarbonylContact O-C 3.56Å; A374-C391 WeakPolarHBondContact O-CA 3.35Å; A374-D392 HydrophobicContact CB-CB 4.37Å; A374-D392 PolarHBondContact O-N 3.06Å
375	I	98.9	Very high	98.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	105.4	177.3	-64.6	163.8	0	0	0	108.8	M328 N343 L348 A373 T378 A389 V390 C391	M328-I375 WeakPolarHBondContact CE-O 3.46Å; N343-I375 PolarHBondContact O-N 3.05Å; L348-I375 HydrophobicContact CB-CD1 4.18Å; A373-I375 PolarHBondContact O-N 3.05Å; I375-T378 HydrophobicContact CG2-CG2 3.84Å; I375-A389 HydrophobicContact CD1-CB 4.47Å; I375-A389 HydrophobicContact CG2-CB 3.75Å; I375-V390 CarbonylContact C-O 3.56Å; I375-V390 WeakPolarHBondContact CA-O 3.39Å; I375-C391 VanDerWaalsContact CG1-SG 3.58Å
376	R	98.8	Very high	98.3	Very high	30 Å²	30	39.2 Å²	39.2	11%	0.113	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-39.5	-172.6	-70.3	-69.4	174.8	-171.5	-3.7	114	L58 F59 W326 Y327 R329 V390 D392	L58-R376 WeakPolarHBondContact O-CB 3.26Å; F59-R376 HydrophobicContact CD1-CG 4.43Å; F59-R376 WeakPolarHBondContact O-CB 3.38Å; W326-R376 PolarHBondContact O-NH1 3.43Å; Y327-R376 VanDerWaalsContact O-CD 3.28Å; Y327-R376 WeakPolarHBondContact O-CD 3.32Å; Y327-R376 PolarHBondContact O-NH1 2.61Å; Y327-R376 VanDerWaalsContact O-NH1 3.12Å; R329-R376 PolarHBondContact N-O 2.85Å; R376-V390 PolarHBondContact N-O 2.98Å; R376-D392 VanDerWaalsContact CG-OD1 3.27Å; R376-D392 WeakPolarHBondContact CG-OD1 3.44Å; R376-D392 IonicContact CZ-OD1 3.97Å; R376-D392 IonicContact CZ-OD2 2.93Å; R376-D392 IonicContact NE-OD1 2.92Å; R376-D392 PolarHBondContact NE-OD1 2.78Å; R376-D392 IonicContact NE-OD2 3.83Å; R376-D392 PolarHBondContact NE-OD2 3.12Å; R376-D392 IonicContact NH2-OD1 3.69Å; R376-D392 PolarHBondContact NH2-OD1 3.2Å; R376-D392 IonicContact NH2-OD2 2.88Å; R376-D392 PolarHBondContact NH2-OD2 2.83Å
377	Q	98.9	Very high	98.4	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.009	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	152.7	179	-171.9	168	48.9	0	0	110.3	V61 R329 V390	V61-Q377 HydrophobicContact CG1-CB 4.17Å; V61-Q377 HydrophobicContact CG1-CG 4.17Å; V61-Q377 WeakPolarHBondContact CG1-O 3.43Å; V61-Q377 PolarHBondContact O-OE1 2.94Å; R329-Q377 HydrophobicContact CB-CB 4.41Å; R329-Q377 HydrophobicContact CB-CG 4.24Å; Q377-V390 PolarHBondContact O-N 3.44Å
378	T	98.9	Very high	98.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	155.5	170	55.6	0	0	0	0	111.5	S331 L348 I375 I388 A389	S331-T378 WeakPolarHBondContact CB-O 3.36Å; S331-T378 VanDerWaalsContact OG-C 3.28Å; S331-T378 PolarHBondContact OG-O 3.49Å; S331-T378 PolarHBondContact OG-OG1 3.5Å; L348-T378 HydrophobicContact CD1-CG2 3.38Å; L348-T378 HydrophobicContact CD2-CG2 4.26Å; L348-T378 HydrophobicContact CG-CG2 4.47Å; I375-T378 HydrophobicContact CG2-CG2 3.84Å; T378-I388 CarbonylContact C-O 3.52Å; T378-I388 WeakPolarHBondContact CA-O 3.33Å; T378-I388 WeakPolarHBondContact CB-O 3.27Å; T378-A389 HydrophobicContact CG2-CB 3.69Å
379	S	98.9	Very high	98.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.014	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	133.2	174.5	-166.1	0	0	0	0	110.6	F63 I388	F63-S379 WeakPolarHBondContact CE2-O 3.42Å; F63-S379 PolarHBondContact N-OG 2.66Å; S379-I388 PolarHBondContact N-O 2.7Å; S379-I388 PolarHBondContact O-N 2.73Å
380	F	98.9	Very high	98.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	143	170.8	-72.5	-81.4	0	0	0	110	F44 F63 W65 D333 M338 A340 I386 L387	F44-F380 HydrophobicContact CE1-CE1 4.37Å; F44-F380 AromaticContact CZ-CE1 3.97Å; F44-F380 HydrophobicContact CZ-CE1 3.97Å; F63-F380 VanDerWaalsContact CD2-O 3.27Å; F63-F380 WeakPolarHBondContact CD2-O 3.36Å; W65-F380 PolarHBondContact NE1-O 3.02Å; D333-F380 HydrophobicContact CB-CB 3.9Å; D333-F380 HydrophobicContact CB-CD1 4.3Å; D333-F380 HydrophobicContact CB-CD2 3.94Å; D333-F380 HydrophobicContact CB-CG 3.79Å; M338-F380 HydrophobicContact CB-CE1 4.3Å; M338-F380 HydrophobicContact CB-CE2 4.34Å; M338-F380 HydrophobicContact CB-CZ 3.84Å; M338-F380 HydrophobicContact CE-CD1 4.02Å; M338-F380 HydrophobicContact CE-CE1 3.75Å; M338-F380 HydrophobicContact CE-CZ 4.41Å; M338-F380 HydrophobicContact SD-CE1 4.34Å; A340-F380 HydrophobicContact CB-CE2 3.59Å; A340-F380 HydrophobicContact CB-CZ 3.68Å; F380-I386 CarbonylContact C-O 3.55Å; F380-I386 WeakPolarHBondContact CA-O 3.3Å; F380-L387 HydrophobicContact CD1-CB 4.04Å; F380-L387 HydrophobicContact CD1-CD1 3.85Å; F380-L387 HydrophobicContact CD1-CG 4.4Å; F380-L387 HydrophobicContact CD2-CD1 4.1Å; F380-L387 HydrophobicContact CE1-CB 4Å; F380-L387 HydrophobicContact CE1-CD1 3.77Å; F380-L387 HydrophobicContact CE1-CD2 3.89Å; F380-L387 HydrophobicContact CE1-CG 4.11Å; F380-L387 HydrophobicContact CE2-CD1 4.03Å; F380-L387 HydrophobicContact CG-CD1 4.03Å; F380-L387 HydrophobicContact CZ-CD1 3.87Å; F380-L387 HydrophobicContact CZ-CD2 4.04Å; F380-L387 HydrophobicContact CZ-CG 4.46Å
381	S	98.6	Very high	98.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.098	C	C	.	.			trans	-61.6	157.7	162	61.3	0	0	0	0	110.1	F63 D383 S384 S385 I386	F63-S381 VanDerWaalsContact CD2-N 3.32Å; S381-D383 VanDerWaalsContact CB-OD1 3.31Å; S381-D383 WeakPolarHBondContact CB-OD1 3.33Å; S381-D383 PolarHBondContact O-N 3.2Å; S381-D383 PolarHBondContact OG-OD1 2.97Å; S381-S384 WeakPolarHBondContact O-CA 3.32Å; S381-S384 PolarHBondContact O-N 2.78Å; S381-S385 PolarHBondContact OG-N 3.07Å; S381-S385 VanDerWaalsContact OG-N 3.15Å; S381-S385 PolarHBondContact OG-OG 3.48Å; S381-I386 PolarHBondContact N-O 2.76Å; S381-I386 PolarHBondContact OG-N 2.73Å; S381-I386 PolarHBondContact OG-O 2.7Å
382	R	98	Very high	98.5	Very high	97 Å²	97	20.2 Å²	20.2	37%	0.366	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-33.9	-174.5	-167.5	-176.2	-174.8	179.6	-0.3	113.4	W65 S67 F334 S384	W65-R382 HydrophobicContact CB-CB 4.46Å; W65-R382 HydrophobicContact CB-CG 4.24Å; W65-R382 HydrophobicContact CG-CB 4.17Å; W65-R382 HydrophobicContact CG-CG 4.24Å; W65-R382 WeakPolarHBondContact O-CD 3.45Å; W65-R382 PolarHBondContact O-NE 3.04Å; W65-R382 PolarHBondContact O-NH1 3.17Å; S67-R382 PolarHBondContact O-NH1 3.12Å; F334-R382 HydrophobicContact CB-CG 4.37Å; F334-R382 HydrophobicContact CD2-CG 4.4Å; F334-R382 HydrophobicContact CG-CG 4.24Å; R382-S384 VanDerWaalsContact C-N 3.27Å
383	D	96.7	Very high	98.6	Very high	81 Å²	81	17.8 Å²	17.8	43%	0.433	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	1.1	176	68.2	-16.4	0	0	0	113.5	S381 S385	S381-D383 VanDerWaalsContact CB-OD1 3.31Å; S381-D383 WeakPolarHBondContact CB-OD1 3.33Å; S381-D383 PolarHBondContact O-N 3.2Å; S381-D383 PolarHBondContact OG-OD1 2.97Å; D383-S385 PolarHBondContact O-N 2.94Å; D383-S385 VanDerWaalsContact O-N 3.15Å; D383-S385 PolarHBondContact OD1-N 2.84Å; D383-S385 VanDerWaalsContact OD1-N 3.12Å; D383-S385 PolarHBondContact OD1-OG 3.47Å; D383-S385 VanDerWaalsContact OD2-CB 3.25Å; D383-S385 WeakPolarHBondContact OD2-CB 3.49Å; D383-S385 PolarHBondContact OD2-OG 3.36Å
384	S	97.5	Very high	98.6	Very high	1 Å²	1	17 Å²	17	1%	0.007	9%	0.085	C	C	.	.	S	Bend	trans	57.4	23.6	-178	-22	0	0	0	0	114.1	D333 S381 R382 R401	D333-S384 WeakPolarHBondContact CB-OG 3.08Å; D333-S384 WeakPolarHBondContact OD2-CB 3.09Å; D333-S384 PolarHBondContact OD2-OG 2.94Å; S381-S384 WeakPolarHBondContact O-CA 3.32Å; S381-S384 PolarHBondContact O-N 2.78Å; R382-S384 VanDerWaalsContact C-N 3.27Å; S384-R401 WeakPolarHBondContact O-CD 3.38Å; S384-R401 PolarHBondContact O-NE 3.39Å
385	S	97.2	Very high	98.6	Very high	36 Å²	36	17 Å²	17	25%	0.252	9%	0.085	S	C	.	.	S	Bend	trans	-82.3	-27.5	177.9	68.4	0	0	0	0	113.2	S381 D383 R401	S381-S385 PolarHBondContact OG-N 3.07Å; S381-S385 VanDerWaalsContact OG-N 3.15Å; S381-S385 PolarHBondContact OG-OG 3.48Å; D383-S385 PolarHBondContact O-N 2.94Å; D383-S385 VanDerWaalsContact O-N 3.15Å; D383-S385 PolarHBondContact OD1-N 2.84Å; D383-S385 VanDerWaalsContact OD1-N 3.12Å; D383-S385 PolarHBondContact OD1-OG 3.47Å; D383-S385 VanDerWaalsContact OD2-CB 3.25Å; D383-S385 WeakPolarHBondContact OD2-CB 3.49Å; D383-S385 PolarHBondContact OD2-OG 3.36Å; S385-R401 WeakPolarHBondContact O-CB 3.22Å; S385-R401 PolarHBondContact O-N 2.76Å
386	I	98.6	Very high	98.6	Very high	7 Å²	7	17 Å²	17	4%	0.036	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.5	179.8	-56.1	178.9	0	0	0	109.4	F63 L73 C88 F380 S381 I388 R398 W399	F63-I386 HydrophobicContact CE2-CG2 4.47Å; F63-I386 HydrophobicContact CZ-CB 4.17Å; F63-I386 HydrophobicContact CZ-CG2 3.89Å; L73-I386 HydrophobicContact CD1-CD1 3.65Å; L73-I386 HydrophobicContact CD1-CG1 4.21Å; C88-I386 HydrophobicContact CB-CD1 3.62Å; F380-I386 CarbonylContact C-O 3.55Å; F380-I386 WeakPolarHBondContact CA-O 3.3Å; S381-I386 PolarHBondContact N-O 2.76Å; S381-I386 PolarHBondContact OG-N 2.73Å; S381-I386 PolarHBondContact OG-O 2.7Å; I386-I388 HydrophobicContact CG2-CD1 4.11Å; I386-I388 HydrophobicContact CG2-CG1 4.2Å; I386-R398 HydrophobicContact CG2-CG 3.78Å; I386-W399 WeakPolarHBondContact CA-O 2.92Å
387	L	98.9	Very high	98.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120.9	169.6	174.9	59.7	0	0	0	108.7	F44 A340 L348 V350 L366 F380 W399	F44-L387 HydrophobicContact CD1-CB 4.27Å; F44-L387 HydrophobicContact CE1-CB 4.01Å; A340-L387 HydrophobicContact CB-CD1 4.25Å; A340-L387 HydrophobicContact CB-CD2 4.24Å; L348-L387 HydrophobicContact CD2-CD2 3.63Å; L348-L387 HydrophobicContact CD2-CG 4.06Å; L348-L387 HydrophobicContact CG-CD2 4.31Å; V350-L387 HydrophobicContact CG2-CD2 3.95Å; L366-L387 HydrophobicContact CD1-CD2 4.19Å; F380-L387 HydrophobicContact CD1-CB 4.04Å; F380-L387 HydrophobicContact CD1-CD1 3.85Å; F380-L387 HydrophobicContact CD1-CG 4.4Å; F380-L387 HydrophobicContact CD2-CD1 4.1Å; F380-L387 HydrophobicContact CE1-CB 4Å; F380-L387 HydrophobicContact CE1-CD1 3.77Å; F380-L387 HydrophobicContact CE1-CD2 3.89Å; F380-L387 HydrophobicContact CE1-CG 4.11Å; F380-L387 HydrophobicContact CE2-CD1 4.03Å; F380-L387 HydrophobicContact CG-CD1 4.03Å; F380-L387 HydrophobicContact CZ-CD1 3.87Å; F380-L387 HydrophobicContact CZ-CD2 4.04Å; F380-L387 HydrophobicContact CZ-CG 4.46Å; L387-W399 HydrophobicContact CB-CB 4.18Å; L387-W399 PolarHBondContact N-O 3.01Å; L387-W399 WeakPolarHBondContact O-CB 3.39Å; L387-W399 PolarHBondContact O-N 2.84Å
388	I	98.9	Very high	98.6	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	139.5	174.8	-61.2	-70.4	0	0	0	109.3	V61 F63 F75 T378 S379 I386 V390 I396 W397 R398	V61-I388 HydrophobicContact CG2-CB 4.35Å; V61-I388 HydrophobicContact CG2-CG2 3.77Å; F63-I388 HydrophobicContact CE2-CB 4.01Å; F63-I388 HydrophobicContact CE2-CG1 3.4Å; F63-I388 HydrophobicContact CZ-CB 4.49Å; F63-I388 HydrophobicContact CZ-CD1 4.35Å; F63-I388 HydrophobicContact CZ-CG1 3.41Å; F63-I388 VanDerWaalsContact CZ-CG1 3.41Å; F75-I388 HydrophobicContact CD1-CD1 4.36Å; F75-I388 HydrophobicContact CD1-CG1 4.1Å; F75-I388 HydrophobicContact CD2-CG2 4.32Å; F75-I388 HydrophobicContact CE1-CD1 3.83Å; F75-I388 HydrophobicContact CE1-CG1 4.06Å; F75-I388 HydrophobicContact CE2-CG2 4.03Å; F75-I388 HydrophobicContact CG-CG1 4.39Å; F75-I388 HydrophobicContact CZ-CD1 4.01Å; F75-I388 HydrophobicContact CZ-CG1 4.31Å; F75-I388 HydrophobicContact CZ-CG2 4.3Å; T378-I388 CarbonylContact C-O 3.52Å; T378-I388 WeakPolarHBondContact CA-O 3.33Å; T378-I388 WeakPolarHBondContact CB-O 3.27Å; S379-I388 PolarHBondContact N-O 2.7Å; S379-I388 PolarHBondContact O-N 2.73Å; I386-I388 HydrophobicContact CG2-CD1 4.11Å; I386-I388 HydrophobicContact CG2-CG1 4.2Å; I388-V390 HydrophobicContact CG2-CG1 4.36Å; I388-I396 HydrophobicContact CG2-CG2 3.73Å; I388-W397 WeakPolarHBondContact CA-O 3.47Å; I388-R398 HydrophobicContact CD1-CB 3.72Å; I388-R398 HydrophobicContact CD1-CG 3.87Å
389	A	98.9	Very high	98.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.2	171	0	0	0	0	0	110.2	L348 I375 T378 I396 W397	L348-A389 HydrophobicContact CD2-CB 4.21Å; I375-A389 HydrophobicContact CD1-CB 4.47Å; I375-A389 HydrophobicContact CG2-CB 3.75Å; T378-A389 HydrophobicContact CG2-CB 3.69Å; A389-I396 CarbonylContact O-C 3.55Å; A389-I396 WeakPolarHBondContact O-CA 3.32Å; A389-W397 HydrophobicContact CB-CB 4.3Å; A389-W397 PolarHBondContact N-O 2.83Å; A389-W397 PolarHBondContact O-N 2.78Å
390	V	98.9	Very high	98.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	146.5	177.6	-61.3	0	0	0	0	111.5	L58 V61 T77 I375 R376 Q377 I388 S395 I396	L58-V390 HydrophobicContact CB-CB 3.72Å; L58-V390 HydrophobicContact CB-CG2 4Å; L58-V390 HydrophobicContact CD1-CB 4.01Å; L58-V390 HydrophobicContact CD1-CG1 4.12Å; V61-V390 HydrophobicContact CB-CB 4.41Å; V61-V390 HydrophobicContact CB-CG1 3.66Å; V61-V390 HydrophobicContact CB-CG2 3.85Å; V61-V390 HydrophobicContact CG1-CB 4.46Å; V61-V390 HydrophobicContact CG1-CG1 4.02Å; V61-V390 HydrophobicContact CG1-CG2 3.74Å; V61-V390 HydrophobicContact CG2-CG1 3.98Å; T77-V390 HydrophobicContact CG2-CG1 3.84Å; I375-V390 CarbonylContact C-O 3.56Å; I375-V390 WeakPolarHBondContact CA-O 3.39Å; R376-V390 PolarHBondContact N-O 2.98Å; Q377-V390 PolarHBondContact O-N 3.44Å; I388-V390 HydrophobicContact CG2-CG1 4.36Å; V390-S395 WeakPolarHBondContact CA-O 3.4Å; V390-I396 HydrophobicContact CG1-CG1 4.19Å; V390-I396 HydrophobicContact CG1-CG2 4.32Å
391	C	98.9	Very high	98.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	163.4	-164.7	-57.5	0	0	0	0	114.7	L58 A373 A374 I375 D393 A394 S395	L58-C391 PolarHBondContact N-O 3.17Å; L58-C391 VanDerWaalsContact N-O 3.1Å; A373-C391 HydrophobicContact CB-CB 3.94Å; A374-C391 CarbonylContact O-C 3.56Å; A374-C391 WeakPolarHBondContact O-CA 3.35Å; I375-C391 VanDerWaalsContact CG1-SG 3.58Å; C391-D393 WeakPolarHBondContact CB-OD1 3.39Å; C391-D393 PolarHBondContact O-N 3.22Å; C391-A394 PolarHBondContact O-N 3.43Å; C391-S395 WeakPolarHBondContact CB-OG 3.24Å; C391-S395 PolarHBondContact N-O 3.41Å
392	D	98.8	Very high	98.2	Very high	45 Å²	45	26.8 Å²	26.8	24%	0.241	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.9	176.4	-86.1	-1	0	0	0	114.6	P57 A374 R376 A394	P57-D392 VanDerWaalsContact CA-O 3.27Å; P57-D392 WeakPolarHBondContact CA-O 3.22Å; P57-D392 HydrophobicContact CB-CB 4.46Å; P57-D392 WeakPolarHBondContact CG-O 3.39Å; A374-D392 HydrophobicContact CB-CB 4.37Å; A374-D392 PolarHBondContact O-N 3.06Å; R376-D392 VanDerWaalsContact CG-OD1 3.27Å; R376-D392 WeakPolarHBondContact CG-OD1 3.44Å; R376-D392 IonicContact CZ-OD1 3.97Å; R376-D392 IonicContact CZ-OD2 2.93Å; R376-D392 IonicContact NE-OD1 2.92Å; R376-D392 PolarHBondContact NE-OD1 2.78Å; R376-D392 IonicContact NE-OD2 3.83Å; R376-D392 PolarHBondContact NE-OD2 3.12Å; R376-D392 IonicContact NH2-OD1 3.69Å; R376-D392 PolarHBondContact NH2-OD1 3.2Å; R376-D392 IonicContact NH2-OD2 2.88Å; R376-D392 PolarHBondContact NH2-OD2 2.83Å; D392-A394 PolarHBondContact O-N 2.89Å
393	D	98.7	Very high	97.2	Very high	48 Å²	48	37.4 Å²	37.4	26%	0.257	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	21	178.6	73.5	-28.2	0	0	0	112.8	K51 A373 C391 S395	K51-D393 WeakPolarHBondContact CD-O 3.31Å; K51-D393 WeakPolarHBondContact CE-O 3.23Å; K51-D393 PolarHBondContact NZ-O 3.46Å; A373-D393 HydrophobicContact CB-CB 3.8Å; A373-D393 VanDerWaalsContact CB-CG 3.43Å; A373-D393 WeakPolarHBondContact CB-OD1 3.5Å; C391-D393 WeakPolarHBondContact CB-OD1 3.39Å; C391-D393 PolarHBondContact O-N 3.22Å; D393-S395 PolarHBondContact O-N 3.44Å; D393-S395 VanDerWaalsContact OD1-CB 3.23Å; D393-S395 WeakPolarHBondContact OD1-CB 3.38Å; D393-S395 PolarHBondContact OD1-N 2.9Å; D393-S395 PolarHBondContact OD1-OG 3.4Å
394	A	98.8	Very high	97.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	63.6	11.9	-174.8	0	0	0	0	0	115.2	K51 E52 Q56 C391 D392	K51-A394 WeakPolarHBondContact CA-O 3.46Å; K51-A394 HydrophobicContact CG-CB 4.11Å; E52-A394 HydrophobicContact CB-CB 4.27Å; E52-A394 PolarHBondContact N-O 3.04Å; Q56-A394 WeakPolarHBondContact O-CA 3.2Å; Q56-A394 WeakPolarHBondContact O-CB 3.44Å; C391-A394 PolarHBondContact O-N 3.43Å; D392-A394 PolarHBondContact O-N 2.89Å
395	S	98.9	Very high	97.2	Very high	7 Å²	7	37 Å²	37	5%	0.049	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	145.8	178.8	68.6	0	0	0	0	112.9	L50 V390 C391 D393 W397	L50-S395 CarbonylContact O-C 3.54Å; L50-S395 VanDerWaalsContact O-CA 3.3Å; L50-S395 WeakPolarHBondContact O-CA 3.18Å; V390-S395 WeakPolarHBondContact CA-O 3.4Å; C391-S395 WeakPolarHBondContact CB-OG 3.24Å; C391-S395 PolarHBondContact N-O 3.41Å; D393-S395 PolarHBondContact O-N 3.44Å; D393-S395 VanDerWaalsContact OD1-CB 3.23Å; D393-S395 WeakPolarHBondContact OD1-CB 3.38Å; D393-S395 PolarHBondContact OD1-N 2.9Å; D393-S395 PolarHBondContact OD1-OG 3.4Å; S395-W397 PolarHBondContact OG-NE1 3.23Å
396	I	98.9	Very high	97.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.2	175.5	-52.2	178.9	0	0	0	107.6	S49 L50 E52 L58 F75 T77 Y86 I388 A389 V390	S49-I396 CarbonylContact C-O 3.33Å; S49-I396 WeakPolarHBondContact CA-O 3.46Å; L50-I396 HydrophobicContact CD1-CB 4.34Å; L50-I396 HydrophobicContact CD1-CD1 3.75Å; L50-I396 HydrophobicContact CD1-CG1 4.16Å; L50-I396 HydrophobicContact CG-CB 4.26Å; L50-I396 HydrophobicContact CG-CD1 4.39Å; L50-I396 PolarHBondContact N-O 3Å; L50-I396 PolarHBondContact O-N 2.96Å; E52-I396 HydrophobicContact CG-CD1 4.25Å; L58-I396 HydrophobicContact CD1-CD1 4.18Å; L58-I396 HydrophobicContact CD1-CG1 3.64Å; F75-I396 HydrophobicContact CE2-CD1 4.46Å; F75-I396 HydrophobicContact CE2-CG2 4.08Å; F75-I396 HydrophobicContact CZ-CG2 4.06Å; T77-I396 HydrophobicContact CG2-CD1 3.74Å; T77-I396 HydrophobicContact CG2-CG1 4.4Å; Y86-I396 HydrophobicContact CD2-CD1 4.19Å; Y86-I396 HydrophobicContact CE1-CD1 4.44Å; Y86-I396 HydrophobicContact CE2-CD1 3.49Å; Y86-I396 VanDerWaalsContact CE2-CD1 3.49Å; I388-I396 HydrophobicContact CG2-CG2 3.73Å; A389-I396 CarbonylContact O-C 3.55Å; A389-I396 WeakPolarHBondContact O-CA 3.32Å; V390-I396 HydrophobicContact CG1-CG1 4.19Å; V390-I396 HydrophobicContact CG1-CG2 4.32Å
397	W	98.9	Very high	97.2	Very high	8 Å²	8	38.8 Å²	38.8	3%	0.03	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.4	-176.5	-65.1	82.3	0	0	0	110.9	H368 K370 C371 I388 A389 S395	H368-W397 HydrophobicContact CB-CE3 4.33Å; H368-W397 HydrophobicContact CB-CZ3 3.87Å; H368-W397 AromaticContact CE1-CZ3 3.82Å; H368-W397 AromaticContact CG-CZ3 3.53Å; H368-W397 AromaticContact ND1-CH2 3.38Å; H368-W397 WeakPolarHBondContact ND1-CH2 3.44Å; H368-W397 AromaticContact ND1-CZ3 3.2Å; H368-W397 WeakPolarHBondContact ND1-CZ3 3.44Å; K370-W397 HydrophobicContact CB-CH2 3.85Å; K370-W397 HydrophobicContact CB-CZ2 4.49Å; K370-W397 WeakPolarHBondContact O-CZ2 3.17Å; C371-W397 VanDerWaalsContact CA-CZ2 3.4Å; C371-W397 HydrophobicContact CB-CD2 3.8Å; C371-W397 VanDerWaalsContact CB-CE2 3.5Å; C371-W397 HydrophobicContact CB-CE3 4Å; C371-W397 HydrophobicContact CB-CH2 3.76Å; C371-W397 HydrophobicContact CB-CZ2 3.48Å; C371-W397 VanDerWaalsContact CB-CZ2 3.48Å; C371-W397 HydrophobicContact CB-CZ3 4Å; I388-W397 WeakPolarHBondContact CA-O 3.47Å; A389-W397 HydrophobicContact CB-CB 4.3Å; A389-W397 PolarHBondContact N-O 2.83Å; A389-W397 PolarHBondContact O-N 2.78Å; S395-W397 PolarHBondContact OG-NE1 3.23Å
398	R	98.8	Very high	97.1	Very high	7 Å²	7	41.3 Å²	41.3	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124.3	178.1	-179.8	-178.9	162.7	175.1	-4.6	111.8	C46 V47 N48 H89 G92 E93 I94 I386 I388 D400	C46-R398 WeakPolarHBondContact CA-O 3.45Å; V47-R398 HydrophobicContact CG2-CB 4.17Å; V47-R398 HydrophobicContact CG2-CG 3.63Å; V47-R398 PolarHBondContact N-O 3.33Å; N48-R398 HydrophobicContact CB-CB 4.43Å; N48-R398 PolarHBondContact O-N 2.79Å; H89-R398 PolarHBondContact O-NH1 3.31Å; H89-R398 PolarHBondContact O-NH2 2.93Å; G92-R398 VanDerWaalsContact C-NH1 3.28Å; G92-R398 PolarHBondContact O-NH1 3.17Å; E93-R398 PolarHBondContact O-NH1 3.29Å; I94-R398 HydrophobicContact CD1-CB 3.73Å; I94-R398 HydrophobicContact CG1-CB 4.27Å; I386-R398 HydrophobicContact CG2-CG 3.78Å; I388-R398 HydrophobicContact CD1-CB 3.72Å; I388-R398 HydrophobicContact CD1-CG 3.87Å; R398-D400 WeakPolarHBondContact CG-OD1 3.21Å; R398-D400 IonicContact CZ-OD1 2.98Å; R398-D400 IonicContact CZ-OD2 3.74Å; R398-D400 IonicContact NE-OD1 3.6Å; R398-D400 PolarHBondContact NE-OD1 2.89Å; R398-D400 IonicContact NE-OD2 3.64Å; R398-D400 IonicContact NH2-OD1 2.72Å; R398-D400 PolarHBondContact NH2-OD1 3.18Å; R398-D400 IonicContact NH2-OD2 3.26Å; R398-D400 PolarHBondContact NH2-OD2 3.48Å
399	W	98.8	Very high	96.9	Very high	9 Å²	9	44 Å²	44	3%	0.034	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	115.7	178.7	-59.2	86.2	0	0	0	109.7	F44 K45 C46 L348 L366 H368 I386 L387	F44-W399 HydrophobicContact CB-CB 4.15Å; F44-W399 HydrophobicContact CB-CE3 4.46Å; F44-W399 HydrophobicContact CD1-CB 4.26Å; K45-W399 CarbonylContact O-C 3.58Å; K45-W399 WeakPolarHBondContact O-CA 3.32Å; C46-W399 HydrophobicContact CB-CD2 4.17Å; C46-W399 HydrophobicContact CB-CE3 3.77Å; C46-W399 HydrophobicContact CB-CH2 3.81Å; C46-W399 HydrophobicContact CB-CZ2 4.22Å; C46-W399 HydrophobicContact CB-CZ3 3.58Å; C46-W399 VanDerWaalsContact N-CE3 3.32Å; L348-W399 HydrophobicContact CD2-CG 4.5Å; L366-W399 HydrophobicContact CB-CD2 4.23Å; L366-W399 HydrophobicContact CB-CE3 3.87Å; L366-W399 HydrophobicContact CB-CH2 3.81Å; L366-W399 HydrophobicContact CB-CZ2 4.14Å; L366-W399 HydrophobicContact CB-CZ3 3.66Å; L366-W399 HydrophobicContact CD1-CB 4.47Å; L366-W399 HydrophobicContact CD1-CD2 4.02Å; L366-W399 HydrophobicContact CD1-CE3 3.95Å; L366-W399 HydrophobicContact CD1-CG 4.25Å; L366-W399 HydrophobicContact CD2-CE3 4.38Å; L366-W399 HydrophobicContact CD2-CZ3 4.46Å; L366-W399 HydrophobicContact CG-CE3 4.29Å; L366-W399 HydrophobicContact CG-CZ3 4.44Å; H368-W399 HydrophobicContact CB-CH2 4.21Å; H368-W399 HydrophobicContact CB-CZ2 4.45Å; I386-W399 WeakPolarHBondContact CA-O 2.92Å; L387-W399 HydrophobicContact CB-CB 4.18Å; L387-W399 PolarHBondContact N-O 3.01Å; L387-W399 WeakPolarHBondContact O-CB 3.39Å; L387-W399 PolarHBondContact O-N 2.84Å
400	D	98.5	Very high	96.8	Very high	37 Å²	37	47.1 Å²	47.1	20%	0.198	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	133.3	177.5	-73.7	16.1	0	0	0	109.4	F44 K45 V47 R398 L402	F44-D400 CarbonylContact C-O 3.58Å; F44-D400 VanDerWaalsContact CA-O 3.29Å; F44-D400 WeakPolarHBondContact CA-O 2.9Å; K45-D400 PolarHBondContact N-O 3.09Å; K45-D400 PolarHBondContact O-N 3.37Å; V47-D400 HydrophobicContact CG1-CB 3.9Å; V47-D400 HydrophobicContact CG2-CB 4.27Å; V47-D400 WeakPolarHBondContact CG2-OD1 3.27Å; R398-D400 WeakPolarHBondContact CG-OD1 3.21Å; R398-D400 IonicContact CZ-OD1 2.98Å; R398-D400 IonicContact CZ-OD2 3.74Å; R398-D400 IonicContact NE-OD1 3.6Å; R398-D400 PolarHBondContact NE-OD1 2.89Å; R398-D400 IonicContact NE-OD2 3.64Å; R398-D400 IonicContact NH2-OD1 2.72Å; R398-D400 PolarHBondContact NH2-OD1 3.18Å; R398-D400 IonicContact NH2-OD2 3.26Å; R398-D400 PolarHBondContact NH2-OD2 3.48Å; D400-L402 PolarHBondContact O-N 3.11Å
401	R	97.1	Very high	96.6	Very high	90 Å²	90	50.8 Å²	50.8	34%	0.34	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	127.6	179.6	-165.8	172.1	67.3	178	-8.4	110	F44 S384 S385	F44-R401 HydrophobicContact CD1-CB 3.82Å; F44-R401 HydrophobicContact CD1-CG 4.3Å; F44-R401 HydrophobicContact CE1-CB 3.53Å; F44-R401 HydrophobicContact CE1-CG 3.88Å; F44-R401 HydrophobicContact CE2-CG 4.31Å; F44-R401 HydrophobicContact CZ-CB 4.06Å; F44-R401 HydrophobicContact CZ-CG 3.87Å; S384-R401 WeakPolarHBondContact O-CD 3.38Å; S384-R401 PolarHBondContact O-NE 3.39Å; S385-R401 WeakPolarHBondContact O-CB 3.22Å; S385-R401 PolarHBondContact O-N 2.76Å
402	L	92.5	Very high	96.4	Very high	89 Å²	89	55 Å²	55	47%	0.466	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	133.1	171.1	-57.5	-178.9	0	0	0	108.6	S43 K45 D400	S43-L402 PolarHBondContact O-N 2.72Å; K45-L402 HydrophobicContact CB-CD2 3.99Å; K45-L402 HydrophobicContact CB-CG 4.4Å; D400-L402 PolarHBondContact O-N 3.11Å
403	R	78.8	Confident	96.2	Very high	320 Å²	320	55.9 Å²	55.9	100%	1.208	24%	0.237	S	C	*	.			trans	-70	0	177.2	-72.1	-173	179.3	-175.4	-0.7	112.3

Retrieved 403 of 403 residues in 246.9 ms (Link to these results)

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