A0A096MMG8_PAPAN Loading...

SLIT and NTRK like family member 3

AlphaFold DB , UniProt , Accession A0A096MMG8, Species PAPAN (Papio anubis, Olive baboon), Gene SLITRK3, Length 979 aa.

						>A0A096MMG8_PAPAN|A0A096MMG8|SLITRK3
MKPSIAEMLHRGRMLWIILLSTIALGWTTPIPLIEDSEEIDEPCFDPCYCEVKESLFHIHCDSKGFTNISQITEFWSRPFKLYLQRNSMRKLYTNSFLHLNNAVSINLGNNALQDIQTGAFNGLKILKRLYLHENKLDVFRNDTFLGLESLEYLQADYNVIKRIESGAFRNLSKLRVLILNDNLIPMLPTNLFKAVSLTHLDLRGNRLKVLFYRGMLDHIGRSLMELQLEENPWNCTCEIVQLKSWLERIPYTALVGDITCETPFHFHGKDLREIKKTELCPLLSDSEVEASLGIPHLSSSKENAWPTKPSSMLSSVHFTASSVEYKSSNKQPKPTKQPRTPRPPSTSQALYPGPNQPPIAPYQTRPPIPIICPTGCTCNLHINDLGLTVNCKERGFNNISELLPRPLNAKKLYLSSNLIQKIYRSDFWNFSSLDLLHLGNNRISYVQDGAFINLPNLKSLFLNGNDIEKLTPGMFRGLQSLHYLYFEFNVIREIQPAAFSLMPNLKLLFLNNNLLRTLPTDAFAGTSLARLNLRKNYFLYLPVAGVLEHLNAIVQIDLNENPWDCTCDLVPFKQWIETISSVSVVGDVLCRSPENLTHRDVRTIELEVLCPEMLHVAPAGASPAQPGDSHLIGAPTSASPYEFSPPGGPVPLSVLILSLLVLFFSAVFVAAGLFAYVLRRRRKKLPFRSKRQEGVDLTGIQMQCHRLFEDGGGGGGGSGGGGRPTLSSPEKAPPVGHVYEYIPHPVTQMCNNPIYKPREEEEVAVSSAQEAGSAELGGPGTQPPGMGEALLGSEQFAETPKENHSNYRTLLEKEKEWALAVSSSQLNTIVTVNHHHPHPHHPAVGGVSGVVGGTGGDLAGFRHHEKNGGVVLFPPGGGCGGGSMLLDRERPQPAPCTVGFVDCLYGTVPKLKELHVHPPGMQYPDLQQDARLKETLLFSAGKGFTDHQTQKSDYLELRAKLQTKPDYLEVLEKTTYRF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.6	Very low	43.8	Very low	240 Å²	240	142.2 Å²	142.2	100%	1.182	72%	0.718	S	S	*	*				0	156.2	0	-65.4	82.1	169.1	0	0	109.7
2	K	36.4	Very low	44.1	Very low	199 Å²	199	133.3 Å²	133.3	87%	0.865	69%	0.688	S	S	*	*			trans	-116.9	131	166.8	-69.2	-178.5	178.4	179.6	0	108.4
3	P	39.7	Very low	44.5	Very low	113 Å²	113	136.5 Å²	136.5	73%	0.734	69%	0.686	S	S	*	*			trans	-68.4	165.3	169.7	29.8	-33.6	0	0	0	111	E7	P3-E7 WeakPolarHBondContact CB-OE2 3.42Å
4	S	43.4	Very low	44.9	Very low	68 Å²	68	135.1 Å²	135.1	48%	0.476	68%	0.679	S	S	.	*			trans	-93.2	159	-164.7	81.9	0	0	0	0	114.1	A6 E7	S4-A6 PolarHBondContact O-N 3Å; S4-A6 VanDerWaalsContact O-N 3.12Å; S4-A6 PolarHBondContact OG-N 3.14Å; S4-E7 PolarHBondContact N-OE2 2.87Å; S4-E7 PolarHBondContact O-N 2.76Å
5	I	49.1	Very low	45.3	Very low	143 Å²	143	134.3 Å²	134.3	73%	0.733	68%	0.676	S	S	*	*	H	α-helix	trans	-61.2	-21.2	178	-67.5	169.8	0	0	0	112.2	E7	I5-E7 PolarHBondContact O-N 3.19Å
6	A	46.1	Very low	45.4	Very low	68 Å²	68	137.4 Å²	137.4	56%	0.562	68%	0.677	S	S	*	*	H	α-helix	trans	-66	-34.3	177.9	0	0	0	0	0	113.5	S4 M8 L9	S4-A6 PolarHBondContact O-N 3Å; S4-A6 VanDerWaalsContact O-N 3.12Å; S4-A6 PolarHBondContact OG-N 3.14Å; A6-M8 PolarHBondContact O-N 2.67Å; A6-L9 PolarHBondContact O-N 3.47Å
7	E	43.8	Very low	45.9	Very low	122 Å²	122	135.3 Å²	135.3	57%	0.57	67%	0.668	S	S	*	*	H	α-helix	trans	-72.3	-30.3	-177.6	-69.9	174.5	90.4	0	0	112.5	P3 S4 I5 H10 R11	P3-E7 WeakPolarHBondContact CB-OE2 3.42Å; S4-E7 PolarHBondContact N-OE2 2.87Å; S4-E7 PolarHBondContact O-N 2.76Å; I5-E7 PolarHBondContact O-N 3.19Å; E7-H10 PolarHBondContact O-N 3.43Å; E7-R11 PolarHBondContact O-N 2.85Å
8	M	43.3	Very low	46.4	Very low	150 Å²	150	133 Å²	133	74%	0.739	66%	0.658	S	S	*	*	H	α-helix	trans	-67.2	-35.8	176.7	-73.9	-176.6	64.3	0	0	112.5	A6 H10 G12	A6-M8 PolarHBondContact O-N 2.67Å; M8-H10 PolarHBondContact O-N 2.77Å; M8-G12 PolarHBondContact O-N 2.88Å
9	L	45.8	Very low	46.7	Very low	125 Å²	125	131.6 Å²	131.6	65%	0.654	65%	0.652	S	S	*	*	H	α-helix	trans	-66.7	-35.9	177.9	-107.4	73.8	0	0	0	112.7	A6 R13	A6-L9 PolarHBondContact O-N 3.47Å; L9-R13 PolarHBondContact O-N 3.32Å
10	H	47.9	Very low	46.8	Very low	134 Å²	134	130.2 Å²	130.2	62%	0.62	65%	0.647	S	S	*	*	H	α-helix	trans	-72.6	-40	-179.2	-110.8	-82.2	0	0	0	112.9	E7 M8 G12 R13 M14	E7-H10 PolarHBondContact O-N 3.43Å; M8-H10 PolarHBondContact O-N 2.77Å; H10-G12 PolarHBondContact O-N 2.94Å; H10-R13 PolarHBondContact O-N 3.11Å; H10-M14 PolarHBondContact O-N 2.99Å
11	R	47.2	Very low	46.7	Very low	202 Å²	202	126.5 Å²	126.5	76%	0.762	63%	0.634	S	S	*	*	H	α-helix	trans	-63.9	-38.8	174.9	-101.4	-176.6	171.5	-171.7	-2.4	112.6	E7 M14 L15	E7-R11 PolarHBondContact O-N 2.85Å; R11-M14 PolarHBondContact O-N 3.17Å; R11-L15 PolarHBondContact O-N 2.86Å; R11-L15 VanDerWaalsContact O-N 3.15Å
12	G	46.3	Very low	47.3	Very low	35 Å²	35	118.9 Å²	118.9	36%	0.361	60%	0.601	S	S	.	*	H	α-helix	trans	-60.9	-44.2	176.2	0	0	0	0	0	113.2	M8 H10 L15 W16	M8-G12 PolarHBondContact O-N 2.88Å; H10-G12 PolarHBondContact O-N 2.94Å; G12-L15 PolarHBondContact O-N 2.78Å; G12-W16 PolarHBondContact O-N 2.95Å
13	R	50.5	Low	48	Very low	175 Å²	175	114.1 Å²	114.1	66%	0.66	58%	0.584	S	S	*	*	H	α-helix	trans	-66.5	-41.6	178	-75.5	174.1	65.9	175.3	-0.7	112.8	L9 H10 W16 I17	L9-R13 PolarHBondContact O-N 3.32Å; H10-R13 PolarHBondContact O-N 3.11Å; R13-W16 PolarHBondContact O-N 3.12Å; R13-I17 WeakPolarHBondContact O-CD1 3.42Å; R13-I17 VanDerWaalsContact O-CG1 3.31Å; R13-I17 WeakPolarHBondContact O-CG1 3.46Å; R13-I17 PolarHBondContact O-N 2.99Å; R13-I17 VanDerWaalsContact O-N 3.08Å
14	M	49.6	Very low	48.2	Very low	118 Å²	118	111.6 Å²	111.6	58%	0.581	57%	0.572	S	S	*	*	H	α-helix	trans	-60.6	-44.9	176	-90.3	-66.1	-159.8	0	0	112.5	H10 R11 W16 I17 I18	H10-M14 PolarHBondContact O-N 2.99Å; R11-M14 PolarHBondContact O-N 3.17Å; M14-W16 PolarHBondContact O-N 3.11Å; M14-I17 PolarHBondContact O-N 3.48Å; M14-I18 WeakPolarHBondContact O-CG1 3.5Å; M14-I18 PolarHBondContact O-N 2.85Å
15	L	50.6	Low	48.2	Very low	122 Å²	122	114.2 Å²	114.2	64%	0.639	58%	0.58	S	S	*	*	H	α-helix	trans	-61.7	-40.5	178.5	-90.8	157.6	0	0	0	112.8	R11 G12 I18 L19	R11-L15 PolarHBondContact O-N 2.86Å; R11-L15 VanDerWaalsContact O-N 3.15Å; G12-L15 PolarHBondContact O-N 2.78Å; L15-I18 PolarHBondContact O-N 2.77Å; L15-L19 WeakPolarHBondContact O-CB 3.38Å; L15-L19 PolarHBondContact O-N 2.93Å
16	W	47.7	Very low	47.8	Very low	184 Å²	184	109.9 Å²	109.9	70%	0.697	57%	0.572	S	S	*	*	H	α-helix	trans	-66.5	-38.4	175	-91.5	78.4	0	0	0	113.4	G12 R13 M14 L19 L20	G12-W16 PolarHBondContact O-N 2.95Å; R13-W16 PolarHBondContact O-N 3.12Å; M14-W16 PolarHBondContact O-N 3.11Å; W16-L19 PolarHBondContact O-N 3.18Å; W16-L20 WeakPolarHBondContact O-CB 3.47Å; W16-L20 WeakPolarHBondContact O-CG 3.33Å; W16-L20 PolarHBondContact O-N 3.13Å
17	I	54	Low	47.6	Very low	102 Å²	102	117.3 Å²	117.3	52%	0.523	59%	0.585	S	S	.	*	H	α-helix	trans	-67.2	-39.5	177.7	-68.3	164.8	0	0	0	110.8	R13 M14 L20 S21	R13-I17 WeakPolarHBondContact O-CD1 3.42Å; R13-I17 VanDerWaalsContact O-CG1 3.31Å; R13-I17 WeakPolarHBondContact O-CG1 3.46Å; R13-I17 PolarHBondContact O-N 2.99Å; R13-I17 VanDerWaalsContact O-N 3.08Å; M14-I17 PolarHBondContact O-N 3.48Å; I17-L20 PolarHBondContact O-N 3.33Å; I17-S21 PolarHBondContact O-N 3.12Å; I17-S21 PolarHBondContact O-OG 3.07Å
18	I	55.1	Low	47.5	Very low	94 Å²	94	116.5 Å²	116.5	48%	0.482	59%	0.588	S	S	.	*	H	α-helix	trans	-69.1	-37.4	176	-65.9	165	0	0	0	111.3	M14 L15 S21 T22	M14-I18 WeakPolarHBondContact O-CG1 3.5Å; M14-I18 PolarHBondContact O-N 2.85Å; L15-I18 PolarHBondContact O-N 2.77Å; I18-S21 PolarHBondContact O-OG 3.46Å; I18-T22 WeakPolarHBondContact O-CB 3.41Å; I18-T22 WeakPolarHBondContact O-CG2 3.03Å; I18-T22 PolarHBondContact O-N 3.21Å; I18-T22 PolarHBondContact O-OG1 2.84Å
19	L	50.6	Low	47.4	Very low	106 Å²	106	114.1 Å²	114.1	56%	0.555	58%	0.582	S	S	*	*	H	α-helix	trans	-64.6	-39.8	174	-151.9	81	0	0	0	111.8	L15 W16 T22 I23	L15-L19 WeakPolarHBondContact O-CB 3.38Å; L15-L19 PolarHBondContact O-N 2.93Å; W16-L19 PolarHBondContact O-N 3.18Å; L19-T22 WeakPolarHBondContact CA-OG1 3.34Å; L19-T22 PolarHBondContact O-OG1 3.17Å; L19-T22 VanDerWaalsContact O-OG1 3.08Å; L19-I23 WeakPolarHBondContact O-CD1 3.39Å; L19-I23 VanDerWaalsContact O-CG1 3.25Å; L19-I23 WeakPolarHBondContact O-CG1 3.45Å; L19-I23 PolarHBondContact O-N 3.3Å; L19-I23 VanDerWaalsContact O-N 3.17Å
20	L	48.6	Very low	47	Very low	103 Å²	103	114.1 Å²	114.1	54%	0.539	59%	0.59	S	S	.	*	H	α-helix	trans	-71.7	-38.3	177.1	-74.8	165	0	0	0	112.8	W16 I17 I23 A24	W16-L20 WeakPolarHBondContact O-CB 3.47Å; W16-L20 WeakPolarHBondContact O-CG 3.33Å; W16-L20 PolarHBondContact O-N 3.13Å; I17-L20 PolarHBondContact O-N 3.33Å; L20-I23 PolarHBondContact O-N 3.28Å; L20-A24 WeakPolarHBondContact O-CB 3.15Å; L20-A24 PolarHBondContact O-N 3.39Å
21	S	46.1	Very low	46.6	Very low	53 Å²	53	114.1 Å²	114.1	37%	0.371	59%	0.593	S	S	.	*	H	α-helix	trans	-71.1	-35	177.4	68	0	0	0	0	112.8	I17 I18 A24 L25	I17-S21 PolarHBondContact O-N 3.12Å; I17-S21 PolarHBondContact O-OG 3.07Å; I18-S21 PolarHBondContact O-OG 3.46Å; S21-A24 PolarHBondContact O-N 2.98Å; S21-L25 WeakPolarHBondContact O-CB 3.5Å; S21-L25 WeakPolarHBondContact O-CG 3.41Å; S21-L25 PolarHBondContact O-N 2.86Å
22	T	51.4	Low	46	Very low	81 Å²	81	109.6 Å²	109.6	50%	0.497	59%	0.59	S	S	.	*	H	α-helix	trans	-69	-35.1	173.9	46.2	0	0	0	0	112.6	I18 L19 G26	I18-T22 WeakPolarHBondContact O-CB 3.41Å; I18-T22 WeakPolarHBondContact O-CG2 3.03Å; I18-T22 PolarHBondContact O-N 3.21Å; I18-T22 PolarHBondContact O-OG1 2.84Å; L19-T22 WeakPolarHBondContact CA-OG1 3.34Å; L19-T22 PolarHBondContact O-OG1 3.17Å; L19-T22 VanDerWaalsContact O-OG1 3.08Å; T22-G26 PolarHBondContact O-N 3.05Å
23	I	51.1	Low	45.3	Very low	98 Å²	98	115.4 Å²	115.4	50%	0.503	61%	0.612	S	S	.	*	H	α-helix	trans	-65.9	-42.1	170.1	-69.4	166.2	0	0	0	110.9	L19 L20 G26 W27	L19-I23 WeakPolarHBondContact O-CD1 3.39Å; L19-I23 VanDerWaalsContact O-CG1 3.25Å; L19-I23 WeakPolarHBondContact O-CG1 3.45Å; L19-I23 PolarHBondContact O-N 3.3Å; L19-I23 VanDerWaalsContact O-N 3.17Å; L20-I23 PolarHBondContact O-N 3.28Å; I23-G26 PolarHBondContact O-N 3.17Å; I23-W27 VanDerWaalsContact O-CD1 3.26Å
24	A	43.9	Very low	44.7	Very low	60 Å²	60	113.4 Å²	113.4	50%	0.496	61%	0.613	S	S	.	*	H	α-helix	trans	-65.9	-40.3	179.4	0	0	0	0	0	113.4	L20 S21 G26 W27	L20-A24 WeakPolarHBondContact O-CB 3.15Å; L20-A24 PolarHBondContact O-N 3.39Å; S21-A24 PolarHBondContact O-N 2.98Å; A24-G26 VanDerWaalsContact C-N 3.31Å; A24-G26 PolarHBondContact O-N 3.43Å; A24-W27 PolarHBondContact O-N 3.17Å
25	L	44.2	Very low	44	Very low	123 Å²	123	115.1 Å²	115.1	64%	0.644	62%	0.62	S	S	*	*	H	α-helix	trans	-73.2	-21.7	177.4	-72.7	166.6	0	0	0	113.2	S21 W27 T28	S21-L25 WeakPolarHBondContact O-CB 3.5Å; S21-L25 WeakPolarHBondContact O-CG 3.41Å; S21-L25 PolarHBondContact O-N 2.86Å; L25-W27 PolarHBondContact O-N 2.95Å; L25-T28 PolarHBondContact O-OG1 3.12Å
26	G	39.8	Very low	43.3	Very low	53 Å²	53	116.5 Å²	116.5	55%	0.546	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.2	-2.1	172	0	0	0	0	0	114.9	T22 I23 A24	T22-G26 PolarHBondContact O-N 3.05Å; I23-G26 PolarHBondContact O-N 3.17Å; A24-G26 VanDerWaalsContact C-N 3.31Å; A24-G26 PolarHBondContact O-N 3.43Å
27	W	41.4	Very low	42.9	Very low	224 Å²	224	111.7 Å²	111.7	85%	0.848	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	5.1	-177	-81.7	58.3	0	0	0	114	I23 A24 L25	I23-W27 VanDerWaalsContact O-CD1 3.26Å; A24-W27 PolarHBondContact O-N 3.17Å; L25-W27 PolarHBondContact O-N 2.95Å
28	T	42.4	Very low	42.2	Very low	104 Å²	104	113.8 Å²	113.8	64%	0.638	63%	0.63	S	S	*	*	S	Bend	trans	-114.1	0.6	-175.2	55.4	0	0	0	0	115.2	L25	L25-T28 PolarHBondContact O-OG1 3.12Å
29	T	41.7	Very low	41.7	Very low	100 Å²	100	116.1 Å²	116.1	61%	0.613	64%	0.638	S	S	*	*	S	Bend	trans	-92.1	117.9	164.8	50.9	0	0	0	0	109.4	I31	T29-I31 VanDerWaalsContact C-N 3.34Å; T29-I31 PolarHBondContact O-N 3.36Å
30	P	37.7	Very low	41.5	Very low	125 Å²	125	115.5 Å²	115.5	81%	0.812	64%	0.635	S	S	*	*			trans	-69.7	94.9	169	29.3	-32.5	0	0	0	108.8
31	I	38.4	Very low	41.4	Very low	134 Å²	134	117.5 Å²	117.5	69%	0.687	65%	0.646	S	S	*	*			trans	-59.2	126.9	152.7	-59.2	173.3	0	0	0	104.9	T29 L33	T29-I31 VanDerWaalsContact C-N 3.34Å; T29-I31 PolarHBondContact O-N 3.36Å; I31-L33 PolarHBondContact O-N 3.36Å
32	P	35.6	Very low	42	Very low	108 Å²	108	116 Å²	116	70%	0.701	63%	0.633	S	S	*	*			trans	-62	107.5	170.4	26.3	-32	0	0	0	107.2	I34	P32-I34 PolarHBondContact O-N 3.19Å
33	L	31.5	Very low	42.3	Very low	157 Å²	157	116.1 Å²	116.1	82%	0.822	64%	0.635	S	S	*	*			trans	-65.8	95.7	159.6	-78.2	170.5	0	0	0	105.4	I31 E35	I31-L33 PolarHBondContact O-N 3.36Å; L33-E35 PolarHBondContact O-N 2.82Å; L33-E35 VanDerWaalsContact O-N 3.14Å
34	I	38.6	Very low	43.2	Very low	132 Å²	132	113.6 Å²	113.6	68%	0.677	63%	0.626	S	S	*	*			trans	-53.8	116.7	153.3	-62.2	173.5	0	0	0	104.4	P32 D36	P32-I34 PolarHBondContact O-N 3.19Å; I34-D36 VanDerWaalsContact C-N 3.25Å; I34-D36 PolarHBondContact O-N 2.89Å
35	E	33.4	Very low	44.4	Very low	155 Å²	155	113 Å²	113	72%	0.724	61%	0.612	S	S	*	*			trans	-70.4	92.2	172.2	-71.1	179.5	114.8	0	0	106.7	L33 S37 E38	L33-E35 PolarHBondContact O-N 2.82Å; L33-E35 VanDerWaalsContact O-N 3.14Å; E35-S37 CarbonylContact O-C 3.5Å; E35-S37 PolarHBondContact O-N 3.4Å; E35-E38 PolarHBondContact O-N 3.42Å
36	D	37.1	Very low	45.3	Very low	150 Å²	150	113.9 Å²	113.9	80%	0.802	62%	0.618	S	S	*	*	S	Bend	trans	-72.4	24.7	168.3	-78.8	-17.9	0	0	0	111.7	I34	I34-D36 VanDerWaalsContact C-N 3.25Å; I34-D36 PolarHBondContact O-N 2.89Å
37	S	38.3	Very low	46.9	Very low	83 Å²	83	114.6 Å²	114.6	58%	0.58	61%	0.612	S	S	*	*	S	Bend		-92.3	92.1	127.9	54.7	0	0	0	0	107.5	E35 E39	E35-S37 CarbonylContact O-C 3.5Å; E35-S37 PolarHBondContact O-N 3.4Å; S37-E39 PolarHBondContact O-N 2.78Å
38	E	38.9	Very low	48.9	Very low	146 Å²	146	104.2 Å²	104.2	68%	0.682	57%	0.574	S	S	*	*			trans	-54.3	100.7	152.6	-70.6	-179.7	132.2	0	0	106.1	E35 I40	E35-E38 PolarHBondContact O-N 3.42Å; E38-I40 HydrophobicContact CB-CG1 3.79Å; E38-I40 PolarHBondContact O-N 2.73Å
39	E	45.2	Very low	50.9	Low	143 Å²	143	103.7 Å²	103.7	67%	0.668	56%	0.561	S	S	*	*			trans	-59.7	80.2	134.3	-65.2	-156.5	118.2	0	0	105.8	S37 D41	S37-E39 PolarHBondContact O-N 2.78Å; E39-D41 PolarHBondContact O-N 3.19Å
40	I	45.6	Very low	52.9	Low	93 Å²	93	100.6 Å²	100.6	48%	0.477	54%	0.543	S	S	.	.			trans	-51.8	101.2	144.2	-53.9	178.5	0	0	0	103.1	E38 E42	E38-I40 HydrophobicContact CB-CG1 3.79Å; E38-I40 PolarHBondContact O-N 2.73Å; I40-E42 HydrophobicContact CB-CG 4.45Å; I40-E42 HydrophobicContact CG2-CG 3.99Å; I40-E42 PolarHBondContact O-N 2.03Å
41	D	47.7	Very low	55	Low	145 Å²	145	96.5 Å²	96.5	78%	0.775	51%	0.513	S	S	*	.			trans	-57.3	81.8	157.8	-79.6	-43.8	0	0	0	105.8	E39 P43	E39-D41 PolarHBondContact O-N 3.19Å; D41-P43 WeakPolarHBondContact O-CD 3.33Å
42	E	59	Low	56.9	Low	22 Å²	22	94.1 Å²	94.1	10%	0.103	51%	0.505	C	S	.	.			trans	-60.2	106.3	174.1	-69	-166	128.6	0	0	105.3	I40 C44 S77 R78	I40-E42 HydrophobicContact CB-CG 4.45Å; I40-E42 HydrophobicContact CG2-CG 3.99Å; I40-E42 PolarHBondContact O-N 2.03Å; E42-C44 PolarHBondContact O-N 3.15Å; E42-C44 VanDerWaalsContact O-N 3.11Å; E42-S77 WeakPolarHBondContact OE1-CA 3.24Å; E42-S77 WeakPolarHBondContact OE1-CB 3.19Å; E42-S77 PolarHBondContact OE1-N 3.08Å; E42-S77 PolarHBondContact OE1-OG 3.31Å; E42-R78 WeakPolarHBondContact OE2-CG 3.08Å
43	P	57.9	Low	58.6	Low	83 Å²	83	91.9 Å²	91.9	54%	0.539	48%	0.484	S	S	.	.			trans	-62.2	123.8	-158	22.1	-32.9	0	0	0	108.8	D41 F45	D41-P43 WeakPolarHBondContact O-CD 3.33Å; P43-F45 PolarHBondContact O-N 3.11Å
44	C	68.4	Low	60	Low	45 Å²	45	91.8 Å²	91.8	30%	0.304	48%	0.479	S	S	.	.			trans	-67.3	129.3	174	-164.3	0	0	0	0	108.4	E42 D46 C48 C50	E42-C44 PolarHBondContact O-N 3.15Å; E42-C44 VanDerWaalsContact O-N 3.11Å; C44-D46 PolarHBondContact O-N 3.26Å; C44-D46 VanDerWaalsContact O-N 3.08Å; C44-C48 PolarHBondContact SG-O 3Å; C44-C48 VanDerWaalsContact SG-O 3.42Å; C44-C50 VanDerWaalsContact CA-SG 3.54Å; C44-C50 HydrophobicContact CB-CB 3.69Å; C44-C50 WeakPolarHBondContact CB-SG 3.48Å; C44-C50 WeakPolarHBondContact SG-CB 3.45Å; C44-C50 PolarHBondContact SG-N 3.36Å; C44-C50 CovalentContact SG-SG 2.04Å; C44-C50 PolarHBondContact SG-SG 3.06Å
45	F	70.5	Confident	61.3	Low	48 Å²	48	91 Å²	91	21%	0.211	49%	0.485	C	S	.	.			trans	-74	100.7	-176.1	-179.4	-94	0	0	0	110.3	P43 C48 F66 Q71 E74 W76	P43-F45 PolarHBondContact O-N 3.11Å; F45-C48 WeakPolarHBondContact O-CA 3.48Å; F45-C48 WeakPolarHBondContact O-CB 3.35Å; F45-C48 PolarHBondContact O-N 3.37Å; F45-F66 HydrophobicContact CD1-CZ 4.38Å; F45-F66 HydrophobicContact CE1-CE1 4.02Å; F45-F66 AromaticContact CE1-CZ 4Å; F45-F66 HydrophobicContact CE1-CZ 4Å; F45-Q71 WeakPolarHBondContact CE1-O 3.43Å; F45-Q71 WeakPolarHBondContact CZ-O 3.43Å; F45-E74 HydrophobicContact CB-CG 4.06Å; F45-E74 HydrophobicContact CD2-CG 3.95Å; F45-E74 HydrophobicContact CG-CG 4.41Å; F45-W76 HydrophobicContact CB-CZ2 4.42Å
46	D	63.1	Low	63	Low	142 Å²	142	85.2 Å²	85.2	76%	0.759	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	131.2	170.9	-87.6	-46.3	0	0	0	110.5	C44	C44-D46 PolarHBondContact O-N 3.26Å; C44-D46 VanDerWaalsContact O-N 3.08Å
47	P	72.6	Confident	65.3	Low	67 Å²	67	78.9 Å²	78.9	44%	0.435	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	cis	-99.3	19.3	14	39.8	-38.5	0	0	0	114.8	K64	P47-K64 HydrophobicContact CB-CD 4.37Å; P47-K64 HydrophobicContact CG-CB 4.25Å; P47-K64 HydrophobicContact CG-CD 4.19Å; P47-K64 HydrophobicContact CG-CG 4.33Å; P47-K64 WeakPolarHBondContact O-CD 3.48Å; P47-K64 WeakPolarHBondContact O-CE 3.33Å; P47-K64 PolarHBondContact O-NZ 2.89Å
48	C	84.1	Confident	67.4	Low	6 Å²	6	75.1 Å²	75.1	4%	0.041	40%	0.398	C	S	.	.	S	Bend	trans	-73.9	158.1	171.3	-50.2	0	0	0	0	111.1	C44 F45 I59 H60 C61	C44-C48 PolarHBondContact SG-O 3Å; C44-C48 VanDerWaalsContact SG-O 3.42Å; F45-C48 WeakPolarHBondContact O-CA 3.48Å; F45-C48 WeakPolarHBondContact O-CB 3.35Å; F45-C48 PolarHBondContact O-N 3.37Å; C48-I59 HydrophobicContact CB-CG2 4.47Å; C48-H60 VanDerWaalsContact CA-O 3.31Å; C48-H60 WeakPolarHBondContact CA-O 3.36Å; C48-H60 WeakPolarHBondContact CB-O 3.38Å; C48-C61 HydrophobicContact CB-CB 4Å; C48-C61 WeakPolarHBondContact CB-SG 3.15Å; C48-C61 WeakPolarHBondContact SG-CA 3.26Å; C48-C61 WeakPolarHBondContact SG-CB 3.01Å; C48-C61 CovalentContact SG-SG 2.03Å; C48-C61 PolarHBondContact SG-SG 2.97Å
49	Y	83.4	Confident	69.6	Low	93 Å²	93	68.2 Å²	68.2	37%	0.365	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	150.8	170.3	75.8	-92.5	0	0	0	111.2	H60	Y49-H60 HydrophobicContact CD1-CB 3.66Å; Y49-H60 HydrophobicContact CD2-CB 4.1Å; Y49-H60 AromaticContact CD2-CD2 3.84Å; Y49-H60 HydrophobicContact CE1-CB 3.29Å; Y49-H60 AromaticContact CE1-CG 3.92Å; Y49-H60 HydrophobicContact CE2-CB 3.76Å; Y49-H60 AromaticContact CE2-CD2 3.3Å; Y49-H60 WeakPolarHBondContact CE2-CD2 3.43Å; Y49-H60 AromaticContact CE2-CG 3.56Å; Y49-H60 AromaticContact CE2-NE2 3.84Å; Y49-H60 HydrophobicContact CG-CB 4.06Å; Y49-H60 AromaticContact CZ-CD2 3.66Å; Y49-H60 AromaticContact CZ-CG 3.38Å; Y49-H60 AromaticContact CZ-ND1 3.85Å; Y49-H60 PolarHBondContact N-O 3.1Å; Y49-H60 PolarHBondContact O-N 2.74Å; Y49-H60 PolarHBondContact OH-ND1 3.08Å
50	C	84.6	Confident	71.5	Confident	36 Å²	36	61.6 Å²	61.6	24%	0.243	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	138	-173.9	-56.7	0	0	0	0	110.5	C44 F57 H58	C44-C50 VanDerWaalsContact CA-SG 3.54Å; C44-C50 HydrophobicContact CB-CB 3.69Å; C44-C50 WeakPolarHBondContact CB-SG 3.48Å; C44-C50 WeakPolarHBondContact SG-CB 3.45Å; C44-C50 PolarHBondContact SG-N 3.36Å; C44-C50 CovalentContact SG-SG 2.04Å; C44-C50 PolarHBondContact SG-SG 3.06Å; C50-F57 HydrophobicContact CB-CE1 3.91Å; C50-F57 HydrophobicContact CB-CE2 3.99Å; C50-F57 HydrophobicContact CB-CZ 3.46Å; C50-F57 VanDerWaalsContact CB-CZ 3.46Å; C50-H58 CarbonylContact C-O 3.14Å; C50-H58 VanDerWaalsContact CA-O 3.27Å; C50-H58 WeakPolarHBondContact CA-O 3.22Å
51	E	82.3	Confident	73.5	Confident	38 Å²	38	57.1 Å²	57.1	18%	0.178	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.5	174.6	68.9	-176.7	173.3	0	0	110	K53 H58 H60	E51-K53 HydrophobicContact CG-CD 4.32Å; E51-K53 HydrophobicContact CG-CG 4.4Å; E51-K53 IonicContact OE1-NZ 2.75Å; E51-K53 WeakPolarHBondContact OE2-CE 3.41Å; E51-K53 IonicContact OE2-NZ 3.29Å; E51-K53 PolarHBondContact OE2-NZ 3.36Å; E51-H58 HydrophobicContact CG-CB 3.33Å; E51-H58 PolarHBondContact N-O 3.36Å; E51-H58 PolarHBondContact O-N 3.25Å; E51-H58 WeakPolarHBondContact OE1-CB 3.47Å; E51-H58 IonicContact OE1-CE1 2.67Å; E51-H58 IonicContact OE1-CG 3.74Å; E51-H58 IonicContact OE1-ND1 2.86Å; E51-H58 PolarHBondContact OE1-ND1 3.26Å; E51-H60 VanDerWaalsContact CD-NE2 3.31Å; E51-H60 IonicContact OE1-CE1 3.42Å; E51-H60 PolarHBondContact OE1-CE1 3.35Å; E51-H60 IonicContact OE1-NE2 2.71Å; E51-H60 PolarHBondContact OE1-NE2 3.12Å
52	V	78.3	Confident	75.3	Confident	85 Å²	85	50.5 Å²	50.5	52%	0.515	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	113.4	171.8	-166	0	0	0	0	108.2	F57	V52-F57 HydrophobicContact CG2-CD2 4.04Å; V52-F57 HydrophobicContact CG2-CE2 4.2Å
53	K	71.3	Confident	76.6	Confident	60 Å²	60	51.7 Å²	51.7	26%	0.261	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	120.3	177.6	-79	179.3	173.7	159	0	109.8	E51 S55 L56 E578 T579	E51-K53 HydrophobicContact CG-CD 4.32Å; E51-K53 HydrophobicContact CG-CG 4.4Å; E51-K53 IonicContact OE1-NZ 2.75Å; E51-K53 WeakPolarHBondContact OE2-CE 3.41Å; E51-K53 IonicContact OE2-NZ 3.29Å; E51-K53 PolarHBondContact OE2-NZ 3.36Å; K53-S55 PolarHBondContact O-N 3.43Å; K53-L56 PolarHBondContact N-O 3.41Å; K53-L56 WeakPolarHBondContact O-CB 3.42Å; K53-L56 PolarHBondContact O-N 3.26Å; K53-L56 VanDerWaalsContact O-O 3.1Å; K53-E578 PolarHBondContact NZ-O 3.32Å; K53-T579 PolarHBondContact NZ-O 3.09Å; K53-T579 VanDerWaalsContact NZ-O 3.17Å
54	E	60.1	Low	78	Confident	155 Å²	155	51.7 Å²	51.7	72%	0.724	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	43.4	179.1	-48	-160.9	123.2	0	0	114.4	L56 K965	E54-L56 PolarHBondContact O-N 3.3Å; E54-L56 VanDerWaalsContact O-N 3.17Å; E54-K965 IonicContact OE1-NZ 2.59Å; E54-K965 PolarHBondContact OE1-NZ 2.99Å; E54-K965 IonicContact OE2-NZ 2.64Å; E54-K965 PolarHBondContact OE2-NZ 3.32Å
55	S	65.3	Low	78.8	Confident	115 Å²	115	51.7 Å²	51.7	80%	0.804	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	17	-174.9	-53	0	0	0	0	115.2	K53	K53-S55 PolarHBondContact O-N 3.43Å
56	L	70.2	Confident	79.6	Confident	34 Å²	34	50 Å²	50	18%	0.178	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	134.5	171.4	-161.5	85.5	0	0	0	108.9	K53 E54 P79 K81 V104	K53-L56 PolarHBondContact N-O 3.41Å; K53-L56 WeakPolarHBondContact O-CB 3.42Å; K53-L56 PolarHBondContact O-N 3.26Å; K53-L56 VanDerWaalsContact O-O 3.1Å; E54-L56 PolarHBondContact O-N 3.3Å; E54-L56 VanDerWaalsContact O-N 3.17Å; L56-P79 HydrophobicContact CD1-CB 3.86Å; L56-P79 HydrophobicContact CD1-CG 4.02Å; L56-P79 VanDerWaalsContact CD1-O 3.26Å; L56-P79 WeakPolarHBondContact CD1-O 3.44Å; L56-P79 WeakPolarHBondContact CG-O 3.22Å; L56-K81 HydrophobicContact CD2-CD 4.16Å; L56-K81 HydrophobicContact CD2-CG 3.61Å; L56-V104 HydrophobicContact CD1-CG2 4.28Å
57	F	84.3	Confident	80.7	Confident	18 Å²	18	47.2 Å²	47.2	8%	0.079	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	144.5	178.1	-156.6	-124.2	0	0	0	110.1	C50 V52 I59 W76 P79 F80 K81	C50-F57 HydrophobicContact CB-CE1 3.91Å; C50-F57 HydrophobicContact CB-CE2 3.99Å; C50-F57 HydrophobicContact CB-CZ 3.46Å; C50-F57 VanDerWaalsContact CB-CZ 3.46Å; V52-F57 HydrophobicContact CG2-CD2 4.04Å; V52-F57 HydrophobicContact CG2-CE2 4.2Å; F57-I59 HydrophobicContact CD1-CD1 3.85Å; F57-I59 HydrophobicContact CD1-CG1 3.53Å; F57-I59 HydrophobicContact CE1-CD1 4.16Å; F57-I59 HydrophobicContact CE1-CG1 3.76Å; F57-W76 HydrophobicContact CD1-CG 4.4Å; F57-W76 AromaticContact CE1-CD1 3.66Å; F57-W76 HydrophobicContact CE1-CG 4.37Å; F57-W76 AromaticContact CE1-NE1 3.76Å; F57-P79 PolarHBondContact N-O 3.22Å; F57-P79 VanDerWaalsContact N-O 3.1Å; F57-F80 HydrophobicContact CB-CB 3.87Å; F57-F80 HydrophobicContact CD1-CB 4.44Å; F57-F80 CarbonylContact O-C 3.51Å; F57-F80 WeakPolarHBondContact O-CA 3.31Å; F57-K81 PolarHBondContact O-N 2.95Å
58	H	82.1	Confident	81.3	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.019	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	116	-177.1	-90.1	-159.5	0	0	0	108.1	C50 E51 K81 Y83	C50-H58 CarbonylContact C-O 3.14Å; C50-H58 VanDerWaalsContact CA-O 3.27Å; C50-H58 WeakPolarHBondContact CA-O 3.22Å; E51-H58 HydrophobicContact CG-CB 3.33Å; E51-H58 PolarHBondContact N-O 3.36Å; E51-H58 PolarHBondContact O-N 3.25Å; E51-H58 WeakPolarHBondContact OE1-CB 3.47Å; E51-H58 IonicContact OE1-CE1 2.67Å; E51-H58 IonicContact OE1-CG 3.74Å; E51-H58 IonicContact OE1-ND1 2.86Å; E51-H58 PolarHBondContact OE1-ND1 3.26Å; H58-K81 PolarHBondContact NE2-NZ 3.18Å; H58-Y83 HydrophobicContact CB-CE2 4.15Å; H58-Y83 PolarHBondContact CE1-OH 3.37Å; H58-Y83 PolarHBondContact ND1-OH 3.16Å
59	I	86.4	Confident	81.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	110.4	-170.1	-51.9	166.2	0	0	0	108.2	C48 F57 W76 F80 K81 L82 Y83	C48-I59 HydrophobicContact CB-CG2 4.47Å; F57-I59 HydrophobicContact CD1-CD1 3.85Å; F57-I59 HydrophobicContact CD1-CG1 3.53Å; F57-I59 HydrophobicContact CE1-CD1 4.16Å; F57-I59 HydrophobicContact CE1-CG1 3.76Å; I59-W76 HydrophobicContact CD1-CD2 3.41Å; I59-W76 VanDerWaalsContact CD1-CD2 3.41Å; I59-W76 HydrophobicContact CD1-CE3 3.41Å; I59-W76 VanDerWaalsContact CD1-CE3 3.41Å; I59-W76 HydrophobicContact CD1-CG 4.07Å; I59-W76 HydrophobicContact CD1-CH2 3.77Å; I59-W76 HydrophobicContact CD1-CZ2 3.78Å; I59-W76 HydrophobicContact CD1-CZ3 3.59Å; I59-W76 HydrophobicContact CG2-CH2 4.26Å; I59-W76 HydrophobicContact CG2-CZ2 4.31Å; I59-F80 HydrophobicContact CD1-CB 4.07Å; I59-F80 HydrophobicContact CD1-CD2 3.58Å; I59-F80 HydrophobicContact CD1-CE2 4.1Å; I59-F80 HydrophobicContact CD1-CG 3.86Å; I59-K81 PolarHBondContact N-O 3.16Å; I59-L82 HydrophobicContact CB-CD1 3.91Å; I59-L82 HydrophobicContact CG2-CD1 3.76Å; I59-L82 WeakPolarHBondContact O-CA 3.38Å; I59-Y83 VanDerWaalsContact O-CD2 3.3Å; I59-Y83 WeakPolarHBondContact O-CD2 3.13Å; I59-Y83 PolarHBondContact O-N 2.96Å
60	H	84.9	Confident	81.2	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.019	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	100.3	-174.7	-57.7	-103.5	0	0	0	110	C48 Y49 E51 Y83 S582	C48-H60 VanDerWaalsContact CA-O 3.31Å; C48-H60 WeakPolarHBondContact CA-O 3.36Å; C48-H60 WeakPolarHBondContact CB-O 3.38Å; Y49-H60 HydrophobicContact CD1-CB 3.66Å; Y49-H60 HydrophobicContact CD2-CB 4.1Å; Y49-H60 AromaticContact CD2-CD2 3.84Å; Y49-H60 HydrophobicContact CE1-CB 3.29Å; Y49-H60 AromaticContact CE1-CG 3.92Å; Y49-H60 HydrophobicContact CE2-CB 3.76Å; Y49-H60 AromaticContact CE2-CD2 3.3Å; Y49-H60 WeakPolarHBondContact CE2-CD2 3.43Å; Y49-H60 AromaticContact CE2-CG 3.56Å; Y49-H60 AromaticContact CE2-NE2 3.84Å; Y49-H60 HydrophobicContact CG-CB 4.06Å; Y49-H60 AromaticContact CZ-CD2 3.66Å; Y49-H60 AromaticContact CZ-CG 3.38Å; Y49-H60 AromaticContact CZ-ND1 3.85Å; Y49-H60 PolarHBondContact N-O 3.1Å; Y49-H60 PolarHBondContact O-N 2.74Å; Y49-H60 PolarHBondContact OH-ND1 3.08Å; E51-H60 VanDerWaalsContact CD-NE2 3.31Å; E51-H60 IonicContact OE1-CE1 3.42Å; E51-H60 PolarHBondContact OE1-CE1 3.35Å; E51-H60 IonicContact OE1-NE2 2.71Å; E51-H60 PolarHBondContact OE1-NE2 3.12Å; H60-Y83 HydrophobicContact CB-CD2 4.33Å; H60-Y83 AromaticContact CE1-CD2 3.57Å; H60-Y83 AromaticContact CE1-CE2 3.38Å; H60-Y83 WeakPolarHBondContact CE1-CE2 3.38Å; H60-Y83 AromaticContact CG-CD2 3.58Å; H60-Y83 AromaticContact ND1-CD2 3.22Å; H60-Y83 WeakPolarHBondContact ND1-CD2 3.28Å; H60-Y83 AromaticContact ND1-CE2 3.57Å; H60-Y83 AromaticContact ND1-CG 3.87Å; H60-Y83 AromaticContact NE2-CE2 3.72Å; H60-S582 PolarHBondContact CE1-OG 2.94Å; H60-S582 PolarHBondContact ND1-OG 3.49Å
61	C	87.3	Confident	81	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.268	C	S	.	.			trans	-111.8	25.1	-177.5	-73.1	0	0	0	0	111.7	C48 K64 F66 L82 Y83 L84 N87	C48-C61 HydrophobicContact CB-CB 4Å; C48-C61 WeakPolarHBondContact CB-SG 3.15Å; C48-C61 WeakPolarHBondContact SG-CA 3.26Å; C48-C61 WeakPolarHBondContact SG-CB 3.01Å; C48-C61 CovalentContact SG-SG 2.03Å; C48-C61 PolarHBondContact SG-SG 2.97Å; C61-K64 WeakPolarHBondContact O-CG 3.35Å; C61-F66 HydrophobicContact CB-CD2 4.34Å; C61-F66 HydrophobicContact CB-CE2 3.81Å; C61-L82 HydrophobicContact CB-CD1 4.43Å; C61-Y83 CarbonylContact C-O 3.59Å; C61-Y83 VanDerWaalsContact CA-O 3.31Å; C61-Y83 WeakPolarHBondContact CA-O 3.37Å; C61-Y83 WeakPolarHBondContact CB-O 3.01Å; C61-Y83 PolarHBondContact N-O 2.82Å; C61-L84 HydrophobicContact CB-CD2 3.36Å; C61-L84 HydrophobicContact CB-CG 4.21Å; C61-N87 PolarHBondContact O-ND2 3.05Å
62	D	86.3	Confident	80.8	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.027	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	150.1	-172.5	64.3	-58	0	0	0	114.2	K64 Y83 Q85	D62-K64 WeakPolarHBondContact O-CE 3.18Å; D62-K64 WeakPolarHBondContact O-CG 3.23Å; D62-K64 PolarHBondContact O-N 3.18Å; D62-Y83 PolarHBondContact N-O 3.15Å; D62-Q85 VanDerWaalsContact CA-O 3.26Å; D62-Q85 WeakPolarHBondContact CA-O 3.39Å; D62-Q85 VanDerWaalsContact CB-CD 3.48Å; D62-Q85 HydrophobicContact CB-CG 3.8Å; D62-Q85 VanDerWaalsContact CB-O 3.27Å; D62-Q85 WeakPolarHBondContact CB-O 3.18Å; D62-Q85 PolarHBondContact OD2-NE2 3.48Å; D62-Q85 VanDerWaalsContact OD2-NE2 3.12Å
63	S	85.2	Confident	80	Confident	47 Å²	47	45.5 Å²	45.5	33%	0.329	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	15.8	-175.2	-48.3	0	0	0	0	115.5	Q85 R86	S63-Q85 PolarHBondContact N-O 3.03Å; S63-R86 PolarHBondContact OG-NH1 3.1Å
64	K	86.7	Confident	80	Confident	83 Å²	83	45.7 Å²	45.7	36%	0.361	26%	0.264	S	S	.	.	S	Bend	trans	-84	-5.5	-177.1	-54.1	-60	172.2	158	0	114.3	P47 C61 D62 F66 N87	P47-K64 HydrophobicContact CB-CD 4.37Å; P47-K64 HydrophobicContact CG-CB 4.25Å; P47-K64 HydrophobicContact CG-CD 4.19Å; P47-K64 HydrophobicContact CG-CG 4.33Å; P47-K64 WeakPolarHBondContact O-CD 3.48Å; P47-K64 WeakPolarHBondContact O-CE 3.33Å; P47-K64 PolarHBondContact O-NZ 2.89Å; C61-K64 WeakPolarHBondContact O-CG 3.35Å; D62-K64 WeakPolarHBondContact O-CE 3.18Å; D62-K64 WeakPolarHBondContact O-CG 3.23Å; D62-K64 PolarHBondContact O-N 3.18Å; K64-F66 HydrophobicContact CB-CD2 3.8Å; K64-F66 HydrophobicContact CB-CE2 3.52Å; K64-F66 HydrophobicContact CB-CZ 4.25Å; K64-F66 HydrophobicContact CG-CE2 3.97Å; K64-N87 PolarHBondContact N-OD1 3.46Å
65	G	85	Confident	80.4	Confident	45 Å²	45	44 Å²	44	46%	0.464	26%	0.255	S	S	.	.			trans	83.4	14.3	177.2	0	0	0	0	0	115.5	T67 N87	G65-T67 PolarHBondContact O-N 2.78Å; G65-N87 PolarHBondContact N-OD1 2.83Å
66	F	87.9	Confident	81	Confident	14 Å²	14	38.7 Å²	38.7	6%	0.061	22%	0.217	C	C	.	.			trans	-56.1	137.4	179.1	-67.5	-67.1	0	0	0	112	F45 C61 K64 Q71 I72 L84 N87 S88 M89	F45-F66 HydrophobicContact CD1-CZ 4.38Å; F45-F66 HydrophobicContact CE1-CE1 4.02Å; F45-F66 AromaticContact CE1-CZ 4Å; F45-F66 HydrophobicContact CE1-CZ 4Å; C61-F66 HydrophobicContact CB-CD2 4.34Å; C61-F66 HydrophobicContact CB-CE2 3.81Å; K64-F66 HydrophobicContact CB-CD2 3.8Å; K64-F66 HydrophobicContact CB-CE2 3.52Å; K64-F66 HydrophobicContact CB-CZ 4.25Å; K64-F66 HydrophobicContact CG-CE2 3.97Å; F66-Q71 HydrophobicContact CD1-CB 3.8Å; F66-Q71 HydrophobicContact CE1-CB 4.15Å; F66-I72 HydrophobicContact CD1-CD1 4.49Å; F66-I72 HydrophobicContact CD1-CG1 4.32Å; F66-I72 HydrophobicContact CD2-CD1 4.18Å; F66-I72 HydrophobicContact CE1-CD1 4.46Å; F66-I72 HydrophobicContact CE1-CG1 4.02Å; F66-I72 HydrophobicContact CE2-CD1 4.16Å; F66-I72 HydrophobicContact CE2-CG1 4.47Å; F66-I72 HydrophobicContact CG-CD1 4.35Å; F66-I72 HydrophobicContact CZ-CD1 4.3Å; F66-I72 HydrophobicContact CZ-CG1 4.11Å; F66-L84 HydrophobicContact CD2-CD2 4.17Å; F66-N87 HydrophobicContact CB-CB 4.09Å; F66-N87 WeakPolarHBondContact CD2-OD1 3.26Å; F66-N87 PolarHBondContact N-OD1 2.73Å; F66-N87 WeakPolarHBondContact O-CB 3.29Å; F66-S88 CarbonylContact O-C 3.55Å; F66-S88 WeakPolarHBondContact O-CA 3.3Å; F66-S88 PolarHBondContact O-N 3.31Å; F66-M89 HydrophobicContact CB-CE 4.44Å; F66-M89 PolarHBondContact O-N 2.79Å
67	T	86.4	Confident	81.3	Confident	82 Å²	82	40.2 Å²	40.2	50%	0.503	23%	0.231	S	C	.	.	S	Bend	trans	-108.9	-21.4	-178.4	59.3	0	0	0	0	113	G65 Q71	G65-T67 PolarHBondContact O-N 2.78Å; T67-Q71 PolarHBondContact OG1-OE1 2.93Å
68	N	85.5	Confident	81.1	Confident	36 Å²	36	43.2 Å²	43.2	19%	0.193	24%	0.241	C	C	.	.			trans	-150.9	144.4	176.4	-176.5	10.5	0	0	0	109.5	S70 Q71	N68-S70 PolarHBondContact ND2-OG 3.23Å; N68-S70 VanDerWaalsContact ND2-OG 3.14Å; N68-S70 PolarHBondContact O-N 2.99Å; N68-S70 PolarHBondContact OD1-N 3.15Å; N68-Q71 WeakPolarHBondContact O-CB 3.4Å; N68-Q71 WeakPolarHBondContact O-CG 3.47Å; N68-Q71 PolarHBondContact O-N 3.5Å; N68-Q71 VanDerWaalsContact O-N 3.11Å
69	I	85.7	Confident	81.3	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-61.9	-23.2	177.4	-159.5	77.9	0	0	0	112.4	Q71 I72 L84 M89 S96 F97 L100	I69-Q71 PolarHBondContact O-N 2.83Å; I69-I72 HydrophobicContact CD1-CD1 4.21Å; I69-I72 WeakPolarHBondContact O-CB 3.45Å; I69-I72 PolarHBondContact O-N 3.31Å; I69-L84 HydrophobicContact CD1-CD1 3.36Å; I69-M89 HydrophobicContact CB-SD 4.44Å; I69-M89 HydrophobicContact CD1-SD 4.46Å; I69-S96 VanDerWaalsContact CG2-CB 3.47Å; I69-S96 WeakPolarHBondContact CG2-O 3.41Å; I69-F97 HydrophobicContact CB-CZ 4.43Å; I69-F97 HydrophobicContact CD1-CD1 4.37Å; I69-F97 HydrophobicContact CD1-CE1 3.66Å; I69-F97 HydrophobicContact CD1-CZ 4.05Å; I69-F97 HydrophobicContact CG1-CD1 4.2Å; I69-F97 HydrophobicContact CG1-CE1 3.85Å; I69-F97 HydrophobicContact CG1-CZ 4.12Å; I69-L100 HydrophobicContact CD1-CD1 4.13Å; I69-L100 HydrophobicContact CG1-CD1 3.88Å
70	S	80.3	Confident	81.3	Confident	73 Å²	73	45.7 Å²	45.7	51%	0.51	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-63.3	-3.9	174.2	-48	0	0	0	0	114.4	N68 I72 T73	N68-S70 PolarHBondContact ND2-OG 3.23Å; N68-S70 VanDerWaalsContact ND2-OG 3.14Å; N68-S70 PolarHBondContact O-N 2.99Å; N68-S70 PolarHBondContact OD1-N 3.15Å; S70-I72 VanDerWaalsContact C-N 3.29Å; S70-T73 WeakPolarHBondContact O-CG2 3.3Å
71	Q	79.7	Confident	81.4	Confident	86 Å²	86	47.1 Å²	47.1	40%	0.402	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-84.6	-2.1	168.2	-59.3	-177.1	-85.7	0	0	112.7	F45 F66 T67 N68 I69	F45-Q71 WeakPolarHBondContact CE1-O 3.43Å; F45-Q71 WeakPolarHBondContact CZ-O 3.43Å; F66-Q71 HydrophobicContact CD1-CB 3.8Å; F66-Q71 HydrophobicContact CE1-CB 4.15Å; T67-Q71 PolarHBondContact OG1-OE1 2.93Å; N68-Q71 WeakPolarHBondContact O-CB 3.4Å; N68-Q71 WeakPolarHBondContact O-CG 3.47Å; N68-Q71 PolarHBondContact O-N 3.5Å; N68-Q71 VanDerWaalsContact O-N 3.11Å; I69-Q71 PolarHBondContact O-N 2.83Å
72	I	77.1	Confident	81.5	Confident	5 Å²	5	47.1 Å²	47.1	3%	0.026	26%	0.264	C	S	.	.			trans	-124.8	87.9	-179.8	-58.1	167.3	0	0	0	106.5	F66 I69 S70 W76 L84	F66-I72 HydrophobicContact CD1-CD1 4.49Å; F66-I72 HydrophobicContact CD1-CG1 4.32Å; F66-I72 HydrophobicContact CD2-CD1 4.18Å; F66-I72 HydrophobicContact CE1-CD1 4.46Å; F66-I72 HydrophobicContact CE1-CG1 4.02Å; F66-I72 HydrophobicContact CE2-CD1 4.16Å; F66-I72 HydrophobicContact CE2-CG1 4.47Å; F66-I72 HydrophobicContact CG-CD1 4.35Å; F66-I72 HydrophobicContact CZ-CD1 4.3Å; F66-I72 HydrophobicContact CZ-CG1 4.11Å; I69-I72 HydrophobicContact CD1-CD1 4.21Å; I69-I72 WeakPolarHBondContact O-CB 3.45Å; I69-I72 PolarHBondContact O-N 3.31Å; S70-I72 VanDerWaalsContact C-N 3.29Å; I72-W76 HydrophobicContact CG2-CH2 3.72Å; I72-W76 HydrophobicContact CG2-CZ3 4.2Å; I72-L84 HydrophobicContact CD1-CD1 4.38Å; I72-L84 HydrophobicContact CD1-CD2 3.44Å; I72-L84 VanDerWaalsContact CD1-CD2 3.44Å
73	T	63.1	Low	81.6	Confident	87 Å²	87	47 Å²	47	53%	0.534	26%	0.263	S	S	.	.			trans	-97.8	4.6	-168.5	47.8	0	0	0	0	114.6	S70	S70-T73 WeakPolarHBondContact O-CG2 3.3Å
74	E	70.4	Confident	81.9	Confident	64 Å²	64	44.8 Å²	44.8	30%	0.299	25%	0.247	S	C	.	.			trans	-76.1	153.2	-173.3	-69.3	-49.8	135.4	0	0	114.5	F45 W76	F45-E74 HydrophobicContact CB-CG 4.06Å; F45-E74 HydrophobicContact CD2-CG 3.95Å; F45-E74 HydrophobicContact CG-CG 4.41Å; E74-W76 HydrophobicContact CB-CD2 4.31Å; E74-W76 HydrophobicContact CB-CH2 3.81Å; E74-W76 HydrophobicContact CB-CZ2 3.49Å; E74-W76 VanDerWaalsContact CB-CZ2 3.49Å; E74-W76 HydrophobicContact CB-CZ3 4.32Å; E74-W76 HydrophobicContact CG-CZ2 4.15Å
75	F	69.6	Low	81.9	Confident	121 Å²	121	41 Å²	41	53%	0.531	23%	0.231	S	C	.	.			trans	-117.6	101	178.2	179.3	-95.9	0	0	0	110.3
76	W	77.5	Confident	82	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.008	22%	0.217	C	C	.	.			trans	-88.5	120.2	176.6	-60.9	-70.9	0	0	0	110.7	F45 F57 I59 I72 E74 R78 F80 L100 N102	F45-W76 HydrophobicContact CB-CZ2 4.42Å; F57-W76 HydrophobicContact CD1-CG 4.4Å; F57-W76 AromaticContact CE1-CD1 3.66Å; F57-W76 HydrophobicContact CE1-CG 4.37Å; F57-W76 AromaticContact CE1-NE1 3.76Å; I59-W76 HydrophobicContact CD1-CD2 3.41Å; I59-W76 VanDerWaalsContact CD1-CD2 3.41Å; I59-W76 HydrophobicContact CD1-CE3 3.41Å; I59-W76 VanDerWaalsContact CD1-CE3 3.41Å; I59-W76 HydrophobicContact CD1-CG 4.07Å; I59-W76 HydrophobicContact CD1-CH2 3.77Å; I59-W76 HydrophobicContact CD1-CZ2 3.78Å; I59-W76 HydrophobicContact CD1-CZ3 3.59Å; I59-W76 HydrophobicContact CG2-CH2 4.26Å; I59-W76 HydrophobicContact CG2-CZ2 4.31Å; I72-W76 HydrophobicContact CG2-CH2 3.72Å; I72-W76 HydrophobicContact CG2-CZ3 4.2Å; E74-W76 HydrophobicContact CB-CD2 4.31Å; E74-W76 HydrophobicContact CB-CH2 3.81Å; E74-W76 HydrophobicContact CB-CZ2 3.49Å; E74-W76 VanDerWaalsContact CB-CZ2 3.49Å; E74-W76 HydrophobicContact CB-CZ3 4.32Å; E74-W76 HydrophobicContact CG-CZ2 4.15Å; W76-R78 VanDerWaalsContact C-N 3.33Å; W76-F80 HydrophobicContact CB-CD1 3.78Å; W76-F80 HydrophobicContact CB-CE1 3.96Å; W76-F80 HydrophobicContact CE3-CD1 4.38Å; W76-F80 AromaticContact CE3-CE1 3.92Å; W76-F80 HydrophobicContact CE3-CE1 3.92Å; W76-F80 HydrophobicContact CE3-CE2 4.09Å; W76-F80 AromaticContact CE3-CZ 3.76Å; W76-F80 HydrophobicContact CE3-CZ 3.76Å; W76-F80 HydrophobicContact CZ3-CE2 4.42Å; W76-F80 HydrophobicContact CZ3-CZ 4.34Å; W76-L100 HydrophobicContact CE3-CD2 3.98Å; W76-L100 HydrophobicContact CZ3-CD2 3.57Å; W76-N102 PolarHBondContact O-ND2 2.56Å
77	S	76.8	Confident	82.1	Confident	67 Å²	67	40.5 Å²	40.5	47%	0.469	22%	0.215	S	C	.	.	S	Bend	trans	-74.8	-25.7	179.8	73.1	0	0	0	0	112.5	E42 N102	E42-S77 WeakPolarHBondContact OE1-CA 3.24Å; E42-S77 WeakPolarHBondContact OE1-CB 3.19Å; E42-S77 PolarHBondContact OE1-N 3.08Å; E42-S77 PolarHBondContact OE1-OG 3.31Å; S77-N102 PolarHBondContact O-ND2 2.76Å
78	R	80	Confident	82.3	Confident	81 Å²	81	39.4 Å²	39.4	31%	0.306	21%	0.211	S	C	.	.	S	Bend	trans	-85.6	148	178.6	-60.3	177.9	-178.3	-163.6	1.3	110.8	E42 W76 F80	E42-R78 WeakPolarHBondContact OE2-CG 3.08Å; W76-R78 VanDerWaalsContact C-N 3.33Å; R78-F80 WeakPolarHBondContact O-CD1 3.22Å; R78-F80 PolarHBondContact O-N 3.3Å
79	P	84.9	Confident	82.5	Confident	56 Å²	56	37.8 Å²	37.8	36%	0.364	20%	0.202	S	C	.	.			trans	-66.5	132.6	175.4	26.6	-33.1	0	0	0	111.3	L56 F57 N102 V104	L56-P79 HydrophobicContact CD1-CB 3.86Å; L56-P79 HydrophobicContact CD1-CG 4.02Å; L56-P79 VanDerWaalsContact CD1-O 3.26Å; L56-P79 WeakPolarHBondContact CD1-O 3.44Å; L56-P79 WeakPolarHBondContact CG-O 3.22Å; F57-P79 PolarHBondContact N-O 3.22Å; F57-P79 VanDerWaalsContact N-O 3.1Å; P79-N102 WeakPolarHBondContact CA-O 3.25Å; P79-V104 HydrophobicContact CB-CG2 3.86Å
80	F	87.4	Confident	82.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	161.5	-167.9	66.6	-95.5	0	0	0	115.8	F57 I59 W76 R78 L82 L100 N102 A103 V104	F57-F80 HydrophobicContact CB-CB 3.87Å; F57-F80 HydrophobicContact CD1-CB 4.44Å; F57-F80 CarbonylContact O-C 3.51Å; F57-F80 WeakPolarHBondContact O-CA 3.31Å; I59-F80 HydrophobicContact CD1-CB 4.07Å; I59-F80 HydrophobicContact CD1-CD2 3.58Å; I59-F80 HydrophobicContact CD1-CE2 4.1Å; I59-F80 HydrophobicContact CD1-CG 3.86Å; W76-F80 HydrophobicContact CB-CD1 3.78Å; W76-F80 HydrophobicContact CB-CE1 3.96Å; W76-F80 HydrophobicContact CE3-CD1 4.38Å; W76-F80 AromaticContact CE3-CE1 3.92Å; W76-F80 HydrophobicContact CE3-CE1 3.92Å; W76-F80 HydrophobicContact CE3-CE2 4.09Å; W76-F80 AromaticContact CE3-CZ 3.76Å; W76-F80 HydrophobicContact CE3-CZ 3.76Å; W76-F80 HydrophobicContact CZ3-CE2 4.42Å; W76-F80 HydrophobicContact CZ3-CZ 4.34Å; R78-F80 WeakPolarHBondContact O-CD1 3.22Å; R78-F80 PolarHBondContact O-N 3.3Å; F80-L82 HydrophobicContact CD2-CB 4.06Å; F80-L82 HydrophobicContact CE2-CB 3.94Å; F80-L82 HydrophobicContact CE2-CD2 4.28Å; F80-L100 HydrophobicContact CE2-CD2 4.39Å; F80-L100 HydrophobicContact CZ-CB 3.98Å; F80-L100 HydrophobicContact CZ-CD2 3.85Å; F80-N102 HydrophobicContact CD1-CB 3.98Å; F80-N102 HydrophobicContact CE1-CB 3.87Å; F80-N102 PolarHBondContact N-O 3.49Å; F80-N102 VanDerWaalsContact N-O 3.1Å; F80-A103 HydrophobicContact CD2-CB 4.13Å; F80-A103 HydrophobicContact CE1-CB 4.32Å; F80-A103 HydrophobicContact CE2-CB 3.52Å; F80-A103 HydrophobicContact CZ-CB 3.64Å; F80-V104 PolarHBondContact O-N 2.84Å
81	K	87.3	Confident	83.2	Confident	33 Å²	33	46 Å²	46	14%	0.143	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138.6	162.1	-53.9	-164.5	-176.2	83.4	0	109.2	L56 F57 H58 I59 Y83 S105 V583	L56-K81 HydrophobicContact CD2-CD 4.16Å; L56-K81 HydrophobicContact CD2-CG 3.61Å; F57-K81 PolarHBondContact O-N 2.95Å; H58-K81 PolarHBondContact NE2-NZ 3.18Å; I59-K81 PolarHBondContact N-O 3.16Å; K81-Y83 HydrophobicContact CB-CE2 4.14Å; K81-Y83 WeakPolarHBondContact CD-OH 3.3Å; K81-S105 CarbonylContact C-O 3.51Å; K81-S105 WeakPolarHBondContact CA-O 3.34Å; K81-V583 HydrophobicContact CD-CG2 3.89Å
82	L	89.5	Confident	83.9	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.8	-179.1	176.5	60	0	0	0	110.2	I59 C61 F80 L84 L100 S105 I106 N107	I59-L82 HydrophobicContact CB-CD1 3.91Å; I59-L82 HydrophobicContact CG2-CD1 3.76Å; I59-L82 WeakPolarHBondContact O-CA 3.38Å; C61-L82 HydrophobicContact CB-CD1 4.43Å; F80-L82 HydrophobicContact CD2-CB 4.06Å; F80-L82 HydrophobicContact CE2-CB 3.94Å; F80-L82 HydrophobicContact CE2-CD2 4.28Å; L82-L84 HydrophobicContact CD1-CD1 4.23Å; L82-L84 HydrophobicContact CD1-CG 4.13Å; L82-L84 HydrophobicContact CD2-CD1 3.72Å; L82-L84 HydrophobicContact CD2-CG 4.49Å; L82-L84 HydrophobicContact CG-CD1 3.72Å; L82-L84 HydrophobicContact CG-CG 3.99Å; L82-L100 HydrophobicContact CD2-CD1 3.92Å; L82-S105 PolarHBondContact N-O 2.87Å; L82-I106 HydrophobicContact CB-CG1 4.33Å; L82-I106 WeakPolarHBondContact O-CA 3.19Å; L82-N107 PolarHBondContact O-N 2.93Å
83	Y	88.6	Confident	84.5	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.008	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117.4	-179.1	-50.1	-83.1	0	0	0	109.3	H58 I59 H60 C61 D62 K81 N107 S582 V583	H58-Y83 HydrophobicContact CB-CE2 4.15Å; H58-Y83 PolarHBondContact CE1-OH 3.37Å; H58-Y83 PolarHBondContact ND1-OH 3.16Å; I59-Y83 VanDerWaalsContact O-CD2 3.3Å; I59-Y83 WeakPolarHBondContact O-CD2 3.13Å; I59-Y83 PolarHBondContact O-N 2.96Å; H60-Y83 HydrophobicContact CB-CD2 4.33Å; H60-Y83 AromaticContact CE1-CD2 3.57Å; H60-Y83 AromaticContact CE1-CE2 3.38Å; H60-Y83 WeakPolarHBondContact CE1-CE2 3.38Å; H60-Y83 AromaticContact CG-CD2 3.58Å; H60-Y83 AromaticContact ND1-CD2 3.22Å; H60-Y83 WeakPolarHBondContact ND1-CD2 3.28Å; H60-Y83 AromaticContact ND1-CE2 3.57Å; H60-Y83 AromaticContact ND1-CG 3.87Å; H60-Y83 AromaticContact NE2-CE2 3.72Å; C61-Y83 CarbonylContact C-O 3.59Å; C61-Y83 VanDerWaalsContact CA-O 3.31Å; C61-Y83 WeakPolarHBondContact CA-O 3.37Å; C61-Y83 WeakPolarHBondContact CB-O 3.01Å; C61-Y83 PolarHBondContact N-O 2.82Å; D62-Y83 PolarHBondContact N-O 3.15Å; K81-Y83 HydrophobicContact CB-CE2 4.14Å; K81-Y83 WeakPolarHBondContact CD-OH 3.3Å; Y83-N107 HydrophobicContact CD1-CB 4.39Å; Y83-S582 VanDerWaalsContact CD1-OG 3.32Å; Y83-S582 WeakPolarHBondContact CD1-OG 3.31Å; Y83-S582 WeakPolarHBondContact CE1-OG 3.17Å; Y83-S582 WeakPolarHBondContact CE2-OG 3.36Å; Y83-V583 HydrophobicContact CE1-CB 4.47Å; Y83-V583 HydrophobicContact CE1-CG2 3.55Å; Y83-V583 WeakPolarHBondContact OH-CG2 3.33Å
84	L	89.8	Confident	85.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.217	C	C	.	.			trans	-129.3	19.2	-175.4	-74.1	163.4	0	0	0	112.3	C61 F66 I69 I72 L82 N87 M89 N107 L108 N111	C61-L84 HydrophobicContact CB-CD2 3.36Å; C61-L84 HydrophobicContact CB-CG 4.21Å; F66-L84 HydrophobicContact CD2-CD2 4.17Å; I69-L84 HydrophobicContact CD1-CD1 3.36Å; I72-L84 HydrophobicContact CD1-CD1 4.38Å; I72-L84 HydrophobicContact CD1-CD2 3.44Å; I72-L84 VanDerWaalsContact CD1-CD2 3.44Å; L82-L84 HydrophobicContact CD1-CD1 4.23Å; L82-L84 HydrophobicContact CD1-CG 4.13Å; L82-L84 HydrophobicContact CD2-CD1 3.72Å; L82-L84 HydrophobicContact CD2-CG 4.49Å; L82-L84 HydrophobicContact CG-CD1 3.72Å; L82-L84 HydrophobicContact CG-CG 3.99Å; L84-N87 PolarHBondContact O-ND2 3.21Å; L84-M89 HydrophobicContact CB-CE 3.82Å; L84-M89 HydrophobicContact CD1-CE 4.14Å; L84-M89 HydrophobicContact CD2-CE 3.97Å; L84-M89 HydrophobicContact CG-CE 4.21Å; L84-N107 CarbonylContact C-O 3.6Å; L84-N107 WeakPolarHBondContact CA-O 3.48Å; L84-N107 VanDerWaalsContact CB-O 3.3Å; L84-N107 WeakPolarHBondContact CB-O 3.3Å; L84-N107 PolarHBondContact N-O 3.04Å; L84-L108 HydrophobicContact CB-CD2 3.96Å; L84-L108 HydrophobicContact CD1-CD2 4.01Å; L84-N111 PolarHBondContact O-ND2 3.17Å
85	Q	88.2	Confident	86.5	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.019	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	154.8	177.5	65.8	-79.8	-9.1	0	0	112.9	D62 S63 N87 N107 G109	D62-Q85 VanDerWaalsContact CA-O 3.26Å; D62-Q85 WeakPolarHBondContact CA-O 3.39Å; D62-Q85 VanDerWaalsContact CB-CD 3.48Å; D62-Q85 HydrophobicContact CB-CG 3.8Å; D62-Q85 VanDerWaalsContact CB-O 3.27Å; D62-Q85 WeakPolarHBondContact CB-O 3.18Å; D62-Q85 PolarHBondContact OD2-NE2 3.48Å; D62-Q85 VanDerWaalsContact OD2-NE2 3.12Å; S63-Q85 PolarHBondContact N-O 3.03Å; Q85-N87 PolarHBondContact O-N 3.08Å; Q85-N87 PolarHBondContact O-ND2 2.87Å; Q85-N107 PolarHBondContact OE1-ND2 3Å; Q85-N107 VanDerWaalsContact OE1-ND2 3.12Å; Q85-G109 WeakPolarHBondContact CA-O 3.3Å; Q85-G109 WeakPolarHBondContact CB-O 3.48Å
86	R	86.1	Confident	87.2	Confident	43 Å²	43	41.3 Å²	41.3	16%	0.162	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	22.9	177.8	-103.1	176	-69	146.3	-11.2	116.7	S63 G109 N110 D588 D601	S63-R86 PolarHBondContact OG-NH1 3.1Å; R86-G109 PolarHBondContact N-O 3.17Å; R86-N110 WeakPolarHBondContact CA-O 3.42Å; R86-N110 HydrophobicContact CG-CB 4.44Å; R86-N110 PolarHBondContact N-O 3.14Å; R86-D588 VanDerWaalsContact CD-OD1 3.22Å; R86-D588 WeakPolarHBondContact CD-OD1 3.27Å; R86-D588 IonicContact CZ-OD1 3.68Å; R86-D588 IonicContact CZ-OD2 3.44Å; R86-D588 IonicContact NE-OD1 2.78Å; R86-D588 PolarHBondContact NE-OD1 3.47Å; R86-D588 IonicContact NE-OD2 3.31Å; R86-D588 PolarHBondContact NE-OD2 2.81Å; R86-D588 VanDerWaalsContact NH2-CG 3.26Å; R86-D588 IonicContact NH2-OD2 3.58Å; R86-D588 PolarHBondContact NH2-OD2 3.48Å; R86-D601 IonicContact CZ-OD2 2.73Å; R86-D601 VanDerWaalsContact CZ-OD2 3.29Å; R86-D601 VanDerWaalsContact NH1-CB 3.28Å; R86-D601 IonicContact NH1-OD2 2.68Å; R86-D601 PolarHBondContact NH1-OD2 2.83Å; R86-D601 IonicContact NH2-OD2 3.48Å; R86-D601 PolarHBondContact NH2-OD2 2.03Å
87	N	90.2	Very high	87.8	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.032	20%	0.202	C	C	.	.	S	Bend	trans	-89.3	-175.9	166.8	-71.4	-67.9	0	0	0	110.4	C61 K64 G65 F66 L84 Q85 M89 N111	C61-N87 PolarHBondContact O-ND2 3.05Å; K64-N87 PolarHBondContact N-OD1 3.46Å; G65-N87 PolarHBondContact N-OD1 2.83Å; F66-N87 HydrophobicContact CB-CB 4.09Å; F66-N87 WeakPolarHBondContact CD2-OD1 3.26Å; F66-N87 PolarHBondContact N-OD1 2.73Å; F66-N87 WeakPolarHBondContact O-CB 3.29Å; L84-N87 PolarHBondContact O-ND2 3.21Å; Q85-N87 PolarHBondContact O-N 3.08Å; Q85-N87 PolarHBondContact O-ND2 2.87Å; N87-M89 HydrophobicContact CB-CE 3.94Å; N87-N111 VanDerWaalsContact C-OD1 3.23Å; N87-N111 WeakPolarHBondContact CA-OD1 3.33Å; N87-N111 WeakPolarHBondContact CB-OD1 3.38Å; N87-N111 WeakPolarHBondContact O-CA 3.03Å; N87-N111 PolarHBondContact O-OD1 2.92Å
88	S	90.5	Very high	88.1	Confident	59 Å²	59	42.5 Å²	42.5	41%	0.413	20%	0.203	S	C	.	.			trans	-111.6	33.8	-177.4	-77.2	0	0	0	0	112.5	F66 R90	F66-S88 CarbonylContact O-C 3.55Å; F66-S88 WeakPolarHBondContact O-CA 3.3Å; F66-S88 PolarHBondContact O-N 3.31Å; S88-R90 VanDerWaalsContact C-N 3.3Å; S88-R90 PolarHBondContact O-N 2.95Å
89	M	89.8	Confident	88.2	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	21%	0.213	C	C	.	.			trans	-74.9	78.9	-179.9	-74.8	-177.9	-86.8	0	0	112	F66 I69 L84 N87 K91 L108 N111 L113	F66-M89 HydrophobicContact CB-CE 4.44Å; F66-M89 PolarHBondContact O-N 2.79Å; I69-M89 HydrophobicContact CB-SD 4.44Å; I69-M89 HydrophobicContact CD1-SD 4.46Å; L84-M89 HydrophobicContact CB-CE 3.82Å; L84-M89 HydrophobicContact CD1-CE 4.14Å; L84-M89 HydrophobicContact CD2-CE 3.97Å; L84-M89 HydrophobicContact CG-CE 4.21Å; N87-M89 HydrophobicContact CB-CE 3.94Å; M89-K91 VanDerWaalsContact C-N 3.27Å; M89-K91 PolarHBondContact O-N 2.88Å; M89-L108 HydrophobicContact CE-CD2 3.87Å; M89-L108 HydrophobicContact SD-CD2 4.34Å; M89-N111 PolarHBondContact N-OD1 3.24Å; M89-L113 WeakPolarHBondContact O-CA 3.31Å; M89-L113 WeakPolarHBondContact O-CB 3.3Å; M89-L113 VanDerWaalsContact O-CD1 3.26Å; M89-L113 WeakPolarHBondContact O-CD1 3.31Å
90	R	90.3	Very high	88.2	Confident	165 Å²	165	41.2 Å²	41.2	62%	0.623	20%	0.196	S	C	*	.			trans	-65.9	-24	-178.9	-63.6	-178.1	-173.3	-174.3	2.7	114.1	S88 Q114	S88-R90 VanDerWaalsContact C-N 3.3Å; S88-R90 PolarHBondContact O-N 2.95Å; R90-Q114 PolarHBondContact O-N 2.89Å
91	K	91.5	Very high	88.2	Confident	82 Å²	82	44 Å²	44	36%	0.357	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	147.9	177.9	-64.8	-158.1	171.7	-146.7	0	111.5	M89 D115	M89-K91 VanDerWaalsContact C-N 3.27Å; M89-K91 PolarHBondContact O-N 2.88Å; K91-D115 WeakPolarHBondContact CA-O 3.43Å; K91-D115 HydrophobicContact CD-CB 4.14Å; K91-D115 HydrophobicContact CG-CB 4.16Å; K91-D115 IonicContact NZ-OD2 3.19Å; K91-D115 PolarHBondContact NZ-OD2 2.84Å
92	L	92.5	Very high	88.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132	168.4	-60.9	175.2	0	0	0	109.8	F97 L108 L113 D115 I116 Q117 A120 F121	L92-F97 HydrophobicContact CD1-CE2 4.02Å; L92-F97 HydrophobicContact CD1-CZ 4.31Å; L92-F97 HydrophobicContact CD2-CE2 3.97Å; L92-F97 HydrophobicContact CD2-CZ 4.07Å; L92-F97 HydrophobicContact CG-CE2 4.44Å; L92-L108 HydrophobicContact CD1-CD1 4.14Å; L92-L113 HydrophobicContact CD1-CD1 4.42Å; L92-L113 HydrophobicContact CD1-CD2 3.86Å; L92-L113 HydrophobicContact CG-CD1 3.85Å; L92-L113 HydrophobicContact CG-CD2 4.19Å; L92-D115 PolarHBondContact N-O 2.84Å; L92-D115 VanDerWaalsContact N-O 3.11Å; L92-I116 HydrophobicContact CB-CG2 4.4Å; L92-I116 HydrophobicContact CD1-CD1 4.5Å; L92-I116 HydrophobicContact CD1-CG1 4.26Å; L92-Q117 WeakPolarHBondContact O-CB 3.45Å; L92-Q117 WeakPolarHBondContact O-CG 3.49Å; L92-Q117 PolarHBondContact O-N 2.82Å; L92-A120 HydrophobicContact CB-CB 4.03Å; L92-F121 HydrophobicContact CD1-CE1 3.99Å; L92-F121 HydrophobicContact CD1-CZ 3.99Å
93	Y	90.4	Very high	88.3	Confident	109 Å²	109	44.1 Å²	44.1	43%	0.427	21%	0.213	S	C	.	.			trans	-96.9	158.8	-175	-61.7	-81.5	0	0	0	111.8	N95 S96 Q117 A120	Y93-N95 PolarHBondContact O-N 3.13Å; Y93-S96 PolarHBondContact N-OG 2.85Å; Y93-S96 VanDerWaalsContact N-OG 3.12Å; Y93-S96 WeakPolarHBondContact O-CB 3.31Å; Y93-S96 PolarHBondContact O-N 2.79Å; Y93-S96 VanDerWaalsContact O-N 3.13Å; Y93-S96 PolarHBondContact O-OG 2.91Å; Y93-Q117 VanDerWaalsContact CA-OE1 3.29Å; Y93-A120 WeakPolarHBondContact O-CA 3.36Å; Y93-A120 VanDerWaalsContact O-CB 3.24Å; Y93-A120 WeakPolarHBondContact O-CB 2.99Å
94	T	89.3	Confident	88.3	Confident	64 Å²	64	45.5 Å²	45.5	39%	0.393	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	137.7	176	-60.1	0	0	0	0	111.6	S96 Q117 T118	T94-S96 PolarHBondContact O-N 2.04Å; T94-Q117 VanDerWaalsContact N-OE1 3.11Å; T94-T118 WeakPolarHBondContact CG2-O 3.21Å; T94-T118 PolarHBondContact OG1-O 3.4Å
95	N	87.3	Confident	88.4	Confident	77 Å²	77	45.7 Å²	45.7	41%	0.412	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	14.5	-175.6	-55	-26.5	0	0	0	115.6	Y93 F97 L98 G119 N122	Y93-N95 PolarHBondContact O-N 3.13Å; N95-F97 PolarHBondContact O-N 2.91Å; N95-F97 VanDerWaalsContact O-N 3.07Å; N95-L98 WeakPolarHBondContact O-CB 3.46Å; N95-L98 PolarHBondContact O-N 3.06Å; N95-L98 VanDerWaalsContact O-N 3.12Å; N95-G119 PolarHBondContact N-O 3.07Å; N95-N122 WeakPolarHBondContact OD1-CB 3.43Å; N95-N122 PolarHBondContact OD1-ND2 3.23Å
96	S	84.4	Confident	88.6	Confident	16 Å²	16	45.5 Å²	45.5	11%	0.112	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.7	-40.4	175.9	-99.8	0	0	0	0	114	I69 Y93 T94 A120	I69-S96 VanDerWaalsContact CG2-CB 3.47Å; I69-S96 WeakPolarHBondContact CG2-O 3.41Å; Y93-S96 PolarHBondContact N-OG 2.85Å; Y93-S96 VanDerWaalsContact N-OG 3.12Å; Y93-S96 WeakPolarHBondContact O-CB 3.31Å; Y93-S96 PolarHBondContact O-N 2.79Å; Y93-S96 VanDerWaalsContact O-N 3.13Å; Y93-S96 PolarHBondContact O-OG 2.91Å; T94-S96 PolarHBondContact O-N 2.04Å; S96-A120 PolarHBondContact N-O 2.99Å
97	F	88.3	Confident	88.9	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	18.4	-173.3	-65	-99.6	0	0	0	114.3	I69 L92 N95 H99 L100 I106 L108 A120 F121 L124	I69-F97 HydrophobicContact CB-CZ 4.43Å; I69-F97 HydrophobicContact CD1-CD1 4.37Å; I69-F97 HydrophobicContact CD1-CE1 3.66Å; I69-F97 HydrophobicContact CD1-CZ 4.05Å; I69-F97 HydrophobicContact CG1-CD1 4.2Å; I69-F97 HydrophobicContact CG1-CE1 3.85Å; I69-F97 HydrophobicContact CG1-CZ 4.12Å; L92-F97 HydrophobicContact CD1-CE2 4.02Å; L92-F97 HydrophobicContact CD1-CZ 4.31Å; L92-F97 HydrophobicContact CD2-CE2 3.97Å; L92-F97 HydrophobicContact CD2-CZ 4.07Å; L92-F97 HydrophobicContact CG-CE2 4.44Å; N95-F97 PolarHBondContact O-N 2.91Å; N95-F97 VanDerWaalsContact O-N 3.07Å; F97-H99 VanDerWaalsContact C-N 3.28Å; F97-H99 PolarHBondContact O-N 3.09Å; F97-L100 HydrophobicContact CB-CD1 4.48Å; F97-L100 HydrophobicContact CD1-CD1 3.6Å; F97-L100 HydrophobicContact CE1-CD1 4.26Å; F97-L100 HydrophobicContact CG-CD1 4.39Å; F97-L100 PolarHBondContact O-N 2.99Å; F97-I106 HydrophobicContact CD1-CD1 3.84Å; F97-I106 HydrophobicContact CE1-CD1 4.09Å; F97-I106 HydrophobicContact CE1-CG2 4.36Å; F97-L108 HydrophobicContact CE1-CD1 4.36Å; F97-L108 HydrophobicContact CZ-CD1 3.85Å; F97-L108 HydrophobicContact CZ-CD2 4.49Å; F97-A120 WeakPolarHBondContact CD2-O 3.25Å; F97-A120 PolarHBondContact N-O 3.24Å; F97-F121 AromaticContact CD2-CD1 3.98Å; F97-F121 HydrophobicContact CD2-CD1 3.98Å; F97-F121 HydrophobicContact CD2-CE1 4.45Å; F97-F121 HydrophobicContact CE2-CD1 4.04Å; F97-F121 HydrophobicContact CE2-CE1 4.03Å; F97-F121 HydrophobicContact CZ-CE1 4.4Å; F97-L124 HydrophobicContact CB-CD1 3.59Å; F97-L124 HydrophobicContact CB-CD2 3.94Å; F97-L124 HydrophobicContact CB-CG 3.67Å; F97-L124 HydrophobicContact CD1-CD1 3.95Å; F97-L124 HydrophobicContact CD2-CD1 4.45Å; F97-L124 HydrophobicContact CG-CD1 3.75Å; F97-L124 HydrophobicContact CG-CG 4.37Å
98	L	84.9	Confident	89.1	Confident	94 Å²	94	43.8 Å²	43.8	49%	0.492	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-35.3	-172.1	-173.2	65.4	0	0	0	114.1	N95 L100	N95-L98 WeakPolarHBondContact O-CB 3.46Å; N95-L98 PolarHBondContact O-N 3.06Å; N95-L98 VanDerWaalsContact O-N 3.12Å; L98-L100 VanDerWaalsContact C-N 3.31Å
99	H	82	Confident	89.1	Confident	108 Å²	108	41 Å²	41	50%	0.5	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-16.4	179.1	-57.7	-83.1	0	0	0	113.1	F97 N101	F97-H99 VanDerWaalsContact C-N 3.28Å; F97-H99 PolarHBondContact O-N 3.09Å; H99-N101 VanDerWaalsContact C-N 3.3Å; H99-N101 PolarHBondContact O-N 3.44Å
100	L	84.8	Confident	89.1	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	21%	0.209	C	C	.	.			trans	-96.7	30.2	-169.5	-57.8	175.6	0	0	0	112.2	I69 W76 F80 L82 F97 L98 N102 A103 L124	I69-L100 HydrophobicContact CD1-CD1 4.13Å; I69-L100 HydrophobicContact CG1-CD1 3.88Å; W76-L100 HydrophobicContact CE3-CD2 3.98Å; W76-L100 HydrophobicContact CZ3-CD2 3.57Å; F80-L100 HydrophobicContact CE2-CD2 4.39Å; F80-L100 HydrophobicContact CZ-CB 3.98Å; F80-L100 HydrophobicContact CZ-CD2 3.85Å; L82-L100 HydrophobicContact CD2-CD1 3.92Å; F97-L100 HydrophobicContact CB-CD1 4.48Å; F97-L100 HydrophobicContact CD1-CD1 3.6Å; F97-L100 HydrophobicContact CE1-CD1 4.26Å; F97-L100 HydrophobicContact CG-CD1 4.39Å; F97-L100 PolarHBondContact O-N 2.99Å; L98-L100 VanDerWaalsContact C-N 3.31Å; L100-N102 PolarHBondContact O-N 3.09Å; L100-N102 VanDerWaalsContact O-N 3.09Å; L100-A103 VanDerWaalsContact O-CB 3.25Å; L100-A103 WeakPolarHBondContact O-CB 3.43Å; L100-A103 PolarHBondContact O-N 2.75Å; L100-L124 HydrophobicContact CB-CD2 4.09Å; L100-L124 WeakPolarHBondContact O-CD2 3.22Å
101	N	86.6	Confident	89.2	Confident	58 Å²	58	35.6 Å²	35.6	31%	0.31	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.1	-172.2	65.3	-12.3	0	0	0	114.9	H99	H99-N101 VanDerWaalsContact C-N 3.3Å; H99-N101 PolarHBondContact O-N 3.44Å
102	N	88.5	Confident	89.1	Confident	37 Å²	37	33.1 Å²	33.1	20%	0.198	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	5.9	179.4	-72.7	-32.1	0	0	0	114.2	W76 S77 P79 F80 L100 V104	W76-N102 PolarHBondContact O-ND2 2.56Å; S77-N102 PolarHBondContact O-ND2 2.76Å; P79-N102 WeakPolarHBondContact CA-O 3.25Å; F80-N102 HydrophobicContact CD1-CB 3.98Å; F80-N102 HydrophobicContact CE1-CB 3.87Å; F80-N102 PolarHBondContact N-O 3.49Å; F80-N102 VanDerWaalsContact N-O 3.1Å; L100-N102 PolarHBondContact O-N 3.09Å; L100-N102 VanDerWaalsContact O-N 3.09Å; N102-V104 PolarHBondContact O-N 2.78Å
103	A	89.4	Confident	89.2	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	124.2	176.1	0	0	0	0	0	111.7	F80 L100 I106 L124 L127	F80-A103 HydrophobicContact CD2-CB 4.13Å; F80-A103 HydrophobicContact CE1-CB 4.32Å; F80-A103 HydrophobicContact CE2-CB 3.52Å; F80-A103 HydrophobicContact CZ-CB 3.64Å; L100-A103 VanDerWaalsContact O-CB 3.25Å; L100-A103 WeakPolarHBondContact O-CB 3.43Å; L100-A103 PolarHBondContact O-N 2.75Å; A103-I106 HydrophobicContact CB-CD1 3.82Å; A103-I106 HydrophobicContact CB-CG1 3.97Å; A103-L124 HydrophobicContact CB-CD2 3.98Å; A103-L127 HydrophobicContact CB-CD1 3.99Å; A103-L127 VanDerWaalsContact O-CA 3.32Å; A103-L127 WeakPolarHBondContact O-CA 3.45Å; A103-L127 WeakPolarHBondContact O-CD1 3.06Å; A103-L127 PolarHBondContact O-N 2.91Å
104	V	89.6	Confident	89.3	Confident	31 Å²	31	32.8 Å²	32.8	19%	0.188	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-28.7	175.6	-177.4	0	0	0	0	111.4	L56 P79 F80 N102 I126 K128 R129	L56-V104 HydrophobicContact CD1-CG2 4.28Å; P79-V104 HydrophobicContact CB-CG2 3.86Å; F80-V104 PolarHBondContact O-N 2.84Å; N102-V104 PolarHBondContact O-N 2.78Å; V104-I126 HydrophobicContact CG2-CD1 4.27Å; V104-K128 HydrophobicContact CG1-CB 4.39Å; V104-K128 HydrophobicContact CG1-CD 4.08Å; V104-K128 HydrophobicContact CG1-CG 4.43Å; V104-K128 PolarHBondContact O-N 3.01Å; V104-R129 PolarHBondContact O-N 2.83Å
105	S	92	Very high	89.3	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	134.1	177.9	-170.8	0	0	0	0	110.5	K81 L82 R129	K81-S105 CarbonylContact C-O 3.51Å; K81-S105 WeakPolarHBondContact CA-O 3.34Å; L82-S105 PolarHBondContact N-O 2.87Å; S105-R129 WeakPolarHBondContact CA-O 3.37Å
106	I	92.8	Very high	89.6	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	124.4	176.1	-72.1	170.5	0	0	0	109	L82 F97 A103 L108 L124 L127 R129 L130 Y131	L82-I106 HydrophobicContact CB-CG1 4.33Å; L82-I106 WeakPolarHBondContact O-CA 3.19Å; F97-I106 HydrophobicContact CD1-CD1 3.84Å; F97-I106 HydrophobicContact CE1-CD1 4.09Å; F97-I106 HydrophobicContact CE1-CG2 4.36Å; A103-I106 HydrophobicContact CB-CD1 3.82Å; A103-I106 HydrophobicContact CB-CG1 3.97Å; I106-L108 HydrophobicContact CG2-CD1 3.68Å; I106-L108 HydrophobicContact CG2-CG 3.74Å; I106-L124 HydrophobicContact CD1-CD1 3.69Å; I106-L124 HydrophobicContact CD1-CD2 3.75Å; I106-L124 HydrophobicContact CD1-CG 4.4Å; I106-L127 HydrophobicContact CB-CD1 4.09Å; I106-L127 HydrophobicContact CD1-CD1 3.79Å; I106-L127 HydrophobicContact CD1-CD2 4.42Å; I106-L127 HydrophobicContact CG1-CD1 3.68Å; I106-R129 PolarHBondContact N-O 2.77Å; I106-L130 HydrophobicContact CB-CD1 4.33Å; I106-L130 HydrophobicContact CG2-CD1 4.19Å; I106-Y131 PolarHBondContact O-N 2.86Å; I106-Y131 VanDerWaalsContact O-N 3.1Å
107	N	92.2	Very high	90	Very high	13 Å²	13	30.5 Å²	30.5	7%	0.07	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.1	170.8	-171.6	3.5	0	0	0	111.4	L82 Y83 L84 Q85 G109 Y131	L82-N107 PolarHBondContact O-N 2.93Å; Y83-N107 HydrophobicContact CD1-CB 4.39Å; L84-N107 CarbonylContact C-O 3.6Å; L84-N107 WeakPolarHBondContact CA-O 3.48Å; L84-N107 VanDerWaalsContact CB-O 3.3Å; L84-N107 WeakPolarHBondContact CB-O 3.3Å; L84-N107 PolarHBondContact N-O 3.04Å; Q85-N107 PolarHBondContact OE1-ND2 3Å; Q85-N107 VanDerWaalsContact OE1-ND2 3.12Å; N107-G109 PolarHBondContact OD1-N 3.46Å; N107-Y131 HydrophobicContact CB-CD2 4.31Å; N107-Y131 VanDerWaalsContact OD1-CB 3.31Å; N107-Y131 WeakPolarHBondContact OD1-CB 3.49Å
108	L	93.3	Very high	89.9	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.18	C	C	.	.			trans	-120.3	22	176.7	-69.8	159.3	0	0	0	111.3	L84 M89 L92 F97 I106 N111 F121 L130 Y131 L132 N135	L84-L108 HydrophobicContact CB-CD2 3.96Å; L84-L108 HydrophobicContact CD1-CD2 4.01Å; M89-L108 HydrophobicContact CE-CD2 3.87Å; M89-L108 HydrophobicContact SD-CD2 4.34Å; L92-L108 HydrophobicContact CD1-CD1 4.14Å; F97-L108 HydrophobicContact CE1-CD1 4.36Å; F97-L108 HydrophobicContact CZ-CD1 3.85Å; F97-L108 HydrophobicContact CZ-CD2 4.49Å; I106-L108 HydrophobicContact CG2-CD1 3.68Å; I106-L108 HydrophobicContact CG2-CG 3.74Å; L108-N111 PolarHBondContact O-ND2 3.25Å; L108-N111 VanDerWaalsContact O-ND2 3.16Å; L108-F121 HydrophobicContact CD1-CE1 4.31Å; L108-L130 HydrophobicContact CD1-CD1 4.26Å; L108-Y131 CarbonylContact C-O 3.49Å; L108-Y131 WeakPolarHBondContact CA-O 3.33Å; L108-Y131 PolarHBondContact N-O 3.36Å; L108-L132 HydrophobicContact CB-CD2 4.02Å; L108-L132 HydrophobicContact CD1-CD2 4.31Å; L108-N135 PolarHBondContact O-ND2 2.64Å
109	G	91.1	Very high	90	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.157	C	C	.	.			trans	-61.1	157.4	177.4	0	0	0	0	0	113.6	Q85 R86 N107 N111 H133	Q85-G109 WeakPolarHBondContact CA-O 3.3Å; Q85-G109 WeakPolarHBondContact CB-O 3.48Å; R86-G109 PolarHBondContact N-O 3.17Å; N107-G109 PolarHBondContact OD1-N 3.46Å; G109-N111 VanDerWaalsContact C-N 3.31Å; G109-N111 PolarHBondContact O-N 2.84Å; G109-N111 VanDerWaalsContact O-N 3.16Å; G109-N111 PolarHBondContact O-ND2 2.99Å; G109-H133 CarbonylContact C-O 3.56Å; G109-H133 WeakPolarHBondContact CA-O 2.99Å
110	N	89.9	Confident	90.5	Very high	51 Å²	51	24.3 Å²	24.3	27%	0.273	13%	0.133	S	C	.	.	S	Bend	trans	44	49.3	178.3	-163.4	4.3	0	0	0	114.1	R86 H133 E134 D588	R86-N110 WeakPolarHBondContact CA-O 3.42Å; R86-N110 HydrophobicContact CG-CB 4.44Å; R86-N110 PolarHBondContact N-O 3.14Å; N110-H133 PolarHBondContact N-O 2.84Å; N110-E134 WeakPolarHBondContact CA-O 3.37Å; N110-E134 HydrophobicContact CB-CB 4.16Å; N110-D588 PolarHBondContact ND2-OD1 3.15Å
111	N	91.3	Very high	90.9	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.011	13%	0.132	C	C	.	.	S	Bend	trans	-107	-1.5	180	-97.2	-88.9	0	0	0	113.7	L84 N87 M89 L108 G109 L113 N135	L84-N111 PolarHBondContact O-ND2 3.17Å; N87-N111 VanDerWaalsContact C-OD1 3.23Å; N87-N111 WeakPolarHBondContact CA-OD1 3.33Å; N87-N111 WeakPolarHBondContact CB-OD1 3.38Å; N87-N111 WeakPolarHBondContact O-CA 3.03Å; N87-N111 PolarHBondContact O-OD1 2.92Å; M89-N111 PolarHBondContact N-OD1 3.24Å; L108-N111 PolarHBondContact O-ND2 3.25Å; L108-N111 VanDerWaalsContact O-ND2 3.16Å; G109-N111 VanDerWaalsContact C-N 3.31Å; G109-N111 PolarHBondContact O-N 2.84Å; G109-N111 VanDerWaalsContact O-N 3.16Å; G109-N111 PolarHBondContact O-ND2 2.99Å; N111-L113 HydrophobicContact CB-CB 4.34Å; N111-L113 PolarHBondContact O-N 3.23Å; N111-L113 VanDerWaalsContact O-N 3.17Å; N111-N135 WeakPolarHBondContact CA-OD1 3.03Å; N111-N135 WeakPolarHBondContact CB-OD1 3.27Å; N111-N135 PolarHBondContact N-OD1 3.47Å
112	A	91.4	Very high	91.1	Very high	30 Å²	30	23.4 Å²	23.4	25%	0.248	13%	0.128	C	C	.	.			trans	51.1	29	-166.1	0	0	0	0	0	113.8	Q114 N135 K136	A112-Q114 PolarHBondContact O-N 3.25Å; A112-N135 PolarHBondContact N-OD1 2.79Å; A112-N135 VanDerWaalsContact N-OD1 3.12Å; A112-K136 HydrophobicContact CB-CD 4.12Å
113	L	94.3	Very high	90.8	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.01	13%	0.129	C	C	.	.			trans	-62.4	124.5	179.8	176	62.2	0	0	0	110.6	M89 L92 N111 I116 L132 N135 K136 L137	M89-L113 WeakPolarHBondContact O-CA 3.31Å; M89-L113 WeakPolarHBondContact O-CB 3.3Å; M89-L113 VanDerWaalsContact O-CD1 3.26Å; M89-L113 WeakPolarHBondContact O-CD1 3.31Å; L92-L113 HydrophobicContact CD1-CD1 4.42Å; L92-L113 HydrophobicContact CD1-CD2 3.86Å; L92-L113 HydrophobicContact CG-CD1 3.85Å; L92-L113 HydrophobicContact CG-CD2 4.19Å; N111-L113 HydrophobicContact CB-CB 4.34Å; N111-L113 PolarHBondContact O-N 3.23Å; N111-L113 VanDerWaalsContact O-N 3.17Å; L113-I116 HydrophobicContact CD1-CG1 4.43Å; L113-I116 HydrophobicContact CD2-CD1 4Å; L113-I116 HydrophobicContact CD2-CG1 3.97Å; L113-I116 HydrophobicContact CG-CG1 4.35Å; L113-L132 HydrophobicContact CD2-CD2 4.1Å; L113-N135 HydrophobicContact CB-CB 4.16Å; L113-N135 VanDerWaalsContact CB-OD1 3.3Å; L113-N135 WeakPolarHBondContact CB-OD1 3.38Å; L113-N135 PolarHBondContact N-OD1 3.23Å; L113-K136 CarbonylContact O-C 3.23Å; L113-K136 VanDerWaalsContact O-CA 3.28Å; L113-K136 WeakPolarHBondContact O-CA 3.48Å; L113-K136 PolarHBondContact O-N 3.35Å; L113-L137 HydrophobicContact CD2-CD2 4.14Å; L113-L137 HydrophobicContact CG-CD2 3.83Å; L113-L137 PolarHBondContact O-N 3.33Å
114	Q	92.1	Very high	90.9	Very high	100 Å²	100	22.7 Å²	22.7	47%	0.467	13%	0.129	S	C	.	.			trans	-104.8	-35.8	-175.5	-65.8	174.6	10.7	0	0	113.1	R90 A112 K136	R90-Q114 PolarHBondContact O-N 2.89Å; A112-Q114 PolarHBondContact O-N 3.25Å; Q114-K136 HydrophobicContact CG-CB 3.94Å
115	D	89.6	Confident	90.9	Very high	32 Å²	32	27.2 Å²	27.2	17%	0.171	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	130.5	-166.6	-173.8	29.1	0	0	0	111	K91 L92 R141	K91-D115 WeakPolarHBondContact CA-O 3.43Å; K91-D115 HydrophobicContact CD-CB 4.14Å; K91-D115 HydrophobicContact CG-CB 4.16Å; K91-D115 IonicContact NZ-OD2 3.19Å; K91-D115 PolarHBondContact NZ-OD2 2.84Å; L92-D115 PolarHBondContact N-O 2.84Å; L92-D115 VanDerWaalsContact N-O 3.11Å; D115-R141 IonicContact OD1-CZ 2.73Å; D115-R141 VanDerWaalsContact OD1-CZ 3.31Å; D115-R141 IonicContact OD1-NH1 2.78Å; D115-R141 PolarHBondContact OD1-NH1 2.77Å; D115-R141 IonicContact OD1-NH2 2.85Å; D115-R141 PolarHBondContact OD1-NH2 3.4Å
116	I	93.7	Very high	90.8	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.026	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115	178.1	-57.3	176.7	0	0	0	107.3	L92 L113 A120 F121 L132 L137 R141 T144	L92-I116 HydrophobicContact CB-CG2 4.4Å; L92-I116 HydrophobicContact CD1-CD1 4.5Å; L92-I116 HydrophobicContact CD1-CG1 4.26Å; L113-I116 HydrophobicContact CD1-CG1 4.43Å; L113-I116 HydrophobicContact CD2-CD1 4Å; L113-I116 HydrophobicContact CD2-CG1 3.97Å; L113-I116 HydrophobicContact CG-CG1 4.35Å; I116-A120 HydrophobicContact CG2-CB 3.89Å; I116-F121 HydrophobicContact CD1-CE2 4.3Å; I116-F121 HydrophobicContact CD1-CZ 4.19Å; I116-F121 HydrophobicContact CG2-CE2 3.88Å; I116-F121 HydrophobicContact CG2-CZ 4.27Å; I116-L132 HydrophobicContact CD1-CD1 4.37Å; I116-L137 HydrophobicContact CD1-CD1 4.13Å; I116-L137 HydrophobicContact CD1-CD2 3.82Å; I116-L137 HydrophobicContact CG1-CD2 3.8Å; I116-R141 PolarHBondContact O-NH1 3.23Å; I116-R141 VanDerWaalsContact O-NH1 3.15Å; I116-T144 HydrophobicContact CB-CG2 4.17Å; I116-T144 HydrophobicContact CD1-CG2 4.31Å; I116-T144 HydrophobicContact CG2-CG2 4.09Å
117	Q	91.1	Very high	90.8	Very high	71 Å²	71	30.5 Å²	30.5	33%	0.332	16%	0.163	S	C	.	.			trans	-68.4	148.9	175.9	-68	-171.7	-18.7	0	0	111.3	L92 Y93 T94 G119 A120	L92-Q117 WeakPolarHBondContact O-CB 3.45Å; L92-Q117 WeakPolarHBondContact O-CG 3.49Å; L92-Q117 PolarHBondContact O-N 2.82Å; Y93-Q117 VanDerWaalsContact CA-OE1 3.29Å; T94-Q117 VanDerWaalsContact N-OE1 3.11Å; Q117-G119 PolarHBondContact O-N 2.02Å; Q117-A120 VanDerWaalsContact O-CB 3.3Å; Q117-A120 WeakPolarHBondContact O-CB 3.39Å; Q117-A120 PolarHBondContact O-N 3.5Å
118	T	87.6	Confident	90.7	Very high	72 Å²	72	33.8 Å²	33.8	44%	0.442	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	129.6	178.1	47.5	0	0	0	0	110.8	T94 A120 D143	T94-T118 WeakPolarHBondContact CG2-O 3.21Å; T94-T118 PolarHBondContact OG1-O 3.4Å; T118-A120 VanDerWaalsContact C-N 3.33Å; T118-D143 HydrophobicContact CG2-CB 3.98Å
119	G	87.4	Confident	90.6	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.01	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	21.2	-176.2	0	0	0	0	0	115	N95 Q117 F121 N122 D143	N95-G119 PolarHBondContact N-O 3.07Å; Q117-G119 PolarHBondContact O-N 2.02Å; G119-F121 VanDerWaalsContact C-N 3.27Å; G119-F121 PolarHBondContact O-N 3.41Å; G119-N122 VanDerWaalsContact O-CB 3.3Å; G119-N122 WeakPolarHBondContact O-CB 3.4Å; G119-N122 PolarHBondContact O-N 3.28Å; G119-N122 PolarHBondContact O-ND2 3Å; G119-D143 PolarHBondContact N-O 3.01Å
120	A	91.6	Very high	90.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-42.6	172.1	0	0	0	0	0	112.2	L92 Y93 S96 F97 I116 Q117 T118 N122	L92-A120 HydrophobicContact CB-CB 4.03Å; Y93-A120 WeakPolarHBondContact O-CA 3.36Å; Y93-A120 VanDerWaalsContact O-CB 3.24Å; Y93-A120 WeakPolarHBondContact O-CB 2.99Å; S96-A120 PolarHBondContact N-O 2.99Å; F97-A120 WeakPolarHBondContact CD2-O 3.25Å; F97-A120 PolarHBondContact N-O 3.24Å; I116-A120 HydrophobicContact CG2-CB 3.89Å; Q117-A120 VanDerWaalsContact O-CB 3.3Å; Q117-A120 WeakPolarHBondContact O-CB 3.39Å; Q117-A120 PolarHBondContact O-N 3.5Å; T118-A120 VanDerWaalsContact C-N 3.33Å; A120-N122 PolarHBondContact O-N 3.06Å
121	F	93.3	Very high	90.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	13	179.6	-56.2	-61.1	0	0	0	114.5	L92 F97 L108 I116 G119 G123 L124 L130 T144 F145 L146 L148	L92-F121 HydrophobicContact CD1-CE1 3.99Å; L92-F121 HydrophobicContact CD1-CZ 3.99Å; F97-F121 AromaticContact CD2-CD1 3.98Å; F97-F121 HydrophobicContact CD2-CD1 3.98Å; F97-F121 HydrophobicContact CD2-CE1 4.45Å; F97-F121 HydrophobicContact CE2-CD1 4.04Å; F97-F121 HydrophobicContact CE2-CE1 4.03Å; F97-F121 HydrophobicContact CZ-CE1 4.4Å; L108-F121 HydrophobicContact CD1-CE1 4.31Å; I116-F121 HydrophobicContact CD1-CE2 4.3Å; I116-F121 HydrophobicContact CD1-CZ 4.19Å; I116-F121 HydrophobicContact CG2-CE2 3.88Å; I116-F121 HydrophobicContact CG2-CZ 4.27Å; G119-F121 VanDerWaalsContact C-N 3.27Å; G119-F121 PolarHBondContact O-N 3.41Å; F121-G123 PolarHBondContact O-N 3.48Å; F121-L124 HydrophobicContact CB-CD1 3.99Å; F121-L124 HydrophobicContact CD1-CD1 3.84Å; F121-L124 HydrophobicContact CG-CD1 4.37Å; F121-L124 WeakPolarHBondContact O-CB 3.49Å; F121-L124 PolarHBondContact O-N 3.12Å; F121-L130 HydrophobicContact CE1-CD1 4.37Å; F121-L130 HydrophobicContact CE1-CD2 4.22Å; F121-L130 HydrophobicContact CE2-CD2 4.21Å; F121-L130 HydrophobicContact CZ-CD2 3.95Å; F121-T144 VanDerWaalsContact CD2-O 3.29Å; F121-T144 WeakPolarHBondContact CD2-O 3.34Å; F121-F145 HydrophobicContact CD2-CD1 4.41Å; F121-F145 HydrophobicContact CE2-CD1 4.1Å; F121-F145 HydrophobicContact CE2-CE1 4.4Å; F121-L146 CarbonylContact C-O 3.36Å; F121-L148 HydrophobicContact CB-CD1 4.02Å; F121-L148 HydrophobicContact CB-CD2 3.88Å; F121-L148 HydrophobicContact CB-CG 3.75Å; F121-L148 HydrophobicContact CD2-CD1 3.81Å; F121-L148 HydrophobicContact CD2-CG 4.44Å; F121-L148 HydrophobicContact CE2-CD1 4.42Å; F121-L148 HydrophobicContact CG-CD1 3.9Å; F121-L148 HydrophobicContact CG-CD2 4.4Å; F121-L148 HydrophobicContact CG-CG 4.2Å
122	N	90.2	Very high	91.1	Very high	40 Å²	40	37.3 Å²	37.3	21%	0.214	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	131.2	174.2	-77.6	-16	0	0	0	110.8	N95 G119 A120	N95-N122 WeakPolarHBondContact OD1-CB 3.43Å; N95-N122 PolarHBondContact OD1-ND2 3.23Å; G119-N122 VanDerWaalsContact O-CB 3.3Å; G119-N122 WeakPolarHBondContact O-CB 3.4Å; G119-N122 PolarHBondContact O-N 3.28Å; G119-N122 PolarHBondContact O-ND2 3Å; A120-N122 PolarHBondContact O-N 3.06Å
123	G	83.9	Confident	91.1	Very high	22 Å²	22	36.1 Å²	36.1	23%	0.227	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	107.4	-28.8	-176	0	0	0	0	0	113.9	F121 K125	F121-G123 PolarHBondContact O-N 3.48Å; G123-K125 PolarHBondContact O-N 3.13Å
124	L	91.2	Very high	90.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.			trans	-77.5	43.7	-172.2	-64.6	178.7	0	0	0	115	F97 L100 A103 I106 F121 I126 L127 L148	F97-L124 HydrophobicContact CB-CD1 3.59Å; F97-L124 HydrophobicContact CB-CD2 3.94Å; F97-L124 HydrophobicContact CB-CG 3.67Å; F97-L124 HydrophobicContact CD1-CD1 3.95Å; F97-L124 HydrophobicContact CD2-CD1 4.45Å; F97-L124 HydrophobicContact CG-CD1 3.75Å; F97-L124 HydrophobicContact CG-CG 4.37Å; L100-L124 HydrophobicContact CB-CD2 4.09Å; L100-L124 WeakPolarHBondContact O-CD2 3.22Å; A103-L124 HydrophobicContact CB-CD2 3.98Å; I106-L124 HydrophobicContact CD1-CD1 3.69Å; I106-L124 HydrophobicContact CD1-CD2 3.75Å; I106-L124 HydrophobicContact CD1-CG 4.4Å; F121-L124 HydrophobicContact CB-CD1 3.99Å; F121-L124 HydrophobicContact CD1-CD1 3.84Å; F121-L124 HydrophobicContact CG-CD1 4.37Å; F121-L124 WeakPolarHBondContact O-CB 3.49Å; F121-L124 PolarHBondContact O-N 3.12Å; L124-I126 VanDerWaalsContact C-N 3.25Å; L124-I126 PolarHBondContact O-N 3.48Å; L124-I126 VanDerWaalsContact O-N 3.15Å; L124-L127 HydrophobicContact CB-CB 4.15Å; L124-L127 HydrophobicContact CD1-CD2 4.35Å; L124-L127 WeakPolarHBondContact O-CB 3.16Å; L124-L127 PolarHBondContact O-N 2.87Å; L124-L127 VanDerWaalsContact O-N 3.14Å; L124-L148 HydrophobicContact CB-CD2 3.66Å; L124-L148 HydrophobicContact CD1-CD2 4.1Å
125	K	88	Confident	90.9	Very high	127 Å²	127	34.2 Å²	34.2	55%	0.552	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.1	-169.5	-65.4	-168.4	175.6	-165.7	0	115.1	G123 S150	G123-K125 PolarHBondContact O-N 3.13Å; K125-S150 WeakPolarHBondContact O-CB 3.28Å; K125-S150 PolarHBondContact O-OG 2.92Å
126	I	90.6	Very high	91.2	Very high	72 Å²	72	38.4 Å²	38.4	37%	0.369	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-0.5	179.2	77	174.7	0	0	0	113.6	V104 L124 K128	V104-I126 HydrophobicContact CG2-CD1 4.27Å; L124-I126 VanDerWaalsContact C-N 3.25Å; L124-I126 PolarHBondContact O-N 3.48Å; L124-I126 VanDerWaalsContact O-N 3.15Å; I126-K128 PolarHBondContact O-N 2.7Å
127	L	94.1	Very high	91.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.183	C	C	.	.			trans	-62	122.9	-177.6	-166.9	80.9	0	0	0	110.3	A103 I106 L124 L130 L148 S150 L151	A103-L127 HydrophobicContact CB-CD1 3.99Å; A103-L127 VanDerWaalsContact O-CA 3.32Å; A103-L127 WeakPolarHBondContact O-CA 3.45Å; A103-L127 WeakPolarHBondContact O-CD1 3.06Å; A103-L127 PolarHBondContact O-N 2.91Å; I106-L127 HydrophobicContact CB-CD1 4.09Å; I106-L127 HydrophobicContact CD1-CD1 3.79Å; I106-L127 HydrophobicContact CD1-CD2 4.42Å; I106-L127 HydrophobicContact CG1-CD1 3.68Å; L124-L127 HydrophobicContact CB-CB 4.15Å; L124-L127 HydrophobicContact CD1-CD2 4.35Å; L124-L127 WeakPolarHBondContact O-CB 3.16Å; L124-L127 PolarHBondContact O-N 2.87Å; L124-L127 VanDerWaalsContact O-N 3.14Å; L127-L130 HydrophobicContact CD2-CB 4.06Å; L127-L130 HydrophobicContact CD2-CD1 4.48Å; L127-L148 HydrophobicContact CB-CD2 4.09Å; L127-L148 HydrophobicContact CD2-CD2 3.59Å; L127-L148 HydrophobicContact CG-CD2 4.46Å; L127-S150 CarbonylContact O-C 3.46Å; L127-L151 HydrophobicContact CD2-CD1 4.05Å; L127-L151 HydrophobicContact CG-CD1 4.34Å; L127-L151 VanDerWaalsContact O-CA 3.27Å; L127-L151 WeakPolarHBondContact O-CA 3.3Å; L127-L151 PolarHBondContact O-N 3.05Å
128	K	89.3	Confident	91.3	Very high	82 Å²	82	38 Å²	38	36%	0.357	18%	0.183	S	C	.	.			trans	-98	-30	178.5	-74.2	176	169.9	-99.8	0	112.8	V104 I126 E152 Y153	V104-K128 HydrophobicContact CG1-CB 4.39Å; V104-K128 HydrophobicContact CG1-CD 4.08Å; V104-K128 HydrophobicContact CG1-CG 4.43Å; V104-K128 PolarHBondContact O-N 3.01Å; I126-K128 PolarHBondContact O-N 2.7Å; K128-E152 HydrophobicContact CG-CG 4.48Å; K128-E152 VanDerWaalsContact NZ-CD 3.32Å; K128-E152 IonicContact NZ-OE1 3.91Å; K128-E152 PolarHBondContact NZ-OE1 3.09Å; K128-E152 IonicContact NZ-OE2 3.04Å; K128-E152 PolarHBondContact NZ-OE2 3.49Å; K128-E152 PolarHBondContact O-N 2.84Å; K128-Y153 PolarHBondContact O-N 3.11Å
129	R	90.4	Very high	91.6	Very high	106 Å²	106	35.8 Å²	35.8	40%	0.4	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	132.3	-175.9	-48.5	-167.6	-178.7	136.5	4.1	111.9	V104 S105 I106 Y131 Y153	V104-R129 PolarHBondContact O-N 2.83Å; S105-R129 WeakPolarHBondContact CA-O 3.37Å; I106-R129 PolarHBondContact N-O 2.77Å; R129-Y131 HydrophobicContact CB-CE2 3.71Å; R129-Y131 WeakPolarHBondContact CD-OH 3.36Å; R129-Y153 WeakPolarHBondContact CA-O 3.2Å; R129-Y153 HydrophobicContact CB-CD1 4.41Å
130	L	95.3	Very high	91.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.5	175.6	178.8	59.3	0	0	0	109.5	I106 L108 F121 L127 L132 F145 L148 L151 Y153 L154 Q155	I106-L130 HydrophobicContact CB-CD1 4.33Å; I106-L130 HydrophobicContact CG2-CD1 4.19Å; L108-L130 HydrophobicContact CD1-CD1 4.26Å; F121-L130 HydrophobicContact CE1-CD1 4.37Å; F121-L130 HydrophobicContact CE1-CD2 4.22Å; F121-L130 HydrophobicContact CE2-CD2 4.21Å; F121-L130 HydrophobicContact CZ-CD2 3.95Å; L127-L130 HydrophobicContact CD2-CB 4.06Å; L127-L130 HydrophobicContact CD2-CD1 4.48Å; L130-L132 HydrophobicContact CD1-CD2 4.47Å; L130-L132 HydrophobicContact CD1-CG 4.42Å; L130-L132 HydrophobicContact CD2-CD1 4.14Å; L130-L132 HydrophobicContact CD2-CG 4.49Å; L130-L132 HydrophobicContact CG-CD1 4.3Å; L130-L132 HydrophobicContact CG-CG 4.16Å; L130-F145 HydrophobicContact CD2-CD1 4.31Å; L130-F145 HydrophobicContact CD2-CE1 4.28Å; L130-L148 HydrophobicContact CD2-CD1 3.63Å; L130-L151 HydrophobicContact CB-CD1 3.76Å; L130-L151 HydrophobicContact CB-CD2 4.41Å; L130-Y153 PolarHBondContact N-O 2.71Å; L130-Y153 VanDerWaalsContact N-O 3.11Å; L130-L154 HydrophobicContact CB-CD1 4.09Å; L130-L154 HydrophobicContact CD2-CD1 4.03Å; L130-L154 HydrophobicContact CG-CD1 4.06Å; L130-Q155 PolarHBondContact O-N 3.42Å; L130-Q155 VanDerWaalsContact O-N 3.09Å
131	Y	92.6	Very high	92	Very high	22 Å²	22	39.5 Å²	39.5	9%	0.086	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.9	179.1	-55.1	-102.8	0	0	0	109.4	I106 N107 L108 R129 Y153 Q155 V583	I106-Y131 PolarHBondContact O-N 2.86Å; I106-Y131 VanDerWaalsContact O-N 3.1Å; N107-Y131 HydrophobicContact CB-CD2 4.31Å; N107-Y131 VanDerWaalsContact OD1-CB 3.31Å; N107-Y131 WeakPolarHBondContact OD1-CB 3.49Å; L108-Y131 CarbonylContact C-O 3.49Å; L108-Y131 WeakPolarHBondContact CA-O 3.33Å; L108-Y131 PolarHBondContact N-O 3.36Å; R129-Y131 HydrophobicContact CB-CE2 3.71Å; R129-Y131 WeakPolarHBondContact CD-OH 3.36Å; Y131-Y153 AromaticContact CD1-CE1 3.93Å; Y131-Y153 HydrophobicContact CD1-CE1 3.93Å; Y131-Y153 HydrophobicContact CE1-CD1 4.16Å; Y131-Y153 AromaticContact CE1-CE1 3.36Å; Y131-Y153 HydrophobicContact CE1-CE1 3.36Å; Y131-Y153 AromaticContact CZ-CE1 3.72Å; Y131-Q155 HydrophobicContact CD1-CB 4.2Å; Y131-Q155 VanDerWaalsContact CD1-OE1 3.25Å; Y131-V583 HydrophobicContact CE1-CG1 4.49Å; Y131-V583 HydrophobicContact CE2-CG1 4.24Å; Y131-V583 WeakPolarHBondContact OH-CG1 3.28Å
132	L	94.8	Very high	91.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.199	C	C	.	.			trans	-131.3	15.7	-177.9	-65.9	170.2	0	0	0	111.7	L108 L113 I116 L130 N135 L137 F145 L154 Q155 A156 N159	L108-L132 HydrophobicContact CB-CD2 4.02Å; L108-L132 HydrophobicContact CD1-CD2 4.31Å; L113-L132 HydrophobicContact CD2-CD2 4.1Å; I116-L132 HydrophobicContact CD1-CD1 4.37Å; L130-L132 HydrophobicContact CD1-CD2 4.47Å; L130-L132 HydrophobicContact CD1-CG 4.42Å; L130-L132 HydrophobicContact CD2-CD1 4.14Å; L130-L132 HydrophobicContact CD2-CG 4.49Å; L130-L132 HydrophobicContact CG-CD1 4.3Å; L130-L132 HydrophobicContact CG-CG 4.16Å; L132-N135 PolarHBondContact O-ND2 3.02Å; L132-L137 HydrophobicContact CB-CD1 4.25Å; L132-L137 HydrophobicContact CD1-CD1 4.28Å; L132-F145 HydrophobicContact CD1-CE1 3.96Å; L132-F145 HydrophobicContact CD1-CZ 4.45Å; L132-L154 HydrophobicContact CD1-CD1 4.28Å; L132-Q155 PolarHBondContact N-O 2.88Å; L132-A156 HydrophobicContact CB-CB 4.09Å; L132-N159 PolarHBondContact O-ND2 3.1Å
133	H	91.4	Very high	91.7	Very high	4 Å²	4	44 Å²	44	2%	0.019	21%	0.208	C	C	.	.			trans	-56.5	154.9	-178.6	71.3	101.5	0	0	0	113.2	G109 N110 N135 Q155 D157	G109-H133 CarbonylContact C-O 3.56Å; G109-H133 WeakPolarHBondContact CA-O 2.99Å; N110-H133 PolarHBondContact N-O 2.84Å; H133-N135 VanDerWaalsContact C-N 3.27Å; H133-N135 PolarHBondContact O-N 3.04Å; H133-N135 PolarHBondContact O-ND2 2.75Å; H133-N135 VanDerWaalsContact O-ND2 3.14Å; H133-Q155 HydrophobicContact CB-CG 4.39Å; H133-D157 CarbonylContact C-O 3.11Å; H133-D157 VanDerWaalsContact CA-O 3.3Å; H133-D157 WeakPolarHBondContact CA-O 3.3Å; H133-D157 WeakPolarHBondContact CB-OD1 3.47Å
134	E	89.8	Confident	92.1	Very high	56 Å²	56	43 Å²	43	26%	0.262	20%	0.197	S	C	.	.	S	Bend	trans	56.5	37.6	173.4	-65	169.5	-112.1	0	0	114	N110 D157 Y158	N110-E134 WeakPolarHBondContact CA-O 3.37Å; N110-E134 HydrophobicContact CB-CB 4.16Å; E134-D157 PolarHBondContact N-O 2.89Å; E134-Y158 VanDerWaalsContact CA-O 3.28Å; E134-Y158 WeakPolarHBondContact CA-O 3.42Å; E134-Y158 HydrophobicContact CG-CG 4.46Å
135	N	94	Very high	92.2	Very high	6 Å²	6	43.1 Å²	43.1	3%	0.032	20%	0.198	C	C	.	.			trans	-110.4	-173.1	176.9	-81.2	-63.7	0	0	0	111.6	L108 N111 A112 L113 L132 H133 L137 N159	L108-N135 PolarHBondContact O-ND2 2.64Å; N111-N135 WeakPolarHBondContact CA-OD1 3.03Å; N111-N135 WeakPolarHBondContact CB-OD1 3.27Å; N111-N135 PolarHBondContact N-OD1 3.47Å; A112-N135 PolarHBondContact N-OD1 2.79Å; A112-N135 VanDerWaalsContact N-OD1 3.12Å; L113-N135 HydrophobicContact CB-CB 4.16Å; L113-N135 VanDerWaalsContact CB-OD1 3.3Å; L113-N135 WeakPolarHBondContact CB-OD1 3.38Å; L113-N135 PolarHBondContact N-OD1 3.23Å; L132-N135 PolarHBondContact O-ND2 3.02Å; H133-N135 VanDerWaalsContact C-N 3.27Å; H133-N135 PolarHBondContact O-N 3.04Å; H133-N135 PolarHBondContact O-ND2 2.75Å; H133-N135 VanDerWaalsContact O-ND2 3.14Å; N135-L137 HydrophobicContact CB-CG 4.3Å; N135-N159 WeakPolarHBondContact CA-OD1 3.05Å; N135-N159 WeakPolarHBondContact CB-OD1 3.34Å; N135-N159 PolarHBondContact N-ND2 3.13Å; N135-N159 PolarHBondContact O-OD1 2.9Å
136	K	94.1	Very high	92.4	Very high	120 Å²	120	40 Å²	40	52%	0.522	19%	0.186	S	C	.	.			trans	-119.7	29.6	-174.3	-62.2	-175.4	-178.6	-178.6	0	111.6	A112 L113 Q114 N159 V160	A112-K136 HydrophobicContact CB-CD 4.12Å; L113-K136 CarbonylContact O-C 3.23Å; L113-K136 VanDerWaalsContact O-CA 3.28Å; L113-K136 WeakPolarHBondContact O-CA 3.48Å; L113-K136 PolarHBondContact O-N 3.35Å; Q114-K136 HydrophobicContact CG-CB 3.94Å; K136-N159 PolarHBondContact N-OD1 3.34Å; K136-V160 WeakPolarHBondContact O-CG2 3.49Å
137	L	94.9	Very high	92.3	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	17%	0.173	C	C	.	.			trans	-69	130.7	179.2	-60.9	171.4	0	0	0	110.1	L113 I116 L132 N135 F140 N159 V160 I161	L113-L137 HydrophobicContact CD2-CD2 4.14Å; L113-L137 HydrophobicContact CG-CD2 3.83Å; L113-L137 PolarHBondContact O-N 3.33Å; I116-L137 HydrophobicContact CD1-CD1 4.13Å; I116-L137 HydrophobicContact CD1-CD2 3.82Å; I116-L137 HydrophobicContact CG1-CD2 3.8Å; L132-L137 HydrophobicContact CB-CD1 4.25Å; L132-L137 HydrophobicContact CD1-CD1 4.28Å; N135-L137 HydrophobicContact CB-CG 4.3Å; L137-F140 HydrophobicContact CD1-CE1 4.07Å; L137-N159 WeakPolarHBondContact CB-OD1 3.4Å; L137-N159 WeakPolarHBondContact CG-OD1 3.31Å; L137-N159 PolarHBondContact N-OD1 3.35Å; L137-V160 CarbonylContact O-C 3.05Å; L137-V160 VanDerWaalsContact O-CG2 3.31Å; L137-V160 WeakPolarHBondContact O-CG2 3.28Å; L137-V160 PolarHBondContact O-N 3.04Å; L137-I161 HydrophobicContact CB-CG1 4.28Å; L137-I161 WeakPolarHBondContact O-CG1 3.41Å; L137-I161 PolarHBondContact O-N 3.01Å; L137-I161 VanDerWaalsContact O-N 3.08Å
138	D	92.6	Very high	92.3	Very high	63 Å²	63	36.9 Å²	36.9	34%	0.337	17%	0.173	S	C	.	.			trans	-110.1	-26	-177.7	99.5	-50.1	0	0	0	114.7	V160 I161 K162 R163	D138-V160 HydrophobicContact CB-CG2 4.28Å; D138-I161 CarbonylContact O-C 3.49Å; D138-I161 WeakPolarHBondContact O-CA 3.21Å; D138-K162 PolarHBondContact O-N 3.16Å; D138-R163 PolarHBondContact O-N 3.17Å
139	V	93.6	Very high	92.4	Very high	26 Å²	26	37.8 Å²	37.8	16%	0.158	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	133.1	179.4	177.8	0	0	0	0	111.9	R141 R163	V139-R141 HydrophobicContact CG1-CG 3.94Å; V139-R163 WeakPolarHBondContact CA-O 3.19Å; V139-R163 HydrophobicContact CG1-CB 4.48Å; V139-R163 HydrophobicContact CG2-CB 4.23Å
140	F	94.7	Very high	92.6	Very high	1 Å²	1	33.6 Å²	33.6	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116.5	161.8	-70.8	-6.8	0	0	0	110.1	L137 F145 A156 I161 R163 I164 E165 A168 F169 L180	L137-F140 HydrophobicContact CD1-CE1 4.07Å; F140-F145 HydrophobicContact CB-CE2 4.33Å; F140-F145 HydrophobicContact CD1-CE2 4.25Å; F140-F145 HydrophobicContact CD1-CZ 4.15Å; F140-F145 AromaticContact CD2-CE2 3.69Å; F140-F145 HydrophobicContact CD2-CE2 3.69Å; F140-F145 AromaticContact CD2-CZ 3.98Å; F140-F145 HydrophobicContact CD2-CZ 3.98Å; F140-F145 HydrophobicContact CE1-CE2 4.48Å; F140-F145 AromaticContact CE1-CZ 3.96Å; F140-F145 HydrophobicContact CE1-CZ 3.96Å; F140-F145 AromaticContact CE2-CE2 3.94Å; F140-F145 HydrophobicContact CE2-CE2 3.94Å; F140-F145 AromaticContact CE2-CZ 3.77Å; F140-F145 HydrophobicContact CE2-CZ 3.77Å; F140-F145 AromaticContact CG-CE2 3.85Å; F140-F145 HydrophobicContact CG-CE2 3.85Å; F140-F145 HydrophobicContact CG-CZ 4.16Å; F140-F145 HydrophobicContact CZ-CE2 4.33Å; F140-F145 AromaticContact CZ-CZ 3.76Å; F140-F145 HydrophobicContact CZ-CZ 3.76Å; F140-A156 HydrophobicContact CZ-CB 3.79Å; F140-I161 HydrophobicContact CD1-CD1 4.25Å; F140-I161 HydrophobicContact CE1-CD1 3.56Å; F140-I161 HydrophobicContact CE1-CG1 4.21Å; F140-I161 HydrophobicContact CE2-CD1 3.9Å; F140-I161 HydrophobicContact CZ-CD1 3.36Å; F140-I161 HydrophobicContact CZ-CG1 4.46Å; F140-R163 PolarHBondContact N-O 3.09Å; F140-I164 HydrophobicContact CB-CB 4.48Å; F140-I164 HydrophobicContact CB-CG1 4.24Å; F140-I164 HydrophobicContact CB-CG2 4.17Å; F140-I164 HydrophobicContact CD2-CD1 4.21Å; F140-I164 HydrophobicContact CD2-CG1 4.21Å; F140-E165 PolarHBondContact O-N 2.91Å; F140-A168 HydrophobicContact CB-CB 4.19Å; F140-F169 AromaticContact CD2-CE1 3.97Å; F140-F169 HydrophobicContact CD2-CE1 3.97Å; F140-F169 HydrophobicContact CD2-CZ 4.12Å; F140-F169 HydrophobicContact CE2-CE1 4.31Å; F140-F169 HydrophobicContact CE2-CZ 4.42Å; F140-L180 HydrophobicContact CE2-CD2 3.92Å; F140-L180 HydrophobicContact CZ-CD2 4.46Å
141	R	93.1	Very high	92.6	Very high	79 Å²	79	33.6 Å²	33.6	30%	0.298	17%	0.165	S	C	.	.			trans	-92.7	161.3	-179	-52.9	179.6	-169.2	108.2	0.9	110.6	D115 I116 V139 D143 T144 E165	D115-R141 IonicContact OD1-CZ 2.73Å; D115-R141 VanDerWaalsContact OD1-CZ 3.31Å; D115-R141 IonicContact OD1-NH1 2.78Å; D115-R141 PolarHBondContact OD1-NH1 2.77Å; D115-R141 IonicContact OD1-NH2 2.85Å; D115-R141 PolarHBondContact OD1-NH2 3.4Å; I116-R141 PolarHBondContact O-NH1 3.23Å; I116-R141 VanDerWaalsContact O-NH1 3.15Å; V139-R141 HydrophobicContact CG1-CG 3.94Å; R141-D143 PolarHBondContact O-N 3.27Å; R141-D143 VanDerWaalsContact O-N 3.09Å; R141-T144 WeakPolarHBondContact CB-OG1 3.27Å; R141-T144 PolarHBondContact N-OG1 3.12Å; R141-T144 WeakPolarHBondContact O-CB 2.81Å; R141-T144 PolarHBondContact O-N 3.14Å; R141-T144 VanDerWaalsContact O-N 3.08Å; R141-T144 PolarHBondContact O-OG1 3.12Å; R141-E165 VanDerWaalsContact CA-OE2 3.23Å; R141-E165 WeakPolarHBondContact CA-OE2 3.47Å
142	N	89.5	Confident	92.5	Very high	61 Å²	61	35 Å²	35	33%	0.326	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-41.8	-177.1	-68	-44.6	0	0	0	114	E165 G167	N142-E165 PolarHBondContact N-OE2 2.91Å; N142-E165 PolarHBondContact ND2-OE2 3.05Å; N142-E165 VanDerWaalsContact OD1-CB 3.3Å; N142-E165 WeakPolarHBondContact OD1-CB 3.09Å; N142-G167 WeakPolarHBondContact OD1-CA 3.38Å; N142-G167 PolarHBondContact OD1-N 3.43Å
143	D	88.7	Confident	92.3	Very high	73 Å²	73	36.7 Å²	36.7	39%	0.39	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	20.1	-175.9	-57.4	-75.6	0	0	0	113.5	T118 G119 R141 F145 L146	T118-D143 HydrophobicContact CG2-CB 3.98Å; G119-D143 PolarHBondContact N-O 3.01Å; R141-D143 PolarHBondContact O-N 3.27Å; R141-D143 VanDerWaalsContact O-N 3.09Å; D143-F145 VanDerWaalsContact C-N 3.3Å; D143-F145 PolarHBondContact O-N 3.4Å; D143-L146 HydrophobicContact CB-CB 4.31Å; D143-L146 WeakPolarHBondContact O-CB 3.35Å; D143-L146 PolarHBondContact O-N 2.88Å
144	T	91.5	Very high	92.6	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.012	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-39	174.1	-73	0	0	0	0	111.6	I116 F121 R141	I116-T144 HydrophobicContact CB-CG2 4.17Å; I116-T144 HydrophobicContact CD1-CG2 4.31Å; I116-T144 HydrophobicContact CG2-CG2 4.09Å; F121-T144 VanDerWaalsContact CD2-O 3.29Å; F121-T144 WeakPolarHBondContact CD2-O 3.34Å; R141-T144 WeakPolarHBondContact CB-OG1 3.27Å; R141-T144 PolarHBondContact N-OG1 3.12Å; R141-T144 WeakPolarHBondContact O-CB 2.81Å; R141-T144 PolarHBondContact O-N 3.14Å; R141-T144 VanDerWaalsContact O-N 3.08Å; R141-T144 PolarHBondContact O-OG1 3.12Å
145	F	94.1	Very high	92.7	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.009	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	23.8	-178.4	-57.3	-73.4	0	0	0	113.6	F121 L130 L132 F140 D143 G147 L148 L154 A168 F169 L172	F121-F145 HydrophobicContact CD2-CD1 4.41Å; F121-F145 HydrophobicContact CE2-CD1 4.1Å; F121-F145 HydrophobicContact CE2-CE1 4.4Å; L130-F145 HydrophobicContact CD2-CD1 4.31Å; L130-F145 HydrophobicContact CD2-CE1 4.28Å; L132-F145 HydrophobicContact CD1-CE1 3.96Å; L132-F145 HydrophobicContact CD1-CZ 4.45Å; F140-F145 HydrophobicContact CB-CE2 4.33Å; F140-F145 HydrophobicContact CD1-CE2 4.25Å; F140-F145 HydrophobicContact CD1-CZ 4.15Å; F140-F145 AromaticContact CD2-CE2 3.69Å; F140-F145 HydrophobicContact CD2-CE2 3.69Å; F140-F145 AromaticContact CD2-CZ 3.98Å; F140-F145 HydrophobicContact CD2-CZ 3.98Å; F140-F145 HydrophobicContact CE1-CE2 4.48Å; F140-F145 AromaticContact CE1-CZ 3.96Å; F140-F145 HydrophobicContact CE1-CZ 3.96Å; F140-F145 AromaticContact CE2-CE2 3.94Å; F140-F145 HydrophobicContact CE2-CE2 3.94Å; F140-F145 AromaticContact CE2-CZ 3.77Å; F140-F145 HydrophobicContact CE2-CZ 3.77Å; F140-F145 AromaticContact CG-CE2 3.85Å; F140-F145 HydrophobicContact CG-CE2 3.85Å; F140-F145 HydrophobicContact CG-CZ 4.16Å; F140-F145 HydrophobicContact CZ-CE2 4.33Å; F140-F145 AromaticContact CZ-CZ 3.76Å; F140-F145 HydrophobicContact CZ-CZ 3.76Å; D143-F145 VanDerWaalsContact C-N 3.3Å; D143-F145 PolarHBondContact O-N 3.4Å; F145-G147 PolarHBondContact O-N 3.11Å; F145-L148 HydrophobicContact CB-CD1 4.22Å; F145-L148 HydrophobicContact CD1-CD1 4Å; F145-L148 PolarHBondContact O-N 3.17Å; F145-L154 HydrophobicContact CD1-CD2 4.5Å; F145-L154 HydrophobicContact CE1-CD1 4.14Å; F145-L154 HydrophobicContact CE1-CD2 4.02Å; F145-L154 HydrophobicContact CE2-CD2 4.35Å; F145-L154 HydrophobicContact CZ-CD2 3.94Å; F145-A168 WeakPolarHBondContact CD2-O 3.49Å; F145-F169 HydrophobicContact CD2-CD1 4.15Å; F145-F169 HydrophobicContact CD2-CE1 4.24Å; F145-F169 HydrophobicContact CE2-CD1 4.26Å; F145-F169 AromaticContact CE2-CE1 3.87Å; F145-F169 HydrophobicContact CE2-CE1 3.87Å; F145-L172 HydrophobicContact CB-CD1 4.11Å; F145-L172 HydrophobicContact CB-CD2 4.02Å; F145-L172 HydrophobicContact CB-CG 4.33Å; F145-L172 HydrophobicContact CD2-CD1 4.42Å; F145-L172 HydrophobicContact CG-CD1 4.26Å
146	L	91.9	Very high	92.7	Very high	60 Å²	60	34 Å²	34	31%	0.314	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	132.3	175.4	-175.8	66.6	0	0	0	110.8	F121 D143	F121-L146 CarbonylContact C-O 3.36Å; D143-L146 HydrophobicContact CB-CB 4.31Å; D143-L146 WeakPolarHBondContact O-CB 3.35Å; D143-L146 PolarHBondContact O-N 2.88Å
147	G	88.5	Confident	92.4	Very high	8 Å²	8	29 Å²	29	8%	0.082	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	102	-18.1	-175.9	0	0	0	0	0	115.3	F145 E149	F145-G147 PolarHBondContact O-N 3.11Å; G147-E149 VanDerWaalsContact C-N 3.33Å; G147-E149 PolarHBondContact O-N 3.46Å
148	L	93.9	Very high	92.2	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.			trans	-90.9	43.9	-171.6	-62.6	-179.7	0	0	0	114.5	F121 L124 L127 L130 F145 S150 L151 L172	F121-L148 HydrophobicContact CB-CD1 4.02Å; F121-L148 HydrophobicContact CB-CD2 3.88Å; F121-L148 HydrophobicContact CB-CG 3.75Å; F121-L148 HydrophobicContact CD2-CD1 3.81Å; F121-L148 HydrophobicContact CD2-CG 4.44Å; F121-L148 HydrophobicContact CE2-CD1 4.42Å; F121-L148 HydrophobicContact CG-CD1 3.9Å; F121-L148 HydrophobicContact CG-CD2 4.4Å; F121-L148 HydrophobicContact CG-CG 4.2Å; L124-L148 HydrophobicContact CB-CD2 3.66Å; L124-L148 HydrophobicContact CD1-CD2 4.1Å; L127-L148 HydrophobicContact CB-CD2 4.09Å; L127-L148 HydrophobicContact CD2-CD2 3.59Å; L127-L148 HydrophobicContact CG-CD2 4.46Å; L130-L148 HydrophobicContact CD2-CD1 3.63Å; F145-L148 HydrophobicContact CB-CD1 4.22Å; F145-L148 HydrophobicContact CD1-CD1 4Å; F145-L148 PolarHBondContact O-N 3.17Å; L148-S150 PolarHBondContact O-N 2.9Å; L148-S150 VanDerWaalsContact O-N 3.09Å; L148-L151 HydrophobicContact CB-CB 4.28Å; L148-L151 HydrophobicContact CD1-CD2 4.34Å; L148-L151 WeakPolarHBondContact O-CB 3.16Å; L148-L151 PolarHBondContact O-N 3.17Å; L148-L151 VanDerWaalsContact O-N 3.16Å; L148-L172 HydrophobicContact CB-CD2 3.71Å; L148-L172 WeakPolarHBondContact O-CD2 3.42Å
149	E	90.9	Very high	92.2	Very high	100 Å²	100	30.3 Å²	30.3	47%	0.467	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.1	-173.5	-65.5	169.5	-141.3	0	0	114.6	G147 S173	G147-E149 VanDerWaalsContact C-N 3.33Å; G147-E149 PolarHBondContact O-N 3.46Å; E149-S173 PolarHBondContact O-OG 2.96Å
150	S	94.1	Very high	92.3	Very high	19 Å²	19	31.8 Å²	31.8	13%	0.133	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	5.1	-179.2	-64.2	0	0	0	0	115.6	K125 L127 L148 E152 K174	K125-S150 WeakPolarHBondContact O-CB 3.28Å; K125-S150 PolarHBondContact O-OG 2.92Å; L127-S150 CarbonylContact O-C 3.46Å; L148-S150 PolarHBondContact O-N 2.9Å; L148-S150 VanDerWaalsContact O-N 3.09Å; S150-E152 PolarHBondContact O-N 3.48Å; S150-K174 PolarHBondContact OG-NZ 2.77Å
151	L	96.1	Very high	92.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.155	C	C	.	.			trans	-64.4	126.7	-173.6	-162	72.8	0	0	0	111.5	L127 L130 L148 L154 L172 K174 L175	L127-L151 HydrophobicContact CD2-CD1 4.05Å; L127-L151 HydrophobicContact CG-CD1 4.34Å; L127-L151 VanDerWaalsContact O-CA 3.27Å; L127-L151 WeakPolarHBondContact O-CA 3.3Å; L127-L151 PolarHBondContact O-N 3.05Å; L130-L151 HydrophobicContact CB-CD1 3.76Å; L130-L151 HydrophobicContact CB-CD2 4.41Å; L148-L151 HydrophobicContact CB-CB 4.28Å; L148-L151 HydrophobicContact CD1-CD2 4.34Å; L148-L151 WeakPolarHBondContact O-CB 3.16Å; L148-L151 PolarHBondContact O-N 3.17Å; L148-L151 VanDerWaalsContact O-N 3.16Å; L151-L154 HydrophobicContact CD2-CB 3.97Å; L151-L154 HydrophobicContact CD2-CD1 4.36Å; L151-L154 HydrophobicContact CD2-CD2 4.47Å; L151-L172 HydrophobicContact CB-CD2 4.19Å; L151-L172 HydrophobicContact CD2-CD1 4.36Å; L151-L172 HydrophobicContact CD2-CD2 4.13Å; L151-K174 CarbonylContact O-C 3.54Å; L151-L175 HydrophobicContact CD2-CD1 4.35Å; L151-L175 HydrophobicContact CG-CD1 4.42Å; L151-L175 WeakPolarHBondContact O-CA 3.36Å; L151-L175 PolarHBondContact O-N 2.04Å
152	E	90.8	Very high	92.3	Very high	52 Å²	52	33 Å²	33	24%	0.243	16%	0.163	C	C	.	.			trans	-105.7	-27	179.8	-71.5	168.7	-172.9	0	0	112	K128 S150 K174 R176 V177	K128-E152 HydrophobicContact CG-CG 4.48Å; K128-E152 VanDerWaalsContact NZ-CD 3.32Å; K128-E152 IonicContact NZ-OE1 3.91Å; K128-E152 PolarHBondContact NZ-OE1 3.09Å; K128-E152 IonicContact NZ-OE2 3.04Å; K128-E152 PolarHBondContact NZ-OE2 3.49Å; K128-E152 PolarHBondContact O-N 2.84Å; S150-E152 PolarHBondContact O-N 3.48Å; E152-K174 HydrophobicContact CG-CB 4.39Å; E152-R176 PolarHBondContact O-N 2.91Å; E152-V177 PolarHBondContact O-N 3.1Å; E152-V177 VanDerWaalsContact O-N 3.16Å
153	Y	91.3	Very high	92.3	Very high	34 Å²	34	36.9 Å²	36.9	13%	0.133	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	127.3	-174.9	-178.4	-81.7	0	0	0	110.9	K128 R129 L130 Y131 Q155 V177 I179	K128-Y153 PolarHBondContact O-N 3.11Å; R129-Y153 WeakPolarHBondContact CA-O 3.2Å; R129-Y153 HydrophobicContact CB-CD1 4.41Å; L130-Y153 PolarHBondContact N-O 2.71Å; L130-Y153 VanDerWaalsContact N-O 3.11Å; Y131-Y153 AromaticContact CD1-CE1 3.93Å; Y131-Y153 HydrophobicContact CD1-CE1 3.93Å; Y131-Y153 HydrophobicContact CE1-CD1 4.16Å; Y131-Y153 AromaticContact CE1-CE1 3.36Å; Y131-Y153 HydrophobicContact CE1-CE1 3.36Å; Y131-Y153 AromaticContact CZ-CE1 3.72Å; Y153-Q155 HydrophobicContact CE1-CB 3.65Å; Y153-Q155 PolarHBondContact OH-OE1 2.81Å; Y153-Q155 VanDerWaalsContact OH-OE1 3.08Å; Y153-V177 HydrophobicContact CD2-CB 3.62Å; Y153-V177 HydrophobicContact CD2-CG1 3.58Å; Y153-V177 HydrophobicContact CD2-CG2 4.21Å; Y153-V177 HydrophobicContact CE2-CB 4.2Å; Y153-V177 HydrophobicContact CE2-CG1 3.62Å; Y153-V177 HydrophobicContact CG-CB 4.38Å; Y153-I179 HydrophobicContact CE2-CD1 4.07Å; Y153-I179 WeakPolarHBondContact OH-CD1 3.37Å
154	L	96	Very high	92.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	123.4	174.5	179.5	57.1	0	0	0	110.1	L130 L132 F145 L151 F169 L172 L175 V177 L178 I179	L130-L154 HydrophobicContact CB-CD1 4.09Å; L130-L154 HydrophobicContact CD2-CD1 4.03Å; L130-L154 HydrophobicContact CG-CD1 4.06Å; L132-L154 HydrophobicContact CD1-CD1 4.28Å; F145-L154 HydrophobicContact CD1-CD2 4.5Å; F145-L154 HydrophobicContact CE1-CD1 4.14Å; F145-L154 HydrophobicContact CE1-CD2 4.02Å; F145-L154 HydrophobicContact CE2-CD2 4.35Å; F145-L154 HydrophobicContact CZ-CD2 3.94Å; L151-L154 HydrophobicContact CD2-CB 3.97Å; L151-L154 HydrophobicContact CD2-CD1 4.36Å; L151-L154 HydrophobicContact CD2-CD2 4.47Å; L154-F169 HydrophobicContact CD2-CE1 4.29Å; L154-L172 HydrophobicContact CD2-CD1 4.34Å; L154-L175 HydrophobicContact CB-CD1 3.75Å; L154-L175 HydrophobicContact CB-CD2 4.44Å; L154-V177 PolarHBondContact N-O 3.06Å; L154-L178 HydrophobicContact CB-CD1 4.11Å; L154-L178 HydrophobicContact CD2-CD1 3.93Å; L154-L178 HydrophobicContact CG-CD1 4.05Å; L154-L178 WeakPolarHBondContact O-CA 3.42Å; L154-I179 PolarHBondContact O-N 2.77Å
155	Q	91.9	Very high	92.7	Very high	9 Å²	9	36.3 Å²	36.3	4%	0.042	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.3	176.5	175.8	179.2	-3.3	0	0	110.2	L130 Y131 L132 H133 Y153 D157 I179	L130-Q155 PolarHBondContact O-N 3.42Å; L130-Q155 VanDerWaalsContact O-N 3.09Å; Y131-Q155 HydrophobicContact CD1-CB 4.2Å; Y131-Q155 VanDerWaalsContact CD1-OE1 3.25Å; L132-Q155 PolarHBondContact N-O 2.88Å; H133-Q155 HydrophobicContact CB-CG 4.39Å; Y153-Q155 HydrophobicContact CE1-CB 3.65Å; Y153-Q155 PolarHBondContact OH-OE1 2.81Å; Y153-Q155 VanDerWaalsContact OH-OE1 3.08Å; Q155-D157 VanDerWaalsContact CD-OD1 3.3Å; Q155-D157 WeakPolarHBondContact CG-OD1 3.31Å; Q155-D157 PolarHBondContact NE2-OD1 2.87Å; Q155-D157 PolarHBondContact NE2-OD2 3.3Å; Q155-I179 HydrophobicContact CB-CB 4.33Å; Q155-I179 HydrophobicContact CG-CB 4.23Å; Q155-I179 HydrophobicContact CG-CG2 4.18Å
156	A	94.7	Very high	92.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.189	C	C	.	.			trans	-147.8	39.4	-179.9	0	0	0	0	0	112.8	L132 F140 I161 I179 L180 N183	L132-A156 HydrophobicContact CB-CB 4.09Å; F140-A156 HydrophobicContact CZ-CB 3.79Å; A156-I161 HydrophobicContact CB-CD1 4.48Å; A156-I179 PolarHBondContact N-O 2.8Å; A156-L180 HydrophobicContact CB-CD2 4.11Å; A156-N183 PolarHBondContact O-ND2 3.46Å
157	D	88.8	Confident	92.4	Very high	15 Å²	15	37 Å²	37	8%	0.08	18%	0.181	C	C	.	.			trans	-70.4	167.9	173.1	56.4	-50.8	0	0	0	113.5	H133 E134 Q155 N159 I179 N181	H133-D157 CarbonylContact C-O 3.11Å; H133-D157 VanDerWaalsContact CA-O 3.3Å; H133-D157 WeakPolarHBondContact CA-O 3.3Å; H133-D157 WeakPolarHBondContact CB-OD1 3.47Å; E134-D157 PolarHBondContact N-O 2.89Å; Q155-D157 VanDerWaalsContact CD-OD1 3.3Å; Q155-D157 WeakPolarHBondContact CG-OD1 3.31Å; Q155-D157 PolarHBondContact NE2-OD1 2.87Å; Q155-D157 PolarHBondContact NE2-OD2 3.3Å; D157-N159 PolarHBondContact O-N 3.42Å; D157-N159 PolarHBondContact O-ND2 3.24Å; D157-I179 HydrophobicContact CB-CG2 4.2Å; D157-N181 VanDerWaalsContact CA-O 3.25Å; D157-N181 WeakPolarHBondContact CA-O 3.41Å; D157-N181 WeakPolarHBondContact CB-ND2 3.42Å; D157-N181 WeakPolarHBondContact CB-O 3.26Å; D157-N181 VanDerWaalsContact CB-OD1 3.3Å; D157-N181 WeakPolarHBondContact CB-OD1 3.24Å
158	Y	89.4	Confident	92.6	Very high	89 Å²	89	36.8 Å²	36.8	35%	0.349	18%	0.177	S	C	.	.	S	Bend	trans	49.1	46	-177.8	-70	-88.1	0	0	0	112.8	E134 N181 D182 R535	E134-Y158 VanDerWaalsContact CA-O 3.28Å; E134-Y158 WeakPolarHBondContact CA-O 3.42Å; E134-Y158 HydrophobicContact CG-CG 4.46Å; Y158-N181 PolarHBondContact N-O 3.37Å; Y158-D182 WeakPolarHBondContact CA-O 3.49Å; Y158-D182 HydrophobicContact CD1-CB 3.92Å; Y158-D182 HydrophobicContact CD2-CB 4.04Å; Y158-D182 HydrophobicContact CE1-CB 3.82Å; Y158-D182 HydrophobicContact CE2-CB 3.91Å; Y158-D182 WeakPolarHBondContact CE2-OD2 3.37Å; Y158-D182 HydrophobicContact CG-CB 4.01Å; Y158-D182 PolarHBondContact N-O 3.06Å; Y158-D182 PolarHBondContact OH-OD2 2.77Å; Y158-R535 PolarHBondContact OH-NH1 3.39Å
159	N	93	Very high	92.6	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.037	18%	0.178	C	C	.	.	S	Bend	trans	-118.7	-178.9	177.2	-90.7	-98.9	0	0	0	110.1	L132 N135 K136 L137 D157 I161 D182 N183	L132-N159 PolarHBondContact O-ND2 3.1Å; N135-N159 WeakPolarHBondContact CA-OD1 3.05Å; N135-N159 WeakPolarHBondContact CB-OD1 3.34Å; N135-N159 PolarHBondContact N-ND2 3.13Å; N135-N159 PolarHBondContact O-OD1 2.9Å; K136-N159 PolarHBondContact N-OD1 3.34Å; L137-N159 WeakPolarHBondContact CB-OD1 3.4Å; L137-N159 WeakPolarHBondContact CG-OD1 3.31Å; L137-N159 PolarHBondContact N-OD1 3.35Å; D157-N159 PolarHBondContact O-N 3.42Å; D157-N159 PolarHBondContact O-ND2 3.24Å; N159-I161 HydrophobicContact CB-CD1 4.18Å; N159-I161 HydrophobicContact CB-CG1 4.06Å; N159-D182 PolarHBondContact N-O 3.21Å; N159-N183 WeakPolarHBondContact CB-OD1 3.17Å; N159-N183 PolarHBondContact O-OD1 3.1Å
160	V	94.6	Very high	92.6	Very high	56 Å²	56	41 Å²	41	34%	0.339	19%	0.189	S	C	.	.			trans	-111.7	30.8	-179.5	-62.2	0	0	0	0	112.2	K136 L137 D138 K162 L184	K136-V160 WeakPolarHBondContact O-CG2 3.49Å; L137-V160 CarbonylContact O-C 3.05Å; L137-V160 VanDerWaalsContact O-CG2 3.31Å; L137-V160 WeakPolarHBondContact O-CG2 3.28Å; L137-V160 PolarHBondContact O-N 3.04Å; D138-V160 HydrophobicContact CB-CG2 4.28Å; V160-K162 PolarHBondContact O-N 3.22Å; V160-K162 VanDerWaalsContact O-N 3.15Å; V160-L184 HydrophobicContact CB-CD1 4.15Å; V160-L184 HydrophobicContact CG1-CD1 4.49Å
161	I	95.5	Very high	92.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.196	C	C	.	.			trans	-66.2	115.2	-172.5	-58.4	163.9	0	0	0	109.4	L137 D138 F140 A156 N159 I164 L180 N183 L184 I185	L137-I161 HydrophobicContact CB-CG1 4.28Å; L137-I161 WeakPolarHBondContact O-CG1 3.41Å; L137-I161 PolarHBondContact O-N 3.01Å; L137-I161 VanDerWaalsContact O-N 3.08Å; D138-I161 CarbonylContact O-C 3.49Å; D138-I161 WeakPolarHBondContact O-CA 3.21Å; F140-I161 HydrophobicContact CD1-CD1 4.25Å; F140-I161 HydrophobicContact CE1-CD1 3.56Å; F140-I161 HydrophobicContact CE1-CG1 4.21Å; F140-I161 HydrophobicContact CE2-CD1 3.9Å; F140-I161 HydrophobicContact CZ-CD1 3.36Å; F140-I161 HydrophobicContact CZ-CG1 4.46Å; A156-I161 HydrophobicContact CB-CD1 4.48Å; N159-I161 HydrophobicContact CB-CD1 4.18Å; N159-I161 HydrophobicContact CB-CG1 4.06Å; I161-I164 HydrophobicContact CG2-CG1 4.05Å; I161-L180 HydrophobicContact CD1-CD2 4.45Å; I161-N183 VanDerWaalsContact CB-OD1 3.24Å; I161-N183 WeakPolarHBondContact CB-OD1 3.04Å; I161-N183 WeakPolarHBondContact CD1-OD1 3.37Å; I161-N183 VanDerWaalsContact CG1-OD1 3.25Å; I161-N183 WeakPolarHBondContact CG1-OD1 3.24Å; I161-N183 PolarHBondContact N-OD1 3.05Å; I161-L184 CarbonylContact O-C 3.12Å; I161-L184 VanDerWaalsContact O-CA 3.27Å; I161-L184 WeakPolarHBondContact O-CA 3.17Å; I161-L184 PolarHBondContact O-N 3.31Å; I161-I185 HydrophobicContact CB-CG1 4.36Å; I161-I185 HydrophobicContact CG2-CD1 4.4Å; I161-I185 HydrophobicContact CG2-CG1 4.09Å; I161-I185 WeakPolarHBondContact O-CG1 3.38Å; I161-I185 PolarHBondContact O-N 2.85Å; I161-I185 VanDerWaalsContact O-N 3.11Å
162	K	92.6	Very high	92.2	Very high	105 Å²	105	42.5 Å²	42.5	46%	0.457	20%	0.196	S	C	.	.			trans	-99.7	-25.9	178.9	-67.4	159.4	-168.6	165.5	0	112.5	D138 V160 L184 P186	D138-K162 PolarHBondContact O-N 3.16Å; V160-K162 PolarHBondContact O-N 3.22Å; V160-K162 VanDerWaalsContact O-N 3.15Å; K162-L184 HydrophobicContact CG-CB 4.08Å; K162-L184 HydrophobicContact CG-CD1 4.45Å; K162-P186 WeakPolarHBondContact O-CD 3.18Å
163	R	91.2	Very high	92.1	Very high	144 Å²	144	43.6 Å²	43.6	54%	0.543	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	144.2	-179.1	-69.8	175	53.8	-136.9	-13.6	111.7	D138 V139 F140 E165	D138-R163 PolarHBondContact O-N 3.17Å; V139-R163 WeakPolarHBondContact CA-O 3.19Å; V139-R163 HydrophobicContact CG1-CB 4.48Å; V139-R163 HydrophobicContact CG2-CB 4.23Å; F140-R163 PolarHBondContact N-O 3.09Å; R163-E165 IonicContact NH2-OE1 2.86Å
164	I	94.9	Very high	92.2	Very high	10 Å²	10	46.7 Å²	46.7	5%	0.051	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	139.3	165.7	-58.2	-179.7	0	0	0	106.4	F140 I161 A168 F169 L180 I185 L188 P189 L192	F140-I164 HydrophobicContact CB-CB 4.48Å; F140-I164 HydrophobicContact CB-CG1 4.24Å; F140-I164 HydrophobicContact CB-CG2 4.17Å; F140-I164 HydrophobicContact CD2-CD1 4.21Å; F140-I164 HydrophobicContact CD2-CG1 4.21Å; I161-I164 HydrophobicContact CG2-CG1 4.05Å; I164-A168 HydrophobicContact CG2-CB 3.83Å; I164-F169 HydrophobicContact CD1-CZ 4.36Å; I164-F169 HydrophobicContact CG2-CZ 4.44Å; I164-L180 HydrophobicContact CD1-CD1 4.11Å; I164-I185 HydrophobicContact CD1-CD1 3.83Å; I164-I185 HydrophobicContact CG1-CD1 4.48Å; I164-L188 HydrophobicContact CD1-CD2 4.25Å; I164-P189 VanDerWaalsContact O-CG 3.31Å; I164-P189 WeakPolarHBondContact O-CG 3.31Å; I164-L192 HydrophobicContact CG2-CD1 3.66Å; I164-L192 HydrophobicContact CG2-CD2 3.97Å
165	E	93.2	Very high	92.1	Very high	53 Å²	53	46.7 Å²	46.7	25%	0.248	22%	0.223	C	C	.	.			trans	-89.1	149	174	-62.3	-174	157.5	0	0	111.4	F140 R141 N142 R163 G167 A168	F140-E165 PolarHBondContact O-N 2.91Å; R141-E165 VanDerWaalsContact CA-OE2 3.23Å; R141-E165 WeakPolarHBondContact CA-OE2 3.47Å; N142-E165 PolarHBondContact N-OE2 2.91Å; N142-E165 PolarHBondContact ND2-OE2 3.05Å; N142-E165 VanDerWaalsContact OD1-CB 3.3Å; N142-E165 WeakPolarHBondContact OD1-CB 3.09Å; R163-E165 IonicContact NH2-OE1 2.86Å; E165-G167 PolarHBondContact O-N 3.14Å; E165-A168 VanDerWaalsContact O-CB 3.31Å; E165-A168 WeakPolarHBondContact O-CB 3.32Å; E165-A168 PolarHBondContact O-N 2.9Å
166	S	89.3	Confident	91.9	Very high	63 Å²	63	50.8 Å²	50.8	44%	0.441	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.6	-171.1	49.5	0	0	0	0	114.9	T190	S166-T190 VanDerWaalsContact CB-O 3.24Å; S166-T190 WeakPolarHBondContact CB-O 3.27Å
167	G	89.8	Confident	91.5	Very high	14 Å²	14	52.1 Å²	52.1	14%	0.144	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-3.6	176.7	0	0	0	0	0	115.1	N142 E165 F169 R170	N142-G167 WeakPolarHBondContact OD1-CA 3.38Å; N142-G167 PolarHBondContact OD1-N 3.43Å; E165-G167 PolarHBondContact O-N 3.14Å; G167-F169 PolarHBondContact O-N 2.68Å; G167-R170 WeakPolarHBondContact O-CB 3.22Å; G167-R170 PolarHBondContact O-N 2.83Å
168	A	93.1	Very high	91.7	Very high	2 Å²	2	51.4 Å²	51.4	2%	0.017	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-32.6	-167.9	0	0	0	0	0	114.4	F140 F145 I164 E165 L192	F140-A168 HydrophobicContact CB-CB 4.19Å; F145-A168 WeakPolarHBondContact CD2-O 3.49Å; I164-A168 HydrophobicContact CG2-CB 3.83Å; E165-A168 VanDerWaalsContact O-CB 3.31Å; E165-A168 WeakPolarHBondContact O-CB 3.32Å; E165-A168 PolarHBondContact O-N 2.9Å; A168-L192 HydrophobicContact CB-CD1 4.43Å
169	F	93.1	Very high	91.7	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	10.1	177.9	-49.7	-38.3	0	0	0	113.9	F140 F145 L154 I164 G167 N171 L172 L178 L180 L192 F193 V196	F140-F169 AromaticContact CD2-CE1 3.97Å; F140-F169 HydrophobicContact CD2-CE1 3.97Å; F140-F169 HydrophobicContact CD2-CZ 4.12Å; F140-F169 HydrophobicContact CE2-CE1 4.31Å; F140-F169 HydrophobicContact CE2-CZ 4.42Å; F145-F169 HydrophobicContact CD2-CD1 4.15Å; F145-F169 HydrophobicContact CD2-CE1 4.24Å; F145-F169 HydrophobicContact CE2-CD1 4.26Å; F145-F169 AromaticContact CE2-CE1 3.87Å; F145-F169 HydrophobicContact CE2-CE1 3.87Å; L154-F169 HydrophobicContact CD2-CE1 4.29Å; I164-F169 HydrophobicContact CD1-CZ 4.36Å; I164-F169 HydrophobicContact CG2-CZ 4.44Å; G167-F169 PolarHBondContact O-N 2.68Å; F169-N171 PolarHBondContact O-N 2.59Å; F169-L172 HydrophobicContact CB-CD1 4.14Å; F169-L172 HydrophobicContact CD1-CD1 3.76Å; F169-L172 HydrophobicContact CG-CD1 4.31Å; F169-L172 PolarHBondContact O-N 3.41Å; F169-L178 HydrophobicContact CD2-CD2 4.23Å; F169-L178 HydrophobicContact CE2-CD2 3.58Å; F169-L178 HydrophobicContact CZ-CD1 4.3Å; F169-L178 HydrophobicContact CZ-CD2 3.91Å; F169-L180 HydrophobicContact CZ-CD1 4.46Å; F169-L192 HydrophobicContact CD2-CD1 3.51Å; F169-L192 HydrophobicContact CD2-CD2 4.19Å; F169-L192 HydrophobicContact CD2-CG 3.68Å; F169-L192 HydrophobicContact CE2-CD1 3.84Å; F169-L192 HydrophobicContact CE2-CD2 3.87Å; F169-L192 HydrophobicContact CE2-CG 3.89Å; F169-L192 HydrophobicContact CG-CD1 4.14Å; F169-F193 HydrophobicContact CD2-CD1 4.49Å; F169-F193 HydrophobicContact CD2-CE1 4.28Å; F169-F193 HydrophobicContact CE2-CE1 4.21Å; F169-V196 HydrophobicContact CB-CG2 3.82Å; F169-V196 WeakPolarHBondContact O-CG2 3.36Å
170	R	90.6	Very high	91.8	Very high	187 Å²	187	48.2 Å²	48.2	71%	0.706	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.5	-174	-180	177.8	177.6	-173.5	-1.3	114.1	G167 A195	G167-R170 WeakPolarHBondContact O-CB 3.22Å; G167-R170 PolarHBondContact O-N 2.83Å; R170-A195 WeakPolarHBondContact O-CB 3.5Å
171	N	88.9	Confident	91.5	Very high	52 Å²	52	46 Å²	46	28%	0.278	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-5.1	-176.1	-56.3	-32.7	0	0	0	112.9	F169 S173	F169-N171 PolarHBondContact O-N 2.59Å; N171-S173 VanDerWaalsContact C-N 3.27Å; N171-S173 PolarHBondContact O-N 2.73Å
172	L	93.1	Very high	91.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.231	C	C	.	.			trans	-89.1	52.4	-171.7	-57.8	-175.5	0	0	0	112.4	F145 L148 L151 L154 F169 K174 L175	F145-L172 HydrophobicContact CB-CD1 4.11Å; F145-L172 HydrophobicContact CB-CD2 4.02Å; F145-L172 HydrophobicContact CB-CG 4.33Å; F145-L172 HydrophobicContact CD2-CD1 4.42Å; F145-L172 HydrophobicContact CG-CD1 4.26Å; L148-L172 HydrophobicContact CB-CD2 3.71Å; L148-L172 WeakPolarHBondContact O-CD2 3.42Å; L151-L172 HydrophobicContact CB-CD2 4.19Å; L151-L172 HydrophobicContact CD2-CD1 4.36Å; L151-L172 HydrophobicContact CD2-CD2 4.13Å; L154-L172 HydrophobicContact CD2-CD1 4.34Å; F169-L172 HydrophobicContact CB-CD1 4.14Å; F169-L172 HydrophobicContact CD1-CD1 3.76Å; F169-L172 HydrophobicContact CG-CD1 4.31Å; F169-L172 PolarHBondContact O-N 3.41Å; L172-K174 PolarHBondContact O-N 3.15Å; L172-L175 HydrophobicContact CB-CB 3.97Å; L172-L175 HydrophobicContact CB-CD2 4.25Å; L172-L175 HydrophobicContact CD1-CD2 3.93Å; L172-L175 WeakPolarHBondContact O-CB 3.15Å; L172-L175 PolarHBondContact O-N 3.23Å
173	S	90.3	Very high	91.2	Very high	75 Å²	75	43.7 Å²	43.7	52%	0.524	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.9	-168.7	68.1	0	0	0	0	115.9	E149 N171	E149-S173 PolarHBondContact O-OG 2.96Å; N171-S173 VanDerWaalsContact C-N 3.27Å; N171-S173 PolarHBondContact O-N 2.73Å
174	K	92.1	Very high	91.3	Very high	99 Å²	99	40 Å²	40	43%	0.43	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	0	-179.8	-56.2	-172.7	-156.7	161.7	0	114	S150 L151 E152 L172 R176	S150-K174 PolarHBondContact OG-NZ 2.77Å; L151-K174 CarbonylContact O-C 3.54Å; E152-K174 HydrophobicContact CG-CB 4.39Å; L172-K174 PolarHBondContact O-N 3.15Å; K174-R176 PolarHBondContact O-N 3.03Å
175	L	93.7	Very high	91.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.198	C	C	.	.			trans	-68.8	123.3	-171.6	179.2	70.5	0	0	0	110.4	L151 L154 L172 V177 L178 V196 S197 L198	L151-L175 HydrophobicContact CD2-CD1 4.35Å; L151-L175 HydrophobicContact CG-CD1 4.42Å; L151-L175 WeakPolarHBondContact O-CA 3.36Å; L151-L175 PolarHBondContact O-N 2.04Å; L154-L175 HydrophobicContact CB-CD1 3.75Å; L154-L175 HydrophobicContact CB-CD2 4.44Å; L172-L175 HydrophobicContact CB-CB 3.97Å; L172-L175 HydrophobicContact CB-CD2 4.25Å; L172-L175 HydrophobicContact CD1-CD2 3.93Å; L172-L175 WeakPolarHBondContact O-CB 3.15Å; L172-L175 PolarHBondContact O-N 3.23Å; L175-V177 WeakPolarHBondContact CD1-O 3.42Å; L175-L178 HydrophobicContact CD2-CB 4.46Å; L175-V196 HydrophobicContact CB-CG1 3.82Å; L175-V196 HydrophobicContact CD2-CG1 4.22Å; L175-V196 HydrophobicContact CG-CG1 4.22Å; L175-V196 VanDerWaalsContact O-CG1 3.26Å; L175-V196 WeakPolarHBondContact O-CG1 3.42Å; L175-S197 CarbonylContact O-C 3.43Å; L175-L198 HydrophobicContact CD2-CD2 4.21Å; L175-L198 HydrophobicContact CG-CD2 3.95Å
176	R	87.4	Confident	91.2	Very high	95 Å²	95	39.8 Å²	39.8	36%	0.358	21%	0.205	S	C	.	.			trans	-112.7	-35.3	-177.8	-66	179.5	-175.6	-160.9	-1.1	112.4	E152 K174 L198 T199 H200	E152-R176 PolarHBondContact O-N 2.91Å; K174-R176 PolarHBondContact O-N 3.03Å; R176-L198 CarbonylContact O-C 3.38Å; R176-L198 WeakPolarHBondContact O-CA 3.47Å; R176-T199 HydrophobicContact CB-CG2 4.42Å; R176-T199 PolarHBondContact O-N 3.04Å; R176-T199 PolarHBondContact O-OG1 2.81Å; R176-H200 PolarHBondContact O-N 3.05Å
177	V	86.6	Confident	91.2	Very high	27 Å²	27	42.5 Å²	42.5	16%	0.164	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.1	-177.3	-179.3	0	0	0	0	109.1	E152 Y153 L154 L175 I179 H200	E152-V177 PolarHBondContact O-N 3.1Å; E152-V177 VanDerWaalsContact O-N 3.16Å; Y153-V177 HydrophobicContact CD2-CB 3.62Å; Y153-V177 HydrophobicContact CD2-CG1 3.58Å; Y153-V177 HydrophobicContact CD2-CG2 4.21Å; Y153-V177 HydrophobicContact CE2-CB 4.2Å; Y153-V177 HydrophobicContact CE2-CG1 3.62Å; Y153-V177 HydrophobicContact CG-CB 4.38Å; L154-V177 PolarHBondContact N-O 3.06Å; L175-V177 WeakPolarHBondContact CD1-O 3.42Å; V177-I179 HydrophobicContact CG1-CD1 4.09Å; V177-I179 HydrophobicContact CG1-CG1 4.05Å; V177-H200 WeakPolarHBondContact CA-O 3.49Å; V177-H200 HydrophobicContact CG1-CB 4.22Å; V177-H200 HydrophobicContact CG2-CB 4.19Å
178	L	93.9	Very high	91.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.2	177.3	177.1	59.2	0	0	0	109.6	L154 F169 L175 L180 F193 L198 H200 L201 D202	L154-L178 HydrophobicContact CB-CD1 4.11Å; L154-L178 HydrophobicContact CD2-CD1 3.93Å; L154-L178 HydrophobicContact CG-CD1 4.05Å; L154-L178 WeakPolarHBondContact O-CA 3.42Å; F169-L178 HydrophobicContact CD2-CD2 4.23Å; F169-L178 HydrophobicContact CE2-CD2 3.58Å; F169-L178 HydrophobicContact CZ-CD1 4.3Å; F169-L178 HydrophobicContact CZ-CD2 3.91Å; L175-L178 HydrophobicContact CD2-CB 4.46Å; L178-L180 HydrophobicContact CD1-CD1 4.02Å; L178-L180 HydrophobicContact CD1-CD2 4.18Å; L178-L180 HydrophobicContact CD1-CG 3.87Å; L178-L180 HydrophobicContact CD2-CD1 3.89Å; L178-L180 HydrophobicContact CG-CD1 3.88Å; L178-L180 HydrophobicContact CG-CG 3.99Å; L178-F193 HydrophobicContact CD2-CE1 3.96Å; L178-L198 HydrophobicContact CB-CD1 4.11Å; L178-L198 HydrophobicContact CB-CD2 3.77Å; L178-L198 HydrophobicContact CD2-CD1 4.05Å; L178-H200 PolarHBondContact N-O 3.18Å; L178-L201 HydrophobicContact CB-CD1 4.14Å; L178-L201 HydrophobicContact CD2-CD1 3.98Å; L178-L201 HydrophobicContact CG-CD1 4.04Å; L178-L201 WeakPolarHBondContact O-CA 3.26Å; L178-D202 PolarHBondContact O-N 2.97Å
179	I	88.8	Confident	91.2	Very high	28 Å²	28	43.7 Å²	43.7	14%	0.144	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.2	-177	-62.3	170.8	0	0	0	108.5	Y153 L154 Q155 A156 D157 V177 N181 D202	Y153-I179 HydrophobicContact CE2-CD1 4.07Å; Y153-I179 WeakPolarHBondContact OH-CD1 3.37Å; L154-I179 PolarHBondContact O-N 2.77Å; Q155-I179 HydrophobicContact CB-CB 4.33Å; Q155-I179 HydrophobicContact CG-CB 4.23Å; Q155-I179 HydrophobicContact CG-CG2 4.18Å; A156-I179 PolarHBondContact N-O 2.8Å; D157-I179 HydrophobicContact CB-CG2 4.2Å; V177-I179 HydrophobicContact CG1-CD1 4.09Å; V177-I179 HydrophobicContact CG1-CG1 4.05Å; I179-N181 WeakPolarHBondContact CG2-OD1 3.13Å; I179-D202 HydrophobicContact CG2-CB 4.45Å
180	L	94.6	Very high	90.9	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.237	C	C	.	.			trans	-136.2	20.7	-174.3	-65.8	174.4	0	0	0	112.4	F140 A156 I161 I164 F169 L178 N183 D202 L203 N206	F140-L180 HydrophobicContact CE2-CD2 3.92Å; F140-L180 HydrophobicContact CZ-CD2 4.46Å; A156-L180 HydrophobicContact CB-CD2 4.11Å; I161-L180 HydrophobicContact CD1-CD2 4.45Å; I164-L180 HydrophobicContact CD1-CD1 4.11Å; F169-L180 HydrophobicContact CZ-CD1 4.46Å; L178-L180 HydrophobicContact CD1-CD1 4.02Å; L178-L180 HydrophobicContact CD1-CD2 4.18Å; L178-L180 HydrophobicContact CD1-CG 3.87Å; L178-L180 HydrophobicContact CD2-CD1 3.89Å; L178-L180 HydrophobicContact CG-CD1 3.88Å; L178-L180 HydrophobicContact CG-CG 3.99Å; L180-N183 PolarHBondContact O-ND2 2.87Å; L180-D202 CarbonylContact C-O 3.52Å; L180-D202 WeakPolarHBondContact CA-O 3.32Å; L180-D202 PolarHBondContact N-O 2.75Å; L180-L203 HydrophobicContact CB-CD2 4.09Å; L180-L203 HydrophobicContact CD1-CD2 4.16Å; L180-N206 PolarHBondContact O-ND2 2.87Å
181	N	88.4	Confident	90.8	Very high	11 Å²	11	41.5 Å²	41.5	6%	0.059	22%	0.221	C	C	.	.			trans	-61.5	164.7	176.3	57.8	-73.3	0	0	0	112.3	D157 Y158 I179 N183 D202 R204	D157-N181 VanDerWaalsContact CA-O 3.25Å; D157-N181 WeakPolarHBondContact CA-O 3.41Å; D157-N181 WeakPolarHBondContact CB-ND2 3.42Å; D157-N181 WeakPolarHBondContact CB-O 3.26Å; D157-N181 VanDerWaalsContact CB-OD1 3.3Å; D157-N181 WeakPolarHBondContact CB-OD1 3.24Å; Y158-N181 PolarHBondContact N-O 3.37Å; I179-N181 WeakPolarHBondContact CG2-OD1 3.13Å; N181-N183 PolarHBondContact O-N 3.13Å; N181-N183 PolarHBondContact O-ND2 2.82Å; N181-D202 PolarHBondContact OD1-OD2 3.17Å; N181-R204 CarbonylContact C-O 3.6Å; N181-R204 WeakPolarHBondContact CA-O 3.17Å; N181-R204 HydrophobicContact CB-CB 4.11Å
182	D	89.4	Confident	90.9	Very high	52 Å²	52	39.1 Å²	39.1	28%	0.278	21%	0.209	S	C	.	.	S	Bend	trans	53.3	54.7	173.5	-62.5	-63.7	0	0	0	112.5	Y158 N159 R204	Y158-D182 WeakPolarHBondContact CA-O 3.49Å; Y158-D182 HydrophobicContact CD1-CB 3.92Å; Y158-D182 HydrophobicContact CD2-CB 4.04Å; Y158-D182 HydrophobicContact CE1-CB 3.82Å; Y158-D182 HydrophobicContact CE2-CB 3.91Å; Y158-D182 WeakPolarHBondContact CE2-OD2 3.37Å; Y158-D182 HydrophobicContact CG-CB 4.01Å; Y158-D182 PolarHBondContact N-O 3.06Å; Y158-D182 PolarHBondContact OH-OD2 2.77Å; N159-D182 PolarHBondContact N-O 3.21Å; D182-R204 PolarHBondContact N-O 2.98Å
183	N	94	Very high	90.8	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.021	21%	0.209	C	C	.	.	S	Bend	trans	-136.3	-178.5	-177.5	-93.6	-83	0	0	0	110.9	A156 N159 I161 L180 N181 I185 N206	A156-N183 PolarHBondContact O-ND2 3.46Å; N159-N183 WeakPolarHBondContact CB-OD1 3.17Å; N159-N183 PolarHBondContact O-OD1 3.1Å; I161-N183 VanDerWaalsContact CB-OD1 3.24Å; I161-N183 WeakPolarHBondContact CB-OD1 3.04Å; I161-N183 WeakPolarHBondContact CD1-OD1 3.37Å; I161-N183 VanDerWaalsContact CG1-OD1 3.25Å; I161-N183 WeakPolarHBondContact CG1-OD1 3.24Å; I161-N183 PolarHBondContact N-OD1 3.05Å; L180-N183 PolarHBondContact O-ND2 2.87Å; N181-N183 PolarHBondContact O-N 3.13Å; N181-N183 PolarHBondContact O-ND2 2.82Å; N183-I185 HydrophobicContact CB-CD1 4.49Å; N183-I185 HydrophobicContact CB-CG1 4.39Å; N183-N206 VanDerWaalsContact C-OD1 3.31Å; N183-N206 WeakPolarHBondContact CB-OD1 3.27Å; N183-N206 WeakPolarHBondContact O-CA 3.14Å; N183-N206 PolarHBondContact O-OD1 3.38Å
184	L	93.4	Very high	90.7	Very high	66 Å²	66	42.3 Å²	42.3	35%	0.346	21%	0.213	S	C	.	.			trans	-112.2	23.2	-172	-61.6	178	0	0	0	113.7	V160 I161 K162 P186	V160-L184 HydrophobicContact CB-CD1 4.15Å; V160-L184 HydrophobicContact CG1-CD1 4.49Å; I161-L184 CarbonylContact O-C 3.12Å; I161-L184 VanDerWaalsContact O-CA 3.27Å; I161-L184 WeakPolarHBondContact O-CA 3.17Å; I161-L184 PolarHBondContact O-N 3.31Å; K162-L184 HydrophobicContact CG-CB 4.08Å; K162-L184 HydrophobicContact CG-CD1 4.45Å; L184-P186 VanDerWaalsContact O-CD 3.31Å; L184-P186 WeakPolarHBondContact O-CD 3.29Å
185	I	95.4	Very high	90.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.209	C	C	.	.			trans	-72.6	118	-170.9	-55.9	168.4	0	0	0	110.2	I161 I164 N183 M187 L188 N206 R207 L208	I161-I185 HydrophobicContact CB-CG1 4.36Å; I161-I185 HydrophobicContact CG2-CD1 4.4Å; I161-I185 HydrophobicContact CG2-CG1 4.09Å; I161-I185 WeakPolarHBondContact O-CG1 3.38Å; I161-I185 PolarHBondContact O-N 2.85Å; I161-I185 VanDerWaalsContact O-N 3.11Å; I164-I185 HydrophobicContact CD1-CD1 3.83Å; I164-I185 HydrophobicContact CG1-CD1 4.48Å; N183-I185 HydrophobicContact CB-CD1 4.49Å; N183-I185 HydrophobicContact CB-CG1 4.39Å; I185-M187 WeakPolarHBondContact CG2-O 3.01Å; I185-L188 HydrophobicContact CG2-CD2 3.92Å; I185-N206 VanDerWaalsContact CB-OD1 3.28Å; I185-N206 WeakPolarHBondContact CB-OD1 3.05Å; I185-N206 VanDerWaalsContact CG1-OD1 3.31Å; I185-N206 WeakPolarHBondContact CG1-OD1 3.41Å; I185-N206 PolarHBondContact N-OD1 2.75Å; I185-N206 VanDerWaalsContact N-OD1 3.17Å; I185-R207 CarbonylContact O-C 3.6Å; I185-R207 VanDerWaalsContact O-CA 3.26Å; I185-R207 WeakPolarHBondContact O-CA 3.29Å; I185-R207 WeakPolarHBondContact O-CB 3.19Å; I185-R207 PolarHBondContact O-N 2.84Å; I185-L208 HydrophobicContact CB-CD2 4.49Å; I185-L208 HydrophobicContact CG2-CD2 3.93Å; I185-L208 PolarHBondContact O-N 2.99Å; I185-L208 VanDerWaalsContact O-N 3.17Å
186	P	89.1	Confident	90.3	Very high	59 Å²	59	40.4 Å²	40.4	38%	0.383	21%	0.214	S	C	.	.			trans	-87.9	-25.6	-177.4	34.1	-33.5	0	0	0	113.5	K162 L184 R207	K162-P186 WeakPolarHBondContact O-CD 3.18Å; L184-P186 VanDerWaalsContact O-CD 3.31Å; L184-P186 WeakPolarHBondContact O-CD 3.29Å; P186-R207 WeakPolarHBondContact CA-O 3.26Å
187	M	89.4	Confident	90.3	Very high	120 Å²	120	38.9 Å²	38.9	59%	0.591	22%	0.218	S	C	*	.			trans	-161.6	155.9	176.8	56.7	172.5	62.3	0	0	109.6	I185	I185-M187 WeakPolarHBondContact CG2-O 3.01Å
188	L	91.8	Very high	90.4	Very high	9 Å²	9	37.8 Å²	37.8	5%	0.047	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-99.1	141.4	172.5	-64.1	172.6	0	0	0	110.3	I164 I185 L192 F193 L203 L208 L211 M216	I164-L188 HydrophobicContact CD1-CD2 4.25Å; I185-L188 HydrophobicContact CG2-CD2 3.92Å; L188-L192 HydrophobicContact CD2-CD2 4.09Å; L188-F193 HydrophobicContact CD1-CE2 4.07Å; L188-F193 HydrophobicContact CD1-CZ 4.16Å; L188-L203 HydrophobicContact CD1-CD1 3.98Å; L188-L203 HydrophobicContact CD1-CD2 4.47Å; L188-L208 HydrophobicContact CG-CD2 4.15Å; L188-L211 HydrophobicContact CD1-CD2 4.02Å; L188-M216 HydrophobicContact CB-CE 3.94Å; L188-M216 HydrophobicContact CB-SD 4.33Å
189	P	90.7	Very high	89.9	Confident	31 Å²	31	39 Å²	39	20%	0.201	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-73.3	153.4	176.8	32.1	-38.9	0	0	0	112.7	I164 L192	I164-P189 VanDerWaalsContact O-CG 3.31Å; I164-P189 WeakPolarHBondContact O-CG 3.31Å; P189-L192 HydrophobicContact CG-CB 4.2Å; P189-L192 HydrophobicContact CG-CD1 4.35Å; P189-L192 HydrophobicContact CG-CD2 4.21Å; P189-L192 HydrophobicContact CG-CG 4.49Å; P189-L192 WeakPolarHBondContact O-CB 3.26Å
190	T	88.1	Confident	89.5	Confident	72 Å²	72	39.9 Å²	39.9	44%	0.442	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	147.1	175.2	60.3	0	0	0	0	112.1	S166 L192	S166-T190 VanDerWaalsContact CB-O 3.24Å; S166-T190 WeakPolarHBondContact CB-O 3.27Å; T190-L192 PolarHBondContact O-N 2.89Å
191	N	87.9	Confident	89.3	Confident	70 Å²	70	40 Å²	40	37%	0.374	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	8.4	-177.2	-55.4	-89.1	0	0	0	116.1	F193 K194 G215	N191-F193 VanDerWaalsContact C-N 3.31Å; N191-F193 PolarHBondContact O-N 3.44Å; N191-K194 HydrophobicContact CB-CB 4.24Å; N191-K194 HydrophobicContact CB-CD 4.26Å; N191-K194 WeakPolarHBondContact O-CB 3.42Å; N191-K194 PolarHBondContact O-N 3.48Å; N191-G215 WeakPolarHBondContact CA-O 3.46Å; N191-G215 PolarHBondContact N-O 3.36Å
192	L	90.8	Very high	89.1	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.01	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-44	-178	-177.2	58.3	0	0	0	114	I164 A168 F169 L188 P189 T190	I164-L192 HydrophobicContact CG2-CD1 3.66Å; I164-L192 HydrophobicContact CG2-CD2 3.97Å; A168-L192 HydrophobicContact CB-CD1 4.43Å; F169-L192 HydrophobicContact CD2-CD1 3.51Å; F169-L192 HydrophobicContact CD2-CD2 4.19Å; F169-L192 HydrophobicContact CD2-CG 3.68Å; F169-L192 HydrophobicContact CE2-CD1 3.84Å; F169-L192 HydrophobicContact CE2-CD2 3.87Å; F169-L192 HydrophobicContact CE2-CG 3.89Å; F169-L192 HydrophobicContact CG-CD1 4.14Å; L188-L192 HydrophobicContact CD2-CD2 4.09Å; P189-L192 HydrophobicContact CG-CB 4.2Å; P189-L192 HydrophobicContact CG-CD1 4.35Å; P189-L192 HydrophobicContact CG-CD2 4.21Å; P189-L192 HydrophobicContact CG-CG 4.49Å; P189-L192 WeakPolarHBondContact O-CB 3.26Å; T190-L192 PolarHBondContact O-N 2.89Å
193	F	90.6	Very high	89.3	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.018	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	6.3	-176.8	-54.7	-68.2	0	0	0	113.5	F169 L178 L188 N191 A195 V196 L198 L201 H219 I220	F169-F193 HydrophobicContact CD2-CD1 4.49Å; F169-F193 HydrophobicContact CD2-CE1 4.28Å; F169-F193 HydrophobicContact CE2-CE1 4.21Å; L178-F193 HydrophobicContact CD2-CE1 3.96Å; L188-F193 HydrophobicContact CD1-CE2 4.07Å; L188-F193 HydrophobicContact CD1-CZ 4.16Å; N191-F193 VanDerWaalsContact C-N 3.31Å; N191-F193 PolarHBondContact O-N 3.44Å; F193-A195 PolarHBondContact O-N 2.96Å; F193-A195 VanDerWaalsContact O-N 3.13Å; F193-V196 PolarHBondContact O-N 3.27Å; F193-V196 VanDerWaalsContact O-N 3.08Å; F193-L198 HydrophobicContact CD1-CD1 3.7Å; F193-L198 HydrophobicContact CE1-CD1 3.75Å; F193-L201 HydrophobicContact CE1-CD2 4.39Å; F193-L201 HydrophobicContact CZ-CD2 4.11Å; F193-H219 HydrophobicContact CB-CB 4.43Å; F193-I220 HydrophobicContact CB-CG1 4.06Å; F193-I220 HydrophobicContact CD2-CD1 3.56Å; F193-I220 HydrophobicContact CD2-CG1 3.71Å; F193-I220 HydrophobicContact CE2-CD1 3.75Å; F193-I220 HydrophobicContact CE2-CG1 4.37Å; F193-I220 HydrophobicContact CG-CD1 4.22Å; F193-I220 HydrophobicContact CG-CG1 3.92Å
194	K	88.6	Confident	89	Confident	138 Å²	138	40.4 Å²	40.4	60%	0.6	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.1	-172.7	178.6	168.2	-179.9	175.3	0	114.7	N191	N191-K194 HydrophobicContact CB-CB 4.24Å; N191-K194 HydrophobicContact CB-CD 4.26Å; N191-K194 WeakPolarHBondContact O-CB 3.42Å; N191-K194 PolarHBondContact O-N 3.48Å
195	A	86.4	Confident	88.7	Confident	43 Å²	43	38 Å²	38	36%	0.355	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	5.7	179.6	0	0	0	0	0	113.9	R170 F193	R170-A195 WeakPolarHBondContact O-CB 3.5Å; F193-A195 PolarHBondContact O-N 2.96Å; F193-A195 VanDerWaalsContact O-N 3.13Å
196	V	90.7	Very high	88.7	Confident	16 Å²	16	38 Å²	38	10%	0.097	21%	0.212	C	C	.	.			trans	-128.2	148.9	-166.3	-171.2	0	0	0	0	110.7	F169 L175 F193 L198	F169-V196 HydrophobicContact CB-CG2 3.82Å; F169-V196 WeakPolarHBondContact O-CG2 3.36Å; L175-V196 HydrophobicContact CB-CG1 3.82Å; L175-V196 HydrophobicContact CD2-CG1 4.22Å; L175-V196 HydrophobicContact CG-CG1 4.22Å; L175-V196 VanDerWaalsContact O-CG1 3.26Å; L175-V196 WeakPolarHBondContact O-CG1 3.42Å; F193-V196 PolarHBondContact O-N 3.27Å; F193-V196 VanDerWaalsContact O-N 3.08Å; V196-L198 HydrophobicContact CG1-CD2 3.63Å; V196-L198 HydrophobicContact CG1-CG 3.79Å
197	S	87.9	Confident	88.9	Confident	63 Å²	63	41.7 Å²	41.7	44%	0.441	22%	0.218	S	C	.	.			trans	-124.4	75.3	178.5	-167	0	0	0	0	110.4	L175 S223	L175-S197 CarbonylContact O-C 3.43Å; S197-S223 WeakPolarHBondContact OG-CB 2.89Å; S197-S223 PolarHBondContact OG-OG 3.02Å
198	L	88.3	Confident	89.1	Confident	5 Å²	5	36 Å²	36	3%	0.026	19%	0.19	C	C	.	.			trans	-70.8	131.1	-177.1	-63.4	178.7	0	0	0	111.7	L175 R176 L178 F193 V196 L201 S223 L224	L175-L198 HydrophobicContact CD2-CD2 4.21Å; L175-L198 HydrophobicContact CG-CD2 3.95Å; R176-L198 CarbonylContact O-C 3.38Å; R176-L198 WeakPolarHBondContact O-CA 3.47Å; L178-L198 HydrophobicContact CB-CD1 4.11Å; L178-L198 HydrophobicContact CB-CD2 3.77Å; L178-L198 HydrophobicContact CD2-CD1 4.05Å; F193-L198 HydrophobicContact CD1-CD1 3.7Å; F193-L198 HydrophobicContact CE1-CD1 3.75Å; V196-L198 HydrophobicContact CG1-CD2 3.63Å; V196-L198 HydrophobicContact CG1-CG 3.79Å; L198-L201 HydrophobicContact CD1-CB 4.21Å; L198-L201 HydrophobicContact CD1-CD1 4.15Å; L198-L201 HydrophobicContact CD1-CD2 4.04Å; L198-L201 HydrophobicContact CD1-CG 4.37Å; L198-S223 CarbonylContact O-C 3.34Å; L198-L224 WeakPolarHBondContact O-CA 3.39Å; L198-L224 PolarHBondContact O-N 3.07Å
199	T	83.1	Confident	89	Confident	25 Å²	25	41.2 Å²	41.2	15%	0.153	21%	0.212	C	C	.	.	S	Bend	trans	-96	-30	166.1	64.6	0	0	0	0	111.7	R176 S223 M225 E226	R176-T199 HydrophobicContact CB-CG2 4.42Å; R176-T199 PolarHBondContact O-N 3.04Å; R176-T199 PolarHBondContact O-OG1 2.81Å; T199-S223 WeakPolarHBondContact CA-O 3.34Å; T199-M225 WeakPolarHBondContact O-CA 3.3Å; T199-M225 WeakPolarHBondContact O-CB 3.43Å; T199-M225 PolarHBondContact O-N 3.4Å; T199-E226 PolarHBondContact O-N 3.03Å
200	H	81.7	Confident	88.8	Confident	47 Å²	47	40.3 Å²	40.3	22%	0.218	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	130.1	177.3	-56.9	64.8	0	0	0	110	R176 V177 L178 E226	R176-H200 PolarHBondContact O-N 3.05Å; V177-H200 WeakPolarHBondContact CA-O 3.49Å; V177-H200 HydrophobicContact CG1-CB 4.22Å; V177-H200 HydrophobicContact CG2-CB 4.19Å; L178-H200 PolarHBondContact N-O 3.18Å; H200-E226 WeakPolarHBondContact CA-O 3.49Å; H200-E226 IonicContact CD2-OE2 2.64Å; H200-E226 PolarHBondContact CD2-OE2 2.91Å
201	L	89.2	Confident	88.9	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.016	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	114.4	177.9	175.7	53.8	0	0	0	110.3	L178 F193 L198 L203 I220 L224 E226 L227 Q228	L178-L201 HydrophobicContact CB-CD1 4.14Å; L178-L201 HydrophobicContact CD2-CD1 3.98Å; L178-L201 HydrophobicContact CG-CD1 4.04Å; L178-L201 WeakPolarHBondContact O-CA 3.26Å; F193-L201 HydrophobicContact CE1-CD2 4.39Å; F193-L201 HydrophobicContact CZ-CD2 4.11Å; L198-L201 HydrophobicContact CD1-CB 4.21Å; L198-L201 HydrophobicContact CD1-CD1 4.15Å; L198-L201 HydrophobicContact CD1-CD2 4.04Å; L198-L201 HydrophobicContact CD1-CG 4.37Å; L201-L203 HydrophobicContact CD1-CD1 4.17Å; L201-L203 HydrophobicContact CD1-CD2 4.34Å; L201-L203 HydrophobicContact CD1-CG 3.93Å; L201-L203 HydrophobicContact CD2-CD1 3.95Å; L201-L203 HydrophobicContact CG-CD1 3.95Å; L201-L203 HydrophobicContact CG-CG 4.08Å; L201-I220 HydrophobicContact CD2-CD1 4.18Å; L201-L224 HydrophobicContact CB-CD1 4.35Å; L201-E226 PolarHBondContact N-O 3.12Å; L201-L227 HydrophobicContact CB-CD1 4Å; L201-L227 HydrophobicContact CD2-CD1 3.91Å; L201-L227 HydrophobicContact CG-CD1 3.82Å; L201-L227 VanDerWaalsContact O-CA 3.32Å; L201-L227 WeakPolarHBondContact O-CA 3.35Å; L201-Q228 PolarHBondContact O-N 3.48Å
202	D	85.5	Confident	88.7	Confident	13 Å²	13	37.1 Å²	37.1	7%	0.07	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123	173.5	-169.6	-3.3	0	0	0	110.7	L178 I179 L180 N181 R204 Q228	L178-D202 PolarHBondContact O-N 2.97Å; I179-D202 HydrophobicContact CG2-CB 4.45Å; L180-D202 CarbonylContact C-O 3.52Å; L180-D202 WeakPolarHBondContact CA-O 3.32Å; L180-D202 PolarHBondContact N-O 2.75Å; N181-D202 PolarHBondContact OD1-OD2 3.17Å; D202-R204 WeakPolarHBondContact OD1-CB 3.16Å; D202-R204 VanDerWaalsContact OD1-CG 3.27Å; D202-R204 WeakPolarHBondContact OD1-CG 3.47Å; D202-R204 IonicContact OD1-CZ 3.95Å; D202-R204 PolarHBondContact OD1-N 3.05Å; D202-R204 IonicContact OD1-NE 2.84Å; D202-R204 PolarHBondContact OD1-NE 3.39Å; D202-R204 IonicContact OD2-CZ 2.64Å; D202-R204 IonicContact OD2-NE 3.48Å; D202-R204 PolarHBondContact OD2-NE 2.93Å; D202-R204 IonicContact OD2-NH2 3.87Å; D202-R204 PolarHBondContact OD2-NH2 3.48Å; D202-Q228 HydrophobicContact CB-CB 4.47Å; D202-Q228 VanDerWaalsContact CG-OE1 3.24Å; D202-Q228 PolarHBondContact OD2-OE1 3.32Å; D202-Q228 VanDerWaalsContact OD2-OE1 3.13Å
203	L	92.6	Very high	88.3	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.016	19%	0.19	C	C	.	.			trans	-128.7	17.3	179.6	-70.5	166.5	0	0	0	112	L180 L188 L201 N206 L208 L227 Q228 L229 N232	L180-L203 HydrophobicContact CB-CD2 4.09Å; L180-L203 HydrophobicContact CD1-CD2 4.16Å; L188-L203 HydrophobicContact CD1-CD1 3.98Å; L188-L203 HydrophobicContact CD1-CD2 4.47Å; L201-L203 HydrophobicContact CD1-CD1 4.17Å; L201-L203 HydrophobicContact CD1-CD2 4.34Å; L201-L203 HydrophobicContact CD1-CG 3.93Å; L201-L203 HydrophobicContact CD2-CD1 3.95Å; L201-L203 HydrophobicContact CG-CD1 3.95Å; L201-L203 HydrophobicContact CG-CG 4.08Å; L203-N206 WeakPolarHBondContact O-CB 3.39Å; L203-N206 PolarHBondContact O-ND2 3.41Å; L203-L208 HydrophobicContact CB-CD1 4.13Å; L203-L208 HydrophobicContact CD1-CD1 4.21Å; L203-L227 HydrophobicContact CD1-CD1 4.47Å; L203-Q228 PolarHBondContact N-O 3.34Å; L203-L229 HydrophobicContact CB-CD2 4.15Å; L203-L229 HydrophobicContact CD1-CD2 4Å; L203-N232 PolarHBondContact O-ND2 2.81Å
204	R	88.6	Confident	87.8	Confident	59 Å²	59	47.3 Å²	47.3	22%	0.223	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	158.4	-177.7	-69	177.9	-66.1	148.2	3.5	113.4	N181 D182 D202 N206 Q228 E230	N181-R204 CarbonylContact C-O 3.6Å; N181-R204 WeakPolarHBondContact CA-O 3.17Å; N181-R204 HydrophobicContact CB-CB 4.11Å; D182-R204 PolarHBondContact N-O 2.98Å; D202-R204 WeakPolarHBondContact OD1-CB 3.16Å; D202-R204 VanDerWaalsContact OD1-CG 3.27Å; D202-R204 WeakPolarHBondContact OD1-CG 3.47Å; D202-R204 IonicContact OD1-CZ 3.95Å; D202-R204 PolarHBondContact OD1-N 3.05Å; D202-R204 IonicContact OD1-NE 2.84Å; D202-R204 PolarHBondContact OD1-NE 3.39Å; D202-R204 IonicContact OD2-CZ 2.64Å; D202-R204 IonicContact OD2-NE 3.48Å; D202-R204 PolarHBondContact OD2-NE 2.93Å; D202-R204 IonicContact OD2-NH2 3.87Å; D202-R204 PolarHBondContact OD2-NH2 3.48Å; R204-N206 PolarHBondContact O-N 3.2Å; R204-N206 PolarHBondContact O-ND2 2.97Å; R204-Q228 HydrophobicContact CG-CB 3.75Å; R204-Q228 VanDerWaalsContact CZ-OE1 3.24Å; R204-E230 WeakPolarHBondContact CA-O 3.5Å; R204-E230 HydrophobicContact CG-CB 3.99Å; R204-E230 WeakPolarHBondContact CG-OE2 3.25Å
205	G	87.2	Confident	87.2	Confident	16 Å²	16	41 Å²	41	17%	0.165	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	18.4	174	0	0	0	0	0	115	E230	G205-E230 PolarHBondContact N-O 3.17Å
206	N	94.3	Very high	87.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.18	C	C	.	.	S	Bend	trans	-93.8	-171.1	-179.8	-88.2	-91.9	0	0	0	111.6	L180 N183 I185 L203 R204 L208 N232 P233	L180-N206 PolarHBondContact O-ND2 2.87Å; N183-N206 VanDerWaalsContact C-OD1 3.31Å; N183-N206 WeakPolarHBondContact CB-OD1 3.27Å; N183-N206 WeakPolarHBondContact O-CA 3.14Å; N183-N206 PolarHBondContact O-OD1 3.38Å; I185-N206 VanDerWaalsContact CB-OD1 3.28Å; I185-N206 WeakPolarHBondContact CB-OD1 3.05Å; I185-N206 VanDerWaalsContact CG1-OD1 3.31Å; I185-N206 WeakPolarHBondContact CG1-OD1 3.41Å; I185-N206 PolarHBondContact N-OD1 2.75Å; I185-N206 VanDerWaalsContact N-OD1 3.17Å; L203-N206 WeakPolarHBondContact O-CB 3.39Å; L203-N206 PolarHBondContact O-ND2 3.41Å; R204-N206 PolarHBondContact O-N 3.2Å; R204-N206 PolarHBondContact O-ND2 2.97Å; N206-L208 HydrophobicContact CB-CG 4.28Å; N206-N232 WeakPolarHBondContact CA-OD1 3.49Å; N206-N232 WeakPolarHBondContact CB-OD1 3.44Å; N206-N232 PolarHBondContact O-OD1 3.31Å; N206-P233 VanDerWaalsContact O-CD 3.3Å; N206-P233 WeakPolarHBondContact O-CD 3.48Å
207	R	93.6	Very high	86.7	Confident	136 Å²	136	38.4 Å²	38.4	51%	0.513	18%	0.175	S	C	.	.			trans	-110.1	20.6	-178.6	-57.4	-56.5	-176.2	-169	1.4	113	I185 P186 K209 N232	I185-R207 CarbonylContact O-C 3.6Å; I185-R207 VanDerWaalsContact O-CA 3.26Å; I185-R207 WeakPolarHBondContact O-CA 3.29Å; I185-R207 WeakPolarHBondContact O-CB 3.19Å; I185-R207 PolarHBondContact O-N 2.84Å; P186-R207 WeakPolarHBondContact CA-O 3.26Å; R207-K209 PolarHBondContact O-N 3.17Å; R207-N232 PolarHBondContact N-OD1 3.45Å
208	L	92.7	Very high	86.4	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.167	C	C	.	.			trans	-64.4	129.9	-176.9	-57.8	172.3	0	0	0	111	I185 L188 L203 N206 L211 N232 P233 W234	I185-L208 HydrophobicContact CB-CD2 4.49Å; I185-L208 HydrophobicContact CG2-CD2 3.93Å; I185-L208 PolarHBondContact O-N 2.99Å; I185-L208 VanDerWaalsContact O-N 3.17Å; L188-L208 HydrophobicContact CG-CD2 4.15Å; L203-L208 HydrophobicContact CB-CD1 4.13Å; L203-L208 HydrophobicContact CD1-CD1 4.21Å; N206-L208 HydrophobicContact CB-CG 4.28Å; L208-L211 HydrophobicContact CD1-CD2 4.45Å; L208-N232 HydrophobicContact CB-CB 4.3Å; L208-N232 WeakPolarHBondContact CB-OD1 3.33Å; L208-N232 VanDerWaalsContact CG-OD1 3.29Å; L208-N232 WeakPolarHBondContact CG-OD1 3.32Å; L208-N232 PolarHBondContact N-OD1 3.08Å; L208-P233 CarbonylContact O-C 3.55Å; L208-P233 WeakPolarHBondContact O-CD 3.16Å; L208-W234 HydrophobicContact CB-CH2 3.65Å; L208-W234 HydrophobicContact CB-CZ2 4.21Å; L208-W234 HydrophobicContact CB-CZ3 3.96Å; L208-W234 HydrophobicContact CD1-CH2 4.07Å
209	K	89.7	Confident	86	Confident	120 Å²	120	40.3 Å²	40.3	52%	0.522	18%	0.178	S	C	.	.			trans	-105.1	-34.4	177.2	-60.5	-168.4	176.4	-173.6	0	113.5	R207 N235	R207-K209 PolarHBondContact O-N 3.17Å; K209-N235 HydrophobicContact CB-CB 4.05Å; K209-N235 PolarHBondContact O-N 2.66Å
210	V	88.5	Confident	85.8	Confident	12 Å²	12	39.6 Å²	39.6	7%	0.073	17%	0.174	C	C	.	.			trans	-148.1	146.3	-175.6	179.7	0	0	0	0	109	F212 N235 E239 I240	V210-F212 HydrophobicContact CG1-CD1 4.35Å; V210-F212 HydrophobicContact CG1-CE1 4.07Å; V210-F212 HydrophobicContact CG1-CZ 4.36Å; V210-N235 HydrophobicContact CG2-CB 4.41Å; V210-E239 HydrophobicContact CG1-CB 4.04Å; V210-E239 HydrophobicContact CG2-CB 4.12Å; V210-I240 HydrophobicContact CB-CD1 4.38Å; V210-I240 HydrophobicContact CG1-CD1 4.39Å; V210-I240 HydrophobicContact CG2-CD1 4.34Å
211	L	88.5	Confident	84.9	Confident	5 Å²	5	38.1 Å²	38.1	3%	0.026	17%	0.171	C	C	.	.			trans	-119.9	123.8	165.4	-65.9	174.3	0	0	0	109.5	L188 L208 M216 L217 L229 W234 L243	L188-L211 HydrophobicContact CD1-CD2 4.02Å; L208-L211 HydrophobicContact CD1-CD2 4.45Å; L211-M216 HydrophobicContact CB-CE 4.09Å; L211-M216 HydrophobicContact CD2-CE 3.51Å; L211-M216 HydrophobicContact CG-CE 4.41Å; L211-L217 HydrophobicContact CB-CD1 4.17Å; L211-L217 HydrophobicContact CB-CD2 4.38Å; L211-L217 HydrophobicContact CB-CG 4.46Å; L211-L217 HydrophobicContact CD1-CD2 4.3Å; L211-L229 HydrophobicContact CD1-CD1 4.23Å; L211-L229 HydrophobicContact CD1-CD2 3.9Å; L211-W234 HydrophobicContact CD1-CH2 3.76Å; L211-W234 HydrophobicContact CD1-CZ3 4.29Å; L211-W234 HydrophobicContact CG-CH2 3.77Å; L211-W234 HydrophobicContact CG-CZ3 3.88Å; L211-L243 HydrophobicContact CB-CB 4.49Å; L211-L243 HydrophobicContact CB-CD1 4.27Å; L211-L243 HydrophobicContact CB-CD2 4.27Å; L211-L243 HydrophobicContact CD1-CD1 4.11Å; L211-L243 HydrophobicContact CD1-CD2 4.27Å; L211-L243 HydrophobicContact CG-CD2 4.49Å
212	F	84.4	Confident	84.1	Confident	69 Å²	69	48.8 Å²	48.8	30%	0.303	21%	0.211	S	C	.	.			trans	-77.8	148	177.5	-59.3	-67.3	0	0	0	111.3	V210 M216 L217	V210-F212 HydrophobicContact CG1-CD1 4.35Å; V210-F212 HydrophobicContact CG1-CE1 4.07Å; V210-F212 HydrophobicContact CG1-CZ 4.36Å; F212-M216 HydrophobicContact CB-SD 4.23Å; F212-M216 HydrophobicContact CD2-SD 4.3Å; F212-M216 WeakPolarHBondContact O-CB 3.46Å; F212-L217 WeakPolarHBondContact O-CG 3.03Å
213	Y	81.9	Confident	83.5	Confident	39 Å²	39	49.8 Å²	49.8	15%	0.153	22%	0.22	C	C	.	.	I	π-helix	trans	-76	-52.5	176.8	173.2	-110.7	0	0	0	111.2	G215 M216 L217 D218 W246 I295	Y213-G215 PolarHBondContact O-N 3.23Å; Y213-M216 PolarHBondContact O-N 2.79Å; Y213-L217 HydrophobicContact CD2-CB 4.21Å; Y213-L217 PolarHBondContact O-N 3.08Å; Y213-D218 HydrophobicContact CE2-CB 4.13Å; Y213-D218 PolarHBondContact O-N 2.83Å; Y213-D218 VanDerWaalsContact O-N 3.17Å; Y213-W246 HydrophobicContact CD2-CB 4.22Å; Y213-W246 AromaticContact CD2-CD1 3.97Å; Y213-W246 HydrophobicContact CD2-CG 4.43Å; Y213-W246 AromaticContact CE2-CD1 3.93Å; Y213-I295 HydrophobicContact CD1-CG1 4.3Å; Y213-I295 HydrophobicContact CE1-CG1 4.01Å
214	R	80.7	Confident	82.8	Confident	182 Å²	182	49.9 Å²	49.9	69%	0.687	22%	0.22	S	C	*	.	I	π-helix	trans	-73	119.6	-172	-172.4	176.5	-176.5	172.4	1.5	111.6	M216	R214-M216 VanDerWaalsContact C-N 3.31Å
215	G	76.8	Confident	82	Confident	6 Å²	6	51.7 Å²	51.7	6%	0.062	23%	0.232	C	C	.	.	I	π-helix	trans	77.3	6.3	-177	0	0	0	0	0	115	N191 Y213 D218	N191-G215 WeakPolarHBondContact CA-O 3.46Å; N191-G215 PolarHBondContact N-O 3.36Å; Y213-G215 PolarHBondContact O-N 3.23Å; G215-D218 VanDerWaalsContact CA-OD1 3.28Å; G215-D218 WeakPolarHBondContact CA-OD1 3.1Å; G215-D218 PolarHBondContact N-OD1 2.82Å; G215-D218 PolarHBondContact N-OD2 2.91Å
216	M	83.1	Confident	81.4	Confident	2 Å²	2	52 Å²	52	1%	0.01	23%	0.229	C	C	.	.	I	π-helix	trans	-132.1	-79.2	177.1	-83.7	166.3	52.7	0	0	110.6	L188 L211 F212 Y213 R214 D218 H219 I220	L188-M216 HydrophobicContact CB-CE 3.94Å; L188-M216 HydrophobicContact CB-SD 4.33Å; L211-M216 HydrophobicContact CB-CE 4.09Å; L211-M216 HydrophobicContact CD2-CE 3.51Å; L211-M216 HydrophobicContact CG-CE 4.41Å; F212-M216 HydrophobicContact CB-SD 4.23Å; F212-M216 HydrophobicContact CD2-SD 4.3Å; F212-M216 WeakPolarHBondContact O-CB 3.46Å; Y213-M216 PolarHBondContact O-N 2.79Å; R214-M216 VanDerWaalsContact C-N 3.31Å; M216-D218 VanDerWaalsContact C-N 3.26Å; M216-D218 PolarHBondContact N-OD1 3.32Å; M216-D218 PolarHBondContact O-N 3.12Å; M216-H219 PolarHBondContact O-N 3.49Å; M216-I220 WeakPolarHBondContact O-CG1 3.3Å; M216-I220 PolarHBondContact O-N 2.66Å
217	L	82.1	Confident	80.9	Confident	2 Å²	2	52 Å²	52	1%	0.01	23%	0.229	C	C	.	.	I	π-helix	trans	-68.7	-27.2	-174.4	-60	171.5	0	0	0	112.5	L211 F212 Y213 H219 I220 G221 L243 W246	L211-L217 HydrophobicContact CB-CD1 4.17Å; L211-L217 HydrophobicContact CB-CD2 4.38Å; L211-L217 HydrophobicContact CB-CG 4.46Å; L211-L217 HydrophobicContact CD1-CD2 4.3Å; F212-L217 WeakPolarHBondContact O-CG 3.03Å; Y213-L217 HydrophobicContact CD2-CB 4.21Å; Y213-L217 PolarHBondContact O-N 3.08Å; L217-H219 PolarHBondContact O-N 2.74Å; L217-I220 HydrophobicContact CD2-CD1 4.37Å; L217-I220 PolarHBondContact O-N 2.97Å; L217-G221 PolarHBondContact O-N 2.95Å; L217-L243 HydrophobicContact CD1-CB 4.31Å; L217-L243 HydrophobicContact CD1-CD1 3.77Å; L217-L243 HydrophobicContact CD2-CD1 4.32Å; L217-W246 HydrophobicContact CB-CB 4.38Å; L217-W246 HydrophobicContact CB-CD2 3.82Å; L217-W246 HydrophobicContact CB-CG 3.7Å; L217-W246 HydrophobicContact CB-CZ2 4.46Å; L217-W246 HydrophobicContact CD1-CB 3.95Å; L217-W246 HydrophobicContact CD1-CD2 4.09Å; L217-W246 HydrophobicContact CD1-CE3 4.24Å; L217-W246 HydrophobicContact CD1-CG 3.99Å; L217-W246 HydrophobicContact CD2-CD2 4.03Å; L217-W246 HydrophobicContact CD2-CE3 3.96Å; L217-W246 HydrophobicContact CD2-CH2 4.17Å; L217-W246 HydrophobicContact CD2-CZ2 4.24Å; L217-W246 HydrophobicContact CD2-CZ3 4.03Å; L217-W246 HydrophobicContact CG-CD2 4.2Å; L217-W246 HydrophobicContact CG-CE3 4.49Å; L217-W246 HydrophobicContact CG-CG 4.32Å; L217-W246 PolarHBondContact O-NE1 2.97Å
218	D	81.9	Confident	80.4	Confident	49 Å²	49	47 Å²	47	26%	0.262	21%	0.212	S	C	.	.	H	α-helix	trans	-59.7	-27.5	172.2	61.2	-12.6	0	0	0	114.3	Y213 G215 M216	Y213-D218 HydrophobicContact CE2-CB 4.13Å; Y213-D218 PolarHBondContact O-N 2.83Å; Y213-D218 VanDerWaalsContact O-N 3.17Å; G215-D218 VanDerWaalsContact CA-OD1 3.28Å; G215-D218 WeakPolarHBondContact CA-OD1 3.1Å; G215-D218 PolarHBondContact N-OD1 2.82Å; G215-D218 PolarHBondContact N-OD2 2.91Å; M216-D218 VanDerWaalsContact C-N 3.26Å; M216-D218 PolarHBondContact N-OD1 3.32Å; M216-D218 PolarHBondContact O-N 3.12Å
219	H	81	Confident	80.2	Confident	58 Å²	58	47 Å²	47	27%	0.269	21%	0.212	S	C	.	.	H	α-helix	trans	-90.5	-33.7	176.6	-65.7	79.6	0	0	0	112.8	F193 M216 L217	F193-H219 HydrophobicContact CB-CB 4.43Å; M216-H219 PolarHBondContact O-N 3.49Å; L217-H219 PolarHBondContact O-N 2.74Å
220	I	77.4	Confident	80	Confident	10 Å²	10	43.6 Å²	43.6	5%	0.051	20%	0.198	C	C	.	.	H	α-helix	trans	-73.4	-42.2	-175	-57	168.3	0	0	0	112.3	F193 L201 M216 L217 R222 L224	F193-I220 HydrophobicContact CB-CG1 4.06Å; F193-I220 HydrophobicContact CD2-CD1 3.56Å; F193-I220 HydrophobicContact CD2-CG1 3.71Å; F193-I220 HydrophobicContact CE2-CD1 3.75Å; F193-I220 HydrophobicContact CE2-CG1 4.37Å; F193-I220 HydrophobicContact CG-CD1 4.22Å; F193-I220 HydrophobicContact CG-CG1 3.92Å; L201-I220 HydrophobicContact CD2-CD1 4.18Å; M216-I220 WeakPolarHBondContact O-CG1 3.3Å; M216-I220 PolarHBondContact O-N 2.66Å; L217-I220 HydrophobicContact CD2-CD1 4.37Å; L217-I220 PolarHBondContact O-N 2.97Å; I220-R222 PolarHBondContact O-N 2.75Å; I220-L224 HydrophobicContact CG2-CB 4.26Å; I220-L224 HydrophobicContact CG2-CD1 3.84Å; I220-L224 HydrophobicContact CG2-CD2 3.6Å; I220-L224 HydrophobicContact CG2-CG 4.12Å
221	G	64.1	Low	79.9	Confident	16 Å²	16	50 Å²	50	17%	0.165	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	10.7	-160.6	0	0	0	0	0	118.5	L217 P251	L217-G221 PolarHBondContact O-N 2.95Å; G221-P251 WeakPolarHBondContact O-CD 3.28Å
222	R	71.4	Confident	80	Confident	227 Å²	227	50.2 Å²	50.2	86%	0.857	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-32	-176.3	-65.9	-174.2	-177.5	-174.4	0.8	115	I220	I220-R222 PolarHBondContact O-N 2.75Å
223	S	73.1	Confident	80.2	Confident	35 Å²	35	48.1 Å²	48.1	25%	0.245	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-3.3	-175.6	36.1	0	0	0	0	113.5	S197 L198 T199	S197-S223 WeakPolarHBondContact OG-CB 2.89Å; S197-S223 PolarHBondContact OG-OG 3.02Å; L198-S223 CarbonylContact O-C 3.34Å; T199-S223 WeakPolarHBondContact CA-O 3.34Å
224	L	76.9	Confident	80.7	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.021	21%	0.214	C	C	.	.			trans	-67.5	129.1	-176.3	-162.5	66.1	0	0	0	112.5	L198 L201 I220 E226 L227 W246 I250	L198-L224 WeakPolarHBondContact O-CA 3.39Å; L198-L224 PolarHBondContact O-N 3.07Å; L201-L224 HydrophobicContact CB-CD1 4.35Å; I220-L224 HydrophobicContact CG2-CB 4.26Å; I220-L224 HydrophobicContact CG2-CD1 3.84Å; I220-L224 HydrophobicContact CG2-CD2 3.6Å; I220-L224 HydrophobicContact CG2-CG 4.12Å; L224-E226 VanDerWaalsContact CD1-O 3.3Å; L224-E226 WeakPolarHBondContact CD1-O 3.49Å; L224-L227 HydrophobicContact CD1-CB 4.38Å; L224-L227 HydrophobicContact CD2-CB 3.58Å; L224-L227 HydrophobicContact CD2-CD2 3.86Å; L224-L227 HydrophobicContact CD2-CG 4.32Å; L224-L227 HydrophobicContact CG-CB 4.24Å; L224-W246 HydrophobicContact CD2-CH2 3.96Å; L224-W246 HydrophobicContact CD2-CZ2 4.36Å; L224-I250 HydrophobicContact CD2-CD1 3.91Å
225	M	72.1	Confident	81.1	Confident	97 Å²	97	39.5 Å²	39.5	48%	0.478	19%	0.191	S	C	.	.	S	Bend	trans	-109.2	-31.3	172.7	-62.6	177.9	171.7	0	0	111.5	T199 A254 L255	T199-M225 WeakPolarHBondContact O-CA 3.3Å; T199-M225 WeakPolarHBondContact O-CB 3.43Å; T199-M225 PolarHBondContact O-N 3.4Å; M225-A254 WeakPolarHBondContact O-CA 3.18Å; M225-L255 PolarHBondContact O-N 3.32Å
226	E	74.6	Confident	81.7	Confident	22 Å²	22	39.2 Å²	39.2	10%	0.103	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	132.9	179.8	-174.7	163	-144.7	0	0	111.7	T199 H200 L201 L224 Q228 L255	T199-E226 PolarHBondContact O-N 3.03Å; H200-E226 WeakPolarHBondContact CA-O 3.49Å; H200-E226 IonicContact CD2-OE2 2.64Å; H200-E226 PolarHBondContact CD2-OE2 2.91Å; L201-E226 PolarHBondContact N-O 3.12Å; L224-E226 VanDerWaalsContact CD1-O 3.3Å; L224-E226 WeakPolarHBondContact CD1-O 3.49Å; E226-Q228 VanDerWaalsContact CD-NE2 3.34Å; E226-Q228 HydrophobicContact CG-CG 4.09Å; E226-Q228 PolarHBondContact OE1-NE2 2.82Å; E226-L255 CarbonylContact C-O 3.22Å; E226-L255 WeakPolarHBondContact CA-O 3.26Å; E226-L255 HydrophobicContact CG-CB 4.43Å
227	L	84.7	Confident	81.8	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	112.5	175.5	170.5	58.6	0	0	0	110.2	L201 L203 L224 L229 W246 L255 V256 G257	L201-L227 HydrophobicContact CB-CD1 4Å; L201-L227 HydrophobicContact CD2-CD1 3.91Å; L201-L227 HydrophobicContact CG-CD1 3.82Å; L201-L227 VanDerWaalsContact O-CA 3.32Å; L201-L227 WeakPolarHBondContact O-CA 3.35Å; L203-L227 HydrophobicContact CD1-CD1 4.47Å; L224-L227 HydrophobicContact CD1-CB 4.38Å; L224-L227 HydrophobicContact CD2-CB 3.58Å; L224-L227 HydrophobicContact CD2-CD2 3.86Å; L224-L227 HydrophobicContact CD2-CG 4.32Å; L224-L227 HydrophobicContact CG-CB 4.24Å; L227-L229 HydrophobicContact CD1-CD1 4.29Å; L227-L229 HydrophobicContact CD1-CD2 4.08Å; L227-L229 HydrophobicContact CD1-CG 3.91Å; L227-L229 HydrophobicContact CD2-CD1 3.85Å; L227-L229 HydrophobicContact CD2-CG 4.37Å; L227-L229 HydrophobicContact CG-CD1 3.88Å; L227-L229 HydrophobicContact CG-CG 3.89Å; L227-W246 HydrophobicContact CD2-CH2 3.44Å; L227-W246 VanDerWaalsContact CD2-CH2 3.44Å; L227-W246 HydrophobicContact CD2-CZ3 3.65Å; L227-L255 PolarHBondContact N-O 3.16Å; L227-V256 HydrophobicContact CB-CG1 4.46Å; L227-V256 HydrophobicContact CD2-CG1 4.29Å; L227-V256 HydrophobicContact CG-CG1 4.32Å; L227-V256 WeakPolarHBondContact O-CA 3Å; L227-G257 PolarHBondContact O-N 2.97Å
228	Q	83.2	Confident	81.9	Confident	30 Å²	30	43.6 Å²	43.6	14%	0.14	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.9	-178.6	-59.3	176.6	-7.7	0	0	109.3	L201 D202 L203 R204 E226 E230	L201-Q228 PolarHBondContact O-N 3.48Å; D202-Q228 HydrophobicContact CB-CB 4.47Å; D202-Q228 VanDerWaalsContact CG-OE1 3.24Å; D202-Q228 PolarHBondContact OD2-OE1 3.32Å; D202-Q228 VanDerWaalsContact OD2-OE1 3.13Å; L203-Q228 PolarHBondContact N-O 3.34Å; R204-Q228 HydrophobicContact CG-CB 3.75Å; R204-Q228 VanDerWaalsContact CZ-OE1 3.24Å; E226-Q228 VanDerWaalsContact CD-NE2 3.34Å; E226-Q228 HydrophobicContact CG-CG 4.09Å; E226-Q228 PolarHBondContact OE1-NE2 2.82Å; Q228-E230 WeakPolarHBondContact CA-OE2 3.47Å
229	L	88.5	Confident	81.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.228	C	C	.	.			trans	-140.8	5.8	-166.6	-74.4	175.8	0	0	0	113.2	L203 L211 L227 W234 V256 I259	L203-L229 HydrophobicContact CB-CD2 4.15Å; L203-L229 HydrophobicContact CD1-CD2 4Å; L211-L229 HydrophobicContact CD1-CD1 4.23Å; L211-L229 HydrophobicContact CD1-CD2 3.9Å; L227-L229 HydrophobicContact CD1-CD1 4.29Å; L227-L229 HydrophobicContact CD1-CD2 4.08Å; L227-L229 HydrophobicContact CD1-CG 3.91Å; L227-L229 HydrophobicContact CD2-CD1 3.85Å; L227-L229 HydrophobicContact CD2-CG 4.37Å; L227-L229 HydrophobicContact CG-CD1 3.88Å; L227-L229 HydrophobicContact CG-CG 3.89Å; L229-W234 HydrophobicContact CB-CZ2 4.04Å; L229-W234 HydrophobicContact CD2-CH2 4.12Å; L229-W234 HydrophobicContact CD2-CZ2 3.89Å; L229-W234 HydrophobicContact CG-CZ2 4.41Å; L229-W234 PolarHBondContact O-NE1 2.94Å; L229-V256 HydrophobicContact CD1-CG1 4.35Å; L229-I259 HydrophobicContact CB-CG1 4.06Å; L229-I259 HydrophobicContact CD1-CD1 3.82Å; L229-I259 HydrophobicContact CD1-CG1 4.19Å
230	E	85.2	Confident	82.2	Confident	48 Å²	48	43.4 Å²	43.4	22%	0.224	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	164.3	178.3	-62	84.3	164.2	0	0	111.7	R204 G205 Q228 N232 G257 D258	R204-E230 WeakPolarHBondContact CA-O 3.5Å; R204-E230 HydrophobicContact CG-CB 3.99Å; R204-E230 WeakPolarHBondContact CG-OE2 3.25Å; G205-E230 PolarHBondContact N-O 3.17Å; Q228-E230 WeakPolarHBondContact CA-OE2 3.47Å; E230-N232 PolarHBondContact O-N 3.43Å; E230-N232 PolarHBondContact O-ND2 2.69Å; E230-G257 VanDerWaalsContact CD-CA 3.47Å; E230-G257 WeakPolarHBondContact OE1-CA 3.45Å; E230-D258 HydrophobicContact CG-CB 4.48Å; E230-D258 PolarHBondContact OE1-N 3.05Å
231	E	85.4	Confident	82.6	Confident	147 Å²	147	43 Å²	43	69%	0.687	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	25.1	172.4	-58.3	-178.2	-168	0	0	114.9
232	N	90.6	Very high	83.6	Confident	9 Å²	9	43.7 Å²	43.7	5%	0.048	21%	0.212	C	C	.	.			trans	-106.1	142.7	173.5	-83.2	-95.7	0	0	0	110.9	L203 N206 R207 L208 E230 W234	L203-N232 PolarHBondContact O-ND2 2.81Å; N206-N232 WeakPolarHBondContact CA-OD1 3.49Å; N206-N232 WeakPolarHBondContact CB-OD1 3.44Å; N206-N232 PolarHBondContact O-OD1 3.31Å; R207-N232 PolarHBondContact N-OD1 3.45Å; L208-N232 HydrophobicContact CB-CB 4.3Å; L208-N232 WeakPolarHBondContact CB-OD1 3.33Å; L208-N232 VanDerWaalsContact CG-OD1 3.29Å; L208-N232 WeakPolarHBondContact CG-OD1 3.32Å; L208-N232 PolarHBondContact N-OD1 3.08Å; E230-N232 PolarHBondContact O-N 3.43Å; E230-N232 PolarHBondContact O-ND2 2.69Å; N232-W234 VanDerWaalsContact C-N 3.27Å; N232-W234 HydrophobicContact CB-CD2 4.33Å; N232-W234 HydrophobicContact CB-CZ2 3.76Å; N232-W234 PolarHBondContact O-N 3.03Å
233	P	89.9	Confident	84.3	Confident	26 Å²	26	32.9 Å²	32.9	17%	0.169	17%	0.171	C	C	.	.			trans	-79.8	66.7	-175.6	34.5	-38	0	0	0	112.5	N206 L208 N235 E262	N206-P233 VanDerWaalsContact O-CD 3.3Å; N206-P233 WeakPolarHBondContact O-CD 3.48Å; L208-P233 CarbonylContact O-C 3.55Å; L208-P233 WeakPolarHBondContact O-CD 3.16Å; P233-N235 PolarHBondContact O-N 3.13Å; P233-E262 HydrophobicContact CB-CB 4.2Å; P233-E262 HydrophobicContact CB-CG 4.05Å
234	W	91.9	Very high	84.9	Confident	1 Å²	1	31.9 Å²	31.9	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	132	-173.5	-64.7	108.2	0	0	0	113.2	L208 L211 L229 N232 I240 L243 I259 E262 T263	L208-W234 HydrophobicContact CB-CH2 3.65Å; L208-W234 HydrophobicContact CB-CZ2 4.21Å; L208-W234 HydrophobicContact CB-CZ3 3.96Å; L208-W234 HydrophobicContact CD1-CH2 4.07Å; L211-W234 HydrophobicContact CD1-CH2 3.76Å; L211-W234 HydrophobicContact CD1-CZ3 4.29Å; L211-W234 HydrophobicContact CG-CH2 3.77Å; L211-W234 HydrophobicContact CG-CZ3 3.88Å; L229-W234 HydrophobicContact CB-CZ2 4.04Å; L229-W234 HydrophobicContact CD2-CH2 4.12Å; L229-W234 HydrophobicContact CD2-CZ2 3.89Å; L229-W234 HydrophobicContact CG-CZ2 4.41Å; L229-W234 PolarHBondContact O-NE1 2.94Å; N232-W234 VanDerWaalsContact C-N 3.27Å; N232-W234 HydrophobicContact CB-CD2 4.33Å; N232-W234 HydrophobicContact CB-CZ2 3.76Å; N232-W234 PolarHBondContact O-N 3.03Å; W234-I240 HydrophobicContact CE3-CD1 4.01Å; W234-L243 HydrophobicContact CE3-CD2 4.34Å; W234-L243 HydrophobicContact CH2-CD2 4.46Å; W234-L243 HydrophobicContact CZ3-CD2 4.1Å; W234-I259 HydrophobicContact CB-CG2 4.44Å; W234-I259 HydrophobicContact CD2-CG2 3.92Å; W234-I259 HydrophobicContact CG-CG2 3.76Å; W234-E262 PolarHBondContact O-N 3.04Å; W234-T263 PolarHBondContact O-N 3.31Å; W234-T263 VanDerWaalsContact O-N 3.11Å
235	N	89.2	Confident	85.2	Confident	38 Å²	38	31.8 Å²	31.8	20%	0.203	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	92.2	177.9	-179.9	36.3	0	0	0	110.2	K209 V210 P233 T237 T263	K209-N235 HydrophobicContact CB-CB 4.05Å; K209-N235 PolarHBondContact O-N 2.66Å; V210-N235 HydrophobicContact CG2-CB 4.41Å; P233-N235 PolarHBondContact O-N 3.13Å; N235-T237 PolarHBondContact ND2-OG1 3.34Å; N235-T237 PolarHBondContact O-N 3.24Å; N235-T237 WeakPolarHBondContact OD1-CG2 3.26Å; N235-T263 CarbonylContact C-O 2.91Å; N235-T263 WeakPolarHBondContact CA-OG1 3.15Å; N235-T263 PolarHBondContact OD1-OG1 2.91Å
236	C	88.5	Confident	85.8	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.141	C	C	.	.			trans	-82.1	62.3	-175.6	-65.5	0	0	0	0	112.8	I240 C261 T263 P264 F267 I275 L280	C236-I240 HydrophobicContact CB-CG2 4.39Å; C236-C261 HydrophobicContact CB-CB 3.73Å; C236-C261 WeakPolarHBondContact CB-SG 3.28Å; C236-C261 WeakPolarHBondContact SG-CB 3.23Å; C236-C261 CovalentContact SG-SG 2.02Å; C236-C261 PolarHBondContact SG-SG 2.94Å; C236-T263 PolarHBondContact N-O 2.73Å; C236-P264 WeakPolarHBondContact O-CD 3.42Å; C236-F267 HydrophobicContact CB-CB 4.35Å; C236-F267 HydrophobicContact CB-CD2 4.43Å; C236-F267 WeakPolarHBondContact O-CD2 3.43Å; C236-I275 HydrophobicContact CB-CD1 4.41Å; C236-L280 HydrophobicContact CB-CD2 3.89Å; C236-L280 WeakPolarHBondContact O-CD2 3.4Å
237	T	86.2	Confident	86.2	Confident	49 Å²	49	27.8 Å²	27.8	30%	0.301	14%	0.142	S	C	.	.	S	Bend	trans	-105.6	-174.7	167.1	61	0	0	0	0	110.3	N235 E239 I240 L280	N235-T237 PolarHBondContact ND2-OG1 3.34Å; N235-T237 PolarHBondContact O-N 3.24Å; N235-T237 WeakPolarHBondContact OD1-CG2 3.26Å; T237-E239 PolarHBondContact O-N 3.27Å; T237-I240 VanDerWaalsContact O-CG2 3.27Å; T237-I240 WeakPolarHBondContact O-CG2 3.14Å; T237-I240 PolarHBondContact O-N 3.33Å; T237-L280 CarbonylContact C-O 3.59Å
238	C	84.4	Confident	85.9	Confident	48 Å²	48	32.6 Å²	32.6	32%	0.324	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-50.8	-30.3	-178.3	-171.3	0	0	0	0	114.4	I240 V241 L280 C281	C238-I240 VanDerWaalsContact C-N 3.27Å; C238-I240 PolarHBondContact O-N 3.49Å; C238-V241 WeakPolarHBondContact O-CB 3.43Å; C238-V241 VanDerWaalsContact O-CG2 3.31Å; C238-V241 WeakPolarHBondContact O-CG2 3.42Å; C238-V241 PolarHBondContact O-N 3.14Å; C238-L280 WeakPolarHBondContact CA-O 3.43Å; C238-L280 PolarHBondContact N-O 3.3Å; C238-C281 HydrophobicContact CB-CB 3.54Å; C238-C281 WeakPolarHBondContact CB-SG 3.34Å; C238-C281 WeakPolarHBondContact SG-CB 3.26Å; C238-C281 CovalentContact SG-SG 2.04Å; C238-C281 PolarHBondContact SG-SG 2.7Å
239	E	82.5	Confident	85.5	Confident	103 Å²	103	36.2 Å²	36.2	48%	0.481	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-60.3	-34.2	178.5	-57.8	-175.5	155.8	0	0	113	V210 T237 V241	V210-E239 HydrophobicContact CG1-CB 4.04Å; V210-E239 HydrophobicContact CG2-CB 4.12Å; T237-E239 PolarHBondContact O-N 3.27Å; E239-V241 PolarHBondContact O-N 3.19Å
240	I	87.4	Confident	84.7	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-71.6	-14.2	-177.9	-146.5	68.1	0	0	0	113.2	V210 W234 C236 T237 C238 Q242 L243 K244 L272 L280	V210-I240 HydrophobicContact CB-CD1 4.38Å; V210-I240 HydrophobicContact CG1-CD1 4.39Å; V210-I240 HydrophobicContact CG2-CD1 4.34Å; W234-I240 HydrophobicContact CE3-CD1 4.01Å; C236-I240 HydrophobicContact CB-CG2 4.39Å; T237-I240 VanDerWaalsContact O-CG2 3.27Å; T237-I240 WeakPolarHBondContact O-CG2 3.14Å; T237-I240 PolarHBondContact O-N 3.33Å; C238-I240 VanDerWaalsContact C-N 3.27Å; C238-I240 PolarHBondContact O-N 3.49Å; I240-Q242 PolarHBondContact O-N 3.35Å; I240-Q242 VanDerWaalsContact O-N 3.12Å; I240-L243 HydrophobicContact CD1-CB 4.45Å; I240-L243 HydrophobicContact CD1-CD2 4.03Å; I240-L243 HydrophobicContact CG1-CB 4.45Å; I240-L243 HydrophobicContact CG1-CD2 4.42Å; I240-L243 WeakPolarHBondContact O-CB 3.49Å; I240-L243 PolarHBondContact O-N 3.21Å; I240-K244 PolarHBondContact O-N 3.39Å; I240-L272 HydrophobicContact CB-CD1 4.46Å; I240-L272 HydrophobicContact CG1-CD1 4.1Å; I240-L272 HydrophobicContact CG1-CD2 3.66Å; I240-L272 HydrophobicContact CG2-CD1 3.48Å; I240-L272 VanDerWaalsContact CG2-CD1 3.48Å; I240-L272 HydrophobicContact CG2-CD2 4.48Å; I240-L280 HydrophobicContact CG2-CD1 3.87Å; I240-L280 HydrophobicContact CG2-CD2 3.94Å; I240-L280 HydrophobicContact CG2-CG 4.4Å
241	V	85.4	Confident	83.5	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-22.4	-177.3	179.5	0	0	0	0	111.7	C238 E239 S245 K277 L280 C281 V289	C238-V241 WeakPolarHBondContact O-CB 3.43Å; C238-V241 VanDerWaalsContact O-CG2 3.31Å; C238-V241 WeakPolarHBondContact O-CG2 3.42Å; C238-V241 PolarHBondContact O-N 3.14Å; E239-V241 PolarHBondContact O-N 3.19Å; V241-S245 VanDerWaalsContact O-CB 3.28Å; V241-S245 WeakPolarHBondContact O-CB 3.49Å; V241-S245 PolarHBondContact O-N 3.3Å; V241-S245 PolarHBondContact O-OG 3.41Å; V241-K277 HydrophobicContact CG1-CB 4.43Å; V241-K277 HydrophobicContact CG1-CD 4.29Å; V241-K277 HydrophobicContact CG1-CG 4.24Å; V241-L280 HydrophobicContact CG2-CB 3.66Å; V241-L280 HydrophobicContact CG2-CD1 4.04Å; V241-C281 HydrophobicContact CG2-CB 4.26Å; V241-V289 HydrophobicContact CG1-CG1 3.67Å
242	Q	83.6	Confident	81.7	Confident	29 Å²	29	38.4 Å²	38.4	14%	0.136	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-55	167.4	-75.8	178.3	68.9	0	0	112.4	I240 S245 W246 L293	I240-Q242 PolarHBondContact O-N 3.35Å; I240-Q242 VanDerWaalsContact O-N 3.12Å; Q242-S245 PolarHBondContact O-N 3.3Å; Q242-W246 PolarHBondContact O-N 3.45Å; Q242-W246 VanDerWaalsContact O-N 3.08Å; Q242-L293 HydrophobicContact CG-CD1 3.61Å; Q242-L293 HydrophobicContact CG-CD2 3.41Å; Q242-L293 VanDerWaalsContact CG-CD2 3.41Å; Q242-L293 HydrophobicContact CG-CG 4.05Å
243	L	87.2	Confident	79.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-44.6	176.7	177.3	58.2	0	0	0	110.6	L211 L217 W234 I240 S245 W246 L247 I259 L272	L211-L243 HydrophobicContact CB-CB 4.49Å; L211-L243 HydrophobicContact CB-CD1 4.27Å; L211-L243 HydrophobicContact CB-CD2 4.27Å; L211-L243 HydrophobicContact CD1-CD1 4.11Å; L211-L243 HydrophobicContact CD1-CD2 4.27Å; L211-L243 HydrophobicContact CG-CD2 4.49Å; L217-L243 HydrophobicContact CD1-CB 4.31Å; L217-L243 HydrophobicContact CD1-CD1 3.77Å; L217-L243 HydrophobicContact CD2-CD1 4.32Å; W234-L243 HydrophobicContact CE3-CD2 4.34Å; W234-L243 HydrophobicContact CH2-CD2 4.46Å; W234-L243 HydrophobicContact CZ3-CD2 4.1Å; I240-L243 HydrophobicContact CD1-CB 4.45Å; I240-L243 HydrophobicContact CD1-CD2 4.03Å; I240-L243 HydrophobicContact CG1-CB 4.45Å; I240-L243 HydrophobicContact CG1-CD2 4.42Å; I240-L243 WeakPolarHBondContact O-CB 3.49Å; I240-L243 PolarHBondContact O-N 3.21Å; L243-S245 PolarHBondContact O-N 3.44Å; L243-W246 HydrophobicContact CD1-CE3 4.04Å; L243-W246 HydrophobicContact CD1-CZ3 4.46Å; L243-W246 WeakPolarHBondContact O-CB 3.24Å; L243-W246 PolarHBondContact O-N 2.8Å; L243-W246 VanDerWaalsContact O-N 3.14Å; L243-L247 HydrophobicContact CD1-CD1 4.36Å; L243-L247 HydrophobicContact CD1-CG 4.25Å; L243-L247 HydrophobicContact CG-CD1 4.13Å; L243-L247 HydrophobicContact CG-CG 4.49Å; L243-L247 VanDerWaalsContact O-CG 3.3Å; L243-L247 WeakPolarHBondContact O-CG 3.38Å; L243-L247 PolarHBondContact O-N 3.06Å; L243-I259 HydrophobicContact CD2-CD1 4.22Å; L243-I259 HydrophobicContact CD2-CG2 4.38Å; L243-L272 HydrophobicContact CB-CD2 4.3Å; L243-L272 HydrophobicContact CD2-CD2 3.95Å; L243-L272 HydrophobicContact CG-CD2 3.95Å
244	K	85.3	Confident	78.4	Confident	14 Å²	14	41.5 Å²	41.5	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-48.6	176.7	-165.8	-172.2	170.6	82.3	0	112.3	I240 W246 L247 E248 L272 R273 I275 K277 L280	I240-K244 PolarHBondContact O-N 3.39Å; K244-W246 PolarHBondContact O-N 3.45Å; K244-L247 PolarHBondContact O-N 3.12Å; K244-E248 VanDerWaalsContact CE-OE1 3.25Å; K244-E248 WeakPolarHBondContact CE-OE1 3.32Å; K244-E248 WeakPolarHBondContact O-CG 3.46Å; K244-E248 PolarHBondContact O-N 3Å; K244-E248 VanDerWaalsContact O-N 3.14Å; K244-L272 HydrophobicContact CB-CD1 4.16Å; K244-L272 HydrophobicContact CB-CD2 4.29Å; K244-L272 HydrophobicContact CB-CG 4.15Å; K244-L272 HydrophobicContact CG-CD1 4.43Å; K244-L272 HydrophobicContact CG-CG 4.33Å; K244-L272 PolarHBondContact NZ-O 3.17Å; K244-R273 PolarHBondContact NZ-O 2.86Å; K244-I275 WeakPolarHBondContact CE-O 3.5Å; K244-I275 PolarHBondContact NZ-O 2.99Å; K244-K277 HydrophobicContact CD-CG 4.04Å; K244-L280 HydrophobicContact CD-CD1 3.9Å
245	S	82.7	Confident	77.1	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-69.7	-15.7	-179.7	-55.7	0	0	0	0	113.5	V241 Q242 L243 R249 K277	V241-S245 VanDerWaalsContact O-CB 3.28Å; V241-S245 WeakPolarHBondContact O-CB 3.49Å; V241-S245 PolarHBondContact O-N 3.3Å; V241-S245 PolarHBondContact O-OG 3.41Å; Q242-S245 PolarHBondContact O-N 3.3Å; L243-S245 PolarHBondContact O-N 3.44Å; S245-R249 VanDerWaalsContact O-CD 3.29Å; S245-R249 WeakPolarHBondContact O-CD 3.45Å; S245-R249 WeakPolarHBondContact O-CG 3.42Å; S245-K277 WeakPolarHBondContact OG-CE 3.34Å; S245-K277 PolarHBondContact OG-NZ 3.3Å
246	W	85.2	Confident	76.6	Confident	11 Å²	11	43.8 Å²	43.8	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-84.4	-41.7	169.7	178.3	81.2	0	0	0	112.5	Y213 L217 L224 L227 Q242 L243 K244 E248 R249 I250	Y213-W246 HydrophobicContact CD2-CB 4.22Å; Y213-W246 AromaticContact CD2-CD1 3.97Å; Y213-W246 HydrophobicContact CD2-CG 4.43Å; Y213-W246 AromaticContact CE2-CD1 3.93Å; L217-W246 HydrophobicContact CB-CB 4.38Å; L217-W246 HydrophobicContact CB-CD2 3.82Å; L217-W246 HydrophobicContact CB-CG 3.7Å; L217-W246 HydrophobicContact CB-CZ2 4.46Å; L217-W246 HydrophobicContact CD1-CB 3.95Å; L217-W246 HydrophobicContact CD1-CD2 4.09Å; L217-W246 HydrophobicContact CD1-CE3 4.24Å; L217-W246 HydrophobicContact CD1-CG 3.99Å; L217-W246 HydrophobicContact CD2-CD2 4.03Å; L217-W246 HydrophobicContact CD2-CE3 3.96Å; L217-W246 HydrophobicContact CD2-CH2 4.17Å; L217-W246 HydrophobicContact CD2-CZ2 4.24Å; L217-W246 HydrophobicContact CD2-CZ3 4.03Å; L217-W246 HydrophobicContact CG-CD2 4.2Å; L217-W246 HydrophobicContact CG-CE3 4.49Å; L217-W246 HydrophobicContact CG-CG 4.32Å; L217-W246 PolarHBondContact O-NE1 2.97Å; L224-W246 HydrophobicContact CD2-CH2 3.96Å; L224-W246 HydrophobicContact CD2-CZ2 4.36Å; L227-W246 HydrophobicContact CD2-CH2 3.44Å; L227-W246 VanDerWaalsContact CD2-CH2 3.44Å; L227-W246 HydrophobicContact CD2-CZ3 3.65Å; Q242-W246 PolarHBondContact O-N 3.45Å; Q242-W246 VanDerWaalsContact O-N 3.08Å; L243-W246 HydrophobicContact CD1-CE3 4.04Å; L243-W246 HydrophobicContact CD1-CZ3 4.46Å; L243-W246 WeakPolarHBondContact O-CB 3.24Å; L243-W246 PolarHBondContact O-N 2.8Å; L243-W246 VanDerWaalsContact O-N 3.14Å; K244-W246 PolarHBondContact O-N 3.45Å; W246-E248 PolarHBondContact O-N 2.99Å; W246-R249 CarbonylContact O-C 3.57Å; W246-R249 WeakPolarHBondContact O-CA 3.33Å; W246-R249 PolarHBondContact O-N 2.99Å; W246-I250 HydrophobicContact CH2-CD1 3.42Å; W246-I250 VanDerWaalsContact CH2-CD1 3.42Å; W246-I250 HydrophobicContact CH2-CG1 4.26Å; W246-I250 HydrophobicContact CZ2-CD1 3.79Å; W246-I250 HydrophobicContact CZ2-CG1 4.16Å; W246-I250 HydrophobicContact CZ3-CD1 3.91Å; W246-I250 PolarHBondContact O-N 2.97Å
247	L	82.6	Confident	75.5	Confident	24 Å²	24	44.1 Å²	44.1	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-59	-31.2	174.2	-67.2	165.7	0	0	0	112.4	L243 K244 R249 V256 I259 L272 R273	L243-L247 HydrophobicContact CD1-CD1 4.36Å; L243-L247 HydrophobicContact CD1-CG 4.25Å; L243-L247 HydrophobicContact CG-CD1 4.13Å; L243-L247 HydrophobicContact CG-CG 4.49Å; L243-L247 VanDerWaalsContact O-CG 3.3Å; L243-L247 WeakPolarHBondContact O-CG 3.38Å; L243-L247 PolarHBondContact O-N 3.06Å; K244-L247 PolarHBondContact O-N 3.12Å; L247-R249 PolarHBondContact O-N 3.4Å; L247-V256 HydrophobicContact CD2-CB 4.38Å; L247-V256 HydrophobicContact CD2-CG1 3.68Å; L247-I259 HydrophobicContact CD1-CD1 3.53Å; L247-I259 HydrophobicContact CD2-CD1 3.97Å; L247-I259 HydrophobicContact CG-CD1 4.36Å; L247-L272 HydrophobicContact CD1-CD2 4.04Å; L247-R273 HydrophobicContact CD1-CG 4.26Å
248	E	78.4	Confident	74.8	Confident	103 Å²	103	42.9 Å²	42.9	48%	0.481	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-11.5	173.4	-70.4	165.3	-169.8	0	0	114	K244 W246 K277	K244-E248 VanDerWaalsContact CE-OE1 3.25Å; K244-E248 WeakPolarHBondContact CE-OE1 3.32Å; K244-E248 WeakPolarHBondContact O-CG 3.46Å; K244-E248 PolarHBondContact O-N 3Å; K244-E248 VanDerWaalsContact O-N 3.14Å; W246-E248 PolarHBondContact O-N 2.99Å; E248-K277 VanDerWaalsContact CD-CE 3.43Å; E248-K277 WeakPolarHBondContact OE1-CE 3.42Å; E248-K277 IonicContact OE1-NZ 2.81Å; E248-K277 WeakPolarHBondContact OE2-CE 3.35Å; E248-K277 IonicContact OE2-NZ 2.72Å; E248-K277 PolarHBondContact OE2-NZ 2.98Å
249	R	75.4	Confident	74.9	Confident	105 Å²	105	40.6 Å²	40.6	40%	0.396	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-8.3	-172.4	-65.6	177.3	-178.7	151.1	0.5	114.6	S245 W246 L247 E290 I295	S245-R249 VanDerWaalsContact O-CD 3.29Å; S245-R249 WeakPolarHBondContact O-CD 3.45Å; S245-R249 WeakPolarHBondContact O-CG 3.42Å; W246-R249 CarbonylContact O-C 3.57Å; W246-R249 WeakPolarHBondContact O-CA 3.33Å; W246-R249 PolarHBondContact O-N 2.99Å; L247-R249 PolarHBondContact O-N 3.4Å; R249-E290 IonicContact CZ-OE1 3.66Å; R249-E290 IonicContact NH2-OE1 3.46Å; R249-E290 PolarHBondContact NH2-OE1 2.98Å; R249-I295 VanDerWaalsContact NH1-CD1 3.28Å; R249-I295 VanDerWaalsContact NH1-CG2 3.3Å
250	I	72.3	Confident	74.9	Confident	27 Å²	27	37.9 Å²	37.9	14%	0.138	19%	0.188	C	C	.	.	S	Bend	trans	-65	143.5	177.9	-158.9	178.9	0	0	0	110.3	L224 W246 Y252 A254 V256	L224-I250 HydrophobicContact CD2-CD1 3.91Å; W246-I250 HydrophobicContact CH2-CD1 3.42Å; W246-I250 VanDerWaalsContact CH2-CD1 3.42Å; W246-I250 HydrophobicContact CH2-CG1 4.26Å; W246-I250 HydrophobicContact CZ2-CD1 3.79Å; W246-I250 HydrophobicContact CZ2-CG1 4.16Å; W246-I250 HydrophobicContact CZ3-CD1 3.91Å; W246-I250 PolarHBondContact O-N 2.97Å; I250-Y252 PolarHBondContact O-N 3.41Å; I250-A254 HydrophobicContact CD1-CB 3.64Å; I250-A254 HydrophobicContact CG1-CB 3.96Å; I250-V256 HydrophobicContact CD1-CG2 3.52Å; I250-V256 HydrophobicContact CG2-CG2 4.4Å
251	P	60.1	Low	74.8	Confident	47 Å²	47	37.9 Å²	37.9	31%	0.305	19%	0.188	S	C	.	.			trans	-54.4	134.8	172.3	20.1	-34.1	0	0	0	111.9	G221 T253 A254	G221-P251 WeakPolarHBondContact O-CD 3.28Å; P251-T253 PolarHBondContact O-N 3.13Å; P251-A254 VanDerWaalsContact O-CB 3.31Å; P251-A254 WeakPolarHBondContact O-CB 3.2Å; P251-A254 PolarHBondContact O-N 2.96Å
252	Y	48	Very low	74.8	Confident	168 Å²	168	42.5 Å²	42.5	66%	0.659	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-13.5	-176	60	-92	0	0	0	114.5	I250 A254	I250-Y252 PolarHBondContact O-N 3.41Å; Y252-A254 VanDerWaalsContact C-N 3.31Å
253	T	51.2	Low	74.5	Confident	92 Å²	92	44 Å²	44	56%	0.564	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-18.6	171.8	50.2	0	0	0	0	113.1	P251 L255	P251-T253 PolarHBondContact O-N 3.13Å; T253-L255 PolarHBondContact O-N 3.15Å
254	A	59.8	Low	74.1	Confident	8 Å²	8	45.5 Å²	45.5	7%	0.066	23%	0.231	C	C	.	.	S	Bend	trans	-76	119.8	176.3	0	0	0	0	0	110.6	M225 I250 P251 Y252 V256	M225-A254 WeakPolarHBondContact O-CA 3.18Å; I250-A254 HydrophobicContact CD1-CB 3.64Å; I250-A254 HydrophobicContact CG1-CB 3.96Å; P251-A254 VanDerWaalsContact O-CB 3.31Å; P251-A254 WeakPolarHBondContact O-CB 3.2Å; P251-A254 PolarHBondContact O-N 2.96Å; Y252-A254 VanDerWaalsContact C-N 3.31Å; A254-V256 HydrophobicContact CB-CG2 4.37Å; A254-V256 PolarHBondContact O-N 3.37Å
255	L	64.1	Low	73.5	Confident	62 Å²	62	53.9 Å²	53.9	33%	0.325	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	114.7	165.9	-63.8	177.4	0	0	0	107.9	M225 E226 L227 T253 Y484	M225-L255 PolarHBondContact O-N 3.32Å; E226-L255 CarbonylContact C-O 3.22Å; E226-L255 WeakPolarHBondContact CA-O 3.26Å; E226-L255 HydrophobicContact CG-CB 4.43Å; L227-L255 PolarHBondContact N-O 3.16Å; T253-L255 PolarHBondContact O-N 3.15Å; L255-Y484 HydrophobicContact CD1-CE2 4.07Å
256	V	77.8	Confident	73.2	Confident	25 Å²	25	59.4 Å²	59.4	15%	0.152	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.2	175.2	-169.4	0	0	0	0	110.1	L227 L229 L247 I250 A254 R273	L227-V256 HydrophobicContact CB-CG1 4.46Å; L227-V256 HydrophobicContact CD2-CG1 4.29Å; L227-V256 HydrophobicContact CG-CG1 4.32Å; L227-V256 WeakPolarHBondContact O-CA 3Å; L229-V256 HydrophobicContact CD1-CG1 4.35Å; L247-V256 HydrophobicContact CD2-CB 4.38Å; L247-V256 HydrophobicContact CD2-CG1 3.68Å; I250-V256 HydrophobicContact CD1-CG2 3.52Å; I250-V256 HydrophobicContact CG2-CG2 4.4Å; A254-V256 HydrophobicContact CB-CG2 4.37Å; A254-V256 PolarHBondContact O-N 3.37Å; V256-R273 PolarHBondContact O-NH1 2.83Å; V256-R273 VanDerWaalsContact O-NH1 3.14Å
257	G	66	Low	73	Confident	6 Å²	6	59.8 Å²	59.8	6%	0.062	30%	0.295	C	S	.	.			trans	-60.4	170.3	-179.7	0	0	0	0	0	115.1	L227 E230 R273	L227-G257 PolarHBondContact O-N 2.97Å; E230-G257 VanDerWaalsContact CD-CA 3.47Å; E230-G257 WeakPolarHBondContact OE1-CA 3.45Å; G257-R273 PolarHBondContact O-NH1 3.02Å
258	D	72.4	Confident	72.7	Confident	23 Å²	23	63.3 Å²	63.3	12%	0.123	31%	0.31	C	S	.	.			trans	-81.7	127.5	-175.1	-75.7	11.2	0	0	0	112	E230 R273	E230-D258 HydrophobicContact CG-CB 4.48Å; E230-D258 PolarHBondContact OE1-N 3.05Å; D258-R273 VanDerWaalsContact CG-NH2 3.3Å; D258-R273 IonicContact OD1-CZ 3.51Å; D258-R273 IonicContact OD1-NH1 3.23Å; D258-R273 IonicContact OD1-NH2 3.98Å; D258-R273 PolarHBondContact OD1-NH2 2.98Å
259	I	85.5	Confident	72.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.288	C	S	.	.			trans	-108.7	76	-172.7	-63.6	161	0	0	0	106.9	L229 W234 L243 L247 D271 L272	L229-I259 HydrophobicContact CB-CG1 4.06Å; L229-I259 HydrophobicContact CD1-CD1 3.82Å; L229-I259 HydrophobicContact CD1-CG1 4.19Å; W234-I259 HydrophobicContact CB-CG2 4.44Å; W234-I259 HydrophobicContact CD2-CG2 3.92Å; W234-I259 HydrophobicContact CG-CG2 3.76Å; L243-I259 HydrophobicContact CD2-CD1 4.22Å; L243-I259 HydrophobicContact CD2-CG2 4.38Å; L247-I259 HydrophobicContact CD1-CD1 3.53Å; L247-I259 HydrophobicContact CD2-CD1 3.97Å; L247-I259 HydrophobicContact CG-CD1 4.36Å; I259-D271 PolarHBondContact N-OD2 3.28Å; I259-D271 CarbonylContact O-C 3.57Å; I259-D271 WeakPolarHBondContact O-CA 3.25Å; I259-L272 HydrophobicContact CB-CB 4.09Å; I259-L272 HydrophobicContact CG2-CB 3.71Å; I259-L272 HydrophobicContact CG2-CD2 3.87Å; I259-L272 HydrophobicContact CG2-CG 4.45Å; I259-L272 PolarHBondContact O-N 2.86Å
260	T	82.6	Confident	72.2	Confident	46 Å²	46	57.4 Å²	57.4	28%	0.282	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-73.9	123.5	176.9	-69.8	0	0	0	0	110	K393	T260-K393 PolarHBondContact OG1-NZ 3.1Å; T260-K393 VanDerWaalsContact OG1-NZ 3.13Å
261	C	85.8	Confident	72.6	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.007	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133	174.9	-59.6	0	0	0	0	111.1	C236 F267 H268 G269 K270 I275	C236-C261 HydrophobicContact CB-CB 3.73Å; C236-C261 WeakPolarHBondContact CB-SG 3.28Å; C236-C261 WeakPolarHBondContact SG-CB 3.23Å; C236-C261 CovalentContact SG-SG 2.02Å; C236-C261 PolarHBondContact SG-SG 2.94Å; C261-F267 HydrophobicContact CB-CB 4.17Å; C261-F267 WeakPolarHBondContact CB-O 3.2Å; C261-H268 CarbonylContact O-C 3.6Å; C261-H268 VanDerWaalsContact O-CA 3.28Å; C261-H268 WeakPolarHBondContact O-CA 3.3Å; C261-G269 PolarHBondContact O-N 3.07Å; C261-K270 PolarHBondContact N-O 3.02Å; C261-K270 PolarHBondContact SG-O 2.72Å; C261-I275 WeakPolarHBondContact SG-CD1 3.23Å
262	E	85.2	Confident	73.7	Confident	99 Å²	99	54 Å²	54	46%	0.463	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-40.3	171.3	177.5	69.9	-172.5	0	0	110.1	P233 W234 H268	P233-E262 HydrophobicContact CB-CB 4.2Å; P233-E262 HydrophobicContact CB-CG 4.05Å; W234-E262 PolarHBondContact O-N 3.04Å; E262-H268 PolarHBondContact O-CD2 2.91Å; E262-H268 VanDerWaalsContact O-CD2 3.3Å
263	T	77.8	Confident	75.3	Confident	59 Å²	59	49 Å²	49	36%	0.362	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	155.6	179.6	45.3	0	0	0	0	110.3	W234 N235 C236	W234-T263 PolarHBondContact O-N 3.31Å; W234-T263 VanDerWaalsContact O-N 3.11Å; N235-T263 CarbonylContact C-O 2.91Å; N235-T263 WeakPolarHBondContact CA-OG1 3.15Å; N235-T263 PolarHBondContact OD1-OG1 2.91Å; C236-T263 PolarHBondContact N-O 2.73Å
264	P	79.1	Confident	76.6	Confident	32 Å²	32	45.9 Å²	45.9	21%	0.208	23%	0.225	C	C	.	.	S	Bend	cis	-72.1	165.6	-12.3	33.2	-37.7	0	0	0	112.7	C236 H266 F267 H268	C236-P264 WeakPolarHBondContact O-CD 3.42Å; P264-H266 WeakPolarHBondContact CG-CE1 3.44Å; P264-H266 VanDerWaalsContact CG-NE2 3.34Å; P264-H266 WeakPolarHBondContact CG-NE2 3.39Å; P264-H266 PolarHBondContact O-N 3.11Å; P264-F267 HydrophobicContact CG-CD2 3.89Å; P264-F267 PolarHBondContact O-N 2.9Å; P264-H268 PolarHBondContact O-N 3.02Å; P264-H268 VanDerWaalsContact O-N 3.08Å
265	F	72.1	Confident	77.5	Confident	191 Å²	191	45.8 Å²	45.8	84%	0.838	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-33.2	-174	-178.2	-101.6	0	0	0	115.3	F267 H268	F265-F267 VanDerWaalsContact C-N 3.26Å; F265-F267 PolarHBondContact O-N 3.37Å; F265-H268 WeakPolarHBondContact O-CB 3.48Å; F265-H268 PolarHBondContact O-N 2.75Å
266	H	76.5	Confident	78.3	Confident	118 Å²	118	48.7 Å²	48.7	55%	0.546	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-11.5	178.4	55.9	-102.4	0	0	0	114.3	P264 K270	P264-H266 WeakPolarHBondContact CG-CE1 3.44Å; P264-H266 VanDerWaalsContact CG-NE2 3.34Å; P264-H266 WeakPolarHBondContact CG-NE2 3.39Å; P264-H266 PolarHBondContact O-N 3.11Å; H266-K270 PolarHBondContact O-NZ 2.91Å
267	F	80.3	Confident	78.4	Confident	19 Å²	19	49.2 Å²	49.2	8%	0.083	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-10	170.9	-64.7	-46.7	0	0	0	114	C236 C261 P264 F265 G269 K270 I275 E279 L280	C236-F267 HydrophobicContact CB-CB 4.35Å; C236-F267 HydrophobicContact CB-CD2 4.43Å; C236-F267 WeakPolarHBondContact O-CD2 3.43Å; C261-F267 HydrophobicContact CB-CB 4.17Å; C261-F267 WeakPolarHBondContact CB-O 3.2Å; P264-F267 HydrophobicContact CG-CD2 3.89Å; P264-F267 PolarHBondContact O-N 2.9Å; F265-F267 VanDerWaalsContact C-N 3.26Å; F265-F267 PolarHBondContact O-N 3.37Å; F267-G269 PolarHBondContact O-N 3.23Å; F267-K270 HydrophobicContact CD1-CD 4.31Å; F267-K270 WeakPolarHBondContact O-CB 3.5Å; F267-K270 PolarHBondContact O-N 3.47Å; F267-I275 HydrophobicContact CB-CD1 3.83Å; F267-I275 HydrophobicContact CD1-CD1 3.71Å; F267-I275 HydrophobicContact CD1-CG1 3.99Å; F267-I275 HydrophobicContact CD1-CG2 3.82Å; F267-I275 HydrophobicContact CD2-CD1 4.42Å; F267-I275 HydrophobicContact CE1-CD1 4.42Å; F267-I275 HydrophobicContact CE1-CG1 4.38Å; F267-I275 HydrophobicContact CE1-CG2 3.39Å; F267-I275 HydrophobicContact CE2-CG2 4.29Å; F267-I275 HydrophobicContact CG-CD1 3.74Å; F267-I275 HydrophobicContact CG-CG2 4.47Å; F267-I275 HydrophobicContact CZ-CG2 3.68Å; F267-E279 HydrophobicContact CE1-CB 4.43Å; F267-E279 HydrophobicContact CZ-CB 4Å; F267-E279 WeakPolarHBondContact CZ-O 3.44Å; F267-L280 HydrophobicContact CD2-CD2 4.26Å; F267-L280 HydrophobicContact CE2-CD2 4.13Å
268	H	76.6	Confident	78.9	Confident	98 Å²	98	52.6 Å²	52.6	45%	0.454	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.2	130.4	175.9	179.2	-66.8	0	0	0	111.7	C261 E262 P264 F265 K270	C261-H268 CarbonylContact O-C 3.6Å; C261-H268 VanDerWaalsContact O-CA 3.28Å; C261-H268 WeakPolarHBondContact O-CA 3.3Å; E262-H268 PolarHBondContact O-CD2 2.91Å; E262-H268 VanDerWaalsContact O-CD2 3.3Å; P264-H268 PolarHBondContact O-N 3.02Å; P264-H268 VanDerWaalsContact O-N 3.08Å; F265-H268 WeakPolarHBondContact O-CB 3.48Å; F265-H268 PolarHBondContact O-N 2.75Å; H268-K270 VanDerWaalsContact C-N 3.29Å; H268-K270 PolarHBondContact O-N 3.26Å
269	G	71.1	Confident	79.3	Confident	2 Å²	2	55.3 Å²	55.3	2%	0.021	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	-23.7	179.4	0	0	0	0	0	115.6	C261 F267 K393 E394	C261-G269 PolarHBondContact O-N 3.07Å; F267-G269 PolarHBondContact O-N 3.23Å; G269-K393 PolarHBondContact O-NZ 2.02Å; G269-E394 WeakPolarHBondContact CA-OE2 3.47Å
270	K	72.9	Confident	79.1	Confident	83 Å²	83	55.7 Å²	55.7	36%	0.361	27%	0.267	S	S	.	.			trans	-75.4	147.1	179.7	-60.2	171.1	-169.9	162.5	0	111.4	C261 H266 F267 H268 I275	C261-K270 PolarHBondContact N-O 3.02Å; C261-K270 PolarHBondContact SG-O 2.72Å; H266-K270 PolarHBondContact O-NZ 2.91Å; F267-K270 HydrophobicContact CD1-CD 4.31Å; F267-K270 WeakPolarHBondContact O-CB 3.5Å; F267-K270 PolarHBondContact O-N 3.47Å; H268-K270 VanDerWaalsContact C-N 3.29Å; H268-K270 PolarHBondContact O-N 3.26Å; K270-I275 HydrophobicContact CB-CD1 4.27Å; K270-I275 HydrophobicContact CB-CG1 4.27Å
271	D	79.4	Confident	79	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-79.1	138.5	171.8	-176.9	-83.6	0	0	0	111.2	I259 R273 E274	I259-D271 PolarHBondContact N-OD2 3.28Å; I259-D271 CarbonylContact O-C 3.57Å; I259-D271 WeakPolarHBondContact O-CA 3.25Å; D271-R273 PolarHBondContact O-N 3.45Å; D271-R273 WeakPolarHBondContact OD1-CA 3.12Å; D271-R273 WeakPolarHBondContact OD1-CB 3.46Å; D271-R273 WeakPolarHBondContact OD1-CG 3.39Å; D271-R273 IonicContact OD1-CZ 3.77Å; D271-R273 PolarHBondContact OD1-N 2.95Å; D271-R273 IonicContact OD1-NE 3.07Å; D271-R273 PolarHBondContact OD1-NE 2.87Å; D271-R273 IonicContact OD1-NH2 3.24Å; D271-R273 PolarHBondContact OD1-NH2 3.13Å; D271-R273 IonicContact OD2-CZ 3.52Å; D271-R273 IonicContact OD2-NE 3.4Å; D271-R273 PolarHBondContact OD2-NE 3.02Å; D271-R273 IonicContact OD2-NH2 2.66Å; D271-R273 PolarHBondContact OD2-NH2 3.11Å; D271-E274 HydrophobicContact CB-CG 4.37Å; D271-E274 PolarHBondContact N-OE1 2.73Å; D271-E274 WeakPolarHBondContact O-CB 3.49Å; D271-E274 PolarHBondContact O-N 3.04Å
272	L	84.7	Confident	78.2	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-26	-179.7	177.3	59.7	0	0	0	113.9	I240 L243 K244 L247 I259 E274 L280	I240-L272 HydrophobicContact CB-CD1 4.46Å; I240-L272 HydrophobicContact CG1-CD1 4.1Å; I240-L272 HydrophobicContact CG1-CD2 3.66Å; I240-L272 HydrophobicContact CG2-CD1 3.48Å; I240-L272 VanDerWaalsContact CG2-CD1 3.48Å; I240-L272 HydrophobicContact CG2-CD2 4.48Å; L243-L272 HydrophobicContact CB-CD2 4.3Å; L243-L272 HydrophobicContact CD2-CD2 3.95Å; L243-L272 HydrophobicContact CG-CD2 3.95Å; K244-L272 HydrophobicContact CB-CD1 4.16Å; K244-L272 HydrophobicContact CB-CD2 4.29Å; K244-L272 HydrophobicContact CB-CG 4.15Å; K244-L272 HydrophobicContact CG-CD1 4.43Å; K244-L272 HydrophobicContact CG-CG 4.33Å; K244-L272 PolarHBondContact NZ-O 3.17Å; L247-L272 HydrophobicContact CD1-CD2 4.04Å; I259-L272 HydrophobicContact CB-CB 4.09Å; I259-L272 HydrophobicContact CG2-CB 3.71Å; I259-L272 HydrophobicContact CG2-CD2 3.87Å; I259-L272 HydrophobicContact CG2-CG 4.45Å; I259-L272 PolarHBondContact O-N 2.86Å; L272-E274 VanDerWaalsContact C-N 3.32Å; L272-L280 HydrophobicContact CD1-CD1 3.74Å; L272-L280 HydrophobicContact CD1-CD2 4.43Å
273	R	81.3	Confident	77	Confident	63 Å²	63	61.9 Å²	61.9	24%	0.238	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-24.2	178.2	-61	163.7	-70.4	-169.5	11.2	111.5	K244 L247 V256 G257 D258 D271	K244-R273 PolarHBondContact NZ-O 2.86Å; L247-R273 HydrophobicContact CD1-CG 4.26Å; V256-R273 PolarHBondContact O-NH1 2.83Å; V256-R273 VanDerWaalsContact O-NH1 3.14Å; G257-R273 PolarHBondContact O-NH1 3.02Å; D258-R273 VanDerWaalsContact CG-NH2 3.3Å; D258-R273 IonicContact OD1-CZ 3.51Å; D258-R273 IonicContact OD1-NH1 3.23Å; D258-R273 IonicContact OD1-NH2 3.98Å; D258-R273 PolarHBondContact OD1-NH2 2.98Å; D271-R273 PolarHBondContact O-N 3.45Å; D271-R273 WeakPolarHBondContact OD1-CA 3.12Å; D271-R273 WeakPolarHBondContact OD1-CB 3.46Å; D271-R273 WeakPolarHBondContact OD1-CG 3.39Å; D271-R273 IonicContact OD1-CZ 3.77Å; D271-R273 PolarHBondContact OD1-N 2.95Å; D271-R273 IonicContact OD1-NE 3.07Å; D271-R273 PolarHBondContact OD1-NE 2.87Å; D271-R273 IonicContact OD1-NH2 3.24Å; D271-R273 PolarHBondContact OD1-NH2 3.13Å; D271-R273 IonicContact OD2-CZ 3.52Å; D271-R273 IonicContact OD2-NE 3.4Å; D271-R273 PolarHBondContact OD2-NE 3.02Å; D271-R273 IonicContact OD2-NH2 2.66Å; D271-R273 PolarHBondContact OD2-NH2 3.11Å
274	E	77.6	Confident	76.2	Confident	28 Å²	28	62.2 Å²	62.2	13%	0.131	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-41.6	175.1	-61.6	175.8	-114.5	0	0	113.6	D271 L272 N391 R395	D271-E274 HydrophobicContact CB-CG 4.37Å; D271-E274 PolarHBondContact N-OE1 2.73Å; D271-E274 WeakPolarHBondContact O-CB 3.49Å; D271-E274 PolarHBondContact O-N 3.04Å; L272-E274 VanDerWaalsContact C-N 3.32Å; E274-N391 HydrophobicContact CG-CB 4.39Å; E274-N391 WeakPolarHBondContact CG-ND2 3.42Å; E274-N391 PolarHBondContact OE1-ND2 2.96Å; E274-R395 IonicContact OE2-CZ 2.64Å; E274-R395 IonicContact OE2-NH2 3.4Å; E274-R395 PolarHBondContact OE2-NH2 2.88Å
275	I	78.9	Confident	75.3	Confident	5 Å²	5	63.3 Å²	63.3	3%	0.026	32%	0.315	C	S	.	.	S	Bend	trans	-75.2	135.5	-168.2	-49.9	164.3	0	0	0	110.8	C236 K244 C261 F267 K270 E279 L280	C236-I275 HydrophobicContact CB-CD1 4.41Å; K244-I275 WeakPolarHBondContact CE-O 3.5Å; K244-I275 PolarHBondContact NZ-O 2.99Å; C261-I275 WeakPolarHBondContact SG-CD1 3.23Å; F267-I275 HydrophobicContact CB-CD1 3.83Å; F267-I275 HydrophobicContact CD1-CD1 3.71Å; F267-I275 HydrophobicContact CD1-CG1 3.99Å; F267-I275 HydrophobicContact CD1-CG2 3.82Å; F267-I275 HydrophobicContact CD2-CD1 4.42Å; F267-I275 HydrophobicContact CE1-CD1 4.42Å; F267-I275 HydrophobicContact CE1-CG1 4.38Å; F267-I275 HydrophobicContact CE1-CG2 3.39Å; F267-I275 HydrophobicContact CE2-CG2 4.29Å; F267-I275 HydrophobicContact CG-CD1 3.74Å; F267-I275 HydrophobicContact CG-CG2 4.47Å; F267-I275 HydrophobicContact CZ-CG2 3.68Å; K270-I275 HydrophobicContact CB-CD1 4.27Å; K270-I275 HydrophobicContact CB-CG1 4.27Å; I275-E279 HydrophobicContact CG2-CB 3.94Å; I275-L280 HydrophobicContact CB-CD2 4.26Å; I275-L280 HydrophobicContact CB-CG 4.29Å; I275-L280 HydrophobicContact CD1-CD2 4.17Å; I275-L280 HydrophobicContact CG2-CD1 4.44Å; I275-L280 HydrophobicContact CG2-CD2 3.78Å; I275-L280 HydrophobicContact CG2-CG 3.74Å
276	K	80.1	Confident	74.6	Confident	123 Å²	123	58.2 Å²	58.2	54%	0.535	30%	0.296	S	S	.	.			trans	-73.7	151.6	-179.7	-54.9	-168.6	-162.3	79.4	0	112.1	T278 E279 L280	K276-T278 VanDerWaalsContact C-N 3.29Å; K276-T278 PolarHBondContact O-N 3.02Å; K276-E279 HydrophobicContact CB-CB 4.3Å; K276-E279 HydrophobicContact CB-CG 3.97Å; K276-E279 WeakPolarHBondContact CG-OE1 3.27Å; K276-E279 PolarHBondContact N-OE2 2.81Å; K276-E279 IonicContact NZ-OE1 2.92Å; K276-E279 PolarHBondContact NZ-OE1 3.02Å; K276-E279 WeakPolarHBondContact O-CB 3.5Å; K276-E279 PolarHBondContact O-N 2.95Å; K276-L280 PolarHBondContact O-N 2.64Å; K276-L280 VanDerWaalsContact O-N 3.07Å
277	K	80.8	Confident	73.6	Confident	37 Å²	37	56.9 Å²	56.9	16%	0.161	30%	0.3	C	S	.	.	H	α-helix	trans	-56.7	-42.5	176.8	-64.9	-173.3	-173.3	-171.4	0	112.4	V241 K244 S245 E248 E279 L280 C281	V241-K277 HydrophobicContact CG1-CB 4.43Å; V241-K277 HydrophobicContact CG1-CD 4.29Å; V241-K277 HydrophobicContact CG1-CG 4.24Å; K244-K277 HydrophobicContact CD-CG 4.04Å; S245-K277 WeakPolarHBondContact OG-CE 3.34Å; S245-K277 PolarHBondContact OG-NZ 3.3Å; E248-K277 VanDerWaalsContact CD-CE 3.43Å; E248-K277 WeakPolarHBondContact OE1-CE 3.42Å; E248-K277 IonicContact OE1-NZ 2.81Å; E248-K277 WeakPolarHBondContact OE2-CE 3.35Å; E248-K277 IonicContact OE2-NZ 2.72Å; E248-K277 PolarHBondContact OE2-NZ 2.98Å; K277-E279 VanDerWaalsContact C-N 3.27Å; K277-E279 PolarHBondContact O-N 2.96Å; K277-L280 PolarHBondContact O-N 3.02Å; K277-C281 PolarHBondContact O-N 2.77Å
278	T	75.7	Confident	72.5	Confident	76 Å²	76	60.8 Å²	60.8	47%	0.466	32%	0.318	S	S	.	.	H	α-helix	trans	-68	-20.8	176.1	51	0	0	0	0	114.2	K276 C281 P282	K276-T278 VanDerWaalsContact C-N 3.29Å; K276-T278 PolarHBondContact O-N 3.02Å; T278-C281 CarbonylContact O-C 3.17Å; T278-P282 WeakPolarHBondContact O-CA 3.29Å
279	E	80.9	Confident	71.6	Confident	81 Å²	81	56.5 Å²	56.5	38%	0.379	30%	0.299	S	S	.	.	H	α-helix	trans	-83.3	-33.6	173.6	-68.3	163.1	-171.1	0	0	111.1	F267 I275 K276 K277	F267-E279 HydrophobicContact CE1-CB 4.43Å; F267-E279 HydrophobicContact CZ-CB 4Å; F267-E279 WeakPolarHBondContact CZ-O 3.44Å; I275-E279 HydrophobicContact CG2-CB 3.94Å; K276-E279 HydrophobicContact CB-CB 4.3Å; K276-E279 HydrophobicContact CB-CG 3.97Å; K276-E279 WeakPolarHBondContact CG-OE1 3.27Å; K276-E279 PolarHBondContact N-OE2 2.81Å; K276-E279 IonicContact NZ-OE1 2.92Å; K276-E279 PolarHBondContact NZ-OE1 3.02Å; K276-E279 WeakPolarHBondContact O-CB 3.5Å; K276-E279 PolarHBondContact O-N 2.95Å; K277-E279 VanDerWaalsContact C-N 3.27Å; K277-E279 PolarHBondContact O-N 2.96Å
280	L	81.8	Confident	71	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	31%	0.314	C	S	.	.	H	α-helix	trans	-74.9	-33.9	173.2	-65.1	166.6	0	0	0	112.8	C236 T237 C238 I240 V241 K244 F267 L272 I275 K276 K277	C236-L280 HydrophobicContact CB-CD2 3.89Å; C236-L280 WeakPolarHBondContact O-CD2 3.4Å; T237-L280 CarbonylContact C-O 3.59Å; C238-L280 WeakPolarHBondContact CA-O 3.43Å; C238-L280 PolarHBondContact N-O 3.3Å; I240-L280 HydrophobicContact CG2-CD1 3.87Å; I240-L280 HydrophobicContact CG2-CD2 3.94Å; I240-L280 HydrophobicContact CG2-CG 4.4Å; V241-L280 HydrophobicContact CG2-CB 3.66Å; V241-L280 HydrophobicContact CG2-CD1 4.04Å; K244-L280 HydrophobicContact CD-CD1 3.9Å; F267-L280 HydrophobicContact CD2-CD2 4.26Å; F267-L280 HydrophobicContact CE2-CD2 4.13Å; L272-L280 HydrophobicContact CD1-CD1 3.74Å; L272-L280 HydrophobicContact CD1-CD2 4.43Å; I275-L280 HydrophobicContact CB-CD2 4.26Å; I275-L280 HydrophobicContact CB-CG 4.29Å; I275-L280 HydrophobicContact CD1-CD2 4.17Å; I275-L280 HydrophobicContact CG2-CD1 4.44Å; I275-L280 HydrophobicContact CG2-CD2 3.78Å; I275-L280 HydrophobicContact CG2-CG 3.74Å; K276-L280 PolarHBondContact O-N 2.64Å; K276-L280 VanDerWaalsContact O-N 3.07Å; K277-L280 PolarHBondContact O-N 3.02Å
281	C	80.9	Confident	70.1	Confident	7 Å²	7	59 Å²	59	5%	0.047	32%	0.324	C	S	.	.			trans	-139.1	86.3	-179.5	-157.5	0	0	0	0	112	C238 V241 K277 T278 L283	C238-C281 HydrophobicContact CB-CB 3.54Å; C238-C281 WeakPolarHBondContact CB-SG 3.34Å; C238-C281 WeakPolarHBondContact SG-CB 3.26Å; C238-C281 CovalentContact SG-SG 2.04Å; C238-C281 PolarHBondContact SG-SG 2.7Å; V241-C281 HydrophobicContact CG2-CB 4.26Å; K277-C281 PolarHBondContact O-N 2.77Å; T278-C281 CarbonylContact O-C 3.17Å; C281-L283 PolarHBondContact O-N 3.31Å
282	P	69.1	Low	68.7	Low	108 Å²	108	63 Å²	63	70%	0.701	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	2.8	-178.5	31.3	-36.6	0	0	0	114.6	T278	T278-P282 WeakPolarHBondContact O-CA 3.29Å
283	L	59.3	Low	67.2	Low	161 Å²	161	64.6 Å²	64.6	84%	0.843	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	-2.1	-173.8	-68.7	174.7	0	0	0	114.6	C281	C281-L283 PolarHBondContact O-N 3.31Å
284	L	60.7	Low	65.6	Low	66 Å²	66	64 Å²	64	35%	0.346	37%	0.373	S	S	.	.	S	Bend	trans	-131.8	137.6	178.2	-67.8	171.8	0	0	0	109.6	E288 V289	L284-E288 HydrophobicContact CB-CB 4.47Å; L284-E288 HydrophobicContact CD2-CB 4.09Å; L284-V289 HydrophobicContact CB-CG2 3.71Å; L284-V289 HydrophobicContact CD1-CG2 4.27Å
285	S	59.9	Low	64.3	Low	55 Å²	55	63.8 Å²	63.8	39%	0.385	37%	0.372	S	S	.	.			trans	-70.9	155.6	167.7	66.5	0	0	0	0	111	S287 E288 V289	S285-S287 PolarHBondContact O-N 3.17Å; S285-S287 VanDerWaalsContact O-N 3.08Å; S285-E288 VanDerWaalsContact CB-OE2 3.25Å; S285-E288 WeakPolarHBondContact CB-OE2 3.34Å; S285-E288 PolarHBondContact N-OE2 3.33Å; S285-E288 PolarHBondContact O-N 3.35Å; S285-E288 VanDerWaalsContact OG-CD 3.3Å; S285-E288 WeakPolarHBondContact OG-CG 3.39Å; S285-E288 PolarHBondContact OG-N 2.83Å; S285-E288 PolarHBondContact OG-OE2 3.46Å; S285-V289 WeakPolarHBondContact O-CG2 3.48Å; S285-V289 PolarHBondContact O-N 3.39Å
286	D	58.3	Low	62.4	Low	83 Å²	83	68.3 Å²	68.3	44%	0.444	40%	0.402	S	S	.	.	H	α-helix	trans	-54.2	-32.3	176.9	-68.1	-65.6	0	0	0	112.1	V289 E290	D286-V289 PolarHBondContact O-N 3.18Å; D286-E290 WeakPolarHBondContact O-CG 3.32Å; D286-E290 PolarHBondContact O-N 3.35Å
287	S	55.1	Low	60.3	Low	91 Å²	91	70 Å²	70	64%	0.636	41%	0.412	S	S	*	.	H	α-helix	trans	-69	-38.5	175.9	-53.9	0	0	0	0	113.6	S285 E290 A291	S285-S287 PolarHBondContact O-N 3.17Å; S285-S287 VanDerWaalsContact O-N 3.08Å; S287-E290 PolarHBondContact O-N 3.45Å; S287-A291 WeakPolarHBondContact O-CB 3.49Å; S287-A291 PolarHBondContact O-N 3.32Å
288	E	58.2	Low	58.1	Low	100 Å²	100	76.3 Å²	76.3	47%	0.467	45%	0.446	S	S	.	.	H	α-helix	trans	-74.6	-32.9	175.6	-68.1	159.2	129.2	0	0	111.5	L284 S285 S292	L284-E288 HydrophobicContact CB-CB 4.47Å; L284-E288 HydrophobicContact CD2-CB 4.09Å; S285-E288 VanDerWaalsContact CB-OE2 3.25Å; S285-E288 WeakPolarHBondContact CB-OE2 3.34Å; S285-E288 PolarHBondContact N-OE2 3.33Å; S285-E288 PolarHBondContact O-N 3.35Å; S285-E288 VanDerWaalsContact OG-CD 3.3Å; S285-E288 WeakPolarHBondContact OG-CG 3.39Å; S285-E288 PolarHBondContact OG-N 2.83Å; S285-E288 PolarHBondContact OG-OE2 3.46Å; E288-S292 WeakPolarHBondContact O-CB 3.44Å; E288-S292 PolarHBondContact O-N 3.19Å; E288-S292 PolarHBondContact O-OG 2.94Å
289	V	57.4	Low	55.7	Low	9 Å²	9	77.6 Å²	77.6	6%	0.055	46%	0.458	C	S	.	.	H	α-helix	trans	-60.8	-48.3	169	171.8	0	0	0	0	110.3	V241 L284 S285 D286 L293	V241-V289 HydrophobicContact CG1-CG1 3.67Å; L284-V289 HydrophobicContact CB-CG2 3.71Å; L284-V289 HydrophobicContact CD1-CG2 4.27Å; S285-V289 WeakPolarHBondContact O-CG2 3.48Å; S285-V289 PolarHBondContact O-N 3.39Å; D286-V289 PolarHBondContact O-N 3.18Å; V289-L293 HydrophobicContact CG1-CD1 3.71Å; V289-L293 VanDerWaalsContact O-CB 3.31Å; V289-L293 WeakPolarHBondContact O-CB 3.2Å; V289-L293 WeakPolarHBondContact O-CD1 3.4Å; V289-L293 WeakPolarHBondContact O-CG 3.44Å; V289-L293 PolarHBondContact O-N 3.46Å
290	E	57.7	Low	53.4	Low	68 Å²	68	79.4 Å²	79.4	32%	0.318	48%	0.48	S	S	.	.	H	α-helix	trans	-67.6	-40.1	179.1	-70.3	-164	137.2	0	0	113.2	R249 D286 S287 I295	R249-E290 IonicContact CZ-OE1 3.66Å; R249-E290 IonicContact NH2-OE1 3.46Å; R249-E290 PolarHBondContact NH2-OE1 2.98Å; D286-E290 WeakPolarHBondContact O-CG 3.32Å; D286-E290 PolarHBondContact O-N 3.35Å; S287-E290 PolarHBondContact O-N 3.45Å; E290-I295 HydrophobicContact CB-CD1 4.48Å; E290-I295 HydrophobicContact CG-CD1 4.23Å
291	A	55.2	Low	50.9	Low	70 Å²	70	83.8 Å²	83.8	58%	0.579	51%	0.512	S	S	*	.	H	α-helix	trans	-66.4	-43.5	177.2	0	0	0	0	0	113.1	S287 L293	S287-A291 WeakPolarHBondContact O-CB 3.49Å; S287-A291 PolarHBondContact O-N 3.32Å; A291-L293 VanDerWaalsContact C-N 3.29Å; A291-L293 PolarHBondContact O-N 3.17Å
292	S	49.7	Very low	48.4	Very low	84 Å²	84	93.2 Å²	93.2	59%	0.587	55%	0.552	S	S	*	*	H	α-helix	trans	-69.9	-25.8	-177.7	-56.7	0	0	0	0	113.2	E288	E288-S292 WeakPolarHBondContact O-CB 3.44Å; E288-S292 PolarHBondContact O-N 3.19Å; E288-S292 PolarHBondContact O-OG 2.94Å
293	L	53.5	Low	46.7	Very low	34 Å²	34	96.4 Å²	96.4	18%	0.178	56%	0.557	C	S	.	*	T	Hydrogen-bonded Turn	trans	-95.2	3.5	-171.9	-64.1	178.9	0	0	0	114.5	Q242 V289 A291 I295	Q242-L293 HydrophobicContact CG-CD1 3.61Å; Q242-L293 HydrophobicContact CG-CD2 3.41Å; Q242-L293 VanDerWaalsContact CG-CD2 3.41Å; Q242-L293 HydrophobicContact CG-CG 4.05Å; V289-L293 HydrophobicContact CG1-CD1 3.71Å; V289-L293 VanDerWaalsContact O-CB 3.31Å; V289-L293 WeakPolarHBondContact O-CB 3.2Å; V289-L293 WeakPolarHBondContact O-CD1 3.4Å; V289-L293 WeakPolarHBondContact O-CG 3.44Å; V289-L293 PolarHBondContact O-N 3.46Å; A291-L293 VanDerWaalsContact C-N 3.29Å; A291-L293 PolarHBondContact O-N 3.17Å; L293-I295 VanDerWaalsContact C-N 3.33Å; L293-I295 HydrophobicContact CB-CD1 4.03Å; L293-I295 HydrophobicContact CB-CG1 4.4Å; L293-I295 PolarHBondContact O-N 3.08Å
294	G	46.2	Very low	45.3	Very low	49 Å²	49	96.6 Å²	96.6	51%	0.505	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	67.9	32	173.7	0	0	0	0	0	113.8
295	I	51.8	Low	43.7	Very low	24 Å²	24	98 Å²	98	12%	0.123	58%	0.581	C	S	.	*	P	Polyproline II helix	trans	-78.1	133.3	178.8	-72.8	158.6	0	0	0	109.2	Y213 R249 E290 L293 H297	Y213-I295 HydrophobicContact CD1-CG1 4.3Å; Y213-I295 HydrophobicContact CE1-CG1 4.01Å; R249-I295 VanDerWaalsContact NH1-CD1 3.28Å; R249-I295 VanDerWaalsContact NH1-CG2 3.3Å; E290-I295 HydrophobicContact CB-CD1 4.48Å; E290-I295 HydrophobicContact CG-CD1 4.23Å; L293-I295 VanDerWaalsContact C-N 3.33Å; L293-I295 HydrophobicContact CB-CD1 4.03Å; L293-I295 HydrophobicContact CB-CG1 4.4Å; L293-I295 PolarHBondContact O-N 3.08Å; I295-H297 PolarHBondContact O-N 2.73Å
296	P	38.5	Very low	42.1	Very low	101 Å²	101	107.3 Å²	107.3	66%	0.656	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-68.8	122	174.7	27.7	-33.2	0	0	0	110.6	L298	P296-L298 PolarHBondContact O-N 2.91Å
297	H	36.1	Very low	40.8	Very low	158 Å²	158	109 Å²	109	73%	0.731	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-60.6	133.1	171.3	-74.4	-77.7	0	0	0	110.9	I295 S299	I295-H297 PolarHBondContact O-N 2.73Å; H297-S299 PolarHBondContact O-N 3.02Å
298	L	33.3	Very low	39.5	Very low	169 Å²	169	111.2 Å²	111.2	89%	0.885	63%	0.633	S	S	*	*			trans	-80.8	113	160	-155.3	79	0	0	0	108	P296 S300	P296-L298 PolarHBondContact O-N 2.91Å; L298-S300 VanDerWaalsContact C-N 3.33Å; L298-S300 PolarHBondContact O-N 3.35Å
299	S	25.8	Very low	38.5	Very low	103 Å²	103	115 Å²	115	72%	0.72	65%	0.648	S	S	*	*			trans	-72.7	84.6	-179.2	57.1	0	0	0	0	111.2	H297 S301	H297-S299 PolarHBondContact O-N 3.02Å; S299-S301 VanDerWaalsContact C-N 3.28Å; S299-S301 PolarHBondContact O-N 3.19Å
300	S	33.4	Very low	37.2	Very low	120 Å²	120	120.3 Å²	120.3	84%	0.839	68%	0.682	S	S	*	*			trans	-72.4	81.6	172	-168.8	0	0	0	0	110.4	L298	L298-S300 VanDerWaalsContact C-N 3.33Å; L298-S300 PolarHBondContact O-N 3.35Å
301	S	29.5	Very low	35.7	Very low	100 Å²	100	121.7 Å²	121.7	70%	0.699	70%	0.7	S	S	*	*			trans	-111.3	79.3	-178.9	65.7	0	0	0	0	112.2	S299	S299-S301 VanDerWaalsContact C-N 3.28Å; S299-S301 PolarHBondContact O-N 3.19Å
302	K	28.6	Very low	34.7	Very low	205 Å²	205	123.3 Å²	123.3	89%	0.891	71%	0.707	S	S	*	*			trans	-158.5	121.2	135.9	-110.6	166.1	-172.9	178.7	0	110
303	E	32.9	Very low	33.6	Very low	174 Å²	174	128.2 Å²	128.2	81%	0.813	72%	0.723	S	S	*	*			trans	-72.1	151.1	-177.1	-61.1	154.2	112.7	0	0	111.3
304	N	30.3	Very low	32.7	Very low	165 Å²	165	133.1 Å²	133.1	88%	0.882	75%	0.748	S	S	*	*				166.1	73.1	127.1	-84.4	-38.8	0	0	0	112.6
305	A	27.1	Very low	31.7	Very low	97 Å²	97	136.6 Å²	136.6	80%	0.802	77%	0.765	S	S	*	*			trans	-157.3	124.3	157.2	0	0	0	0	0	110.1
306	W	26.3	Very low	30.6	Very low	250 Å²	250	140 Å²	140	95%	0.947	79%	0.79	S	S	*	*			trans	-79.5	141.5	172.5	-79.8	71.3	0	0	0	110.6	T308	W306-T308 PolarHBondContact O-N 3.4Å
307	P	30.2	Very low	30.1	Very low	117 Å²	117	141.7 Å²	141.7	76%	0.76	80%	0.799	S	S	*	*			trans	-79.2	112.3	-173.8	30.3	-34.7	0	0	0	112.7	K309	P307-K309 PolarHBondContact O-N 2.97Å; P307-K309 VanDerWaalsContact O-N 3.14Å
308	T	28	Very low	29.7	Very low	139 Å²	139	141.6 Å²	141.6	85%	0.853	80%	0.798	S	S	*	*			trans	-77.2	92.9	170.3	37.9	0	0	0	0	111.8	W306	W306-T308 PolarHBondContact O-N 3.4Å
309	K	36.2	Very low	29.5	Very low	180 Å²	180	141.8 Å²	141.8	78%	0.783	79%	0.792	S	S	*	*			trans	-63.2	143.3	152.3	-70	-177.8	177.4	177.7	0	108.4	P307	P307-K309 PolarHBondContact O-N 2.97Å; P307-K309 VanDerWaalsContact O-N 3.14Å
310	P	31.2	Very low	29.5	Very low	120 Å²	120	143.7 Å²	143.7	78%	0.779	80%	0.8	S	S	*	*				-114.9	127.5	79.1	31.3	-26.5	0	0	0	111.6
311	S	26.5	Very low	29.5	Very low	97 Å²	97	142.5 Å²	142.5	68%	0.678	80%	0.797	S	S	*	*				75.6	111.4	69.8	-62.5	0	0	0	0	112.2
312	S	33.9	Very low	29.4	Very low	104 Å²	104	142.9 Å²	142.9	73%	0.727	80%	0.8	S	S	*	*			trans	-65.7	146.3	176.3	42.9	0	0	0	0	112.7
313	M	26.3	Very low	29.4	Very low	187 Å²	187	138.5 Å²	138.5	92%	0.921	80%	0.795	S	S	*	*			trans	-105	122.3	149	-87.1	-70.9	177.9	0	0	108
314	L	33.6	Very low	29.2	Very low	136 Å²	136	136.3 Å²	136.3	71%	0.712	79%	0.793	S	S	*	*			trans	-72.4	155.5	162.2	-87.6	69.7	0	0	0	108.9
315	S	25.5	Very low	29	Very low	123 Å²	123	135.9 Å²	135.9	86%	0.86	79%	0.786	S	S	*	*				-136.1	128	124.9	58.4	0	0	0	0	108.5
316	S	29.6	Very low	29	Very low	94 Å²	94	139.6 Å²	139.6	66%	0.657	78%	0.78	S	S	*	*			trans	-106.2	139.8	174.3	49.6	0	0	0	0	108.9
317	V	27.9	Very low	28.9	Very low	137 Å²	137	136.1 Å²	136.1	83%	0.83	77%	0.772	S	S	*	*			trans	-141.6	108.8	163.9	-165.4	0	0	0	0	109.4
318	H	28.6	Very low	28.7	Very low	156 Å²	156	136 Å²	136	72%	0.722	77%	0.774	S	S	*	*			trans	-94.4	153.3	147	-64.9	-70	0	0	0	106
319	F	27.9	Very low	28.7	Very low	174 Å²	174	134.2 Å²	134.2	76%	0.763	77%	0.767	S	S	*	*				-164.5	167.1	53.8	-94.8	-81	0	0	0	113.7
320	T	26.9	Very low	28.4	Very low	143 Å²	143	132.4 Å²	132.4	88%	0.877	77%	0.766	S	S	*	*			trans	67.7	167.1	152.2	44.3	0	0	0	0	118.5
321	A	32.1	Very low	28.3	Very low	94 Å²	94	136.3 Å²	136.3	78%	0.777	77%	0.771	S	S	*	*			trans	-133.7	-177.9	-161.1	0	0	0	0	0	112.5
322	S	27.9	Very low	28.6	Very low	108 Å²	108	139.7 Å²	139.7	76%	0.755	78%	0.776	S	S	*	*			trans	89	112	170.6	77.1	0	0	0	0	118.5
323	S	27.9	Very low	28.8	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	78%	0.779	S	S	*	*				86	131.7	124.4	-62.4	0	0	0	0	123
324	V	29.4	Very low	29	Very low	129 Å²	129	140.9 Å²	140.9	78%	0.782	78%	0.775	S	S	*	*			trans	75.7	91.6	148.5	179.4	0	0	0	0	119.5
325	E	26.3	Very low	29.7	Very low	155 Å²	155	139.9 Å²	139.9	72%	0.724	78%	0.777	S	S	*	*				70	147.4	113.6	-131.6	178	-155.4	0	0	124.5
326	Y	26.3	Very low	29.9	Very low	176 Å²	176	140 Å²	140	69%	0.69	77%	0.772	S	S	*	*			trans	78.5	120.8	154.7	-90.1	-60.1	0	0	0	125.2
327	K	24.8	Very low	30.1	Very low	176 Å²	176	145 Å²	145	77%	0.765	78%	0.782	S	S	*	*			trans	70.8	101.4	137.2	-100.5	165.2	-176.8	169.9	0	122.5
328	S	26.7	Very low	30.4	Very low	114 Å²	114	147.1 Å²	147.1	80%	0.797	78%	0.783	S	S	*	*				63	141.2	111.7	-159.1	0	0	0	0	123.4
329	S	27.1	Very low	30.9	Very low	102 Å²	102	145.2 Å²	145.2	71%	0.713	79%	0.785	S	S	*	*			trans	116.1	86.1	137.7	-156	0	0	0	0	119.9
330	N	30	Very low	31	Very low	143 Å²	143	148.6 Å²	148.6	77%	0.765	79%	0.792	S	S	*	*				47.5	111.5	115.5	-170.5	15.9	0	0	0	121
331	K	28.8	Very low	31.5	Very low	201 Å²	201	148.1 Å²	148.1	87%	0.874	79%	0.789	S	S	*	*			trans	-175.8	148.6	133.7	-103.4	159	-174.1	176.7	0	114.3
332	Q	33.8	Very low	31.6	Very low	169 Å²	169	150 Å²	150	79%	0.79	79%	0.793	S	S	*	*			trans	-99.9	163.8	156.4	-65.2	-169.1	-8.6	0	0	109.9
333	P	37.9	Very low	31.8	Very low	121 Å²	121	156.1 Å²	156.1	79%	0.786	80%	0.8	S	S	*	*				-154.7	136.6	91.4	37.1	-17.2	0	0	0	118.4
334	K	30.1	Very low	32.4	Very low	195 Å²	195	156.3 Å²	156.3	85%	0.848	80%	0.799	S	S	*	*			trans	44.9	162.1	139.1	-76.4	-172.7	175.1	179.8	0	124
335	P	49.2	Very low	32.5	Very low	114 Å²	114	155.7 Å²	155.7	74%	0.74	80%	0.797	S	S	*	*			trans	-123.2	170.4	-156.9	43.4	-31.6	0	0	0	117.1
336	T	29.7	Very low	32.6	Very low	125 Å²	125	153.8 Å²	153.8	77%	0.767	80%	0.801	S	S	*	*			trans	-152.4	132.1	164.3	32.5	0	0	0	0	116.1
337	K	32.6	Very low	32.9	Very low	199 Å²	199	152.1 Å²	152.1	87%	0.865	81%	0.809	S	S	*	*			trans	65.6	126.7	143.6	-59.7	177.2	-175.5	179.7	0	121.7
338	Q	34.8	Very low	33.2	Very low	183 Å²	183	149 Å²	149	86%	0.855	81%	0.81	S	S	*	*			trans	-83.8	170.4	156.6	-61.6	178.1	-21.7	0	0	111
339	P	39.1	Very low	33.3	Very low	116 Å²	116	153.1 Å²	153.1	75%	0.753	82%	0.816	S	S	*	*				-153.1	151.7	97.9	38	-20	0	0	0	118.9
340	R	28.7	Very low	33.4	Very low	245 Å²	245	152 Å²	152	93%	0.925	81%	0.814	S	S	*	*			trans	71.2	159	148.6	-75.8	-178.5	173.3	170.9	-1.6	121.5
341	T	38.6	Very low	33.4	Very low	133 Å²	133	153.7 Å²	153.7	82%	0.816	82%	0.821	S	S	*	*			trans	-134.7	155.2	-170.4	48.6	0	0	0	0	112.4
342	P	34.8	Very low	33.6	Very low	132 Å²	132	154.2 Å²	154.2	86%	0.857	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-100.7	171	162.2	-4.8	25.9	0	0	0	114.1
343	R	31.5	Very low	33.6	Very low	238 Å²	238	152.5 Å²	152.5	90%	0.898	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-93.5	161.1	179.6	-101.1	-178.9	170.6	176.1	-4.3	113.4
344	P	41.2	Very low	33.3	Very low	117 Å²	117	149.5 Å²	149.5	76%	0.76	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-96.6	151.4	172.5	37.6	-33.6	0	0	0	114.5
345	P	31.5	Very low	34	Very low	115 Å²	115	146 Å²	146	75%	0.747	81%	0.811	S	S	*	*			trans	-105.8	170.8	151.1	38.6	-29.9	0	0	0	110.7
346	S	28.4	Very low	33.6	Very low	116 Å²	116	147.8 Å²	147.8	81%	0.811	81%	0.814	S	S	*	*			cis	-163.1	157.3	-23.3	48.5	0	0	0	0	108.1
347	T	32	Very low	33.8	Very low	141 Å²	141	150.8 Å²	150.8	87%	0.865	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-69.7	154.1	-169.3	-34.3	0	0	0	0	114.8
348	S	30.6	Very low	33.8	Very low	111 Å²	111	146.3 Å²	146.3	78%	0.776	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-67.5	152.8	178	52.4	0	0	0	0	115.1
349	Q	29.3	Very low	33.8	Very low	200 Å²	200	143.8 Å²	143.8	94%	0.935	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-103	146.1	166.2	-158.5	169.1	16.4	0	0	109.9
350	A	29.8	Very low	33.7	Very low	79 Å²	79	145.3 Å²	145.3	65%	0.653	81%	0.81	S	S	*	*			trans	-113.7	159.6	-167.4	0	0	0	0	0	113.9
351	L	29.9	Very low	34	Very low	177 Å²	177	137.1 Å²	137.1	93%	0.927	80%	0.796	S	S	*	*			trans	-123	137.1	157	-89.8	91.3	0	0	0	110.1
352	Y	32.7	Very low	33.6	Very low	212 Å²	212	136.6 Å²	136.6	83%	0.831	79%	0.794	S	S	*	*			trans	-91.2	151	164.7	-78.6	-89.7	0	0	0	109.1
353	P	33.5	Very low	33.5	Very low	134 Å²	134	140.2 Å²	140.2	87%	0.87	79%	0.792	S	S	*	*				-124.8	170.9	76.2	38.8	-31.2	0	0	0	112.1
354	G	31.7	Very low	33.4	Very low	57 Å²	57	138.1 Å²	138.1	59%	0.588	79%	0.793	S	S	*	*			cis	-178.2	166.7	0.5	0	0	0	0	0	108	N356	G354-N356 PolarHBondContact O-N 3.35Å
355	P	43.8	Very low	33.2	Very low	121 Å²	121	138.7 Å²	138.7	79%	0.786	79%	0.794	S	S	*	*			trans	-84.4	120.6	-165.9	31.3	-33.8	0	0	0	114
356	N	41.3	Very low	33.3	Very low	152 Å²	152	144.2 Å²	144.2	81%	0.813	80%	0.8	S	S	*	*			trans	161.2	94.5	132.9	-83.7	-21	0	0	0	112.7	G354	G354-N356 PolarHBondContact O-N 3.35Å
357	Q	34.2	Very low	33.4	Very low	188 Å²	188	144 Å²	144	88%	0.879	80%	0.796	S	S	*	*			trans	-165.1	142.5	151.9	-110.4	157.4	49.9	0	0	110.4
358	P	33.1	Very low	34	Very low	105 Å²	105	143 Å²	143	68%	0.682	79%	0.792	S	S	*	*			trans	-76.9	157.1	179.3	32.4	-35.3	0	0	0	112	I360	P358-I360 PolarHBondContact O-N 2.84Å; P358-I360 VanDerWaalsContact O-N 3.17Å
359	P	34.9	Very low	34.8	Very low	130 Å²	130	142.9 Å²	142.9	84%	0.844	78%	0.781	S	S	*	*			trans	-70.8	111.6	-178.2	28.5	-34.4	0	0	0	111.7	A361	P359-A361 PolarHBondContact O-N 3.21Å
360	I	36.3	Very low	35.8	Very low	148 Å²	148	137.8 Å²	137.8	76%	0.759	77%	0.766	S	S	*	*			trans	-71.7	120.6	165.2	-61.2	175	0	0	0	107.6	P358	P358-I360 PolarHBondContact O-N 2.84Å; P358-I360 VanDerWaalsContact O-N 3.17Å
361	A	34.6	Very low	37.3	Very low	74 Å²	74	138.6 Å²	138.6	61%	0.612	76%	0.758	S	S	*	*			trans	-63.2	135.9	177.2	0	0	0	0	0	110.4	P359 Y363	P359-A361 PolarHBondContact O-N 3.21Å; A361-Y363 PolarHBondContact O-N 3.35Å
362	P	31.8	Very low	39.1	Very low	122 Å²	122	132.5 Å²	132.5	79%	0.792	73%	0.726	S	S	*	*			trans	-68	111.3	177.2	27.6	-33.2	0	0	0	109.5	Q364	P362-Q364 PolarHBondContact O-N 3.44Å; P362-Q364 VanDerWaalsContact O-N 3.12Å
363	Y	32	Very low	41.2	Very low	208 Å²	208	124.2 Å²	124.2	82%	0.816	70%	0.698	S	S	*	*			trans	-56.6	117.9	166.8	-65	-84.8	0	0	0	108.5	A361 T365	A361-Y363 PolarHBondContact O-N 3.35Å; Y363-T365 PolarHBondContact O-N 3.11Å
364	Q	28.8	Very low	43.6	Very low	193 Å²	193	118 Å²	118	90%	0.902	66%	0.658	S	S	*	*			trans	-65.2	97.8	170.6	-76.1	-175.4	-26.2	0	0	108.7	P362 R366	P362-Q364 PolarHBondContact O-N 3.44Å; P362-Q364 VanDerWaalsContact O-N 3.12Å; Q364-R366 PolarHBondContact O-N 3.14Å
365	T	36.3	Very low	45.7	Very low	129 Å²	129	120.1 Å²	120.1	79%	0.791	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-57.1	120.7	160.8	45	0	0	0	0	107.2	Y363	Y363-T365 PolarHBondContact O-N 3.11Å
366	R	33.6	Very low	47	Very low	232 Å²	232	116.6 Å²	116.6	88%	0.875	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-54.8	136.4	170.3	-73.9	-177.9	175.5	176.4	-1.1	107.5	Q364	Q364-R366 PolarHBondContact O-N 3.14Å
367	P	31.8	Very low	48.9	Very low	110 Å²	110	110.2 Å²	110.2	71%	0.714	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-56.3	143.4	177.3	24.7	-33.9	0	0	0	109.4	I369	P367-I369 PolarHBondContact O-N 3.5Å
368	P	44	Very low	50.9	Low	120 Å²	120	103.3 Å²	103.3	78%	0.779	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-56.6	133	178.3	24.5	-33.6	0	0	0	109.1
369	I	48	Very low	53.2	Low	109 Å²	109	99.5 Å²	99.5	56%	0.559	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-57.9	124.6	178.5	-58.9	174	0	0	0	107.1	P367 I371	P367-I369 PolarHBondContact O-N 3.5Å; I369-I371 PolarHBondContact O-N 3.44Å
370	P	50.1	Low	54.9	Low	94 Å²	94	97 Å²	97	61%	0.61	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-60.5	124.7	-179.8	24.1	-33	0	0	0	109.1	I372	P370-I372 VanDerWaalsContact C-N 3.31Å; P370-I372 PolarHBondContact O-N 3.13Å
371	I	61.1	Low	56.3	Low	95 Å²	95	94 Å²	94	49%	0.487	52%	0.524	S	S	.	.			trans	-74.2	90.4	178	-58.8	173.7	0	0	0	107.6	I369 C373 L381 L388	I369-I371 PolarHBondContact O-N 3.44Å; I371-C373 PolarHBondContact O-N 3.11Å; I371-L381 HydrophobicContact CD1-CB 3.95Å; I371-L381 HydrophobicContact CD1-CD2 3.91Å; I371-L381 HydrophobicContact CG1-CD2 4.25Å; I371-L388 HydrophobicContact CG2-CD1 3.73Å; I371-L388 HydrophobicContact CG2-CD2 4.47Å
372	I	66.9	Low	57.4	Low	49 Å²	49	95 Å²	95	25%	0.251	52%	0.515	S	S	.	.			trans	-76.9	110.6	176.3	-59.1	-175.2	0	0	0	108	P370 P405 R406 P407 L408	P370-I372 VanDerWaalsContact C-N 3.31Å; P370-I372 PolarHBondContact O-N 3.13Å; I372-P405 HydrophobicContact CG2-CB 3.51Å; I372-P405 HydrophobicContact CG2-CG 3.5Å; I372-R406 VanDerWaalsContact CG2-O 3.28Å; I372-R406 WeakPolarHBondContact CG2-O 3.25Å; I372-P407 WeakPolarHBondContact O-CA 3.27Å; I372-P407 WeakPolarHBondContact O-CB 3.36Å; I372-L408 HydrophobicContact CD1-CD1 3.84Å; I372-L408 HydrophobicContact CD1-CG 4.23Å
373	C	77.4	Confident	58.1	Low	38 Å²	38	96.4 Å²	96.4	26%	0.257	52%	0.515	S	S	.	.			trans	-115	135.9	176.6	-167.4	0	0	0	0	110.2	I371 C379 P405	I371-C373 PolarHBondContact O-N 3.11Å; C373-C379 WeakPolarHBondContact CA-SG 3.49Å; C373-C379 HydrophobicContact CB-CB 3.68Å; C373-C379 WeakPolarHBondContact CB-SG 3.34Å; C373-C379 WeakPolarHBondContact SG-CB 3.46Å; C373-C379 PolarHBondContact SG-N 3.11Å; C373-C379 VanDerWaalsContact SG-N 3.4Å; C373-C379 CovalentContact SG-SG 2.03Å; C373-C379 PolarHBondContact SG-SG 2.92Å; C373-P405 WeakPolarHBondContact O-CD 3.3Å; C373-P405 WeakPolarHBondContact O-CG 3.36Å
374	P	83.2	Confident	58.6	Low	4 Å²	4	93.4 Å²	93.4	3%	0.026	51%	0.513	C	S	.	.			trans	-62.4	147.5	176.1	-21.9	33	0	0	0	112.5	G376 C377 V390 L403 L404 P407	P374-G376 PolarHBondContact O-N 3.08Å; P374-C377 HydrophobicContact CB-CB 4.16Å; P374-C377 HydrophobicContact CG-CB 4.43Å; P374-C377 PolarHBondContact O-N 3.23Å; P374-C377 VanDerWaalsContact O-N 3.1Å; P374-V390 HydrophobicContact CG-CG1 4.42Å; P374-L403 HydrophobicContact CB-CB 4.28Å; P374-L403 HydrophobicContact CB-CD2 4.1Å; P374-L403 HydrophobicContact CG-CB 4.18Å; P374-L403 HydrophobicContact CG-CD2 4.22Å; P374-L404 WeakPolarHBondContact CA-O 3.02Å; P374-P407 HydrophobicContact CG-CG 4.26Å
375	T	76	Confident	59.8	Low	101 Å²	101	87.1 Å²	87.1	62%	0.62	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	130.4	174.7	53.2	0	0	0	0	110.5	C377 L404	T375-C377 VanDerWaalsContact C-N 3.3Å; T375-C377 PolarHBondContact O-N 3.12Å; T375-L404 PolarHBondContact N-O 3.36Å; T375-L404 PolarHBondContact OG1-O 2.96Å; T375-L404 VanDerWaalsContact OG1-O 3.14Å
376	G	72	Confident	60.8	Low	48 Å²	48	87.2 Å²	87.2	50%	0.495	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-3.2	-177.9	0	0	0	0	0	115.2	P374 R395	P374-G376 PolarHBondContact O-N 3.08Å; G376-R395 WeakPolarHBondContact O-CD 3.48Å; G376-R395 WeakPolarHBondContact O-CG 3.44Å; G376-R395 VanDerWaalsContact O-CZ 3.31Å; G376-R395 PolarHBondContact O-NE 2.79Å; G376-R395 PolarHBondContact O-NH1 2.86Å
377	C	81.9	Confident	62.5	Low	17 Å²	17	76.4 Å²	76.4	12%	0.115	44%	0.441	C	S	.	.			trans	-101.5	163.7	173.2	-60.1	0	0	0	0	112.4	P374 T375 N391 C392	P374-C377 HydrophobicContact CB-CB 4.16Å; P374-C377 HydrophobicContact CG-CB 4.43Å; P374-C377 PolarHBondContact O-N 3.23Å; P374-C377 VanDerWaalsContact O-N 3.1Å; T375-C377 VanDerWaalsContact C-N 3.3Å; T375-C377 PolarHBondContact O-N 3.12Å; C377-N391 WeakPolarHBondContact CA-O 3.07Å; C377-N391 VanDerWaalsContact CB-O 3.3Å; C377-N391 WeakPolarHBondContact CB-O 3.42Å; C377-C392 HydrophobicContact CB-CB 4.17Å; C377-C392 WeakPolarHBondContact CB-SG 3.48Å; C377-C392 WeakPolarHBondContact SG-CB 3.29Å; C377-C392 CovalentContact SG-SG 2.03Å; C377-C392 PolarHBondContact SG-SG 3.02Å
378	T	76.1	Confident	64.7	Low	43 Å²	43	71.4 Å²	71.4	26%	0.264	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.3	170.1	58.7	0	0	0	0	109.8	N391	T378-N391 PolarHBondContact N-O 2.86Å; T378-N391 PolarHBondContact O-N 3.08Å; T378-N391 PolarHBondContact OG1-O 2.9Å
379	C	79.7	Confident	66.4	Low	25 Å²	25	66.8 Å²	66.8	17%	0.169	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	125.5	-178.9	-49.6	0	0	0	0	112.1	C373 L388 T389 V390	C373-C379 WeakPolarHBondContact CA-SG 3.49Å; C373-C379 HydrophobicContact CB-CB 3.68Å; C373-C379 WeakPolarHBondContact CB-SG 3.34Å; C373-C379 WeakPolarHBondContact SG-CB 3.46Å; C373-C379 PolarHBondContact SG-N 3.11Å; C373-C379 VanDerWaalsContact SG-N 3.4Å; C373-C379 CovalentContact SG-SG 2.03Å; C373-C379 PolarHBondContact SG-SG 2.92Å; C379-L388 HydrophobicContact CB-CD1 3.9Å; C379-L388 HydrophobicContact CB-CG 4.36Å; C379-T389 CarbonylContact C-O 3.35Å; C379-T389 VanDerWaalsContact CA-O 3.25Å; C379-T389 WeakPolarHBondContact CA-O 3.44Å; C379-V390 HydrophobicContact CB-CG2 4.44Å
380	N	70.8	Confident	68.1	Low	78 Å²	78	61.6 Å²	61.6	42%	0.417	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	123.4	-177.4	-67.9	-26.7	0	0	0	109.9	T389	N380-T389 PolarHBondContact N-O 3.23Å; N380-T389 PolarHBondContact O-N 3.43Å
381	L	66.5	Low	69.5	Low	85 Å²	85	57.8 Å²	57.8	45%	0.445	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	122	177.5	-174.4	72	0	0	0	110.2	I371 L388	I371-L381 HydrophobicContact CD1-CB 3.95Å; I371-L381 HydrophobicContact CD1-CD2 3.91Å; I371-L381 HydrophobicContact CG1-CD2 4.25Å; L381-L388 HydrophobicContact CB-CD1 4.25Å; L381-L388 HydrophobicContact CD1-CB 4.32Å; L381-L388 HydrophobicContact CD1-CD1 4.32Å
382	H	57.6	Low	70.6	Confident	95 Å²	95	53.2 Å²	53.2	44%	0.44	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	111	179.6	-64.7	-89.7	0	0	0	110.9	N384 D385 L386 G387 T389	H382-N384 VanDerWaalsContact C-N 3.28Å; H382-N384 PolarHBondContact O-N 3.5Å; H382-D385 HydrophobicContact CB-CB 4.43Å; H382-D385 PolarHBondContact O-N 3.44Å; H382-D385 VanDerWaalsContact O-N 3.12Å; H382-L386 PolarHBondContact O-N 3.37Å; H382-G387 PolarHBondContact N-O 2.98Å; H382-T389 PolarHBondContact CD2-OG1 2.82Å; H382-T389 VanDerWaalsContact CD2-OG1 3.23Å; H382-T389 PolarHBondContact NE2-OG1 3.33Å
383	I	46.1	Very low	71.2	Confident	151 Å²	151	51.6 Å²	51.6	77%	0.774	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-38.2	-171.3	-63.6	170	0	0	0	112.7	D385	I383-D385 VanDerWaalsContact C-N 3.3Å; I383-D385 PolarHBondContact O-N 3.3Å
384	N	43.3	Very low	71.2	Confident	145 Å²	145	53.7 Å²	53.7	78%	0.775	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-23.8	-176.4	-58.4	-2.6	0	0	0	113.6	H382	H382-N384 VanDerWaalsContact C-N 3.28Å; H382-N384 PolarHBondContact O-N 3.5Å
385	D	53.1	Low	71.2	Confident	62 Å²	62	58.2 Å²	58.2	33%	0.332	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-13.3	-166.9	-103.2	24.9	0	0	0	113.2	H382 I383 G387 K411	H382-D385 HydrophobicContact CB-CB 4.43Å; H382-D385 PolarHBondContact O-N 3.44Å; H382-D385 VanDerWaalsContact O-N 3.12Å; I383-D385 VanDerWaalsContact C-N 3.3Å; I383-D385 PolarHBondContact O-N 3.3Å; D385-G387 PolarHBondContact O-N 2.84Å; D385-K411 IonicContact OD2-NZ 2.7Å; D385-K411 PolarHBondContact OD2-NZ 2.85Å
386	L	58.7	Low	71.6	Confident	130 Å²	130	54.9 Å²	54.9	68%	0.681	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	8.7	-162.5	-69.4	85.2	0	0	0	114.7	H382	H382-L386 PolarHBondContact O-N 3.37Å
387	G	68.3	Low	72.4	Confident	5 Å²	5	53.6 Å²	53.6	5%	0.052	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	130.6	-177.9	0	0	0	0	0	112.3	H382 D385	H382-G387 PolarHBondContact N-O 2.98Å; D385-G387 PolarHBondContact O-N 2.84Å
388	L	77.8	Confident	72.7	Confident	6 Å²	6	56 Å²	56	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117.1	173.2	-173.9	65.1	0	0	0	110.1	I371 C379 L381 V390 P407 N409 A410 K411	I371-L388 HydrophobicContact CG2-CD1 3.73Å; I371-L388 HydrophobicContact CG2-CD2 4.47Å; C379-L388 HydrophobicContact CB-CD1 3.9Å; C379-L388 HydrophobicContact CB-CG 4.36Å; L381-L388 HydrophobicContact CB-CD1 4.25Å; L381-L388 HydrophobicContact CD1-CB 4.32Å; L381-L388 HydrophobicContact CD1-CD1 4.32Å; L388-V390 HydrophobicContact CD2-CG2 4.06Å; L388-V390 HydrophobicContact CG-CG2 3.95Å; L388-P407 HydrophobicContact CD2-CB 4.07Å; L388-N409 PolarHBondContact N-O 3.13Å; L388-A410 CarbonylContact O-C 3.49Å; L388-A410 WeakPolarHBondContact O-CA 3.43Å; L388-K411 PolarHBondContact O-N 2.76Å
389	T	80.6	Confident	73.2	Confident	22 Å²	22	56.7 Å²	56.7	14%	0.135	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	123.6	168.1	-66.2	0	0	0	0	108.3	C379 N380 H382 K412 Y414	C379-T389 CarbonylContact C-O 3.35Å; C379-T389 VanDerWaalsContact CA-O 3.25Å; C379-T389 WeakPolarHBondContact CA-O 3.44Å; N380-T389 PolarHBondContact N-O 3.23Å; N380-T389 PolarHBondContact O-N 3.43Å; H382-T389 PolarHBondContact CD2-OG1 2.82Å; H382-T389 VanDerWaalsContact CD2-OG1 3.23Å; H382-T389 PolarHBondContact NE2-OG1 3.33Å; T389-K412 HydrophobicContact CG2-CB 4.25Å; T389-Y414 HydrophobicContact CG2-CD2 4.47Å; T389-Y414 HydrophobicContact CG2-CE2 4.07Å
390	V	83.9	Confident	73.6	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.9	179.9	-179.5	0	0	0	0	108.6	P374 C379 L388 P407 A410 K412 L413 Y414	P374-V390 HydrophobicContact CG-CG1 4.42Å; C379-V390 HydrophobicContact CB-CG2 4.44Å; L388-V390 HydrophobicContact CD2-CG2 4.06Å; L388-V390 HydrophobicContact CG-CG2 3.95Å; V390-P407 HydrophobicContact CG1-CG 4.46Å; V390-P407 HydrophobicContact CG2-CB 3.79Å; V390-P407 HydrophobicContact CG2-CG 3.99Å; V390-A410 HydrophobicContact CG2-CB 4.07Å; V390-K412 PolarHBondContact N-O 3.1Å; V390-L413 HydrophobicContact CB-CD1 3.88Å; V390-L413 HydrophobicContact CG1-CD1 3.72Å; V390-L413 WeakPolarHBondContact O-CA 3.33Å; V390-Y414 PolarHBondContact O-N 3.03Å
391	N	79.1	Confident	74.3	Confident	14 Å²	14	54.2 Å²	54.2	8%	0.075	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.4	175	-173.9	-3.9	0	0	0	110.8	E274 C377 T378 K393 Y414	E274-N391 HydrophobicContact CG-CB 4.39Å; E274-N391 WeakPolarHBondContact CG-ND2 3.42Å; E274-N391 PolarHBondContact OE1-ND2 2.96Å; C377-N391 WeakPolarHBondContact CA-O 3.07Å; C377-N391 VanDerWaalsContact CB-O 3.3Å; C377-N391 WeakPolarHBondContact CB-O 3.42Å; T378-N391 PolarHBondContact N-O 2.86Å; T378-N391 PolarHBondContact O-N 3.08Å; T378-N391 PolarHBondContact OG1-O 2.9Å; N391-K393 VanDerWaalsContact OD1-CB 3.32Å; N391-K393 WeakPolarHBondContact OD1-CB 3.41Å; N391-K393 PolarHBondContact OD1-N 3.03Å; N391-Y414 HydrophobicContact CB-CD2 4.41Å
392	C	84.1	Confident	75.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.279	C	S	.	.			trans	-132.1	25.4	-174.9	-63.4	0	0	0	0	111.1	C377 R395 F397 L403 Y414 L415 N418	C377-C392 HydrophobicContact CB-CB 4.17Å; C377-C392 WeakPolarHBondContact CB-SG 3.48Å; C377-C392 WeakPolarHBondContact SG-CB 3.29Å; C377-C392 CovalentContact SG-SG 2.03Å; C377-C392 PolarHBondContact SG-SG 3.02Å; C392-R395 WeakPolarHBondContact O-CG 3.47Å; C392-F397 HydrophobicContact CB-CD2 4.28Å; C392-F397 HydrophobicContact CB-CE2 3.86Å; C392-L403 HydrophobicContact CB-CD2 4.36Å; C392-L403 VanDerWaalsContact SG-CD2 3.57Å; C392-Y414 WeakPolarHBondContact CA-O 3.39Å; C392-Y414 WeakPolarHBondContact CB-O 3.26Å; C392-Y414 PolarHBondContact N-O 3.3Å; C392-L415 HydrophobicContact CB-CD2 3.59Å; C392-L415 HydrophobicContact CB-CG 4.49Å; C392-N418 PolarHBondContact O-ND2 3.39Å
393	K	78.7	Confident	76.4	Confident	15 Å²	15	48.8 Å²	48.8	7%	0.065	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	140.4	178.2	-174	171.4	-166.7	-91.2	0	111.7	T260 G269 N391 R395 S416	T260-K393 PolarHBondContact OG1-NZ 3.1Å; T260-K393 VanDerWaalsContact OG1-NZ 3.13Å; G269-K393 PolarHBondContact O-NZ 2.02Å; N391-K393 VanDerWaalsContact OD1-CB 3.32Å; N391-K393 WeakPolarHBondContact OD1-CB 3.41Å; N391-K393 PolarHBondContact OD1-N 3.03Å; K393-R395 VanDerWaalsContact C-N 3.32Å; K393-R395 WeakPolarHBondContact O-CD 3.38Å; K393-R395 WeakPolarHBondContact O-CG 3.38Å; K393-R395 PolarHBondContact O-N 3.35Å; K393-R395 PolarHBondContact O-NE 3.12Å; K393-S416 WeakPolarHBondContact CA-O 3.37Å
394	E	78.4	Confident	78	Confident	82 Å²	82	46.5 Å²	46.5	38%	0.383	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	36.2	172.4	-70.3	167.2	-148.9	0	0	115.3	G269 S416 S417	G269-E394 WeakPolarHBondContact CA-OE2 3.47Å; E394-S416 PolarHBondContact N-O 2.89Å; E394-S417 WeakPolarHBondContact CA-O 3.38Å; E394-S417 VanDerWaalsContact CG-CB 3.44Å
395	R	83.2	Confident	79.8	Confident	98 Å²	98	42.6 Å²	42.6	37%	0.37	23%	0.23	S	C	.	.	S	Bend	trans	-100.8	-5.7	178.5	-51.3	-52.6	166.4	126.9	-6.7	113.9	E274 G376 C392 K393 F397 N418	E274-R395 IonicContact OE2-CZ 2.64Å; E274-R395 IonicContact OE2-NH2 3.4Å; E274-R395 PolarHBondContact OE2-NH2 2.88Å; G376-R395 WeakPolarHBondContact O-CD 3.48Å; G376-R395 WeakPolarHBondContact O-CG 3.44Å; G376-R395 VanDerWaalsContact O-CZ 3.31Å; G376-R395 PolarHBondContact O-NE 2.79Å; G376-R395 PolarHBondContact O-NH1 2.86Å; C392-R395 WeakPolarHBondContact O-CG 3.47Å; K393-R395 VanDerWaalsContact C-N 3.32Å; K393-R395 WeakPolarHBondContact O-CD 3.38Å; K393-R395 WeakPolarHBondContact O-CG 3.38Å; K393-R395 PolarHBondContact O-N 3.35Å; K393-R395 PolarHBondContact O-NE 3.12Å; R395-F397 HydrophobicContact CB-CD2 3.75Å; R395-F397 HydrophobicContact CB-CE2 3.5Å; R395-F397 VanDerWaalsContact CB-CE2 3.5Å; R395-F397 HydrophobicContact CB-CZ 4.24Å; R395-F397 HydrophobicContact CG-CE2 3.99Å; R395-N418 PolarHBondContact N-OD1 3.39Å
396	G	84.4	Confident	81	Confident	32 Å²	32	43.2 Å²	43.2	33%	0.33	23%	0.227	S	C	.	.			trans	77.6	20.2	177.6	0	0	0	0	0	114.6	N398 N418	G396-N398 PolarHBondContact O-ND2 2.88Å; G396-N398 VanDerWaalsContact O-ND2 3.14Å; G396-N418 PolarHBondContact N-OD1 2.83Å
397	F	87.7	Confident	81.9	Confident	20 Å²	20	37.3 Å²	37.3	9%	0.088	20%	0.197	C	C	.	.			trans	-60.1	135	176.3	-69.4	-65.4	0	0	0	111.2	C392 R395 E402 L403 N418 L419 I420	C392-F397 HydrophobicContact CB-CD2 4.28Å; C392-F397 HydrophobicContact CB-CE2 3.86Å; R395-F397 HydrophobicContact CB-CD2 3.75Å; R395-F397 HydrophobicContact CB-CE2 3.5Å; R395-F397 VanDerWaalsContact CB-CE2 3.5Å; R395-F397 HydrophobicContact CB-CZ 4.24Å; R395-F397 HydrophobicContact CG-CE2 3.99Å; F397-E402 WeakPolarHBondContact CA-OE2 3.28Å; F397-E402 HydrophobicContact CD1-CB 3.72Å; F397-E402 HydrophobicContact CE1-CB 4.2Å; F397-L403 HydrophobicContact CD2-CD2 4.3Å; F397-L403 HydrophobicContact CE1-CD2 4.26Å; F397-L403 HydrophobicContact CE2-CD2 3.9Å; F397-L403 HydrophobicContact CZ-CD2 3.87Å; F397-N418 HydrophobicContact CB-CB 4.46Å; F397-N418 PolarHBondContact N-OD1 3.29Å; F397-L419 CarbonylContact O-C 3.54Å; F397-L419 VanDerWaalsContact O-C 3.25Å; F397-L419 WeakPolarHBondContact O-CA 3.02Å; F397-L419 PolarHBondContact O-N 3.22Å; F397-I420 PolarHBondContact O-N 3.31Å
398	N	87.9	Confident	82.1	Confident	67 Å²	67	41 Å²	41	36%	0.358	22%	0.215	S	C	.	.	S	Bend	trans	-101.5	-23.1	-179.5	-56.2	-91.9	0	0	0	111.9	G396 E402 I420 Q421	G396-N398 PolarHBondContact O-ND2 2.88Å; G396-N398 VanDerWaalsContact O-ND2 3.14Å; N398-E402 WeakPolarHBondContact CB-OE1 3.49Å; N398-E402 PolarHBondContact N-OE2 3.33Å; N398-I420 WeakPolarHBondContact O-CA 3.41Å; N398-Q421 PolarHBondContact O-N 2.87Å
399	N	87.9	Confident	82	Confident	59 Å²	59	45 Å²	45	32%	0.316	24%	0.236	S	C	.	.	S	Bend	trans	-143.1	143.4	177.6	-55.9	-91.7	0	0	0	109.9	S401 E402	N399-S401 PolarHBondContact O-N 3.06Å; N399-E402 HydrophobicContact CB-CG 4.38Å; N399-E402 WeakPolarHBondContact CB-OE1 3.49Å; N399-E402 PolarHBondContact N-OE1 2.82Å; N399-E402 PolarHBondContact ND2-OE1 3.4Å; N399-E402 VanDerWaalsContact O-CB 3.3Å; N399-E402 WeakPolarHBondContact O-CB 3.25Å; N399-E402 PolarHBondContact O-N 3.22Å
400	I	88.4	Confident	82	Confident	2 Å²	2	44 Å²	44	1%	0.01	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-63.3	-27.8	177.9	-59.1	147.9	0	0	0	111.3	E402 L403 L415 I420 I423 D427 F428 L439	I400-E402 PolarHBondContact O-N 2.98Å; I400-L403 HydrophobicContact CG2-CD1 3.99Å; I400-L403 WeakPolarHBondContact O-CB 3.34Å; I400-L403 VanDerWaalsContact O-CG 3.25Å; I400-L403 WeakPolarHBondContact O-CG 3.34Å; I400-L403 PolarHBondContact O-N 2.04Å; I400-L403 VanDerWaalsContact O-N 3.16Å; I400-L415 HydrophobicContact CG1-CD1 4.32Å; I400-L415 HydrophobicContact CG2-CD1 4.39Å; I400-I420 HydrophobicContact CD1-CG2 4.39Å; I400-I420 HydrophobicContact CG1-CD1 4.04Å; I400-I420 HydrophobicContact CG1-CG2 4.21Å; I400-I423 HydrophobicContact CD1-CB 4.35Å; I400-I423 HydrophobicContact CD1-CD1 4.45Å; I400-I423 HydrophobicContact CD1-CG1 3.95Å; I400-I423 HydrophobicContact CD1-CG2 4Å; I400-D427 HydrophobicContact CB-CB 3.75Å; I400-D427 HydrophobicContact CD1-CB 3.97Å; I400-D427 HydrophobicContact CG2-CB 3.81Å; I400-F428 HydrophobicContact CD1-CE1 4.35Å; I400-F428 HydrophobicContact CD1-CE2 3.91Å; I400-F428 HydrophobicContact CD1-CZ 3.54Å; I400-F428 HydrophobicContact CG1-CZ 4.34Å; I400-F428 HydrophobicContact CG2-CE1 4.02Å; I400-F428 HydrophobicContact CG2-CZ 4.32Å; I400-L439 HydrophobicContact CD1-CD2 4.48Å
401	S	85.3	Confident	82	Confident	48 Å²	48	46.5 Å²	46.5	34%	0.336	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-65.7	-8.9	173.3	-75.9	0	0	0	0	115.4	N399 L403 R406 D427	N399-S401 PolarHBondContact O-N 3.06Å; S401-L403 PolarHBondContact O-N 3.26Å; S401-R406 PolarHBondContact OG-NH2 2.99Å; S401-D427 WeakPolarHBondContact CB-OD1 3.3Å; S401-D427 PolarHBondContact N-OD1 3Å; S401-D427 VanDerWaalsContact N-OD1 3.14Å; S401-D427 PolarHBondContact OG-OD1 2.91Å
402	E	83.6	Confident	82.2	Confident	65 Å²	65	49 Å²	49	30%	0.304	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-74.9	-9.7	171.1	-68.8	155.6	-148.7	0	0	113	F397 N398 N399 I400 L404	F397-E402 WeakPolarHBondContact CA-OE2 3.28Å; F397-E402 HydrophobicContact CD1-CB 3.72Å; F397-E402 HydrophobicContact CE1-CB 4.2Å; N398-E402 WeakPolarHBondContact CB-OE1 3.49Å; N398-E402 PolarHBondContact N-OE2 3.33Å; N399-E402 HydrophobicContact CB-CG 4.38Å; N399-E402 WeakPolarHBondContact CB-OE1 3.49Å; N399-E402 PolarHBondContact N-OE1 2.82Å; N399-E402 PolarHBondContact ND2-OE1 3.4Å; N399-E402 VanDerWaalsContact O-CB 3.3Å; N399-E402 WeakPolarHBondContact O-CB 3.25Å; N399-E402 PolarHBondContact O-N 3.22Å; I400-E402 PolarHBondContact O-N 2.98Å; E402-L404 VanDerWaalsContact C-N 3.29Å; E402-L404 PolarHBondContact O-N 3.12Å
403	L	83.7	Confident	82.3	Confident	1 Å²	1	49 Å²	49	1%	0.005	25%	0.251	C	S	.	.			trans	-70.6	79.3	176.7	-64.1	175.9	0	0	0	111.9	P374 C392 F397 I400 S401 P405 R406 L415	P374-L403 HydrophobicContact CB-CB 4.28Å; P374-L403 HydrophobicContact CB-CD2 4.1Å; P374-L403 HydrophobicContact CG-CB 4.18Å; P374-L403 HydrophobicContact CG-CD2 4.22Å; C392-L403 HydrophobicContact CB-CD2 4.36Å; C392-L403 VanDerWaalsContact SG-CD2 3.57Å; F397-L403 HydrophobicContact CD2-CD2 4.3Å; F397-L403 HydrophobicContact CE1-CD2 4.26Å; F397-L403 HydrophobicContact CE2-CD2 3.9Å; F397-L403 HydrophobicContact CZ-CD2 3.87Å; I400-L403 HydrophobicContact CG2-CD1 3.99Å; I400-L403 WeakPolarHBondContact O-CB 3.34Å; I400-L403 VanDerWaalsContact O-CG 3.25Å; I400-L403 WeakPolarHBondContact O-CG 3.34Å; I400-L403 PolarHBondContact O-N 2.04Å; I400-L403 VanDerWaalsContact O-N 3.16Å; S401-L403 PolarHBondContact O-N 3.26Å; L403-P405 CarbonylContact O-C 3.14Å; L403-R406 WeakPolarHBondContact O-CA 3.38Å; L403-R406 WeakPolarHBondContact O-CG 3.44Å; L403-R406 PolarHBondContact O-N 3.08Å; L403-L415 HydrophobicContact CD1-CD1 4.19Å; L403-L415 HydrophobicContact CD1-CD2 3.97Å; L403-L415 HydrophobicContact CD2-CD2 4.06Å; L403-L415 HydrophobicContact CG-CD2 4.44Å
404	L	80.6	Confident	82.6	Confident	103 Å²	103	49 Å²	49	54%	0.539	25%	0.251	S	S	.	.	S	Bend	trans	-115.1	134	179.5	-64.1	176.7	0	0	0	111.1	P374 T375 E402	P374-L404 WeakPolarHBondContact CA-O 3.02Å; T375-L404 PolarHBondContact N-O 3.36Å; T375-L404 PolarHBondContact OG1-O 2.96Å; T375-L404 VanDerWaalsContact OG1-O 3.14Å; E402-L404 VanDerWaalsContact C-N 3.29Å; E402-L404 PolarHBondContact O-N 3.12Å
405	P	79.4	Confident	83	Confident	64 Å²	64	45.1 Å²	45.1	42%	0.416	23%	0.233	S	C	.	.	S	Bend	cis	-68.9	144.1	-12.3	32.4	-37.6	0	0	0	111.9	I372 C373 L403	I372-P405 HydrophobicContact CG2-CB 3.51Å; I372-P405 HydrophobicContact CG2-CG 3.5Å; C373-P405 WeakPolarHBondContact O-CD 3.3Å; C373-P405 WeakPolarHBondContact O-CG 3.36Å; L403-P405 CarbonylContact O-C 3.14Å
406	R	79.2	Confident	83.1	Confident	75 Å²	75	40.6 Å²	40.6	28%	0.283	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-65.1	133.3	-178	-75.1	-172.6	177.1	-154	2.2	111.2	I372 S401 L403 L408 S426 D427	I372-R406 VanDerWaalsContact CG2-O 3.28Å; I372-R406 WeakPolarHBondContact CG2-O 3.25Å; S401-R406 PolarHBondContact OG-NH2 2.99Å; L403-R406 WeakPolarHBondContact O-CA 3.38Å; L403-R406 WeakPolarHBondContact O-CG 3.44Å; L403-R406 PolarHBondContact O-N 3.08Å; R406-L408 PolarHBondContact O-N 3.37Å; R406-S426 PolarHBondContact NH1-O 2.79Å; R406-S426 PolarHBondContact NH2-O 2.92Å; R406-D427 PolarHBondContact NH1-O 3.39Å
407	P	76.7	Confident	83.1	Confident	5 Å²	5	40.8 Å²	40.8	3%	0.032	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-77.6	121.5	-174.2	31.3	-32.3	0	0	0	111.1	I372 P374 L388 V390 A410 F431	I372-P407 WeakPolarHBondContact O-CA 3.27Å; I372-P407 WeakPolarHBondContact O-CB 3.36Å; P374-P407 HydrophobicContact CG-CG 4.26Å; L388-P407 HydrophobicContact CD2-CB 4.07Å; V390-P407 HydrophobicContact CG1-CG 4.46Å; V390-P407 HydrophobicContact CG2-CB 3.79Å; V390-P407 HydrophobicContact CG2-CG 3.99Å; P407-A410 HydrophobicContact CB-CB 4.4Å; P407-A410 HydrophobicContact CG-CB 4.22Å; P407-F431 HydrophobicContact CG-CE1 3.73Å; P407-F431 HydrophobicContact CG-CZ 3.93Å
408	L	73.4	Confident	83.2	Confident	84 Å²	84	40.2 Å²	40.2	44%	0.44	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	141.1	172.3	-62.9	175.8	0	0	0	110	I372 R406 A410	I372-L408 HydrophobicContact CD1-CD1 3.84Å; I372-L408 HydrophobicContact CD1-CG 4.23Å; R406-L408 PolarHBondContact O-N 3.37Å; L408-A410 VanDerWaalsContact C-N 3.28Å; L408-A410 PolarHBondContact O-N 2.94Å
409	N	75.8	Confident	83.4	Confident	90 Å²	90	40.5 Å²	40.5	48%	0.481	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	32.2	177.1	-53.3	-18.3	0	0	0	114.9	L388 K411 S433	L388-N409 PolarHBondContact N-O 3.13Å; N409-K411 PolarHBondContact O-N 3.5Å; N409-S433 VanDerWaalsContact C-OG 3.28Å; N409-S433 WeakPolarHBondContact CA-OG 3.41Å
410	A	80.4	Confident	83.7	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	126.5	170.4	0	0	0	0	0	110.8	L388 V390 P407 L408 F431 S433 L434	L388-A410 CarbonylContact O-C 3.49Å; L388-A410 WeakPolarHBondContact O-CA 3.43Å; V390-A410 HydrophobicContact CG2-CB 4.07Å; P407-A410 HydrophobicContact CB-CB 4.4Å; P407-A410 HydrophobicContact CG-CB 4.22Å; L408-A410 VanDerWaalsContact C-N 3.28Å; L408-A410 PolarHBondContact O-N 2.94Å; A410-F431 HydrophobicContact CB-CD1 4.04Å; A410-F431 HydrophobicContact CB-CE1 4.08Å; A410-S433 PolarHBondContact N-OG 3.14Å; A410-S433 CarbonylContact O-C 3.51Å; A410-S433 VanDerWaalsContact O-C 3.26Å; A410-S433 WeakPolarHBondContact O-CB 3.01Å; A410-S433 PolarHBondContact O-OG 3.43Å; A410-L434 HydrophobicContact CB-CD2 3.97Å; A410-L434 WeakPolarHBondContact O-CD2 3.43Å; A410-L434 PolarHBondContact O-N 3.02Å
411	K	83.3	Confident	83.9	Confident	51 Å²	51	42.2 Å²	42.2	22%	0.222	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-28.7	177.9	-171	172.3	-176.7	179.3	0	112.7	D385 L388 N409 S433 D435 L436	D385-K411 IonicContact OD2-NZ 2.7Å; D385-K411 PolarHBondContact OD2-NZ 2.85Å; L388-K411 PolarHBondContact O-N 2.76Å; N409-K411 PolarHBondContact O-N 3.5Å; K411-S433 WeakPolarHBondContact CA-O 3.45Å; K411-D435 WeakPolarHBondContact CE-OD2 3.35Å; K411-D435 HydrophobicContact CG-CB 4.22Å; K411-D435 IonicContact NZ-OD2 2.69Å; K411-D435 PolarHBondContact O-N 2.92Å; K411-L436 PolarHBondContact O-N 2.89Å
412	K	83.2	Confident	84.3	Confident	66 Å²	66	44 Å²	44	29%	0.287	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	133.3	170.6	-57.9	-172.3	179	-176.7	0	108.8	T389 V390 Y414 L436	T389-K412 HydrophobicContact CG2-CB 4.25Å; V390-K412 PolarHBondContact N-O 3.1Å; K412-Y414 HydrophobicContact CB-CE2 3.9Å; K412-L436 WeakPolarHBondContact CA-O 3.28Å; K412-L436 HydrophobicContact CB-CB 4.46Å; K412-L436 HydrophobicContact CG-CB 4.18Å
413	L	87.8	Confident	84.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	115.2	179.1	177.8	59.9	0	0	0	110.6	V390 L415 F428 F431 L434 L436 L437 H438	V390-L413 HydrophobicContact CB-CD1 3.88Å; V390-L413 HydrophobicContact CG1-CD1 3.72Å; V390-L413 WeakPolarHBondContact O-CA 3.33Å; L413-L415 HydrophobicContact CD1-CD1 4.25Å; L413-L415 HydrophobicContact CD1-CG 4.12Å; L413-L415 HydrophobicContact CD2-CD1 3.79Å; L413-L415 HydrophobicContact CG-CD1 3.86Å; L413-L415 HydrophobicContact CG-CG 4.08Å; L413-F428 HydrophobicContact CD2-CE1 4.27Å; L413-F431 HydrophobicContact CD2-CD1 4.18Å; L413-F431 HydrophobicContact CD2-CE1 3.7Å; L413-F431 HydrophobicContact CD2-CZ 4.22Å; L413-L434 HydrophobicContact CB-CD1 4.23Å; L413-L434 HydrophobicContact CB-CD2 3.7Å; L413-L434 HydrophobicContact CD2-CD1 4.32Å; L413-L436 PolarHBondContact N-O 3.42Å; L413-L437 HydrophobicContact CB-CD1 4.2Å; L413-L437 HydrophobicContact CD2-CD1 3.96Å; L413-L437 HydrophobicContact CG-CD1 4.11Å; L413-H438 PolarHBondContact O-N 2.9Å
414	Y	84	Confident	85.3	Confident	16 Å²	16	45 Å²	45	6%	0.063	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.7	177.1	-59	-98.6	0	0	0	110	T389 V390 N391 C392 K412 L436 H438	T389-Y414 HydrophobicContact CG2-CD2 4.47Å; T389-Y414 HydrophobicContact CG2-CE2 4.07Å; V390-Y414 PolarHBondContact O-N 3.03Å; N391-Y414 HydrophobicContact CB-CD2 4.41Å; C392-Y414 WeakPolarHBondContact CA-O 3.39Å; C392-Y414 WeakPolarHBondContact CB-O 3.26Å; C392-Y414 PolarHBondContact N-O 3.3Å; K412-Y414 HydrophobicContact CB-CE2 3.9Å; Y414-L436 HydrophobicContact CD1-CD2 4.41Å; Y414-L436 HydrophobicContact CE1-CD2 3.92Å; Y414-L436 HydrophobicContact CE2-CD2 4.38Å; Y414-H438 HydrophobicContact CD1-CB 3.89Å
415	L	87.3	Confident	85.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.217	C	C	.	.			trans	-128.3	19.9	-179.9	-73.3	164.2	0	0	0	111.3	C392 I400 L403 L413 N418 I420 H438 L439 N442	C392-L415 HydrophobicContact CB-CD2 3.59Å; C392-L415 HydrophobicContact CB-CG 4.49Å; I400-L415 HydrophobicContact CG1-CD1 4.32Å; I400-L415 HydrophobicContact CG2-CD1 4.39Å; L403-L415 HydrophobicContact CD1-CD1 4.19Å; L403-L415 HydrophobicContact CD1-CD2 3.97Å; L403-L415 HydrophobicContact CD2-CD2 4.06Å; L403-L415 HydrophobicContact CG-CD2 4.44Å; L413-L415 HydrophobicContact CD1-CD1 4.25Å; L413-L415 HydrophobicContact CD1-CG 4.12Å; L413-L415 HydrophobicContact CD2-CD1 3.79Å; L413-L415 HydrophobicContact CG-CD1 3.86Å; L413-L415 HydrophobicContact CG-CG 4.08Å; L415-N418 PolarHBondContact O-ND2 2.79Å; L415-I420 HydrophobicContact CB-CD1 4.07Å; L415-I420 HydrophobicContact CD1-CD1 4.48Å; L415-I420 HydrophobicContact CD2-CD1 4.45Å; L415-H438 CarbonylContact C-O 3.41Å; L415-H438 WeakPolarHBondContact CA-O 3.49Å; L415-H438 PolarHBondContact N-O 3.08Å; L415-L439 HydrophobicContact CB-CD2 3.89Å; L415-L439 HydrophobicContact CD1-CD2 3.9Å; L415-N442 PolarHBondContact O-ND2 2.92Å
416	S	85.4	Confident	86.1	Confident	4 Å²	4	45.9 Å²	45.9	3%	0.028	22%	0.219	C	C	.	.			trans	-60	155.8	179.3	23.6	0	0	0	0	113.3	K393 E394 N418 H438 G440	K393-S416 WeakPolarHBondContact CA-O 3.37Å; E394-S416 PolarHBondContact N-O 2.89Å; S416-N418 VanDerWaalsContact C-N 3.28Å; S416-N418 PolarHBondContact O-N 2.93Å; S416-N418 PolarHBondContact O-ND2 2.83Å; S416-N418 VanDerWaalsContact O-ND2 3.09Å; S416-H438 WeakPolarHBondContact CB-ND1 3.44Å; S416-H438 PolarHBondContact N-O 3.44Å; S416-G440 WeakPolarHBondContact CA-O 3.46Å; S416-G440 WeakPolarHBondContact CB-O 3.38Å
417	S	84.2	Confident	86.6	Confident	36 Å²	36	42.4 Å²	42.4	25%	0.252	21%	0.206	S	C	.	.	S	Bend	trans	56.4	41.2	171.6	-60.2	0	0	0	0	113.1	E394 G440 N441	E394-S417 WeakPolarHBondContact CA-O 3.38Å; E394-S417 VanDerWaalsContact CG-CB 3.44Å; S417-G440 PolarHBondContact N-O 3.39Å; S417-N441 WeakPolarHBondContact CA-O 2.96Å; S417-N441 PolarHBondContact N-O 3.17Å
418	N	89.1	Confident	87.2	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.043	20%	0.204	C	C	.	.	S	Bend	trans	-114.6	-169.1	175	-77.9	-70.3	0	0	0	110.3	C392 R395 G396 F397 L415 S416 I420 N441 N442	C392-N418 PolarHBondContact O-ND2 3.39Å; R395-N418 PolarHBondContact N-OD1 3.39Å; G396-N418 PolarHBondContact N-OD1 2.83Å; F397-N418 HydrophobicContact CB-CB 4.46Å; F397-N418 PolarHBondContact N-OD1 3.29Å; L415-N418 PolarHBondContact O-ND2 2.79Å; S416-N418 VanDerWaalsContact C-N 3.28Å; S416-N418 PolarHBondContact O-N 2.93Å; S416-N418 PolarHBondContact O-ND2 2.83Å; S416-N418 VanDerWaalsContact O-ND2 3.09Å; N418-I420 HydrophobicContact CB-CD1 4.38Å; N418-I420 HydrophobicContact CB-CG1 4.21Å; N418-N441 PolarHBondContact N-O 3.49Å; N418-N442 WeakPolarHBondContact CA-OD1 3.45Å; N418-N442 WeakPolarHBondContact CB-OD1 3.4Å; N418-N442 PolarHBondContact N-OD1 2.9Å; N418-N442 PolarHBondContact O-OD1 3.3Å
419	L	92	Very high	87.6	Confident	73 Å²	73	45.3 Å²	45.3	38%	0.382	21%	0.211	S	C	.	.			trans	-110.2	24.2	-177.3	-60.7	176.2	0	0	0	111.9	F397 Q421	F397-L419 CarbonylContact O-C 3.54Å; F397-L419 VanDerWaalsContact O-C 3.25Å; F397-L419 WeakPolarHBondContact O-CA 3.02Å; F397-L419 PolarHBondContact O-N 3.22Å; L419-Q421 PolarHBondContact O-N 2.98Å
420	I	94.7	Very high	87.8	Confident	0 Å²	0	46 Å²	46	0%	0	21%	0.214	C	C	.	.			trans	-66.6	122.7	-175	-56.9	168.1	0	0	0	109.2	F397 N398 I400 L415 N418 L439 N442 R443 I444	F397-I420 PolarHBondContact O-N 3.31Å; N398-I420 WeakPolarHBondContact O-CA 3.41Å; I400-I420 HydrophobicContact CD1-CG2 4.39Å; I400-I420 HydrophobicContact CG1-CD1 4.04Å; I400-I420 HydrophobicContact CG1-CG2 4.21Å; L415-I420 HydrophobicContact CB-CD1 4.07Å; L415-I420 HydrophobicContact CD1-CD1 4.48Å; L415-I420 HydrophobicContact CD2-CD1 4.45Å; N418-I420 HydrophobicContact CB-CD1 4.38Å; N418-I420 HydrophobicContact CB-CG1 4.21Å; I420-L439 HydrophobicContact CD1-CD2 4.08Å; I420-N442 HydrophobicContact CB-CB 4.36Å; I420-N442 VanDerWaalsContact CB-OD1 3.32Å; I420-N442 WeakPolarHBondContact CB-OD1 3.37Å; I420-N442 WeakPolarHBondContact CG1-OD1 3.46Å; I420-N442 PolarHBondContact N-OD1 3.44Å; I420-R443 CarbonylContact O-C 3.25Å; I420-R443 WeakPolarHBondContact O-CA 3.39Å; I420-R443 PolarHBondContact O-N 2.78Å; I420-I444 HydrophobicContact CB-CG1 4.33Å; I420-I444 HydrophobicContact CG2-CG1 4.13Å; I420-I444 VanDerWaalsContact O-CG1 3.29Å; I420-I444 WeakPolarHBondContact O-CG1 3.04Å; I420-I444 PolarHBondContact O-N 3.07Å; I420-I444 VanDerWaalsContact O-N 3.15Å
421	Q	93.4	Very high	88	Confident	96 Å²	96	46.1 Å²	46.1	45%	0.449	21%	0.214	S	C	.	.			trans	-103.5	-28.7	-177.3	-69.9	173.6	32.9	0	0	114.1	N398 L419 R443 I444 S445	N398-Q421 PolarHBondContact O-N 2.87Å; L419-Q421 PolarHBondContact O-N 2.98Å; Q421-R443 WeakPolarHBondContact CA-O 3.32Å; Q421-R443 HydrophobicContact CG-CB 4.07Å; Q421-I444 WeakPolarHBondContact O-CA 3.34Å; Q421-S445 PolarHBondContact O-N 3.46Å
422	K	93.2	Very high	88.2	Confident	85 Å²	85	46.8 Å²	46.8	37%	0.37	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	145.2	-170.3	-58.3	-175.3	-178.1	171.9	0	110.4	Y424 Y446	K422-Y424 HydrophobicContact CB-CD2 4.47Å; K422-Y424 HydrophobicContact CB-CE2 3.75Å; K422-Y424 WeakPolarHBondContact CD-OH 3.27Å; K422-Y446 WeakPolarHBondContact CA-O 3.47Å
423	I	94.6	Very high	88.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	124.5	173.3	-53	-174.5	0	0	0	109.4	I400 F428 L439 I444 Y446 V447 Q448 A451 F452 L463	I400-I423 HydrophobicContact CD1-CB 4.35Å; I400-I423 HydrophobicContact CD1-CD1 4.45Å; I400-I423 HydrophobicContact CD1-CG1 3.95Å; I400-I423 HydrophobicContact CD1-CG2 4Å; I423-F428 HydrophobicContact CG2-CD2 4.18Å; I423-F428 HydrophobicContact CG2-CE2 3.6Å; I423-L439 HydrophobicContact CD1-CD1 3.8Å; I423-I444 HydrophobicContact CD1-CD1 4.2Å; I423-I444 HydrophobicContact CD1-CG2 4.23Å; I423-I444 HydrophobicContact CG1-CG2 4.1Å; I423-Y446 PolarHBondContact N-O 3.18Å; I423-V447 HydrophobicContact CB-CG1 4.24Å; I423-V447 HydrophobicContact CB-CG2 4.4Å; I423-V447 HydrophobicContact CD1-CG2 4.05Å; I423-V447 HydrophobicContact CG1-CG2 4.32Å; I423-Q448 WeakPolarHBondContact O-CB 3.31Å; I423-Q448 PolarHBondContact O-N 3.5Å; I423-A451 HydrophobicContact CG2-CB 3.76Å; I423-F452 HydrophobicContact CD1-CE1 4.36Å; I423-F452 HydrophobicContact CD1-CZ 4.14Å; I423-L463 HydrophobicContact CD1-CD2 4.47Å
424	Y	92.9	Very high	88.4	Confident	87 Å²	87	45.3 Å²	45.3	34%	0.341	22%	0.224	S	C	.	.			trans	-110.4	155.9	178.3	-61.8	-80.7	0	0	0	112	K422 S426 D427	K422-Y424 HydrophobicContact CB-CD2 4.47Å; K422-Y424 HydrophobicContact CB-CE2 3.75Å; K422-Y424 WeakPolarHBondContact CD-OH 3.27Å; Y424-S426 PolarHBondContact O-N 3.31Å; Y424-S426 VanDerWaalsContact O-N 3.09Å; Y424-D427 PolarHBondContact N-OD2 3.38Å; Y424-D427 WeakPolarHBondContact O-CB 3.32Å; Y424-D427 PolarHBondContact O-N 2.97Å
425	R	90	Very high	88.5	Confident	121 Å²	121	46 Å²	46	46%	0.457	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-14.8	179.1	-177.8	165.1	171.9	-178.2	-4.3	114.7	G450 I453	R425-G450 WeakPolarHBondContact CG-O 3.31Å; R425-I453 HydrophobicContact CG-CG2 4.28Å
426	S	88.2	Confident	88.5	Confident	66 Å²	66	46.8 Å²	46.8	46%	0.462	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-15.6	172.9	45.9	0	0	0	0	114.2	R406 Y424 W429	R406-S426 PolarHBondContact NH1-O 2.79Å; R406-S426 PolarHBondContact NH2-O 2.92Å; Y424-S426 PolarHBondContact O-N 3.31Å; Y424-S426 VanDerWaalsContact O-N 3.09Å; S426-W429 WeakPolarHBondContact O-CB 3.49Å
427	D	88.9	Confident	88.8	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.011	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-50.6	-174.6	-73.1	-41	0	0	0	111.4	I400 S401 R406 Y424 W429	I400-D427 HydrophobicContact CB-CB 3.75Å; I400-D427 HydrophobicContact CD1-CB 3.97Å; I400-D427 HydrophobicContact CG2-CB 3.81Å; S401-D427 WeakPolarHBondContact CB-OD1 3.3Å; S401-D427 PolarHBondContact N-OD1 3Å; S401-D427 VanDerWaalsContact N-OD1 3.14Å; S401-D427 PolarHBondContact OG-OD1 2.91Å; R406-D427 PolarHBondContact NH1-O 3.39Å; Y424-D427 PolarHBondContact N-OD2 3.38Å; Y424-D427 WeakPolarHBondContact O-CB 3.32Å; Y424-D427 PolarHBondContact O-N 2.97Å; D427-W429 PolarHBondContact O-N 3.48Å
428	F	89.4	Confident	89	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	22.8	178.7	-59.7	-60.3	0	0	0	114.4	I400 L413 I423 N430 F431 L437 L439 F452 N454 L455	I400-F428 HydrophobicContact CD1-CE1 4.35Å; I400-F428 HydrophobicContact CD1-CE2 3.91Å; I400-F428 HydrophobicContact CD1-CZ 3.54Å; I400-F428 HydrophobicContact CG1-CZ 4.34Å; I400-F428 HydrophobicContact CG2-CE1 4.02Å; I400-F428 HydrophobicContact CG2-CZ 4.32Å; L413-F428 HydrophobicContact CD2-CE1 4.27Å; I423-F428 HydrophobicContact CG2-CD2 4.18Å; I423-F428 HydrophobicContact CG2-CE2 3.6Å; F428-N430 PolarHBondContact O-N 2.84Å; F428-F431 HydrophobicContact CB-CB 4.46Å; F428-F431 HydrophobicContact CD1-CD2 4.39Å; F428-F431 HydrophobicContact CD1-CG 4.48Å; F428-F431 PolarHBondContact O-N 3.31Å; F428-L437 HydrophobicContact CD1-CD2 4.3Å; F428-L437 HydrophobicContact CE1-CD1 3.82Å; F428-L437 HydrophobicContact CE1-CD2 3.75Å; F428-L437 HydrophobicContact CE1-CG 4.47Å; F428-L437 HydrophobicContact CE2-CD2 4.01Å; F428-L437 HydrophobicContact CZ-CD1 4.07Å; F428-L437 HydrophobicContact CZ-CD2 3.59Å; F428-L437 HydrophobicContact CZ-CG 4.43Å; F428-L439 HydrophobicContact CZ-CD1 4.09Å; F428-F452 AromaticContact CD2-CD1 3.84Å; F428-F452 HydrophobicContact CD2-CD1 3.84Å; F428-F452 HydrophobicContact CD2-CE1 4.04Å; F428-F452 AromaticContact CE2-CD1 3.93Å; F428-F452 HydrophobicContact CE2-CD1 3.93Å; F428-F452 AromaticContact CE2-CE1 3.64Å; F428-F452 HydrophobicContact CE2-CE1 3.64Å; F428-N454 WeakPolarHBondContact O-CB 3.36Å; F428-L455 HydrophobicContact CB-CD1 4.17Å; F428-L455 HydrophobicContact CB-CD2 4.03Å; F428-L455 HydrophobicContact CB-CG 4.13Å; F428-L455 HydrophobicContact CD1-CD1 4.43Å; F428-L455 HydrophobicContact CD2-CD1 4.32Å; F428-L455 HydrophobicContact CG-CD1 4.03Å
429	W	82.4	Confident	89.1	Confident	150 Å²	150	45.4 Å²	45.4	57%	0.568	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	131.9	171.9	-166.1	-85.5	0	0	0	111.2	S426 D427 F431 N454	S426-W429 WeakPolarHBondContact O-CB 3.49Å; D427-W429 PolarHBondContact O-N 3.48Å; W429-F431 VanDerWaalsContact C-N 3.32Å; W429-F431 WeakPolarHBondContact O-CD2 3.36Å; W429-F431 PolarHBondContact O-N 3.49Å; W429-N454 VanDerWaalsContact CE3-ND2 3.26Å
430	N	78.9	Confident	88.9	Confident	103 Å²	103	42 Å²	42	55%	0.551	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	13.1	-172.4	-65.1	-9.1	0	0	0	117.3	F428 S432	F428-N430 PolarHBondContact O-N 2.84Å; N430-S432 VanDerWaalsContact C-N 3.32Å; N430-S432 PolarHBondContact O-N 3.23Å
431	F	85.6	Confident	88.5	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.018	23%	0.227	C	C	.	.			trans	-90.6	27.9	176.7	-77.9	-89.8	0	0	0	114.4	P407 A410 L413 F428 W429 S433 L434 L455	P407-F431 HydrophobicContact CG-CE1 3.73Å; P407-F431 HydrophobicContact CG-CZ 3.93Å; A410-F431 HydrophobicContact CB-CD1 4.04Å; A410-F431 HydrophobicContact CB-CE1 4.08Å; L413-F431 HydrophobicContact CD2-CD1 4.18Å; L413-F431 HydrophobicContact CD2-CE1 3.7Å; L413-F431 HydrophobicContact CD2-CZ 4.22Å; F428-F431 HydrophobicContact CB-CB 4.46Å; F428-F431 HydrophobicContact CD1-CD2 4.39Å; F428-F431 HydrophobicContact CD1-CG 4.48Å; F428-F431 PolarHBondContact O-N 3.31Å; W429-F431 VanDerWaalsContact C-N 3.32Å; W429-F431 WeakPolarHBondContact O-CD2 3.36Å; W429-F431 PolarHBondContact O-N 3.49Å; F431-S433 PolarHBondContact O-N 2.8Å; F431-L434 HydrophobicContact CB-CD1 3.85Å; F431-L434 HydrophobicContact CB-CG 4.14Å; F431-L434 HydrophobicContact CD1-CD1 3.83Å; F431-L434 HydrophobicContact CD1-CD2 4.43Å; F431-L434 HydrophobicContact CD1-CG 4.1Å; F431-L434 HydrophobicContact CG-CD1 4.2Å; F431-L434 PolarHBondContact O-N 3.33Å; F431-L434 VanDerWaalsContact O-N 3.11Å; F431-L455 HydrophobicContact CB-CD2 3.63Å; F431-L455 WeakPolarHBondContact O-CD2 3.38Å
432	S	85.9	Confident	88.5	Confident	65 Å²	65	42.4 Å²	42.4	46%	0.455	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-13.8	-170.5	54.5	0	0	0	0	115.9	N430 N454 N457	N430-S432 VanDerWaalsContact C-N 3.32Å; N430-S432 PolarHBondContact O-N 3.23Å; S432-N454 VanDerWaalsContact CA-O 3.25Å; S432-N454 WeakPolarHBondContact CA-O 3.4Å; S432-N457 PolarHBondContact O-ND2 3.24Å
433	S	86.3	Confident	88.5	Confident	36 Å²	36	45 Å²	45	25%	0.252	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-2.7	176.3	50.5	0	0	0	0	115	N409 A410 K411 F431 D435	N409-S433 VanDerWaalsContact C-OG 3.28Å; N409-S433 WeakPolarHBondContact CA-OG 3.41Å; A410-S433 PolarHBondContact N-OG 3.14Å; A410-S433 CarbonylContact O-C 3.51Å; A410-S433 VanDerWaalsContact O-C 3.26Å; A410-S433 WeakPolarHBondContact O-CB 3.01Å; A410-S433 PolarHBondContact O-OG 3.43Å; K411-S433 WeakPolarHBondContact CA-O 3.45Å; F431-S433 PolarHBondContact O-N 2.8Å; S433-D435 PolarHBondContact O-N 3.48Å
434	L	89.5	Confident	88.6	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.			trans	-67.1	124.4	-178.5	-73.2	180	0	0	0	112.2	A410 L413 F431 L455 N457 L458	A410-L434 HydrophobicContact CB-CD2 3.97Å; A410-L434 WeakPolarHBondContact O-CD2 3.43Å; A410-L434 PolarHBondContact O-N 3.02Å; L413-L434 HydrophobicContact CB-CD1 4.23Å; L413-L434 HydrophobicContact CB-CD2 3.7Å; L413-L434 HydrophobicContact CD2-CD1 4.32Å; F431-L434 HydrophobicContact CB-CD1 3.85Å; F431-L434 HydrophobicContact CB-CG 4.14Å; F431-L434 HydrophobicContact CD1-CD1 3.83Å; F431-L434 HydrophobicContact CD1-CD2 4.43Å; F431-L434 HydrophobicContact CD1-CG 4.1Å; F431-L434 HydrophobicContact CG-CD1 4.2Å; F431-L434 PolarHBondContact O-N 3.33Å; F431-L434 VanDerWaalsContact O-N 3.11Å; L434-L455 HydrophobicContact CB-CD2 4.39Å; L434-L455 HydrophobicContact CD1-CD2 3.98Å; L434-N457 CarbonylContact O-C 3.51Å; L434-L458 HydrophobicContact CB-CD1 3.78Å; L434-L458 VanDerWaalsContact O-CA 3.26Å; L434-L458 WeakPolarHBondContact O-CA 3.32Å; L434-L458 PolarHBondContact O-N 2.85Å
435	D	85.8	Confident	88.7	Confident	29 Å²	29	43.8 Å²	43.8	16%	0.155	22%	0.221	C	C	.	.	S	Bend	trans	-90.2	-32.5	164.9	-85.7	-4.5	0	0	0	111.4	K411 S433 K459 S460	K411-D435 WeakPolarHBondContact CE-OD2 3.35Å; K411-D435 HydrophobicContact CG-CB 4.22Å; K411-D435 IonicContact NZ-OD2 2.69Å; K411-D435 PolarHBondContact O-N 2.92Å; S433-D435 PolarHBondContact O-N 3.48Å; D435-K459 HydrophobicContact CB-CD 4.19Å; D435-K459 PolarHBondContact O-N 3.09Å; D435-K459 IonicContact OD1-NZ 3.88Å; D435-K459 PolarHBondContact OD1-NZ 3.13Å; D435-K459 IonicContact OD2-NZ 2.65Å; D435-K459 PolarHBondContact OD2-NZ 3.32Å; D435-S460 PolarHBondContact O-N 2.66Å
436	L	88.1	Confident	88.8	Confident	17 Å²	17	43.6 Å²	43.6	9%	0.089	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	133.6	-175.5	-176.7	153.2	0	0	0	111.7	K411 K412 L413 Y414 H438 F462	K411-L436 PolarHBondContact O-N 2.89Å; K412-L436 WeakPolarHBondContact CA-O 3.28Å; K412-L436 HydrophobicContact CB-CB 4.46Å; K412-L436 HydrophobicContact CG-CB 4.18Å; L413-L436 PolarHBondContact N-O 3.42Å; Y414-L436 HydrophobicContact CD1-CD2 4.41Å; Y414-L436 HydrophobicContact CE1-CD2 3.92Å; Y414-L436 HydrophobicContact CE2-CD2 4.38Å; L436-H438 HydrophobicContact CD2-CB 4.25Å; L436-F462 HydrophobicContact CD1-CE2 4.01Å; L436-F462 HydrophobicContact CD2-CE2 4.49Å; L436-F462 HydrophobicContact CG-CE2 4.11Å
437	L	92.5	Very high	89.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	114.5	176.1	174.8	57.4	0	0	0	109.4	L413 F428 L439 F452 L455 L458 S460 L461 F462	L413-L437 HydrophobicContact CB-CD1 4.2Å; L413-L437 HydrophobicContact CD2-CD1 3.96Å; L413-L437 HydrophobicContact CG-CD1 4.11Å; F428-L437 HydrophobicContact CD1-CD2 4.3Å; F428-L437 HydrophobicContact CE1-CD1 3.82Å; F428-L437 HydrophobicContact CE1-CD2 3.75Å; F428-L437 HydrophobicContact CE1-CG 4.47Å; F428-L437 HydrophobicContact CE2-CD2 4.01Å; F428-L437 HydrophobicContact CZ-CD1 4.07Å; F428-L437 HydrophobicContact CZ-CD2 3.59Å; F428-L437 HydrophobicContact CZ-CG 4.43Å; L437-L439 HydrophobicContact CD1-CD1 4.12Å; L437-L439 HydrophobicContact CD1-CG 4.05Å; L437-L439 HydrophobicContact CD2-CD1 3.9Å; L437-L439 HydrophobicContact CG-CD1 3.85Å; L437-L439 HydrophobicContact CG-CG 4.14Å; L437-F452 HydrophobicContact CD2-CD1 4.34Å; L437-F452 HydrophobicContact CD2-CE1 4.11Å; L437-L455 HydrophobicContact CD2-CD1 3.85Å; L437-L458 HydrophobicContact CB-CD1 3.78Å; L437-L458 HydrophobicContact CB-CD2 4.14Å; L437-S460 PolarHBondContact N-O 3.26Å; L437-L461 HydrophobicContact CB-CD1 4.16Å; L437-L461 HydrophobicContact CD2-CD1 3.95Å; L437-L461 HydrophobicContact CG-CD1 3.98Å; L437-L461 WeakPolarHBondContact O-CA 3.49Å; L437-F462 PolarHBondContact O-N 3.16Å; L437-F462 VanDerWaalsContact O-N 3.1Å
438	H	86.8	Confident	89.4	Confident	20 Å²	20	44.2 Å²	44.2	9%	0.093	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	113.4	178.9	-164.9	-52	0	0	0	111.2	L413 Y414 L415 S416 L436 G440 F462	L413-H438 PolarHBondContact O-N 2.9Å; Y414-H438 HydrophobicContact CD1-CB 3.89Å; L415-H438 CarbonylContact C-O 3.41Å; L415-H438 WeakPolarHBondContact CA-O 3.49Å; L415-H438 PolarHBondContact N-O 3.08Å; S416-H438 WeakPolarHBondContact CB-ND1 3.44Å; S416-H438 PolarHBondContact N-O 3.44Å; L436-H438 HydrophobicContact CD2-CB 4.25Å; H438-G440 PolarHBondContact ND1-N 3.39Å; H438-F462 HydrophobicContact CB-CB 4.39Å; H438-F462 HydrophobicContact CB-CD2 4.16Å; H438-F462 AromaticContact CD2-CD1 3.95Å; H438-F462 AromaticContact CD2-CD2 3.68Å; H438-F462 AromaticContact CD2-CG 3.51Å; H438-F462 AromaticContact NE2-CD1 3.96Å; H438-F462 AromaticContact NE2-CG 3.83Å
439	L	93.1	Very high	89.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.			trans	-121.6	5.6	-179.5	-72.2	160.3	0	0	0	112.7	I400 L415 I420 I423 F428 L437 N442 I444 L461 F462 L463 N466	I400-L439 HydrophobicContact CD1-CD2 4.48Å; L415-L439 HydrophobicContact CB-CD2 3.89Å; L415-L439 HydrophobicContact CD1-CD2 3.9Å; I420-L439 HydrophobicContact CD1-CD2 4.08Å; I423-L439 HydrophobicContact CD1-CD1 3.8Å; F428-L439 HydrophobicContact CZ-CD1 4.09Å; L437-L439 HydrophobicContact CD1-CD1 4.12Å; L437-L439 HydrophobicContact CD1-CG 4.05Å; L437-L439 HydrophobicContact CD2-CD1 3.9Å; L437-L439 HydrophobicContact CG-CD1 3.85Å; L437-L439 HydrophobicContact CG-CG 4.14Å; L439-N442 PolarHBondContact O-ND2 2.92Å; L439-I444 HydrophobicContact CB-CD1 3.92Å; L439-I444 HydrophobicContact CD2-CD1 4.37Å; L439-L461 HydrophobicContact CD1-CD1 4.4Å; L439-F462 CarbonylContact C-O 3.56Å; L439-F462 WeakPolarHBondContact CA-O 3.42Å; L439-F462 WeakPolarHBondContact CB-O 3.47Å; L439-F462 PolarHBondContact N-O 2.85Å; L439-L463 HydrophobicContact CB-CD2 3.8Å; L439-L463 HydrophobicContact CD1-CD2 3.95Å; L439-N466 PolarHBondContact O-ND2 3.24Å
440	G	87.7	Confident	89.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.			trans	-62.9	157.4	-179.5	0	0	0	0	0	114.8	S416 S417 H438 N442 F462 N464	S416-G440 WeakPolarHBondContact CA-O 3.46Å; S416-G440 WeakPolarHBondContact CB-O 3.38Å; S417-G440 PolarHBondContact N-O 3.39Å; H438-G440 PolarHBondContact ND1-N 3.39Å; G440-N442 PolarHBondContact O-ND2 2.73Å; G440-F462 PolarHBondContact N-O 2.86Å; G440-N464 CarbonylContact C-O 3.06Å; G440-N464 WeakPolarHBondContact CA-O 3.22Å; G440-N464 WeakPolarHBondContact CA-OD1 3.27Å
441	N	86.3	Confident	90.6	Very high	93 Å²	93	36.6 Å²	36.6	50%	0.497	19%	0.188	S	C	.	.	S	Bend	trans	55.6	55.7	-172.9	-61.6	-11	0	0	0	112.1	S417 N418 N464 G465	S417-N441 WeakPolarHBondContact CA-O 2.96Å; S417-N441 PolarHBondContact N-O 3.17Å; N418-N441 PolarHBondContact N-O 3.49Å; N441-N464 PolarHBondContact N-O 3.49Å; N441-G465 CarbonylContact C-O 3.53Å; N441-G465 WeakPolarHBondContact CA-O 3.39Å; N441-G465 PolarHBondContact N-O 3.15Å
442	N	92	Very high	91	Very high	13 Å²	13	36.4 Å²	36.4	7%	0.07	19%	0.187	C	C	.	.	S	Bend	trans	-123.7	-159.5	172.7	-87.9	-89.5	0	0	0	109	L415 N418 I420 L439 G440 I444 G465 N466	L415-N442 PolarHBondContact O-ND2 2.92Å; N418-N442 WeakPolarHBondContact CA-OD1 3.45Å; N418-N442 WeakPolarHBondContact CB-OD1 3.4Å; N418-N442 PolarHBondContact N-OD1 2.9Å; N418-N442 PolarHBondContact O-OD1 3.3Å; I420-N442 HydrophobicContact CB-CB 4.36Å; I420-N442 VanDerWaalsContact CB-OD1 3.32Å; I420-N442 WeakPolarHBondContact CB-OD1 3.37Å; I420-N442 WeakPolarHBondContact CG1-OD1 3.46Å; I420-N442 PolarHBondContact N-OD1 3.44Å; L439-N442 PolarHBondContact O-ND2 2.92Å; G440-N442 PolarHBondContact O-ND2 2.73Å; N442-I444 HydrophobicContact CB-CD1 3.94Å; N442-I444 HydrophobicContact CB-CG1 3.9Å; N442-G465 PolarHBondContact N-O 3Å; N442-G465 VanDerWaalsContact N-O 3.1Å; N442-N466 VanDerWaalsContact CA-OD1 3.31Å; N442-N466 WeakPolarHBondContact CA-OD1 3.12Å; N442-N466 WeakPolarHBondContact CB-OD1 3.31Å; N442-N466 PolarHBondContact N-OD1 3.47Å; N442-N466 PolarHBondContact O-OD1 3.03Å
443	R	93.9	Very high	91.3	Very high	139 Å²	139	35.7 Å²	35.7	53%	0.525	18%	0.178	S	C	.	.			trans	-120.7	31	176.4	-66.1	-179.8	176.1	-86.1	2.1	111.7	I420 Q421 S445 N466 D467	I420-R443 CarbonylContact O-C 3.25Å; I420-R443 WeakPolarHBondContact O-CA 3.39Å; I420-R443 PolarHBondContact O-N 2.78Å; Q421-R443 WeakPolarHBondContact CA-O 3.32Å; Q421-R443 HydrophobicContact CG-CB 4.07Å; R443-S445 PolarHBondContact O-N 3.38Å; R443-N466 PolarHBondContact N-OD1 3.2Å; R443-D467 VanDerWaalsContact CA-OD2 3.25Å; R443-D467 WeakPolarHBondContact CA-OD2 3.34Å; R443-D467 WeakPolarHBondContact CB-OD2 2.96Å
444	I	96.1	Very high	91.3	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.			trans	-70.6	108.3	-169.1	-59.3	162.2	0	0	0	108.2	I420 Q421 I423 L439 N442 V447 L463 N466 D467 I468	I420-I444 HydrophobicContact CB-CG1 4.33Å; I420-I444 HydrophobicContact CG2-CG1 4.13Å; I420-I444 VanDerWaalsContact O-CG1 3.29Å; I420-I444 WeakPolarHBondContact O-CG1 3.04Å; I420-I444 PolarHBondContact O-N 3.07Å; I420-I444 VanDerWaalsContact O-N 3.15Å; Q421-I444 WeakPolarHBondContact O-CA 3.34Å; I423-I444 HydrophobicContact CD1-CD1 4.2Å; I423-I444 HydrophobicContact CD1-CG2 4.23Å; I423-I444 HydrophobicContact CG1-CG2 4.1Å; L439-I444 HydrophobicContact CB-CD1 3.92Å; L439-I444 HydrophobicContact CD2-CD1 4.37Å; N442-I444 HydrophobicContact CB-CD1 3.94Å; N442-I444 HydrophobicContact CB-CG1 3.9Å; I444-V447 HydrophobicContact CG2-CG2 3.89Å; I444-L463 HydrophobicContact CD1-CD2 4.08Å; I444-N466 HydrophobicContact CB-CB 4.23Å; I444-N466 VanDerWaalsContact CB-OD1 3.25Å; I444-N466 WeakPolarHBondContact CB-OD1 3.35Å; I444-N466 WeakPolarHBondContact CD1-OD1 3.35Å; I444-N466 VanDerWaalsContact CG1-OD1 3.26Å; I444-N466 WeakPolarHBondContact CG1-OD1 3.17Å; I444-N466 PolarHBondContact N-OD1 3Å; I444-D467 CarbonylContact O-C 3.52Å; I444-D467 WeakPolarHBondContact O-CA 3.14Å; I444-D467 PolarHBondContact O-N 3.49Å; I444-D467 VanDerWaalsContact O-N 3.07Å; I444-I468 HydrophobicContact CG2-CD1 4.43Å; I444-I468 HydrophobicContact CG2-CG1 4.36Å; I444-I468 WeakPolarHBondContact O-CG1 3.43Å; I444-I468 PolarHBondContact O-N 3.06Å
445	S	94.6	Very high	91.4	Very high	62 Å²	62	36 Å²	36	43%	0.434	18%	0.177	S	C	.	.			trans	-108.3	-13.8	177.1	46.7	0	0	0	0	112.9	Q421 R443 D467	Q421-S445 PolarHBondContact O-N 3.46Å; R443-S445 PolarHBondContact O-N 3.38Å; S445-D467 WeakPolarHBondContact CA-O 3.38Å
446	Y	93.9	Very high	91.7	Very high	116 Å²	116	37.1 Å²	37.1	46%	0.455	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	128.7	179.9	179.5	-99	0	0	0	112.5	K422 I423 Q448	K422-Y446 WeakPolarHBondContact CA-O 3.47Å; I423-Y446 PolarHBondContact N-O 3.18Å; Y446-Q448 HydrophobicContact CE1-CB 3.98Å
447	V	95	Very high	91.7	Very high	16 Å²	16	40 Å²	40	10%	0.097	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.6	171.1	-177.1	0	0	0	0	108	I423 I444 A451 F452 M475	I423-V447 HydrophobicContact CB-CG1 4.24Å; I423-V447 HydrophobicContact CB-CG2 4.4Å; I423-V447 HydrophobicContact CD1-CG2 4.05Å; I423-V447 HydrophobicContact CG1-CG2 4.32Å; I444-V447 HydrophobicContact CG2-CG2 3.89Å; V447-A451 HydrophobicContact CG1-CB 3.68Å; V447-F452 HydrophobicContact CG1-CE2 3.94Å; V447-F452 HydrophobicContact CG1-CZ 4.12Å; V447-M475 HydrophobicContact CB-CB 4.39Å; V447-M475 HydrophobicContact CB-CE 4.06Å; V447-M475 HydrophobicContact CG1-CB 3.99Å; V447-M475 HydrophobicContact CG1-CE 4.35Å; V447-M475 HydrophobicContact CG2-CE 4.13Å
448	Q	93.6	Very high	91.8	Very high	66 Å²	66	40 Å²	40	31%	0.308	20%	0.201	S	C	.	.			trans	-71.9	144	179.6	-168.5	176.9	25.7	0	0	111.7	I423 Y446 G450 A451	I423-Q448 WeakPolarHBondContact O-CB 3.31Å; I423-Q448 PolarHBondContact O-N 3.5Å; Y446-Q448 HydrophobicContact CE1-CB 3.98Å; Q448-G450 PolarHBondContact O-N 2.86Å; Q448-A451 WeakPolarHBondContact O-CB 3.3Å; Q448-A451 PolarHBondContact O-N 2.84Å
449	D	92.5	Very high	91.8	Very high	91 Å²	91	43 Å²	43	49%	0.487	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	126	173.3	-72.7	-26.2	0	0	0	111.7	T472 G474 M475	D449-T472 PolarHBondContact OD1-OG1 3.03Å; D449-G474 VanDerWaalsContact OD1-C 3.23Å; D449-G474 WeakPolarHBondContact OD1-CA 3.39Å; D449-M475 PolarHBondContact OD1-N 3.48Å; D449-M475 VanDerWaalsContact OD1-N 3.16Å
450	G	90.7	Very high	91.6	Very high	2 Å²	2	43.4 Å²	43.4	2%	0.021	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	19	-173	0	0	0	0	0	114.7	R425 Q448 F452 I453 G474	R425-G450 WeakPolarHBondContact CG-O 3.31Å; Q448-G450 PolarHBondContact O-N 2.86Å; G450-F452 PolarHBondContact O-N 3.1Å; G450-I453 VanDerWaalsContact O-CB 3.29Å; G450-I453 WeakPolarHBondContact O-CB 3.34Å; G450-I453 WeakPolarHBondContact O-CG2 3.45Å; G450-I453 PolarHBondContact O-N 3.44Å; G450-I453 VanDerWaalsContact O-N 3.12Å; G450-G474 PolarHBondContact N-O 2.73Å
451	A	92.9	Very high	92	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-42.7	171.7	0	0	0	0	0	112.6	I423 V447 Q448	I423-A451 HydrophobicContact CG2-CB 3.76Å; V447-A451 HydrophobicContact CG1-CB 3.68Å; Q448-A451 WeakPolarHBondContact O-CB 3.3Å; Q448-A451 PolarHBondContact O-N 2.84Å
452	F	94.2	Very high	92.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	15	-176.6	-49.4	-61	0	0	0	114	I423 F428 L437 V447 G450 N454 L455 L461 L463 M475 R477 L479	I423-F452 HydrophobicContact CD1-CE1 4.36Å; I423-F452 HydrophobicContact CD1-CZ 4.14Å; F428-F452 AromaticContact CD2-CD1 3.84Å; F428-F452 HydrophobicContact CD2-CD1 3.84Å; F428-F452 HydrophobicContact CD2-CE1 4.04Å; F428-F452 AromaticContact CE2-CD1 3.93Å; F428-F452 HydrophobicContact CE2-CD1 3.93Å; F428-F452 AromaticContact CE2-CE1 3.64Å; F428-F452 HydrophobicContact CE2-CE1 3.64Å; L437-F452 HydrophobicContact CD2-CD1 4.34Å; L437-F452 HydrophobicContact CD2-CE1 4.11Å; V447-F452 HydrophobicContact CG1-CE2 3.94Å; V447-F452 HydrophobicContact CG1-CZ 4.12Å; G450-F452 PolarHBondContact O-N 3.1Å; F452-N454 PolarHBondContact O-N 3.21Å; F452-N454 VanDerWaalsContact O-N 3.08Å; F452-L455 HydrophobicContact CB-CD1 4.18Å; F452-L455 HydrophobicContact CD1-CD1 3.83Å; F452-L455 HydrophobicContact CG-CD1 4.45Å; F452-L455 WeakPolarHBondContact O-CB 3.45Å; F452-L455 PolarHBondContact O-N 3.01Å; F452-L461 HydrophobicContact CD2-CD2 4.42Å; F452-L461 HydrophobicContact CE2-CD2 4.07Å; F452-L461 HydrophobicContact CZ-CD2 4.12Å; F452-L463 HydrophobicContact CZ-CD1 4.46Å; F452-M475 VanDerWaalsContact CD2-O 3.24Å; F452-M475 WeakPolarHBondContact CD2-O 3.36Å; F452-R477 CarbonylContact C-O 3.36Å; F452-L479 HydrophobicContact CB-CD1 4.02Å; F452-L479 HydrophobicContact CB-CD2 3.71Å; F452-L479 HydrophobicContact CB-CG 3.75Å; F452-L479 HydrophobicContact CD2-CD1 3.74Å; F452-L479 HydrophobicContact CD2-CG 4.41Å; F452-L479 HydrophobicContact CG-CD1 4.06Å; F452-L479 HydrophobicContact CG-CD2 4.3Å; F452-L479 HydrophobicContact CG-CG 4.33Å
453	I	91.1	Very high	92.3	Very high	50 Å²	50	40.1 Å²	40.1	26%	0.256	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-24.7	-173.5	-161.3	168.9	0	0	0	114.4	R425 G450 R477	R425-I453 HydrophobicContact CG-CG2 4.28Å; G450-I453 VanDerWaalsContact O-CB 3.29Å; G450-I453 WeakPolarHBondContact O-CB 3.34Å; G450-I453 WeakPolarHBondContact O-CG2 3.45Å; G450-I453 PolarHBondContact O-N 3.44Å; G450-I453 VanDerWaalsContact O-N 3.12Å; I453-R477 WeakPolarHBondContact CA-O 3.43Å; I453-R477 PolarHBondContact N-O 2.91Å
454	N	87.7	Confident	92.1	Very high	42 Å²	42	35 Å²	35	23%	0.225	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	10.4	179.8	-65.9	-35.7	0	0	0	113.4	F428 W429 S432 F452 P456	F428-N454 WeakPolarHBondContact O-CB 3.36Å; W429-N454 VanDerWaalsContact CE3-ND2 3.26Å; S432-N454 VanDerWaalsContact CA-O 3.25Å; S432-N454 WeakPolarHBondContact CA-O 3.4Å; F452-N454 PolarHBondContact O-N 3.21Å; F452-N454 VanDerWaalsContact O-N 3.08Å; N454-P456 WeakPolarHBondContact O-CD 3.45Å
455	L	92.1	Very high	91.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.189	C	C	.	.			trans	-113.4	56.4	-175.4	-56.5	-173.7	0	0	0	113.2	F428 F431 L434 L437 F452 N457 L458 L479	F428-L455 HydrophobicContact CB-CD1 4.17Å; F428-L455 HydrophobicContact CB-CD2 4.03Å; F428-L455 HydrophobicContact CB-CG 4.13Å; F428-L455 HydrophobicContact CD1-CD1 4.43Å; F428-L455 HydrophobicContact CD2-CD1 4.32Å; F428-L455 HydrophobicContact CG-CD1 4.03Å; F431-L455 HydrophobicContact CB-CD2 3.63Å; F431-L455 WeakPolarHBondContact O-CD2 3.38Å; L434-L455 HydrophobicContact CB-CD2 4.39Å; L434-L455 HydrophobicContact CD1-CD2 3.98Å; L437-L455 HydrophobicContact CD2-CD1 3.85Å; F452-L455 HydrophobicContact CB-CD1 4.18Å; F452-L455 HydrophobicContact CD1-CD1 3.83Å; F452-L455 HydrophobicContact CG-CD1 4.45Å; F452-L455 WeakPolarHBondContact O-CB 3.45Å; F452-L455 PolarHBondContact O-N 3.01Å; L455-N457 VanDerWaalsContact C-N 3.29Å; L455-N457 PolarHBondContact O-N 3.18Å; L455-L458 HydrophobicContact CB-CB 4.18Å; L455-L458 HydrophobicContact CD1-CD2 4.16Å; L455-L458 PolarHBondContact O-N 2.91Å; L455-L479 HydrophobicContact CB-CD2 4.23Å
456	P	90.1	Very high	91.7	Very high	52 Å²	52	33.2 Å²	33.2	34%	0.338	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-30.6	-172.4	28.5	-36	0	0	0	113.6	N454 S481	N454-P456 WeakPolarHBondContact O-CD 3.45Å; P456-S481 VanDerWaalsContact O-CB 3.26Å; P456-S481 WeakPolarHBondContact O-CB 3.42Å; P456-S481 PolarHBondContact O-N 3.37Å; P456-S481 PolarHBondContact O-OG 3.22Å; P456-S481 VanDerWaalsContact O-OG 3.13Å
457	N	89.5	Confident	91.8	Very high	77 Å²	77	31 Å²	31	41%	0.412	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-4.1	-175.5	-65.2	-59.3	0	0	0	114.2	S432 L434 L455 K459	S432-N457 PolarHBondContact O-ND2 3.24Å; L434-N457 CarbonylContact O-C 3.51Å; L455-N457 VanDerWaalsContact C-N 3.29Å; L455-N457 PolarHBondContact O-N 3.18Å; N457-K459 PolarHBondContact O-N 3.46Å
458	L	93.6	Very high	91.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.			trans	-65	126.6	-171.5	-162.8	76.6	0	0	0	110.8	L434 L437 L455 L461 L479 S481 L482	L434-L458 HydrophobicContact CB-CD1 3.78Å; L434-L458 VanDerWaalsContact O-CA 3.26Å; L434-L458 WeakPolarHBondContact O-CA 3.32Å; L434-L458 PolarHBondContact O-N 2.85Å; L437-L458 HydrophobicContact CB-CD1 3.78Å; L437-L458 HydrophobicContact CB-CD2 4.14Å; L455-L458 HydrophobicContact CB-CB 4.18Å; L455-L458 HydrophobicContact CD1-CD2 4.16Å; L455-L458 PolarHBondContact O-N 2.91Å; L458-L461 HydrophobicContact CD2-CB 4.05Å; L458-L461 HydrophobicContact CD2-CD1 4.4Å; L458-L479 HydrophobicContact CB-CD2 3.97Å; L458-L479 HydrophobicContact CD2-CD2 3.55Å; L458-L479 HydrophobicContact CG-CD2 4.37Å; L458-S481 CarbonylContact O-C 3.56Å; L458-L482 HydrophobicContact CB-CD1 4.42Å; L458-L482 HydrophobicContact CD2-CD1 4.02Å; L458-L482 HydrophobicContact CG-CD1 4.09Å; L458-L482 WeakPolarHBondContact O-CA 3.21Å; L458-L482 PolarHBondContact O-N 3.19Å
459	K	88.2	Confident	91.9	Very high	85 Å²	85	31.1 Å²	31.1	37%	0.37	17%	0.166	S	C	.	.			trans	-104.6	-35.2	-179	-68.5	145.5	-177.9	154.3	0	112.4	D435 N457 H483 Y484	D435-K459 HydrophobicContact CB-CD 4.19Å; D435-K459 PolarHBondContact O-N 3.09Å; D435-K459 IonicContact OD1-NZ 3.88Å; D435-K459 PolarHBondContact OD1-NZ 3.13Å; D435-K459 IonicContact OD2-NZ 2.65Å; D435-K459 PolarHBondContact OD2-NZ 3.32Å; N457-K459 PolarHBondContact O-N 3.46Å; K459-H483 PolarHBondContact O-N 3.34Å; K459-Y484 PolarHBondContact O-N 3.33Å
460	S	88.8	Confident	91.9	Very high	8 Å²	8	31.9 Å²	31.9	6%	0.056	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.8	-177.6	-52.9	0	0	0	0	111.7	D435 L437 Y484	D435-S460 PolarHBondContact O-N 2.66Å; L437-S460 PolarHBondContact N-O 3.26Å; S460-Y484 WeakPolarHBondContact OG-CD2 3.12Å
461	L	95.1	Very high	92.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	118.2	178	177.3	56.3	0	0	0	110.2	L437 L439 F452 L458 L463 L479 L482 Y484 L485 Y486	L437-L461 HydrophobicContact CB-CD1 4.16Å; L437-L461 HydrophobicContact CD2-CD1 3.95Å; L437-L461 HydrophobicContact CG-CD1 3.98Å; L437-L461 WeakPolarHBondContact O-CA 3.49Å; L439-L461 HydrophobicContact CD1-CD1 4.4Å; F452-L461 HydrophobicContact CD2-CD2 4.42Å; F452-L461 HydrophobicContact CE2-CD2 4.07Å; F452-L461 HydrophobicContact CZ-CD2 4.12Å; L458-L461 HydrophobicContact CD2-CB 4.05Å; L458-L461 HydrophobicContact CD2-CD1 4.4Å; L461-L463 HydrophobicContact CD1-CD1 4.29Å; L461-L463 HydrophobicContact CD1-CG 4.2Å; L461-L463 HydrophobicContact CD2-CD1 4Å; L461-L463 HydrophobicContact CG-CD1 4.01Å; L461-L463 HydrophobicContact CG-CG 4.23Å; L461-L479 HydrophobicContact CD2-CD1 3.77Å; L461-L482 HydrophobicContact CB-CD1 3.8Å; L461-L482 HydrophobicContact CB-CD2 4.3Å; L461-Y484 PolarHBondContact N-O 2.7Å; L461-L485 HydrophobicContact CB-CD1 4.05Å; L461-L485 HydrophobicContact CD2-CD1 3.96Å; L461-L485 HydrophobicContact CG-CD1 3.99Å; L461-Y486 PolarHBondContact O-N 2.75Å; L461-Y486 VanDerWaalsContact O-N 3.13Å
462	F	90	Very high	92.1	Very high	37 Å²	37	33.2 Å²	33.2	16%	0.162	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116	179.4	-56.9	-101.3	0	0	0	110.1	L436 L437 H438 L439 G440 Y486	L436-F462 HydrophobicContact CD1-CE2 4.01Å; L436-F462 HydrophobicContact CD2-CE2 4.49Å; L436-F462 HydrophobicContact CG-CE2 4.11Å; L437-F462 PolarHBondContact O-N 3.16Å; L437-F462 VanDerWaalsContact O-N 3.1Å; H438-F462 HydrophobicContact CB-CB 4.39Å; H438-F462 HydrophobicContact CB-CD2 4.16Å; H438-F462 AromaticContact CD2-CD1 3.95Å; H438-F462 AromaticContact CD2-CD2 3.68Å; H438-F462 AromaticContact CD2-CG 3.51Å; H438-F462 AromaticContact NE2-CD1 3.96Å; H438-F462 AromaticContact NE2-CG 3.83Å; L439-F462 CarbonylContact C-O 3.56Å; L439-F462 WeakPolarHBondContact CA-O 3.42Å; L439-F462 WeakPolarHBondContact CB-O 3.47Å; L439-F462 PolarHBondContact N-O 2.85Å; G440-F462 PolarHBondContact N-O 2.86Å; F462-Y486 AromaticContact CD1-CD2 3.34Å; F462-Y486 HydrophobicContact CD1-CD2 3.34Å; F462-Y486 AromaticContact CD1-CE2 3.82Å; F462-Y486 HydrophobicContact CD1-CE2 3.82Å; F462-Y486 AromaticContact CD1-CG 3.91Å; F462-Y486 HydrophobicContact CD1-CG 3.91Å; F462-Y486 AromaticContact CE1-CD2 3.45Å; F462-Y486 HydrophobicContact CE1-CD2 3.45Å; F462-Y486 VanDerWaalsContact CE1-CD2 3.45Å; F462-Y486 AromaticContact CE1-CE2 3.37Å; F462-Y486 HydrophobicContact CE1-CE2 3.37Å; F462-Y486 HydrophobicContact CE1-CG 4.22Å; F462-Y486 AromaticContact CG-CD2 3.97Å; F462-Y486 HydrophobicContact CG-CD2 3.97Å; F462-Y486 HydrophobicContact CZ-CD2 4.14Å; F462-Y486 AromaticContact CZ-CE2 3.8Å; F462-Y486 HydrophobicContact CZ-CE2 3.8Å
463	L	94.6	Very high	91.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.			trans	-126.6	13.8	177.1	-71.7	165.1	0	0	0	111.6	I423 L439 I444 F452 L461 N466 I468 Y486 F487 N490	I423-L463 HydrophobicContact CD1-CD2 4.47Å; L439-L463 HydrophobicContact CB-CD2 3.8Å; L439-L463 HydrophobicContact CD1-CD2 3.95Å; I444-L463 HydrophobicContact CD1-CD2 4.08Å; F452-L463 HydrophobicContact CZ-CD1 4.46Å; L461-L463 HydrophobicContact CD1-CD1 4.29Å; L461-L463 HydrophobicContact CD1-CG 4.2Å; L461-L463 HydrophobicContact CD2-CD1 4Å; L461-L463 HydrophobicContact CG-CD1 4.01Å; L461-L463 HydrophobicContact CG-CG 4.23Å; L463-N466 PolarHBondContact O-ND2 3.04Å; L463-I468 HydrophobicContact CB-CD1 4.25Å; L463-I468 HydrophobicContact CD2-CD1 4.45Å; L463-Y486 CarbonylContact C-O 3.08Å; L463-Y486 WeakPolarHBondContact CA-O 3.47Å; L463-Y486 PolarHBondContact N-O 3Å; L463-F487 HydrophobicContact CB-CD1 3.83Å; L463-F487 HydrophobicContact CB-CE1 3.7Å; L463-F487 HydrophobicContact CD1-CD1 4.47Å; L463-F487 HydrophobicContact CD1-CE1 3.53Å; L463-F487 HydrophobicContact CD1-CZ 3.72Å; L463-F487 HydrophobicContact CG-CE1 4.25Å; L463-N490 PolarHBondContact O-ND2 2.95Å
464	N	89.9	Confident	91.8	Very high	32 Å²	32	33.4 Å²	33.4	17%	0.171	18%	0.18	C	C	.	.			trans	-57.6	149.5	174.5	57.8	-46.8	0	0	0	112.7	G440 N441 N466 Y486 E488	G440-N464 CarbonylContact C-O 3.06Å; G440-N464 WeakPolarHBondContact CA-O 3.22Å; G440-N464 WeakPolarHBondContact CA-OD1 3.27Å; N441-N464 PolarHBondContact N-O 3.49Å; N464-N466 PolarHBondContact O-ND2 3.07Å; N464-Y486 PolarHBondContact N-O 3.13Å; N464-Y486 VanDerWaalsContact N-O 3.16Å; N464-E488 CarbonylContact C-O 3.36Å; N464-E488 WeakPolarHBondContact CA-O 3.11Å; N464-E488 HydrophobicContact CB-CB 3.92Å; N464-E488 HydrophobicContact CB-CG 4.44Å
465	G	87.9	Confident	92.1	Very high	18 Å²	18	31.6 Å²	31.6	19%	0.186	17%	0.17	C	C	.	.	S	Bend	trans	60.9	58.9	179.8	0	0	0	0	0	112.7	N441 N442 E488 F489 N490	N441-G465 CarbonylContact C-O 3.53Å; N441-G465 WeakPolarHBondContact CA-O 3.39Å; N441-G465 PolarHBondContact N-O 3.15Å; N442-G465 PolarHBondContact N-O 3Å; N442-G465 VanDerWaalsContact N-O 3.1Å; G465-E488 PolarHBondContact N-O 3.43Å; G465-F489 WeakPolarHBondContact CA-O 3.3Å; G465-F489 PolarHBondContact N-O 3.46Å; G465-N490 PolarHBondContact N-ND2 3.08Å
466	N	94.9	Very high	92.1	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.027	17%	0.17	C	C	.	.	S	Bend	trans	-143.7	170.2	180	-84.9	-74.7	0	0	0	111.4	L439 N442 R443 I444 L463 N464 I468 N490	L439-N466 PolarHBondContact O-ND2 3.24Å; N442-N466 VanDerWaalsContact CA-OD1 3.31Å; N442-N466 WeakPolarHBondContact CA-OD1 3.12Å; N442-N466 WeakPolarHBondContact CB-OD1 3.31Å; N442-N466 PolarHBondContact N-OD1 3.47Å; N442-N466 PolarHBondContact O-OD1 3.03Å; R443-N466 PolarHBondContact N-OD1 3.2Å; I444-N466 HydrophobicContact CB-CB 4.23Å; I444-N466 VanDerWaalsContact CB-OD1 3.25Å; I444-N466 WeakPolarHBondContact CB-OD1 3.35Å; I444-N466 WeakPolarHBondContact CD1-OD1 3.35Å; I444-N466 VanDerWaalsContact CG1-OD1 3.26Å; I444-N466 WeakPolarHBondContact CG1-OD1 3.17Å; I444-N466 PolarHBondContact N-OD1 3Å; L463-N466 PolarHBondContact O-ND2 3.04Å; N464-N466 PolarHBondContact O-ND2 3.07Å; N466-I468 VanDerWaalsContact C-N 3.33Å; N466-I468 HydrophobicContact CB-CD1 4.4Å; N466-I468 HydrophobicContact CB-CG1 4.17Å; N466-I468 PolarHBondContact O-N 2.76Å; N466-N490 VanDerWaalsContact C-OD1 3.31Å; N466-N490 VanDerWaalsContact CB-OD1 3.25Å; N466-N490 WeakPolarHBondContact CB-OD1 3.44Å; N466-N490 VanDerWaalsContact O-CA 3.32Å; N466-N490 WeakPolarHBondContact O-CA 3.48Å; N466-N490 VanDerWaalsContact O-CG 3.28Å; N466-N490 PolarHBondContact O-OD1 3.03Å; N466-N490 VanDerWaalsContact O-OD1 3.07Å
467	D	95.8	Very high	92.2	Very high	69 Å²	69	36.3 Å²	36.3	37%	0.369	18%	0.181	S	C	.	.			trans	-93	28	-174.4	-63.8	-53.9	0	0	0	113	R443 I444 S445 E469	R443-D467 VanDerWaalsContact CA-OD2 3.25Å; R443-D467 WeakPolarHBondContact CA-OD2 3.34Å; R443-D467 WeakPolarHBondContact CB-OD2 2.96Å; I444-D467 CarbonylContact O-C 3.52Å; I444-D467 WeakPolarHBondContact O-CA 3.14Å; I444-D467 PolarHBondContact O-N 3.49Å; I444-D467 VanDerWaalsContact O-N 3.07Å; S445-D467 WeakPolarHBondContact CA-O 3.38Å; D467-E469 PolarHBondContact O-N 3.01Å
468	I	96	Very high	92.1	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.026	17%	0.169	C	C	.	.			trans	-75.9	118.6	-172.8	-56	176.7	0	0	0	110.4	I444 L463 N466 L471 F487 N490 V491 I492	I444-I468 HydrophobicContact CG2-CD1 4.43Å; I444-I468 HydrophobicContact CG2-CG1 4.36Å; I444-I468 WeakPolarHBondContact O-CG1 3.43Å; I444-I468 PolarHBondContact O-N 3.06Å; L463-I468 HydrophobicContact CB-CD1 4.25Å; L463-I468 HydrophobicContact CD2-CD1 4.45Å; N466-I468 VanDerWaalsContact C-N 3.33Å; N466-I468 HydrophobicContact CB-CD1 4.4Å; N466-I468 HydrophobicContact CB-CG1 4.17Å; N466-I468 PolarHBondContact O-N 2.76Å; I468-L471 HydrophobicContact CG2-CD2 3.99Å; I468-F487 HydrophobicContact CD1-CD1 4.18Å; I468-F487 HydrophobicContact CD1-CE1 3.73Å; I468-N490 WeakPolarHBondContact CB-OD1 3.25Å; I468-N490 WeakPolarHBondContact CG1-OD1 3.14Å; I468-N490 PolarHBondContact N-OD1 3.04Å; I468-V491 CarbonylContact O-C 3.42Å; I468-V491 PolarHBondContact O-N 3.22Å; I468-I492 HydrophobicContact CB-CG1 4.41Å; I468-I492 HydrophobicContact CG2-CG1 4.33Å; I468-I492 WeakPolarHBondContact O-CA 3.39Å; I468-I492 WeakPolarHBondContact O-CG1 3.47Å; I468-I492 PolarHBondContact O-N 3.38Å
469	E	94.3	Very high	92.1	Very high	80 Å²	80	33.3 Å²	33.3	37%	0.374	17%	0.169	S	C	.	.			trans	-91.9	-27.8	-179.4	-62.9	-156.6	150.7	0	0	115.2	D467 V491 I492 R493	D467-E469 PolarHBondContact O-N 3.01Å; E469-V491 HydrophobicContact CG-CG2 3.93Å; E469-I492 CarbonylContact O-C 3.58Å; E469-I492 WeakPolarHBondContact O-CA 3.48Å; E469-R493 PolarHBondContact O-N 3.06Å; E469-R493 IonicContact OE1-CZ 3.19Å; E469-R493 IonicContact OE1-NH1 2.74Å; E469-R493 PolarHBondContact OE1-NH1 2.89Å; E469-R493 IonicContact OE1-NH2 2.66Å; E469-R493 PolarHBondContact OE1-NH2 2.92Å; E469-R493 IonicContact OE2-CZ 2.77Å; E469-R493 IonicContact OE2-NH1 2.75Å; E469-R493 PolarHBondContact OE2-NH1 3.01Å
470	K	93.1	Very high	92.2	Very high	107 Å²	107	35.4 Å²	35.4	47%	0.465	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	145.8	-172.9	-57.1	-161.6	179.1	-159.9	0	112.9	E494	K470-E494 VanDerWaalsContact CA-O 3.31Å; K470-E494 WeakPolarHBondContact CA-O 3.45Å; K470-E494 HydrophobicContact CD-CB 4.21Å; K470-E494 VanDerWaalsContact CE-OE2 3.3Å; K470-E494 WeakPolarHBondContact CE-OE2 3.45Å; K470-E494 HydrophobicContact CG-CB 4.14Å; K470-E494 IonicContact NZ-OE1 2.59Å; K470-E494 IonicContact NZ-OE2 2.78Å; K470-E494 PolarHBondContact NZ-OE2 3.08Å
471	L	94.9	Very high	92.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.4	173.9	-56.5	-174	0	0	0	111.9	I468 M475 F476 F487 I492 E494 I495 Q496 F500 L511	I468-L471 HydrophobicContact CG2-CD2 3.99Å; L471-M475 HydrophobicContact CB-SD 4.21Å; L471-M475 HydrophobicContact CD2-CE 3.81Å; L471-M475 HydrophobicContact CD2-SD 3.83Å; L471-F476 HydrophobicContact CB-CE2 4.31Å; L471-F476 HydrophobicContact CD1-CZ 4.34Å; L471-F476 HydrophobicContact CD2-CZ 4.19Å; L471-F487 HydrophobicContact CD1-CD2 4.2Å; L471-F487 HydrophobicContact CD1-CE2 4Å; L471-F487 HydrophobicContact CD1-CZ 4.41Å; L471-F487 HydrophobicContact CD2-CD1 4.44Å; L471-F487 HydrophobicContact CD2-CE1 3.86Å; L471-F487 HydrophobicContact CD2-CE2 4.13Å; L471-F487 HydrophobicContact CD2-CZ 3.69Å; L471-I492 HydrophobicContact CD1-CD1 4.16Å; L471-I492 HydrophobicContact CD2-CD1 4.11Å; L471-I492 HydrophobicContact CG-CD1 4.18Å; L471-I492 HydrophobicContact CG-CG2 4.09Å; L471-E494 PolarHBondContact N-O 2.8Å; L471-I495 HydrophobicContact CB-CG1 4.3Å; L471-I495 HydrophobicContact CB-CG2 4.39Å; L471-I495 HydrophobicContact CD1-CD1 4.16Å; L471-I495 HydrophobicContact CD1-CG1 4.1Å; L471-I495 HydrophobicContact CG-CG1 4.34Å; L471-Q496 WeakPolarHBondContact O-CB 3.41Å; L471-Q496 PolarHBondContact O-N 2.6Å; L471-F500 HydrophobicContact CD1-CE1 3.93Å; L471-F500 HydrophobicContact CD1-CZ 3.73Å; L471-L511 HydrophobicContact CD1-CD2 4.27Å
472	T	92.5	Very high	92.3	Very high	30 Å²	30	37 Å²	37	18%	0.184	19%	0.191	C	C	.	.			trans	-108.5	158.9	176.9	74.1	0	0	0	0	111	D449 G474 M475 F476	D449-T472 PolarHBondContact OD1-OG1 3.03Å; T472-G474 PolarHBondContact O-N 3.33Å; T472-G474 PolarHBondContact OG1-N 2.78Å; T472-M475 PolarHBondContact N-SD 2.93Å; T472-M475 WeakPolarHBondContact O-CG 3.37Å; T472-M475 PolarHBondContact OG1-N 2.91Å; T472-F476 VanDerWaalsContact O-CD2 3.29Å; T472-F476 WeakPolarHBondContact O-CD2 3.39Å
473	P	89.9	Confident	92.2	Very high	36 Å²	36	37.3 Å²	37.3	23%	0.234	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-28.6	167.4	-15.2	29.6	0	0	0	111.9	P497 L502	P473-P497 WeakPolarHBondContact CG-O 3.19Å; P473-L502 VanDerWaalsContact O-CD1 3.31Å; P473-L502 WeakPolarHBondContact O-CD1 3.08Å
474	G	89.9	Confident	91.9	Very high	18 Å²	18	40 Å²	40	19%	0.186	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-38.5	-176.3	0	0	0	0	0	113.4	D449 G450 T472 F476 R477	D449-G474 VanDerWaalsContact OD1-C 3.23Å; D449-G474 WeakPolarHBondContact OD1-CA 3.39Å; G450-G474 PolarHBondContact N-O 2.73Å; T472-G474 PolarHBondContact O-N 3.33Å; T472-G474 PolarHBondContact OG1-N 2.78Å; G474-F476 VanDerWaalsContact C-N 3.32Å; G474-F476 PolarHBondContact O-N 3.43Å; G474-R477 WeakPolarHBondContact O-CB 3.45Å; G474-R477 PolarHBondContact O-N 3.48Å
475	M	92.8	Very high	92.1	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.02	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-39.7	-177.2	73.1	-165.1	-79.2	0	0	112.5	V447 D449 F452 L471 T472 R477 F487	V447-M475 HydrophobicContact CB-CB 4.39Å; V447-M475 HydrophobicContact CB-CE 4.06Å; V447-M475 HydrophobicContact CG1-CB 3.99Å; V447-M475 HydrophobicContact CG1-CE 4.35Å; V447-M475 HydrophobicContact CG2-CE 4.13Å; D449-M475 PolarHBondContact OD1-N 3.48Å; D449-M475 VanDerWaalsContact OD1-N 3.16Å; F452-M475 VanDerWaalsContact CD2-O 3.24Å; F452-M475 WeakPolarHBondContact CD2-O 3.36Å; L471-M475 HydrophobicContact CB-SD 4.21Å; L471-M475 HydrophobicContact CD2-CE 3.81Å; L471-M475 HydrophobicContact CD2-SD 3.83Å; T472-M475 PolarHBondContact N-SD 2.93Å; T472-M475 WeakPolarHBondContact O-CG 3.37Å; T472-M475 PolarHBondContact OG1-N 2.91Å; M475-R477 VanDerWaalsContact C-N 3.32Å; M475-R477 PolarHBondContact O-N 2.68Å; M475-F487 HydrophobicContact CE-CZ 4.19Å
476	F	92.8	Very high	92.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-3.6	-176.1	-57.6	-67.3	0	0	0	114.7	L471 T472 G474 G478 L479 L485 F487 A499 F500 M503	L471-F476 HydrophobicContact CB-CE2 4.31Å; L471-F476 HydrophobicContact CD1-CZ 4.34Å; L471-F476 HydrophobicContact CD2-CZ 4.19Å; T472-F476 VanDerWaalsContact O-CD2 3.29Å; T472-F476 WeakPolarHBondContact O-CD2 3.39Å; G474-F476 VanDerWaalsContact C-N 3.32Å; G474-F476 PolarHBondContact O-N 3.43Å; F476-G478 PolarHBondContact O-N 3.35Å; F476-L479 HydrophobicContact CB-CD1 4.35Å; F476-L479 HydrophobicContact CD1-CD1 4.05Å; F476-L479 WeakPolarHBondContact O-CB 3.46Å; F476-L479 PolarHBondContact O-N 2.79Å; F476-L479 VanDerWaalsContact O-N 3.15Å; F476-L485 HydrophobicContact CD1-CD2 4.43Å; F476-L485 HydrophobicContact CE1-CD1 4.46Å; F476-L485 HydrophobicContact CE1-CD2 3.92Å; F476-L485 HydrophobicContact CZ-CD2 4.43Å; F476-F487 AromaticContact CE1-CE2 3.74Å; F476-F487 HydrophobicContact CE1-CE2 3.74Å; F476-F487 AromaticContact CE1-CZ 3.63Å; F476-F487 HydrophobicContact CE1-CZ 3.63Å; F476-F487 AromaticContact CZ-CE2 3.57Å; F476-F487 HydrophobicContact CZ-CE2 3.57Å; F476-F487 AromaticContact CZ-CZ 3.57Å; F476-F487 HydrophobicContact CZ-CZ 3.57Å; F476-A499 WeakPolarHBondContact CD2-O 3.39Å; F476-F500 HydrophobicContact CE2-CD1 4.23Å; F476-F500 HydrophobicContact CE2-CE1 4.11Å; F476-F500 HydrophobicContact CZ-CE1 4.15Å; F476-M503 HydrophobicContact CB-CE 3.73Å; F476-M503 HydrophobicContact CB-CG 4.29Å; F476-M503 HydrophobicContact CB-SD 3.84Å; F476-M503 HydrophobicContact CD1-CE 3.58Å; F476-M503 HydrophobicContact CD1-SD 3.83Å; F476-M503 HydrophobicContact CD2-CE 3.89Å; F476-M503 HydrophobicContact CE1-CE 4.12Å; F476-M503 HydrophobicContact CE2-CE 4.39Å; F476-M503 HydrophobicContact CG-CE 3.44Å; F476-M503 VanDerWaalsContact CG-CE 3.44Å; F476-M503 HydrophobicContact CG-SD 3.98Å; F476-M503 HydrophobicContact CZ-CE 4.5Å
477	R	91.4	Very high	92.3	Very high	151 Å²	151	38.2 Å²	38.2	57%	0.57	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	110.1	-176.4	-177.5	177.9	-176.7	166.3	4.3	111.2	F452 I453 G474 M475 L502	F452-R477 CarbonylContact C-O 3.36Å; I453-R477 WeakPolarHBondContact CA-O 3.43Å; I453-R477 PolarHBondContact N-O 2.91Å; G474-R477 WeakPolarHBondContact O-CB 3.45Å; G474-R477 PolarHBondContact O-N 3.48Å; M475-R477 VanDerWaalsContact C-N 3.32Å; M475-R477 PolarHBondContact O-N 2.68Å; R477-L502 HydrophobicContact CB-CD1 3.72Å; R477-L502 HydrophobicContact CG-CD1 4.09Å
478	G	87.4	Confident	91.9	Very high	15 Å²	15	36.1 Å²	36.1	16%	0.155	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	132	-25.8	-179.4	0	0	0	0	0	113.7	F476 Q480	F476-G478 PolarHBondContact O-N 3.35Å; G478-Q480 PolarHBondContact O-N 2.82Å
479	L	93.4	Very high	91.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.2	C	C	.	.			trans	-80	46	-168.5	-65.2	178.4	0	0	0	114.4	F452 L455 L458 L461 F476 S481 L482 M503	F452-L479 HydrophobicContact CB-CD1 4.02Å; F452-L479 HydrophobicContact CB-CD2 3.71Å; F452-L479 HydrophobicContact CB-CG 3.75Å; F452-L479 HydrophobicContact CD2-CD1 3.74Å; F452-L479 HydrophobicContact CD2-CG 4.41Å; F452-L479 HydrophobicContact CG-CD1 4.06Å; F452-L479 HydrophobicContact CG-CD2 4.3Å; F452-L479 HydrophobicContact CG-CG 4.33Å; L455-L479 HydrophobicContact CB-CD2 4.23Å; L458-L479 HydrophobicContact CB-CD2 3.97Å; L458-L479 HydrophobicContact CD2-CD2 3.55Å; L458-L479 HydrophobicContact CG-CD2 4.37Å; L461-L479 HydrophobicContact CD2-CD1 3.77Å; F476-L479 HydrophobicContact CB-CD1 4.35Å; F476-L479 HydrophobicContact CD1-CD1 4.05Å; F476-L479 WeakPolarHBondContact O-CB 3.46Å; F476-L479 PolarHBondContact O-N 2.79Å; F476-L479 VanDerWaalsContact O-N 3.15Å; L479-S481 VanDerWaalsContact C-N 3.32Å; L479-S481 PolarHBondContact O-N 3.14Å; L479-L482 HydrophobicContact CB-CB 4.1Å; L479-L482 HydrophobicContact CD1-CD2 4.28Å; L479-L482 WeakPolarHBondContact O-CB 3.33Å; L479-L482 PolarHBondContact O-N 2.89Å; L479-L482 VanDerWaalsContact O-N 3.14Å; L479-M503 HydrophobicContact CB-CG 3.8Å; L479-M503 HydrophobicContact CB-SD 3.83Å; L479-M503 HydrophobicContact CD1-SD 3.95Å
480	Q	90.6	Very high	91.6	Very high	128 Å²	128	38 Å²	38	60%	0.598	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-32.5	-171.9	-64.6	-178.5	-1.8	0	0	113.6	G478 N505	G478-Q480 PolarHBondContact O-N 2.82Å; Q480-N505 PolarHBondContact O-ND2 3.09Å
481	S	92.1	Very high	91.7	Very high	42 Å²	42	35 Å²	35	29%	0.294	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	6.4	177	-63.8	0	0	0	0	114.7	P456 L458 L479 H483	P456-S481 VanDerWaalsContact O-CB 3.26Å; P456-S481 WeakPolarHBondContact O-CB 3.42Å; P456-S481 PolarHBondContact O-N 3.37Å; P456-S481 PolarHBondContact O-OG 3.22Å; P456-S481 VanDerWaalsContact O-OG 3.13Å; L458-S481 CarbonylContact O-C 3.56Å; L479-S481 VanDerWaalsContact C-N 3.32Å; L479-S481 PolarHBondContact O-N 3.14Å; S481-H483 PolarHBondContact O-N 3.24Å; S481-H483 PolarHBondContact O-ND1 3Å
482	L	94.4	Very high	91.8	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.			trans	-67.8	135	-175.4	-160.6	78.8	0	0	0	111.5	L458 L461 L479 L485 M503 N505 L506	L458-L482 HydrophobicContact CB-CD1 4.42Å; L458-L482 HydrophobicContact CD2-CD1 4.02Å; L458-L482 HydrophobicContact CG-CD1 4.09Å; L458-L482 WeakPolarHBondContact O-CA 3.21Å; L458-L482 PolarHBondContact O-N 3.19Å; L461-L482 HydrophobicContact CB-CD1 3.8Å; L461-L482 HydrophobicContact CB-CD2 4.3Å; L479-L482 HydrophobicContact CB-CB 4.1Å; L479-L482 HydrophobicContact CD1-CD2 4.28Å; L479-L482 WeakPolarHBondContact O-CB 3.33Å; L479-L482 PolarHBondContact O-N 2.89Å; L479-L482 VanDerWaalsContact O-N 3.14Å; L482-L485 HydrophobicContact CD2-CB 3.98Å; L482-L485 HydrophobicContact CD2-CD1 4.16Å; L482-L485 HydrophobicContact CD2-CD2 4.08Å; L482-L485 HydrophobicContact CD2-CG 4.31Å; L482-M503 HydrophobicContact CB-SD 4.38Å; L482-M503 HydrophobicContact CD2-SD 3.53Å; L482-M503 VanDerWaalsContact CD2-SD 3.53Å; L482-N505 CarbonylContact O-C 3.26Å; L482-L506 HydrophobicContact CD2-CD1 4.19Å; L482-L506 HydrophobicContact CG-CD1 4.49Å; L482-L506 WeakPolarHBondContact O-CA 3.3Å; L482-L506 PolarHBondContact O-N 2.85Å; L482-L506 VanDerWaalsContact O-N 3.09Å
483	H	86.8	Confident	91.9	Very high	43 Å²	43	39.5 Å²	39.5	20%	0.199	19%	0.188	C	C	.	.			trans	-115.9	-37.9	-178	-80.6	63	0	0	0	112.2	K459 S481 K507 L508	K459-H483 PolarHBondContact O-N 3.34Å; S481-H483 PolarHBondContact O-N 3.24Å; S481-H483 PolarHBondContact O-ND1 3Å; H483-K507 PolarHBondContact CD2-NZ 3.37Å; H483-K507 PolarHBondContact NE2-NZ 3.32Å; H483-K507 PolarHBondContact O-N 3.07Å; H483-L508 PolarHBondContact O-N 3.06Å
484	Y	89.1	Confident	92	Very high	56 Å²	56	41.7 Å²	41.7	22%	0.22	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	127.8	-173.7	-50.3	-84.8	0	0	0	110.7	L255 K459 S460 L461 L508	L255-Y484 HydrophobicContact CD1-CE2 4.07Å; K459-Y484 PolarHBondContact O-N 3.33Å; S460-Y484 WeakPolarHBondContact OG-CD2 3.12Å; L461-Y484 PolarHBondContact N-O 2.7Å; Y484-L508 HydrophobicContact CD1-CB 3.79Å; Y484-L508 HydrophobicContact CD1-CD1 4.19Å; Y484-L508 HydrophobicContact CD1-CG 4.42Å; Y484-L508 HydrophobicContact CE1-CB 4.43Å
485	L	94.8	Very high	92.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	119.3	-177.5	-176.2	51.7	0	0	0	110.9	L461 F476 L482 F487 F500 M503 L506 L508 L509 F510	L461-L485 HydrophobicContact CB-CD1 4.05Å; L461-L485 HydrophobicContact CD2-CD1 3.96Å; L461-L485 HydrophobicContact CG-CD1 3.99Å; F476-L485 HydrophobicContact CD1-CD2 4.43Å; F476-L485 HydrophobicContact CE1-CD1 4.46Å; F476-L485 HydrophobicContact CE1-CD2 3.92Å; F476-L485 HydrophobicContact CZ-CD2 4.43Å; L482-L485 HydrophobicContact CD2-CB 3.98Å; L482-L485 HydrophobicContact CD2-CD1 4.16Å; L482-L485 HydrophobicContact CD2-CD2 4.08Å; L482-L485 HydrophobicContact CD2-CG 4.31Å; L485-F487 HydrophobicContact CD1-CD2 4.18Å; L485-F487 HydrophobicContact CD1-CE2 3.69Å; L485-F487 HydrophobicContact CD1-CZ 4.2Å; L485-F487 HydrophobicContact CD2-CD2 4.41Å; L485-F487 HydrophobicContact CD2-CE2 3.84Å; L485-F487 HydrophobicContact CG-CD2 3.94Å; L485-F487 HydrophobicContact CG-CE2 3.7Å; L485-F500 HydrophobicContact CD2-CD1 4.48Å; L485-F500 HydrophobicContact CD2-CE1 4.44Å; L485-M503 HydrophobicContact CD2-CE 3.69Å; L485-M503 HydrophobicContact CD2-SD 4.13Å; L485-L506 HydrophobicContact CB-CD1 3.7Å; L485-L506 HydrophobicContact CD2-CD1 4.47Å; L485-L506 HydrophobicContact CD2-CD2 4.31Å; L485-L508 PolarHBondContact N-O 3.41Å; L485-L509 HydrophobicContact CB-CD1 4.2Å; L485-L509 HydrophobicContact CD2-CD1 4.12Å; L485-L509 HydrophobicContact CG-CD1 4.04Å; L485-L509 WeakPolarHBondContact O-CA 3.35Å; L485-F510 PolarHBondContact O-N 2.9Å
486	Y	91.4	Very high	92.2	Very high	18 Å²	18	44.3 Å²	44.3	7%	0.071	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.3	-174.4	-56.9	-87.9	0	0	0	111	L461 F462 L463 N464 E488 L508 F510	L461-Y486 PolarHBondContact O-N 2.75Å; L461-Y486 VanDerWaalsContact O-N 3.13Å; F462-Y486 AromaticContact CD1-CD2 3.34Å; F462-Y486 HydrophobicContact CD1-CD2 3.34Å; F462-Y486 AromaticContact CD1-CE2 3.82Å; F462-Y486 HydrophobicContact CD1-CE2 3.82Å; F462-Y486 AromaticContact CD1-CG 3.91Å; F462-Y486 HydrophobicContact CD1-CG 3.91Å; F462-Y486 AromaticContact CE1-CD2 3.45Å; F462-Y486 HydrophobicContact CE1-CD2 3.45Å; F462-Y486 VanDerWaalsContact CE1-CD2 3.45Å; F462-Y486 AromaticContact CE1-CE2 3.37Å; F462-Y486 HydrophobicContact CE1-CE2 3.37Å; F462-Y486 HydrophobicContact CE1-CG 4.22Å; F462-Y486 AromaticContact CG-CD2 3.97Å; F462-Y486 HydrophobicContact CG-CD2 3.97Å; F462-Y486 HydrophobicContact CZ-CD2 4.14Å; F462-Y486 AromaticContact CZ-CE2 3.8Å; F462-Y486 HydrophobicContact CZ-CE2 3.8Å; L463-Y486 CarbonylContact C-O 3.08Å; L463-Y486 WeakPolarHBondContact CA-O 3.47Å; L463-Y486 PolarHBondContact N-O 3Å; N464-Y486 PolarHBondContact N-O 3.13Å; N464-Y486 VanDerWaalsContact N-O 3.16Å; Y486-E488 WeakPolarHBondContact CD1-OE1 3.25Å; Y486-L508 HydrophobicContact CD1-CD2 4.17Å; Y486-L508 HydrophobicContact CE1-CD2 3.52Å; Y486-F510 HydrophobicContact CD1-CB 4.07Å; Y486-F510 AromaticContact CD1-CD2 3.66Å; Y486-F510 HydrophobicContact CD1-CD2 3.66Å; Y486-F510 HydrophobicContact CD1-CE2 4.42Å; Y486-F510 HydrophobicContact CD1-CG 4.09Å; Y486-F510 AromaticContact CE1-CD2 3.67Å; Y486-F510 HydrophobicContact CE1-CD2 3.67Å; Y486-F510 AromaticContact CE1-CE2 3.99Å; Y486-F510 HydrophobicContact CE1-CE2 3.99Å; Y486-F510 HydrophobicContact CE1-CG 4.27Å
487	F	95.4	Very high	92	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.226	C	C	.	.			trans	-125	18.5	179	-82.8	-63	0	0	0	112.6	L463 I468 L471 M475 F476 L485 N490 I492 L509 F510 L511 N514	L463-F487 HydrophobicContact CB-CD1 3.83Å; L463-F487 HydrophobicContact CB-CE1 3.7Å; L463-F487 HydrophobicContact CD1-CD1 4.47Å; L463-F487 HydrophobicContact CD1-CE1 3.53Å; L463-F487 HydrophobicContact CD1-CZ 3.72Å; L463-F487 HydrophobicContact CG-CE1 4.25Å; I468-F487 HydrophobicContact CD1-CD1 4.18Å; I468-F487 HydrophobicContact CD1-CE1 3.73Å; L471-F487 HydrophobicContact CD1-CD2 4.2Å; L471-F487 HydrophobicContact CD1-CE2 4Å; L471-F487 HydrophobicContact CD1-CZ 4.41Å; L471-F487 HydrophobicContact CD2-CD1 4.44Å; L471-F487 HydrophobicContact CD2-CE1 3.86Å; L471-F487 HydrophobicContact CD2-CE2 4.13Å; L471-F487 HydrophobicContact CD2-CZ 3.69Å; M475-F487 HydrophobicContact CE-CZ 4.19Å; F476-F487 AromaticContact CE1-CE2 3.74Å; F476-F487 HydrophobicContact CE1-CE2 3.74Å; F476-F487 AromaticContact CE1-CZ 3.63Å; F476-F487 HydrophobicContact CE1-CZ 3.63Å; F476-F487 AromaticContact CZ-CE2 3.57Å; F476-F487 HydrophobicContact CZ-CE2 3.57Å; F476-F487 AromaticContact CZ-CZ 3.57Å; F476-F487 HydrophobicContact CZ-CZ 3.57Å; L485-F487 HydrophobicContact CD1-CD2 4.18Å; L485-F487 HydrophobicContact CD1-CE2 3.69Å; L485-F487 HydrophobicContact CD1-CZ 4.2Å; L485-F487 HydrophobicContact CD2-CD2 4.41Å; L485-F487 HydrophobicContact CD2-CE2 3.84Å; L485-F487 HydrophobicContact CG-CD2 3.94Å; L485-F487 HydrophobicContact CG-CE2 3.7Å; F487-N490 WeakPolarHBondContact O-CB 3.07Å; F487-N490 PolarHBondContact O-ND2 3.25Å; F487-I492 HydrophobicContact CB-CD1 3.85Å; F487-I492 HydrophobicContact CD1-CD1 3.98Å; F487-I492 HydrophobicContact CG-CD1 3.98Å; F487-L509 HydrophobicContact CD2-CD1 4.33Å; F487-F510 WeakPolarHBondContact CA-O 3.48Å; F487-F510 WeakPolarHBondContact CB-O 3.45Å; F487-F510 PolarHBondContact N-O 3.39Å; F487-L511 HydrophobicContact CB-CD2 3.7Å; F487-L511 HydrophobicContact CD2-CD2 4.19Å; F487-L511 HydrophobicContact CG-CD2 4.27Å; F487-N514 PolarHBondContact O-ND2 2.98Å
488	E	86.4	Confident	91.9	Very high	25 Å²	25	42.1 Å²	42.1	12%	0.117	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	148.1	-179.1	-47.5	-178	-118.8	0	0	112	N464 G465 Y486 N490 F510 N512	N464-E488 CarbonylContact C-O 3.36Å; N464-E488 WeakPolarHBondContact CA-O 3.11Å; N464-E488 HydrophobicContact CB-CB 3.92Å; N464-E488 HydrophobicContact CB-CG 4.44Å; G465-E488 PolarHBondContact N-O 3.43Å; Y486-E488 WeakPolarHBondContact CD1-OE1 3.25Å; E488-N490 VanDerWaalsContact C-N 3.27Å; E488-N490 PolarHBondContact O-N 2.87Å; E488-N490 PolarHBondContact O-ND2 3.14Å; E488-F510 HydrophobicContact CG-CB 3.75Å; E488-F510 HydrophobicContact CG-CD2 4.41Å; E488-N512 WeakPolarHBondContact CA-O 3.37Å; E488-N512 PolarHBondContact OE2-ND2 2.97Å
489	F	90.3	Very high	92	Very high	117 Å²	117	41.4 Å²	41.4	51%	0.513	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	46	175.3	-54.6	-87	0	0	0	112.9	G465 N512 N513	G465-F489 WeakPolarHBondContact CA-O 3.3Å; G465-F489 PolarHBondContact N-O 3.46Å; F489-N512 PolarHBondContact N-O 3.3Å; F489-N512 VanDerWaalsContact N-O 3.11Å; F489-N513 WeakPolarHBondContact CA-O 3.24Å; F489-N513 HydrophobicContact CD1-CB 3.66Å; F489-N513 HydrophobicContact CE1-CB 3.97Å; F489-N513 WeakPolarHBondContact CE1-ND2 3.37Å; F489-N513 HydrophobicContact CG-CB 4.11Å; F489-N513 WeakPolarHBondContact CZ-ND2 2.99Å; F489-N513 PolarHBondContact N-O 3.47Å
490	N	94.1	Very high	92	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.037	20%	0.204	C	C	.	.			trans	-111.2	-179.9	170.4	-83.8	-111.3	0	0	0	109.7	L463 G465 N466 I468 F487 E488 I492 N513 N514	L463-N490 PolarHBondContact O-ND2 2.95Å; G465-N490 PolarHBondContact N-ND2 3.08Å; N466-N490 VanDerWaalsContact C-OD1 3.31Å; N466-N490 VanDerWaalsContact CB-OD1 3.25Å; N466-N490 WeakPolarHBondContact CB-OD1 3.44Å; N466-N490 VanDerWaalsContact O-CA 3.32Å; N466-N490 WeakPolarHBondContact O-CA 3.48Å; N466-N490 VanDerWaalsContact O-CG 3.28Å; N466-N490 PolarHBondContact O-OD1 3.03Å; N466-N490 VanDerWaalsContact O-OD1 3.07Å; I468-N490 WeakPolarHBondContact CB-OD1 3.25Å; I468-N490 WeakPolarHBondContact CG1-OD1 3.14Å; I468-N490 PolarHBondContact N-OD1 3.04Å; F487-N490 WeakPolarHBondContact O-CB 3.07Å; F487-N490 PolarHBondContact O-ND2 3.25Å; E488-N490 VanDerWaalsContact C-N 3.27Å; E488-N490 PolarHBondContact O-N 2.87Å; E488-N490 PolarHBondContact O-ND2 3.14Å; N490-I492 HydrophobicContact CB-CD1 4.15Å; N490-I492 HydrophobicContact CB-CG1 3.91Å; N490-N513 PolarHBondContact N-O 3.39Å; N490-N514 WeakPolarHBondContact CA-OD1 3.31Å; N490-N514 WeakPolarHBondContact CB-OD1 3.49Å; N490-N514 PolarHBondContact O-OD1 2.67Å; N490-N514 VanDerWaalsContact O-OD1 3.13Å
491	V	95.6	Very high	92	Very high	45 Å²	45	37.2 Å²	37.2	27%	0.273	19%	0.188	S	C	.	.			trans	-106.6	30.4	178	-68.6	0	0	0	0	112.4	I468 E469 R493 L515	I468-V491 CarbonylContact O-C 3.42Å; I468-V491 PolarHBondContact O-N 3.22Å; E469-V491 HydrophobicContact CG-CG2 3.93Å; V491-R493 PolarHBondContact O-N 3.25Å; V491-L515 HydrophobicContact CB-CD1 3.95Å; V491-L515 HydrophobicContact CG1-CD1 4.3Å
492	I	96.5	Very high	91.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.191	C	C	.	.			trans	-67.5	119	-172.2	-53.8	166.2	0	0	0	109.6	I468 E469 L471 F487 N490 I495 L511 N514 L515 L516	I468-I492 HydrophobicContact CB-CG1 4.41Å; I468-I492 HydrophobicContact CG2-CG1 4.33Å; I468-I492 WeakPolarHBondContact O-CA 3.39Å; I468-I492 WeakPolarHBondContact O-CG1 3.47Å; I468-I492 PolarHBondContact O-N 3.38Å; E469-I492 CarbonylContact O-C 3.58Å; E469-I492 WeakPolarHBondContact O-CA 3.48Å; L471-I492 HydrophobicContact CD1-CD1 4.16Å; L471-I492 HydrophobicContact CD2-CD1 4.11Å; L471-I492 HydrophobicContact CG-CD1 4.18Å; L471-I492 HydrophobicContact CG-CG2 4.09Å; F487-I492 HydrophobicContact CB-CD1 3.85Å; F487-I492 HydrophobicContact CD1-CD1 3.98Å; F487-I492 HydrophobicContact CG-CD1 3.98Å; N490-I492 HydrophobicContact CB-CD1 4.15Å; N490-I492 HydrophobicContact CB-CG1 3.91Å; I492-I495 HydrophobicContact CG2-CG1 4.33Å; I492-L511 HydrophobicContact CD1-CD2 3.91Å; I492-N514 VanDerWaalsContact CB-OD1 3.27Å; I492-N514 WeakPolarHBondContact CB-OD1 3.31Å; I492-N514 VanDerWaalsContact CG1-OD1 3.22Å; I492-N514 WeakPolarHBondContact CG1-OD1 3.39Å; I492-N514 PolarHBondContact N-OD1 3.47Å; I492-L515 CarbonylContact O-C 3.33Å; I492-L515 VanDerWaalsContact O-CA 3.26Å; I492-L515 WeakPolarHBondContact O-CA 3.37Å; I492-L515 WeakPolarHBondContact O-CB 3.42Å; I492-L515 PolarHBondContact O-N 2.88Å; I492-L516 HydrophobicContact CB-CD2 4.28Å; I492-L516 HydrophobicContact CG2-CD2 3.69Å; I492-L516 PolarHBondContact O-N 3.38Å; I492-L516 VanDerWaalsContact O-N 3.12Å
493	R	94	Very high	91.8	Very high	125 Å²	125	38.4 Å²	38.4	47%	0.472	19%	0.191	S	C	.	.			trans	-101.8	-27.6	178.2	-60.2	-177.6	-166.4	117.1	16.8	112.9	E469 V491 L515	E469-R493 PolarHBondContact O-N 3.06Å; E469-R493 IonicContact OE1-CZ 3.19Å; E469-R493 IonicContact OE1-NH1 2.74Å; E469-R493 PolarHBondContact OE1-NH1 2.89Å; E469-R493 IonicContact OE1-NH2 2.66Å; E469-R493 PolarHBondContact OE1-NH2 2.92Å; E469-R493 IonicContact OE2-CZ 2.77Å; E469-R493 IonicContact OE2-NH1 2.75Å; E469-R493 PolarHBondContact OE2-NH1 3.01Å; V491-R493 PolarHBondContact O-N 3.25Å; R493-L515 HydrophobicContact CG-CB 3.78Å; R493-L515 HydrophobicContact CG-CD1 4.03Å
494	E	92.3	Very high	91.9	Very high	81 Å²	81	39.5 Å²	39.5	38%	0.379	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	134.4	-169.4	-172.7	-173.1	130.4	0	0	111.3	K470 L471	K470-E494 VanDerWaalsContact CA-O 3.31Å; K470-E494 WeakPolarHBondContact CA-O 3.45Å; K470-E494 HydrophobicContact CD-CB 4.21Å; K470-E494 VanDerWaalsContact CE-OE2 3.3Å; K470-E494 WeakPolarHBondContact CE-OE2 3.45Å; K470-E494 HydrophobicContact CG-CB 4.14Å; K470-E494 IonicContact NZ-OE1 2.59Å; K470-E494 IonicContact NZ-OE2 2.78Å; K470-E494 PolarHBondContact NZ-OE2 3.08Å; L471-E494 PolarHBondContact N-O 2.8Å
495	I	94.8	Very high	91.9	Very high	7 Å²	7	40.4 Å²	40.4	4%	0.036	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.1	168.4	-59.5	-179.8	0	0	0	106.4	L471 I492 A499 F500 L511 L516 L519 P520	L471-I495 HydrophobicContact CB-CG1 4.3Å; L471-I495 HydrophobicContact CB-CG2 4.39Å; L471-I495 HydrophobicContact CD1-CD1 4.16Å; L471-I495 HydrophobicContact CD1-CG1 4.1Å; L471-I495 HydrophobicContact CG-CG1 4.34Å; I492-I495 HydrophobicContact CG2-CG1 4.33Å; I495-A499 HydrophobicContact CG2-CB 3.69Å; I495-F500 HydrophobicContact CD1-CE2 4.2Å; I495-F500 HydrophobicContact CD1-CZ 4.12Å; I495-F500 HydrophobicContact CG2-CE2 4.07Å; I495-F500 HydrophobicContact CG2-CZ 4.33Å; I495-L511 HydrophobicContact CD1-CD1 4.08Å; I495-L516 HydrophobicContact CD1-CD1 4.01Å; I495-L516 HydrophobicContact CD1-CD2 3.96Å; I495-L516 HydrophobicContact CG1-CD2 3.82Å; I495-L519 HydrophobicContact CD1-CD2 3.94Å; I495-P520 WeakPolarHBondContact O-CD 3.25Å; I495-P520 VanDerWaalsContact O-CG 3.24Å; I495-P520 WeakPolarHBondContact O-CG 3.31Å
496	Q	92	Very high	91.8	Very high	70 Å²	70	40.4 Å²	40.4	33%	0.327	21%	0.21	S	C	.	.			trans	-83.4	154.7	177.5	-71.8	-175.8	-14.9	0	0	112.4	L471 A498 A499	L471-Q496 WeakPolarHBondContact O-CB 3.41Å; L471-Q496 PolarHBondContact O-N 2.6Å; Q496-A498 PolarHBondContact O-N 2.86Å; Q496-A499 VanDerWaalsContact O-CB 3.28Å; Q496-A499 WeakPolarHBondContact O-CB 3.29Å; Q496-A499 PolarHBondContact O-N 3.35Å
497	P	90.1	Very high	91.6	Very high	76 Å²	76	44 Å²	44	49%	0.494	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	139.6	175.1	-24.5	32.3	0	0	0	111.9	P473 A499 P520	P473-P497 WeakPolarHBondContact CG-O 3.19Å; P497-A499 PolarHBondContact O-N 3.13Å; P497-A499 VanDerWaalsContact O-N 3.13Å; P497-P520 HydrophobicContact CB-CB 4.4Å; P497-P520 HydrophobicContact CG-CB 3.93Å
498	A	88.8	Confident	91.2	Very high	30 Å²	30	44.3 Å²	44.3	25%	0.248	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	20.9	-178.7	0	0	0	0	0	116	Q496 F500 S501 D522	Q496-A498 PolarHBondContact O-N 2.86Å; A498-F500 VanDerWaalsContact C-N 3.27Å; A498-F500 PolarHBondContact O-N 2.98Å; A498-S501 VanDerWaalsContact O-CB 3.28Å; A498-S501 WeakPolarHBondContact O-CB 3.38Å; A498-S501 PolarHBondContact O-N 3.08Å; A498-S501 PolarHBondContact O-OG 2.64Å; A498-D522 VanDerWaalsContact CA-O 3.26Å; A498-D522 WeakPolarHBondContact CA-O 3.3Å; A498-D522 PolarHBondContact N-O 2.91Å
499	A	89.9	Confident	91.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-40.2	-178.6	0	0	0	0	0	113.9	F476 I495 Q496 P497	F476-A499 WeakPolarHBondContact CD2-O 3.39Å; I495-A499 HydrophobicContact CG2-CB 3.69Å; Q496-A499 VanDerWaalsContact O-CB 3.28Å; Q496-A499 WeakPolarHBondContact O-CB 3.29Å; Q496-A499 PolarHBondContact O-N 3.35Å; P497-A499 PolarHBondContact O-N 3.13Å; P497-A499 VanDerWaalsContact O-N 3.13Å
500	F	92.4	Very high	91.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.1	-177.9	-53.1	-61.6	0	0	0	114.1	L471 F476 L485 I495 A498 L502 M503 L509 L511 A523 F524 T527	L471-F500 HydrophobicContact CD1-CE1 3.93Å; L471-F500 HydrophobicContact CD1-CZ 3.73Å; F476-F500 HydrophobicContact CE2-CD1 4.23Å; F476-F500 HydrophobicContact CE2-CE1 4.11Å; F476-F500 HydrophobicContact CZ-CE1 4.15Å; L485-F500 HydrophobicContact CD2-CD1 4.48Å; L485-F500 HydrophobicContact CD2-CE1 4.44Å; I495-F500 HydrophobicContact CD1-CE2 4.2Å; I495-F500 HydrophobicContact CD1-CZ 4.12Å; I495-F500 HydrophobicContact CG2-CE2 4.07Å; I495-F500 HydrophobicContact CG2-CZ 4.33Å; A498-F500 VanDerWaalsContact C-N 3.27Å; A498-F500 PolarHBondContact O-N 2.98Å; F500-L502 PolarHBondContact O-N 3.43Å; F500-M503 HydrophobicContact CB-CE 4.31Å; F500-M503 HydrophobicContact CD1-CE 3.76Å; F500-M503 PolarHBondContact O-N 3.13Å; F500-L509 HydrophobicContact CD1-CD2 4.35Å; F500-L509 HydrophobicContact CD2-CD2 4.02Å; F500-L509 HydrophobicContact CE1-CD1 4.2Å; F500-L509 HydrophobicContact CE1-CD2 4.04Å; F500-L509 HydrophobicContact CE2-CD2 3.7Å; F500-L509 HydrophobicContact CG-CD2 4.34Å; F500-L509 HydrophobicContact CZ-CD1 4.34Å; F500-L509 HydrophobicContact CZ-CD2 3.71Å; F500-L511 HydrophobicContact CZ-CD1 4.34Å; F500-A523 WeakPolarHBondContact CD2-O 3.49Å; F500-F524 AromaticContact CD2-CD1 3.76Å; F500-F524 HydrophobicContact CD2-CD1 3.76Å; F500-F524 AromaticContact CD2-CE1 3.89Å; F500-F524 HydrophobicContact CD2-CE1 3.89Å; F500-F524 HydrophobicContact CE2-CD1 4.23Å; F500-F524 AromaticContact CE2-CE1 3.86Å; F500-F524 HydrophobicContact CE2-CE1 3.86Å; F500-T527 HydrophobicContact CB-CG2 3.74Å; F500-T527 VanDerWaalsContact O-CG2 3.26Å; F500-T527 WeakPolarHBondContact O-CG2 3.34Å
501	S	90	Very high	91.6	Very high	40 Å²	40	38.8 Å²	38.8	28%	0.28	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.7	-172.9	65.4	0	0	0	0	115.5	A498 M503 A525	A498-S501 VanDerWaalsContact O-CB 3.28Å; A498-S501 WeakPolarHBondContact O-CB 3.38Å; A498-S501 PolarHBondContact O-N 3.08Å; A498-S501 PolarHBondContact O-OG 2.64Å; S501-M503 PolarHBondContact O-N 3.01Å; S501-A525 WeakPolarHBondContact CA-O 3.49Å; S501-A525 VanDerWaalsContact CB-O 3.28Å; S501-A525 WeakPolarHBondContact CB-O 3.25Å
502	L	89.4	Confident	91.4	Very high	67 Å²	67	37.2 Å²	37.2	35%	0.351	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	2.3	178.1	-56.6	-172.4	0	0	0	113.7	P473 R477 F500 P504	P473-L502 VanDerWaalsContact O-CD1 3.31Å; P473-L502 WeakPolarHBondContact O-CD1 3.08Å; R477-L502 HydrophobicContact CB-CD1 3.72Å; R477-L502 HydrophobicContact CG-CD1 4.09Å; F500-L502 PolarHBondContact O-N 3.43Å; L502-P504 WeakPolarHBondContact O-CD 3.39Å
503	M	93.1	Very high	91.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.			trans	-125.3	66.5	-176.8	-60	-177.5	-72.5	0	0	111.3	F476 L479 L482 L485 F500 S501 N505 L506	F476-M503 HydrophobicContact CB-CE 3.73Å; F476-M503 HydrophobicContact CB-CG 4.29Å; F476-M503 HydrophobicContact CB-SD 3.84Å; F476-M503 HydrophobicContact CD1-CE 3.58Å; F476-M503 HydrophobicContact CD1-SD 3.83Å; F476-M503 HydrophobicContact CD2-CE 3.89Å; F476-M503 HydrophobicContact CE1-CE 4.12Å; F476-M503 HydrophobicContact CE2-CE 4.39Å; F476-M503 HydrophobicContact CG-CE 3.44Å; F476-M503 VanDerWaalsContact CG-CE 3.44Å; F476-M503 HydrophobicContact CG-SD 3.98Å; F476-M503 HydrophobicContact CZ-CE 4.5Å; L479-M503 HydrophobicContact CB-CG 3.8Å; L479-M503 HydrophobicContact CB-SD 3.83Å; L479-M503 HydrophobicContact CD1-SD 3.95Å; L482-M503 HydrophobicContact CB-SD 4.38Å; L482-M503 HydrophobicContact CD2-SD 3.53Å; L482-M503 VanDerWaalsContact CD2-SD 3.53Å; L485-M503 HydrophobicContact CD2-CE 3.69Å; L485-M503 HydrophobicContact CD2-SD 4.13Å; F500-M503 HydrophobicContact CB-CE 4.31Å; F500-M503 HydrophobicContact CD1-CE 3.76Å; F500-M503 PolarHBondContact O-N 3.13Å; S501-M503 PolarHBondContact O-N 3.01Å; M503-N505 PolarHBondContact O-N 2.9Å; M503-N505 VanDerWaalsContact O-N 3.15Å; M503-L506 HydrophobicContact CB-CB 4.17Å; M503-L506 HydrophobicContact CE-CD2 4.35Å; M503-L506 WeakPolarHBondContact O-CB 3.41Å; M503-L506 PolarHBondContact O-N 3.21Å; M503-L506 VanDerWaalsContact O-N 3.08Å
504	P	90	Very high	91.2	Very high	65 Å²	65	33.2 Å²	33.2	42%	0.422	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.6	-170.9	27.3	-36.5	0	0	0	114.5	L502 L506 G526	L502-P504 WeakPolarHBondContact O-CD 3.39Å; P504-L506 VanDerWaalsContact C-N 3.35Å; P504-G526 WeakPolarHBondContact CA-O 3.43Å
505	N	89.5	Confident	91.4	Very high	75 Å²	75	31.8 Å²	31.8	40%	0.401	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	2.1	177.2	-70.4	-69.5	0	0	0	113.9	Q480 L482 M503 K507	Q480-N505 PolarHBondContact O-ND2 3.09Å; L482-N505 CarbonylContact O-C 3.26Å; M503-N505 PolarHBondContact O-N 2.9Å; M503-N505 VanDerWaalsContact O-N 3.15Å; N505-K507 PolarHBondContact O-N 3.25Å
506	L	92.8	Very high	91.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.174	C	C	.	.			trans	-67.2	122.6	-176.1	-173.9	67.3	0	0	0	110.8	L482 L485 M503 P504 L509 S528 L529	L482-L506 HydrophobicContact CD2-CD1 4.19Å; L482-L506 HydrophobicContact CG-CD1 4.49Å; L482-L506 WeakPolarHBondContact O-CA 3.3Å; L482-L506 PolarHBondContact O-N 2.85Å; L482-L506 VanDerWaalsContact O-N 3.09Å; L485-L506 HydrophobicContact CB-CD1 3.7Å; L485-L506 HydrophobicContact CD2-CD1 4.47Å; L485-L506 HydrophobicContact CD2-CD2 4.31Å; M503-L506 HydrophobicContact CB-CB 4.17Å; M503-L506 HydrophobicContact CE-CD2 4.35Å; M503-L506 WeakPolarHBondContact O-CB 3.41Å; M503-L506 PolarHBondContact O-N 3.21Å; M503-L506 VanDerWaalsContact O-N 3.08Å; P504-L506 VanDerWaalsContact C-N 3.35Å; L506-L509 HydrophobicContact CD2-CB 4.47Å; L506-S528 CarbonylContact O-C 3.16Å; L506-L529 HydrophobicContact CB-CD2 4.49Å; L506-L529 HydrophobicContact CD2-CD2 3.97Å; L506-L529 HydrophobicContact CG-CD2 3.79Å
507	K	85.4	Confident	91.4	Very high	93 Å²	93	36.5 Å²	36.5	40%	0.404	19%	0.19	S	C	.	.			trans	-113.7	-29.5	-176.7	-68.4	170.7	-161.2	169.6	0	113	H483 N505 A530 R531	H483-K507 PolarHBondContact CD2-NZ 3.37Å; H483-K507 PolarHBondContact NE2-NZ 3.32Å; H483-K507 PolarHBondContact O-N 3.07Å; N505-K507 PolarHBondContact O-N 3.25Å; K507-A530 PolarHBondContact O-N 3.5Å; K507-R531 PolarHBondContact O-N 3.23Å
508	L	87.6	Confident	91.5	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.042	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	125.8	-178.6	-174.4	152.7	0	0	0	110.2	H483 Y484 L485 Y486 F510 R531	H483-L508 PolarHBondContact O-N 3.06Å; Y484-L508 HydrophobicContact CD1-CB 3.79Å; Y484-L508 HydrophobicContact CD1-CD1 4.19Å; Y484-L508 HydrophobicContact CD1-CG 4.42Å; Y484-L508 HydrophobicContact CE1-CB 4.43Å; L485-L508 PolarHBondContact N-O 3.41Å; Y486-L508 HydrophobicContact CD1-CD2 4.17Å; Y486-L508 HydrophobicContact CE1-CD2 3.52Å; L508-F510 HydrophobicContact CD1-CE1 3.97Å; L508-F510 HydrophobicContact CD1-CZ 4.03Å; L508-F510 HydrophobicContact CD2-CD1 3.62Å; L508-F510 HydrophobicContact CD2-CD2 4.25Å; L508-F510 HydrophobicContact CD2-CE1 3.77Å; L508-F510 HydrophobicContact CD2-CE2 4.37Å; L508-F510 HydrophobicContact CD2-CG 3.88Å; L508-F510 HydrophobicContact CD2-CZ 4.15Å; L508-F510 HydrophobicContact CG-CD1 4.05Å; L508-F510 HydrophobicContact CG-CE1 3.81Å; L508-F510 HydrophobicContact CG-CZ 4.31Å; L508-R531 WeakPolarHBondContact CA-O 3.5Å; L508-R531 HydrophobicContact CB-CB 4.43Å; L508-R531 HydrophobicContact CD1-CB 4.26Å; L508-R531 HydrophobicContact CG-CB 4.1Å
509	L	94.3	Very high	91.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	113.4	176.4	175.7	58.6	0	0	0	109.9	L485 F487 F500 L506 L511 F524 L529 R531 L532 N533	L485-L509 HydrophobicContact CB-CD1 4.2Å; L485-L509 HydrophobicContact CD2-CD1 4.12Å; L485-L509 HydrophobicContact CG-CD1 4.04Å; L485-L509 WeakPolarHBondContact O-CA 3.35Å; F487-L509 HydrophobicContact CD2-CD1 4.33Å; F500-L509 HydrophobicContact CD1-CD2 4.35Å; F500-L509 HydrophobicContact CD2-CD2 4.02Å; F500-L509 HydrophobicContact CE1-CD1 4.2Å; F500-L509 HydrophobicContact CE1-CD2 4.04Å; F500-L509 HydrophobicContact CE2-CD2 3.7Å; F500-L509 HydrophobicContact CG-CD2 4.34Å; F500-L509 HydrophobicContact CZ-CD1 4.34Å; F500-L509 HydrophobicContact CZ-CD2 3.71Å; L506-L509 HydrophobicContact CD2-CB 4.47Å; L509-L511 HydrophobicContact CD1-CD1 4.19Å; L509-L511 HydrophobicContact CD1-CG 4.09Å; L509-L511 HydrophobicContact CD2-CD1 3.88Å; L509-L511 HydrophobicContact CG-CD1 3.89Å; L509-L511 HydrophobicContact CG-CG 4.14Å; L509-F524 HydrophobicContact CD2-CD1 4.48Å; L509-F524 HydrophobicContact CD2-CE1 3.87Å; L509-L529 HydrophobicContact CB-CD1 4.4Å; L509-L529 HydrophobicContact CB-CD2 3.77Å; L509-L529 HydrophobicContact CD2-CD1 4.17Å; L509-R531 PolarHBondContact N-O 2.59Å; L509-L532 HydrophobicContact CB-CD1 4.22Å; L509-L532 HydrophobicContact CD2-CD1 4.11Å; L509-L532 HydrophobicContact CG-CD1 4.12Å; L509-L532 WeakPolarHBondContact O-CA 3.46Å; L509-N533 PolarHBondContact O-N 3.47Å
510	F	90.8	Very high	91.7	Very high	33 Å²	33	36.6 Å²	36.6	15%	0.145	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.3	176.6	-76.2	2.8	0	0	0	110.3	L485 Y486 F487 E488 L508 N533	L485-F510 PolarHBondContact O-N 2.9Å; Y486-F510 HydrophobicContact CD1-CB 4.07Å; Y486-F510 AromaticContact CD1-CD2 3.66Å; Y486-F510 HydrophobicContact CD1-CD2 3.66Å; Y486-F510 HydrophobicContact CD1-CE2 4.42Å; Y486-F510 HydrophobicContact CD1-CG 4.09Å; Y486-F510 AromaticContact CE1-CD2 3.67Å; Y486-F510 HydrophobicContact CE1-CD2 3.67Å; Y486-F510 AromaticContact CE1-CE2 3.99Å; Y486-F510 HydrophobicContact CE1-CE2 3.99Å; Y486-F510 HydrophobicContact CE1-CG 4.27Å; F487-F510 WeakPolarHBondContact CA-O 3.48Å; F487-F510 WeakPolarHBondContact CB-O 3.45Å; F487-F510 PolarHBondContact N-O 3.39Å; E488-F510 HydrophobicContact CG-CB 3.75Å; E488-F510 HydrophobicContact CG-CD2 4.41Å; L508-F510 HydrophobicContact CD1-CE1 3.97Å; L508-F510 HydrophobicContact CD1-CZ 4.03Å; L508-F510 HydrophobicContact CD2-CD1 3.62Å; L508-F510 HydrophobicContact CD2-CD2 4.25Å; L508-F510 HydrophobicContact CD2-CE1 3.77Å; L508-F510 HydrophobicContact CD2-CE2 4.37Å; L508-F510 HydrophobicContact CD2-CG 3.88Å; L508-F510 HydrophobicContact CD2-CZ 4.15Å; L508-F510 HydrophobicContact CG-CD1 4.05Å; L508-F510 HydrophobicContact CG-CE1 3.81Å; L508-F510 HydrophobicContact CG-CZ 4.31Å; F510-N533 HydrophobicContact CB-CB 4.43Å; F510-N533 HydrophobicContact CD1-CB 3.57Å; F510-N533 HydrophobicContact CE1-CB 4.03Å; F510-N533 HydrophobicContact CG-CB 4.08Å
511	L	95.1	Very high	91.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.			trans	-127.2	18.4	-177.9	-74.9	163.3	0	0	0	111.3	L471 F487 I492 I495 F500 L509 N514 L516 N533 L534 N537	L471-L511 HydrophobicContact CD1-CD2 4.27Å; F487-L511 HydrophobicContact CB-CD2 3.7Å; F487-L511 HydrophobicContact CD2-CD2 4.19Å; F487-L511 HydrophobicContact CG-CD2 4.27Å; I492-L511 HydrophobicContact CD1-CD2 3.91Å; I495-L511 HydrophobicContact CD1-CD1 4.08Å; F500-L511 HydrophobicContact CZ-CD1 4.34Å; L509-L511 HydrophobicContact CD1-CD1 4.19Å; L509-L511 HydrophobicContact CD1-CG 4.09Å; L509-L511 HydrophobicContact CD2-CD1 3.88Å; L509-L511 HydrophobicContact CG-CD1 3.89Å; L509-L511 HydrophobicContact CG-CG 4.14Å; L511-N514 WeakPolarHBondContact O-CB 3.41Å; L511-N514 PolarHBondContact O-ND2 3.46Å; L511-L516 HydrophobicContact CB-CD1 4.33Å; L511-L516 HydrophobicContact CD1-CD1 4.41Å; L511-N533 CarbonylContact C-O 3.55Å; L511-N533 WeakPolarHBondContact CA-O 3.37Å; L511-N533 WeakPolarHBondContact CB-O 3.35Å; L511-N533 PolarHBondContact N-O 3.47Å; L511-L534 HydrophobicContact CB-CD2 4.08Å; L511-L534 HydrophobicContact CD1-CD2 4.09Å; L511-N537 PolarHBondContact O-ND2 2.93Å
512	N	91.3	Very high	91.1	Very high	12 Å²	12	41.8 Å²	41.8	6%	0.064	22%	0.215	C	C	.	.			trans	-64.8	155	178.5	43.6	-71.1	0	0	0	113.1	E488 F489 N514 N533 R535	E488-N512 WeakPolarHBondContact CA-O 3.37Å; E488-N512 PolarHBondContact OE2-ND2 2.97Å; F489-N512 PolarHBondContact N-O 3.3Å; F489-N512 VanDerWaalsContact N-O 3.11Å; N512-N514 PolarHBondContact O-ND2 3.46Å; N512-N514 VanDerWaalsContact O-ND2 3.08Å; N512-N533 PolarHBondContact N-O 3.46Å; N512-R535 CarbonylContact C-O 3.6Å; N512-R535 WeakPolarHBondContact CA-O 3.25Å; N512-R535 HydrophobicContact CB-CB 4.1Å; N512-R535 WeakPolarHBondContact CB-O 3.44Å
513	N	90.9	Very high	91	Very high	38 Å²	38	38.6 Å²	38.6	20%	0.203	20%	0.198	C	C	.	.	S	Bend	trans	53.3	58.4	-177.5	-57.9	-64.1	0	0	0	112.1	F489 N490 R535 K536	F489-N513 WeakPolarHBondContact CA-O 3.24Å; F489-N513 HydrophobicContact CD1-CB 3.66Å; F489-N513 HydrophobicContact CE1-CB 3.97Å; F489-N513 WeakPolarHBondContact CE1-ND2 3.37Å; F489-N513 HydrophobicContact CG-CB 4.11Å; F489-N513 WeakPolarHBondContact CZ-ND2 2.99Å; F489-N513 PolarHBondContact N-O 3.47Å; N490-N513 PolarHBondContact N-O 3.39Å; N513-R535 PolarHBondContact N-O 2.99Å; N513-K536 WeakPolarHBondContact CA-O 3.36Å; N513-K536 PolarHBondContact N-O 3.44Å; N513-K536 VanDerWaalsContact OD1-CD 3.23Å; N513-K536 WeakPolarHBondContact OD1-CD 3.31Å; N513-K536 VanDerWaalsContact OD1-CE 3.32Å; N513-K536 WeakPolarHBondContact OD1-CE 3.38Å; N513-K536 WeakPolarHBondContact OD1-CG 3.32Å
514	N	95.3	Very high	90.8	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.011	20%	0.198	C	C	.	.	S	Bend	trans	-132.2	-174.6	179.5	-90.5	-87.1	0	0	0	110.8	F487 N490 I492 L511 N512 L516 K536 N537	F487-N514 PolarHBondContact O-ND2 2.98Å; N490-N514 WeakPolarHBondContact CA-OD1 3.31Å; N490-N514 WeakPolarHBondContact CB-OD1 3.49Å; N490-N514 PolarHBondContact O-OD1 2.67Å; N490-N514 VanDerWaalsContact O-OD1 3.13Å; I492-N514 VanDerWaalsContact CB-OD1 3.27Å; I492-N514 WeakPolarHBondContact CB-OD1 3.31Å; I492-N514 VanDerWaalsContact CG1-OD1 3.22Å; I492-N514 WeakPolarHBondContact CG1-OD1 3.39Å; I492-N514 PolarHBondContact N-OD1 3.47Å; L511-N514 WeakPolarHBondContact O-CB 3.41Å; L511-N514 PolarHBondContact O-ND2 3.46Å; N512-N514 PolarHBondContact O-ND2 3.46Å; N512-N514 VanDerWaalsContact O-ND2 3.08Å; N514-L516 HydrophobicContact CB-CG 4.48Å; N514-K536 PolarHBondContact N-O 3.07Å; N514-N537 WeakPolarHBondContact CA-OD1 3.33Å; N514-N537 WeakPolarHBondContact CB-OD1 3.35Å; N514-N537 PolarHBondContact O-OD1 3.15Å
515	L	95.8	Very high	90.6	Very high	52 Å²	52	36.4 Å²	36.4	27%	0.272	19%	0.185	S	C	.	.			trans	-110.5	19.7	-174.1	-56.1	-177.6	0	0	0	113.3	V491 I492 R493 Y538	V491-L515 HydrophobicContact CB-CD1 3.95Å; V491-L515 HydrophobicContact CG1-CD1 4.3Å; I492-L515 CarbonylContact O-C 3.33Å; I492-L515 VanDerWaalsContact O-CA 3.26Å; I492-L515 WeakPolarHBondContact O-CA 3.37Å; I492-L515 WeakPolarHBondContact O-CB 3.42Å; I492-L515 PolarHBondContact O-N 2.88Å; R493-L515 HydrophobicContact CG-CB 3.78Å; R493-L515 HydrophobicContact CG-CD1 4.03Å; L515-Y538 HydrophobicContact CD2-CD2 4.32Å; L515-Y538 HydrophobicContact CD2-CE2 3.69Å
516	L	95.7	Very high	90.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.			trans	-68.6	136.7	-174.8	-61	171.7	0	0	0	111.3	I492 I495 L511 N514 N537 Y538 F539	I492-L516 HydrophobicContact CB-CD2 4.28Å; I492-L516 HydrophobicContact CG2-CD2 3.69Å; I492-L516 PolarHBondContact O-N 3.38Å; I492-L516 VanDerWaalsContact O-N 3.12Å; I495-L516 HydrophobicContact CD1-CD1 4.01Å; I495-L516 HydrophobicContact CD1-CD2 3.96Å; I495-L516 HydrophobicContact CG1-CD2 3.82Å; L511-L516 HydrophobicContact CB-CD1 4.33Å; L511-L516 HydrophobicContact CD1-CD1 4.41Å; N514-L516 HydrophobicContact CB-CG 4.48Å; L516-N537 HydrophobicContact CB-CB 4.26Å; L516-N537 VanDerWaalsContact CB-OD1 3.29Å; L516-N537 WeakPolarHBondContact CB-OD1 3.05Å; L516-N537 WeakPolarHBondContact CG-OD1 3.37Å; L516-N537 PolarHBondContact N-OD1 3.36Å; L516-N537 VanDerWaalsContact N-OD1 3.11Å; L516-Y538 CarbonylContact O-C 3.42Å; L516-Y538 VanDerWaalsContact O-C 3.23Å; L516-Y538 VanDerWaalsContact O-CA 3.25Å; L516-Y538 WeakPolarHBondContact O-CA 3.32Å; L516-Y538 WeakPolarHBondContact O-CB 3.12Å; L516-Y538 PolarHBondContact O-N 3.41Å; L516-F539 HydrophobicContact CB-CE1 3.87Å; L516-F539 HydrophobicContact CB-CE2 4.03Å; L516-F539 HydrophobicContact CB-CZ 3.42Å; L516-F539 VanDerWaalsContact CB-CZ 3.42Å; L516-F539 HydrophobicContact CD1-CE2 4.46Å; L516-F539 HydrophobicContact CD1-CZ 3.9Å; L516-F539 HydrophobicContact CG-CZ 4.3Å; L516-F539 PolarHBondContact O-N 2.99Å
517	R	92.5	Very high	90.1	Very high	175 Å²	175	36.3 Å²	36.3	66%	0.66	20%	0.199	S	C	*	.			trans	-112.6	-31	178.5	-66.3	-176.8	178.1	-162.2	-2.5	114.4	Y538 F539	R517-Y538 WeakPolarHBondContact CA-O 3.31Å; R517-F539 VanDerWaalsContact C-CD1 3.49Å; R517-F539 WeakPolarHBondContact O-CD1 3.46Å
518	T	90.4	Very high	90.2	Very high	73 Å²	73	35.1 Å²	35.1	45%	0.448	20%	0.202	S	C	.	.			trans	-149.2	165.6	178.7	55.3	0	0	0	0	108.8
519	L	92.4	Very high	90.3	Very high	7 Å²	7	34.8 Å²	34.8	4%	0.037	20%	0.201	C	C	.	.			trans	-115.6	140.2	168.7	-63.8	178.8	0	0	0	108.7	I495 F524 L534 F539 L542 V547	I495-L519 HydrophobicContact CD1-CD2 3.94Å; L519-F524 HydrophobicContact CD1-CE2 3.67Å; L519-F524 HydrophobicContact CD1-CZ 3.73Å; L519-L534 HydrophobicContact CD1-CD1 4.39Å; L519-F539 HydrophobicContact CD2-CE1 4.12Å; L519-F539 HydrophobicContact CD2-CZ 4.02Å; L519-F539 HydrophobicContact CG-CE1 3.88Å; L519-F539 HydrophobicContact CG-CZ 4.09Å; L519-L542 HydrophobicContact CB-CD2 4.36Å; L519-L542 HydrophobicContact CD1-CD2 3.88Å; L519-L542 HydrophobicContact CG-CD2 3.87Å; L519-V547 HydrophobicContact CB-CG1 4.01Å; L519-V547 HydrophobicContact CD1-CG1 4.03Å
520	P	90.8	Very high	89.7	Confident	29 Å²	29	36.1 Å²	36.1	19%	0.188	21%	0.212	C	C	.	.			trans	-70.9	155.3	176.1	33.5	-38.3	0	0	0	110.4	I495 P497 A523 V547	I495-P520 WeakPolarHBondContact O-CD 3.25Å; I495-P520 VanDerWaalsContact O-CG 3.24Å; I495-P520 WeakPolarHBondContact O-CG 3.31Å; P497-P520 HydrophobicContact CB-CB 4.4Å; P497-P520 HydrophobicContact CG-CB 3.93Å; P520-A523 HydrophobicContact CG-CB 3.96Å; P520-A523 WeakPolarHBondContact O-CB 3.35Å; P520-A523 PolarHBondContact O-N 3.33Å; P520-V547 WeakPolarHBondContact O-CG2 3.26Å
521	T	84.1	Confident	89.3	Confident	80 Å²	80	38.3 Å²	38.3	49%	0.491	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	144.4	164.1	53.8	0	0	0	0	110.1	A523	T521-A523 PolarHBondContact O-N 3.42Å
522	D	86.2	Confident	89	Confident	69 Å²	69	38.4 Å²	38.4	37%	0.369	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	14	-179.6	-48.2	-50.8	0	0	0	115.3	A498 F524 A525 G546 H550	A498-D522 VanDerWaalsContact CA-O 3.26Å; A498-D522 WeakPolarHBondContact CA-O 3.3Å; A498-D522 PolarHBondContact N-O 2.91Å; D522-F524 VanDerWaalsContact C-N 3.25Å; D522-F524 PolarHBondContact O-N 3.39Å; D522-A525 HydrophobicContact CB-CB 3.78Å; D522-A525 WeakPolarHBondContact O-CB 3.41Å; D522-A525 PolarHBondContact O-N 2.89Å; D522-A525 VanDerWaalsContact O-N 3.08Å; D522-G546 WeakPolarHBondContact CA-O 3.37Å; D522-G546 PolarHBondContact N-O 3.44Å; D522-H550 IonicContact OD1-CE1 3.8Å; D522-H550 PolarHBondContact OD1-CE1 2.89Å
523	A	87.5	Confident	88.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-47	176.7	0	0	0	0	0	113.2	F500 P520 T521 V547	F500-A523 WeakPolarHBondContact CD2-O 3.49Å; P520-A523 HydrophobicContact CG-CB 3.96Å; P520-A523 WeakPolarHBondContact O-CB 3.35Å; P520-A523 PolarHBondContact O-N 3.33Å; T521-A523 PolarHBondContact O-N 3.42Å; A523-V547 HydrophobicContact CB-CG1 4.41Å
524	F	89.1	Confident	89	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	5.5	-177.8	-53.3	-55.3	0	0	0	113.7	F500 L509 L519 D522 G526 T527 L529 L532 V547 H550 L551	F500-F524 AromaticContact CD2-CD1 3.76Å; F500-F524 HydrophobicContact CD2-CD1 3.76Å; F500-F524 AromaticContact CD2-CE1 3.89Å; F500-F524 HydrophobicContact CD2-CE1 3.89Å; F500-F524 HydrophobicContact CE2-CD1 4.23Å; F500-F524 AromaticContact CE2-CE1 3.86Å; F500-F524 HydrophobicContact CE2-CE1 3.86Å; L509-F524 HydrophobicContact CD2-CD1 4.48Å; L509-F524 HydrophobicContact CD2-CE1 3.87Å; L519-F524 HydrophobicContact CD1-CE2 3.67Å; L519-F524 HydrophobicContact CD1-CZ 3.73Å; D522-F524 VanDerWaalsContact C-N 3.25Å; D522-F524 PolarHBondContact O-N 3.39Å; F524-G526 PolarHBondContact O-N 3.5Å; F524-T527 PolarHBondContact O-N 3.29Å; F524-T527 PolarHBondContact O-OG1 3.37Å; F524-L529 HydrophobicContact CD1-CD1 3.58Å; F524-L529 HydrophobicContact CE1-CD1 3.94Å; F524-L529 HydrophobicContact CG-CD1 4.16Å; F524-L532 HydrophobicContact CE1-CD1 4.35Å; F524-L532 HydrophobicContact CE1-CD2 4.39Å; F524-L532 HydrophobicContact CE2-CD2 3.95Å; F524-L532 HydrophobicContact CZ-CD1 4.2Å; F524-L532 HydrophobicContact CZ-CD2 3.72Å; F524-V547 HydrophobicContact CD2-CG1 3.8Å; F524-V547 HydrophobicContact CE2-CG1 3.81Å; F524-H550 HydrophobicContact CB-CB 4.45Å; F524-L551 HydrophobicContact CB-CD2 4.03Å; F524-L551 HydrophobicContact CD2-CD1 4.22Å; F524-L551 HydrophobicContact CD2-CD2 3.77Å; F524-L551 HydrophobicContact CD2-CG 4.14Å; F524-L551 HydrophobicContact CE2-CD1 4.3Å; F524-L551 HydrophobicContact CE2-CD2 4.41Å; F524-L551 HydrophobicContact CG-CD2 3.92Å
525	A	85.9	Confident	88.8	Confident	19 Å²	19	39.7 Å²	39.7	16%	0.157	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	130.6	-177.1	0	0	0	0	0	111.2	S501 D522 T527	S501-A525 WeakPolarHBondContact CA-O 3.49Å; S501-A525 VanDerWaalsContact CB-O 3.28Å; S501-A525 WeakPolarHBondContact CB-O 3.25Å; D522-A525 HydrophobicContact CB-CB 3.78Å; D522-A525 WeakPolarHBondContact O-CB 3.41Å; D522-A525 PolarHBondContact O-N 2.89Å; D522-A525 VanDerWaalsContact O-N 3.08Å; A525-T527 VanDerWaalsContact C-N 3.34Å
526	G	83.1	Confident	88.5	Confident	57 Å²	57	41.9 Å²	41.9	59%	0.588	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.1	1.9	-176.5	0	0	0	0	0	115.8	P504 F524	P504-G526 WeakPolarHBondContact CA-O 3.43Å; F524-G526 PolarHBondContact O-N 3.5Å
527	T	88.7	Confident	88.4	Confident	16 Å²	16	42 Å²	42	10%	0.098	23%	0.23	C	C	.	.			trans	-101.6	161.3	173.7	70.2	0	0	0	0	112.2	F500 F524 A525	F500-T527 HydrophobicContact CB-CG2 3.74Å; F500-T527 VanDerWaalsContact O-CG2 3.26Å; F500-T527 WeakPolarHBondContact O-CG2 3.34Å; F524-T527 PolarHBondContact O-N 3.29Å; F524-T527 PolarHBondContact O-OG1 3.37Å; A525-T527 VanDerWaalsContact C-N 3.34Å
528	S	86.7	Confident	88.6	Confident	68 Å²	68	39.7 Å²	39.7	48%	0.476	22%	0.222	S	C	.	.			trans	-127.2	60.2	179	-161.4	0	0	0	0	110.5	L506 A530 A553	L506-S528 CarbonylContact O-C 3.16Å; S528-A530 PolarHBondContact O-N 3.45Å; S528-A553 WeakPolarHBondContact OG-CB 3.28Å
529	L	89.1	Confident	88.7	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	20%	0.201	C	C	.	.			trans	-65.5	123.9	-176.5	-71.2	174.1	0	0	0	111.6	L506 L509 F524 L551 A553 I554	L506-L529 HydrophobicContact CB-CD2 4.49Å; L506-L529 HydrophobicContact CD2-CD2 3.97Å; L506-L529 HydrophobicContact CG-CD2 3.79Å; L509-L529 HydrophobicContact CB-CD1 4.4Å; L509-L529 HydrophobicContact CB-CD2 3.77Å; L509-L529 HydrophobicContact CD2-CD1 4.17Å; F524-L529 HydrophobicContact CD1-CD1 3.58Å; F524-L529 HydrophobicContact CE1-CD1 3.94Å; F524-L529 HydrophobicContact CG-CD1 4.16Å; L529-L551 HydrophobicContact CB-CD2 4.18Å; L529-L551 HydrophobicContact CD1-CD2 4.04Å; L529-A553 CarbonylContact O-C 3.02Å; L529-I554 WeakPolarHBondContact O-CA 3.32Å; L529-I554 PolarHBondContact O-N 3.18Å
530	A	81.9	Confident	88.6	Confident	28 Å²	28	40 Å²	40	23%	0.231	22%	0.221	C	C	.	.	S	Bend	trans	-98.4	-27.8	172.6	0	0	0	0	0	112.3	K507 S528 V555 Q556	K507-A530 PolarHBondContact O-N 3.5Å; S528-A530 PolarHBondContact O-N 3.45Å; A530-V555 HydrophobicContact CB-CG2 4.22Å; A530-V555 WeakPolarHBondContact O-CA 3.37Å; A530-V555 WeakPolarHBondContact O-CB 3.37Å; A530-V555 PolarHBondContact O-N 3.45Å; A530-Q556 PolarHBondContact O-N 2.82Å; A530-Q556 VanDerWaalsContact O-N 3.12Å
531	R	82.1	Confident	88.6	Confident	78 Å²	78	43.2 Å²	43.2	29%	0.294	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.2	172.1	-59.1	-162.1	-177.5	109.6	0.2	111.7	K507 L508 L509 Q556	K507-R531 PolarHBondContact O-N 3.23Å; L508-R531 WeakPolarHBondContact CA-O 3.5Å; L508-R531 HydrophobicContact CB-CB 4.43Å; L508-R531 HydrophobicContact CD1-CB 4.26Å; L508-R531 HydrophobicContact CG-CB 4.1Å; L509-R531 PolarHBondContact N-O 2.59Å; R531-Q556 VanDerWaalsContact CA-O 3.3Å; R531-Q556 WeakPolarHBondContact CA-O 3.32Å; R531-Q556 HydrophobicContact CG-CB 4.16Å
532	L	90.5	Very high	88.8	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	119.7	177.6	174.6	58	0	0	0	109.7	L509 F524 L534 L551 I554 Q556 I557 D558	L509-L532 HydrophobicContact CB-CD1 4.22Å; L509-L532 HydrophobicContact CD2-CD1 4.11Å; L509-L532 HydrophobicContact CG-CD1 4.12Å; L509-L532 WeakPolarHBondContact O-CA 3.46Å; F524-L532 HydrophobicContact CE1-CD1 4.35Å; F524-L532 HydrophobicContact CE1-CD2 4.39Å; F524-L532 HydrophobicContact CE2-CD2 3.95Å; F524-L532 HydrophobicContact CZ-CD1 4.2Å; F524-L532 HydrophobicContact CZ-CD2 3.72Å; L532-L534 HydrophobicContact CD1-CD2 4.2Å; L532-L534 HydrophobicContact CD1-CG 4.15Å; L532-L534 HydrophobicContact CD2-CD1 4.08Å; L532-L534 HydrophobicContact CD2-CG 4.43Å; L532-L534 HydrophobicContact CG-CD1 4.24Å; L532-L534 HydrophobicContact CG-CG 4.06Å; L532-L551 HydrophobicContact CD2-CD1 3.91Å; L532-I554 HydrophobicContact CB-CD1 3.9Å; L532-Q556 PolarHBondContact N-O 3.25Å; L532-I557 HydrophobicContact CB-CG1 4.22Å; L532-I557 HydrophobicContact CD2-CD1 3.97Å; L532-I557 HydrophobicContact CD2-CG1 4.31Å; L532-I557 HydrophobicContact CG-CD1 4.46Å; L532-I557 HydrophobicContact CG-CG1 4.27Å; L532-I557 VanDerWaalsContact O-CA 3.25Å; L532-I557 WeakPolarHBondContact O-CA 3.43Å; L532-D558 PolarHBondContact O-N 2.89Å
533	N	87.8	Confident	88.9	Confident	22 Å²	22	38.2 Å²	38.2	12%	0.118	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.4	173.8	-161.4	-32.5	0	0	0	111	L509 F510 L511 N512 R535 D558	L509-N533 PolarHBondContact O-N 3.47Å; F510-N533 HydrophobicContact CB-CB 4.43Å; F510-N533 HydrophobicContact CD1-CB 3.57Å; F510-N533 HydrophobicContact CE1-CB 4.03Å; F510-N533 HydrophobicContact CG-CB 4.08Å; L511-N533 CarbonylContact C-O 3.55Å; L511-N533 WeakPolarHBondContact CA-O 3.37Å; L511-N533 WeakPolarHBondContact CB-O 3.35Å; L511-N533 PolarHBondContact N-O 3.47Å; N512-N533 PolarHBondContact N-O 3.46Å; N533-R535 WeakPolarHBondContact OD1-CB 3.1Å; N533-R535 PolarHBondContact OD1-N 2.64Å; N533-D558 HydrophobicContact CB-CB 4.39Å; N533-D558 PolarHBondContact ND2-OD2 2.93Å; N533-D558 WeakPolarHBondContact OD1-CB 3.17Å; N533-D558 PolarHBondContact OD1-OD2 3.48Å
534	L	93.5	Very high	88.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.			trans	-119.5	10.1	177	-65.6	173.6	0	0	0	112.4	L511 L519 L532 N537 F539 L542 D558 L559 N562	L511-L534 HydrophobicContact CB-CD2 4.08Å; L511-L534 HydrophobicContact CD1-CD2 4.09Å; L519-L534 HydrophobicContact CD1-CD1 4.39Å; L532-L534 HydrophobicContact CD1-CD2 4.2Å; L532-L534 HydrophobicContact CD1-CG 4.15Å; L532-L534 HydrophobicContact CD2-CD1 4.08Å; L532-L534 HydrophobicContact CD2-CG 4.43Å; L532-L534 HydrophobicContact CG-CD1 4.24Å; L532-L534 HydrophobicContact CG-CG 4.06Å; L534-N537 PolarHBondContact O-ND2 2.85Å; L534-F539 HydrophobicContact CB-CE2 3.99Å; L534-F539 HydrophobicContact CD1-CE2 4.31Å; L534-F539 HydrophobicContact CD2-CE2 3.95Å; L534-F539 HydrophobicContact CD2-CZ 4.15Å; L534-F539 HydrophobicContact CG-CE2 4.31Å; L534-L542 HydrophobicContact CD1-CD1 4.2Å; L534-D558 CarbonylContact C-O 3.21Å; L534-D558 WeakPolarHBondContact CA-O 3.47Å; L534-D558 WeakPolarHBondContact CB-O 3.41Å; L534-D558 PolarHBondContact N-O 3.46Å; L534-L559 HydrophobicContact CB-CD2 4.38Å; L534-L559 HydrophobicContact CD1-CD2 4.09Å; L534-N562 PolarHBondContact O-ND2 2.81Å
535	R	90.8	Very high	88.5	Confident	57 Å²	57	42.9 Å²	42.9	22%	0.215	24%	0.238	C	C	.	.			trans	-52.9	138.8	-179.1	-177.8	170	168.6	-162.8	-1.8	112.4	Y158 N512 N513 N533 D558 N560 E561	Y158-R535 PolarHBondContact OH-NH1 3.39Å; N512-R535 CarbonylContact C-O 3.6Å; N512-R535 WeakPolarHBondContact CA-O 3.25Å; N512-R535 HydrophobicContact CB-CB 4.1Å; N512-R535 WeakPolarHBondContact CB-O 3.44Å; N513-R535 PolarHBondContact N-O 2.99Å; N533-R535 WeakPolarHBondContact OD1-CB 3.1Å; N533-R535 PolarHBondContact OD1-N 2.64Å; R535-D558 WeakPolarHBondContact CB-OD2 3.35Å; R535-D558 VanDerWaalsContact CD-OD2 3.3Å; R535-D558 WeakPolarHBondContact CD-OD2 3.48Å; R535-D558 PolarHBondContact N-O 3.06Å; R535-N560 CarbonylContact C-O 3.37Å; R535-N560 VanDerWaalsContact CA-O 3.27Å; R535-N560 WeakPolarHBondContact CA-O 3.41Å; R535-N560 HydrophobicContact CG-CB 4.08Å; R535-E561 IonicContact CZ-OE1 2.79Å; R535-E561 IonicContact NE-OE1 3.43Å; R535-E561 PolarHBondContact NE-OE1 2.93Å; R535-E561 IonicContact NH2-OE1 3.8Å; R535-E561 PolarHBondContact NH2-OE1 3.25Å
536	K	88.8	Confident	88.3	Confident	98 Å²	98	42.7 Å²	42.7	43%	0.426	24%	0.237	S	C	.	.	S	Bend	trans	55.4	57.6	174.3	-174.1	151.3	155.2	-173.8	0	111.9	N513 N514 N560 E561	N513-K536 WeakPolarHBondContact CA-O 3.36Å; N513-K536 PolarHBondContact N-O 3.44Å; N513-K536 VanDerWaalsContact OD1-CD 3.23Å; N513-K536 WeakPolarHBondContact OD1-CD 3.31Å; N513-K536 VanDerWaalsContact OD1-CE 3.32Å; N513-K536 WeakPolarHBondContact OD1-CE 3.38Å; N513-K536 WeakPolarHBondContact OD1-CG 3.32Å; N514-K536 PolarHBondContact N-O 3.07Å; K536-N560 PolarHBondContact N-O 3.35Å; K536-E561 HydrophobicContact CB-CB 3.93Å; K536-E561 VanDerWaalsContact CD-OE2 3.26Å; K536-E561 WeakPolarHBondContact CD-OE2 3.33Å; K536-E561 IonicContact NZ-OE2 3.63Å
537	N	95.4	Very high	88.4	Confident	4 Å²	4	40 Å²	40	2%	0.021	21%	0.209	C	C	.	.	S	Bend	trans	-113.5	-162.3	163.4	-83.3	-84.7	0	0	0	108.1	L511 N514 L516 L534 F539 N562 P563	L511-N537 PolarHBondContact O-ND2 2.93Å; N514-N537 WeakPolarHBondContact CA-OD1 3.33Å; N514-N537 WeakPolarHBondContact CB-OD1 3.35Å; N514-N537 PolarHBondContact O-OD1 3.15Å; L516-N537 HydrophobicContact CB-CB 4.26Å; L516-N537 VanDerWaalsContact CB-OD1 3.29Å; L516-N537 WeakPolarHBondContact CB-OD1 3.05Å; L516-N537 WeakPolarHBondContact CG-OD1 3.37Å; L516-N537 PolarHBondContact N-OD1 3.36Å; L516-N537 VanDerWaalsContact N-OD1 3.11Å; L534-N537 PolarHBondContact O-ND2 2.85Å; N537-F539 HydrophobicContact CB-CD2 3.67Å; N537-F539 HydrophobicContact CB-CE2 3.57Å; N537-F539 HydrophobicContact CB-CZ 4.48Å; N537-N562 VanDerWaalsContact CA-OD1 3.24Å; N537-N562 WeakPolarHBondContact CA-OD1 3.24Å; N537-N562 WeakPolarHBondContact CB-OD1 3.18Å; N537-N562 PolarHBondContact N-OD1 3.03Å; N537-N562 PolarHBondContact O-OD1 3.17Å; N537-N562 VanDerWaalsContact O-OD1 3.14Å; N537-P563 WeakPolarHBondContact O-CD 3.17Å
538	Y	95.1	Very high	88.3	Confident	125 Å²	125	39.2 Å²	39.2	49%	0.49	21%	0.205	S	C	.	.			trans	-121.3	32.7	-176.6	-65.6	-100.2	0	0	0	111.3	L515 L516 R517 L540 N562	L515-Y538 HydrophobicContact CD2-CD2 4.32Å; L515-Y538 HydrophobicContact CD2-CE2 3.69Å; L516-Y538 CarbonylContact O-C 3.42Å; L516-Y538 VanDerWaalsContact O-C 3.23Å; L516-Y538 VanDerWaalsContact O-CA 3.25Å; L516-Y538 WeakPolarHBondContact O-CA 3.32Å; L516-Y538 WeakPolarHBondContact O-CB 3.12Å; L516-Y538 PolarHBondContact O-N 3.41Å; R517-Y538 WeakPolarHBondContact CA-O 3.31Å; Y538-L540 PolarHBondContact O-N 3.03Å; Y538-N562 PolarHBondContact N-OD1 2.85Å
539	F	93.6	Very high	88.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.			trans	-66.7	124.3	177.6	-65.9	-65.6	0	0	0	111.4	L516 R517 L519 L534 N537 L542 N562 P563 W564	L516-F539 HydrophobicContact CB-CE1 3.87Å; L516-F539 HydrophobicContact CB-CE2 4.03Å; L516-F539 HydrophobicContact CB-CZ 3.42Å; L516-F539 VanDerWaalsContact CB-CZ 3.42Å; L516-F539 HydrophobicContact CD1-CE2 4.46Å; L516-F539 HydrophobicContact CD1-CZ 3.9Å; L516-F539 HydrophobicContact CG-CZ 4.3Å; L516-F539 PolarHBondContact O-N 2.99Å; R517-F539 VanDerWaalsContact C-CD1 3.49Å; R517-F539 WeakPolarHBondContact O-CD1 3.46Å; L519-F539 HydrophobicContact CD2-CE1 4.12Å; L519-F539 HydrophobicContact CD2-CZ 4.02Å; L519-F539 HydrophobicContact CG-CE1 3.88Å; L519-F539 HydrophobicContact CG-CZ 4.09Å; L534-F539 HydrophobicContact CB-CE2 3.99Å; L534-F539 HydrophobicContact CD1-CE2 4.31Å; L534-F539 HydrophobicContact CD2-CE2 3.95Å; L534-F539 HydrophobicContact CD2-CZ 4.15Å; L534-F539 HydrophobicContact CG-CE2 4.31Å; N537-F539 HydrophobicContact CB-CD2 3.67Å; N537-F539 HydrophobicContact CB-CE2 3.57Å; N537-F539 HydrophobicContact CB-CZ 4.48Å; F539-L542 HydrophobicContact CD1-CD2 3.52Å; F539-L542 HydrophobicContact CD1-CG 4.31Å; F539-L542 HydrophobicContact CE1-CD2 3.69Å; F539-L542 HydrophobicContact CG-CD2 4.1Å; F539-L542 HydrophobicContact CG-CG 4.46Å; F539-L542 HydrophobicContact CZ-CD2 4.37Å; F539-N562 HydrophobicContact CB-CB 4.4Å; F539-N562 VanDerWaalsContact CD2-OD1 3.28Å; F539-N562 WeakPolarHBondContact CD2-OD1 3.5Å; F539-N562 PolarHBondContact N-OD1 2.73Å; F539-P563 CarbonylContact O-C 3.5Å; F539-P563 WeakPolarHBondContact O-CD 3.33Å; F539-W564 HydrophobicContact CB-CE3 4.48Å; F539-W564 HydrophobicContact CB-CH2 3.74Å; F539-W564 HydrophobicContact CB-CZ2 4.32Å; F539-W564 HydrophobicContact CB-CZ3 3.85Å; F539-W564 HydrophobicContact CG-CH2 4.4Å
540	L	90.8	Very high	87.8	Confident	88 Å²	88	44.7 Å²	44.7	46%	0.461	22%	0.223	S	C	.	.	S	Bend	trans	-87.3	-46.2	169.4	-58.3	179.1	0	0	0	110.1	Y538 P563 W564 D565	Y538-L540 PolarHBondContact O-N 3.03Å; L540-P563 HydrophobicContact CD2-CG 4.32Å; L540-P563 WeakPolarHBondContact CD2-O 3.2Å; L540-W564 CarbonylContact O-C 3.6Å; L540-W564 WeakPolarHBondContact O-CA 3.48Å; L540-D565 HydrophobicContact CB-CB 4.16Å; L540-D565 PolarHBondContact O-N 2.78Å
541	Y	89.1	Confident	87.8	Confident	96 Å²	96	43.6 Å²	43.6	38%	0.376	21%	0.213	S	C	.	.			trans	-147	163.4	173.3	66.4	-84	0	0	0	109.4
542	L	89.7	Confident	87.7	Confident	4 Å²	4	47 Å²	47	2%	0.021	24%	0.237	C	C	.	.			trans	-123.1	126.8	170.5	-74.7	177.2	0	0	0	110.1	L519 L534 F539 V544 L548 L559 W564 F573	L519-L542 HydrophobicContact CB-CD2 4.36Å; L519-L542 HydrophobicContact CD1-CD2 3.88Å; L519-L542 HydrophobicContact CG-CD2 3.87Å; L534-L542 HydrophobicContact CD1-CD1 4.2Å; F539-L542 HydrophobicContact CD1-CD2 3.52Å; F539-L542 HydrophobicContact CD1-CG 4.31Å; F539-L542 HydrophobicContact CE1-CD2 3.69Å; F539-L542 HydrophobicContact CG-CD2 4.1Å; F539-L542 HydrophobicContact CG-CG 4.46Å; F539-L542 HydrophobicContact CZ-CD2 4.37Å; L542-V544 PolarHBondContact O-N 2.9Å; L542-L548 HydrophobicContact CB-CD1 3.84Å; L542-L548 HydrophobicContact CD1-CD1 4.5Å; L542-L548 HydrophobicContact CD1-CD2 4.43Å; L542-L559 HydrophobicContact CD1-CD2 4.04Å; L542-W564 HydrophobicContact CB-CZ3 4.47Å; L542-W564 HydrophobicContact CD1-CH2 3.75Å; L542-W564 HydrophobicContact CD1-CZ3 4.32Å; L542-W564 HydrophobicContact CG-CH2 3.85Å; L542-W564 HydrophobicContact CG-CZ3 3.95Å; L542-F573 HydrophobicContact CB-CD2 3.91Å; L542-F573 HydrophobicContact CB-CE2 3.83Å; L542-F573 HydrophobicContact CB-CZ 4.46Å; L542-F573 HydrophobicContact CD1-CE2 3.92Å; L542-F573 HydrophobicContact CD1-CZ 4.23Å; L542-F573 HydrophobicContact CG-CE2 4.35Å
543	P	87.4	Confident	87.3	Confident	39 Å²	39	48.9 Å²	48.9	25%	0.253	25%	0.253	S	S	.	.			trans	-68.1	133.4	176	28.6	-33.9	0	0	0	110.2	V547	P543-V547 HydrophobicContact CG-CB 4.48Å; P543-V547 HydrophobicContact CG-CG2 3.91Å; P543-V547 WeakPolarHBondContact O-CB 3.26Å
544	V	85.7	Confident	87	Confident	28 Å²	28	48.9 Å²	48.9	17%	0.17	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-52.9	177	176	0	0	0	0	111.2	L542 G546 V547 L548 E549 P572 F573 W576	L542-V544 PolarHBondContact O-N 2.9Å; V544-G546 PolarHBondContact O-N 3.21Å; V544-V547 PolarHBondContact O-N 3.4Å; V544-L548 HydrophobicContact CG1-CB 4.48Å; V544-L548 HydrophobicContact CG2-CD1 4.14Å; V544-L548 PolarHBondContact O-N 3.39Å; V544-E549 PolarHBondContact O-N 3.07Å; V544-E549 VanDerWaalsContact O-N 3.08Å; V544-P572 HydrophobicContact CB-CB 4.4Å; V544-P572 HydrophobicContact CG2-CB 4.09Å; V544-P572 WeakPolarHBondContact CG2-O 3.15Å; V544-F573 HydrophobicContact CG2-CB 4.45Å; V544-W576 HydrophobicContact CG1-CB 4.03Å; V544-W576 HydrophobicContact CG1-CG 4.02Å; V544-W576 HydrophobicContact CG2-CB 3.6Å; V544-W576 HydrophobicContact CG2-CG 4.05Å
545	A	83.8	Confident	86.1	Confident	71 Å²	71	53.3 Å²	53.3	59%	0.587	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	127.3	179.3	0	0	0	0	0	110.9	V547	A545-V547 PolarHBondContact O-N 2.91Å; A545-V547 VanDerWaalsContact O-N 3.09Å
546	G	80.3	Confident	85.6	Confident	14 Å²	14	53 Å²	53	14%	0.144	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	-8.4	179.6	0	0	0	0	0	116.4	D522 V544 E549 H550	D522-G546 WeakPolarHBondContact CA-O 3.37Å; D522-G546 PolarHBondContact N-O 3.44Å; V544-G546 PolarHBondContact O-N 3.21Å; G546-E549 PolarHBondContact N-OE2 3.26Å; G546-H550 PolarHBondContact O-CE1 2.9Å; G546-H550 VanDerWaalsContact O-CE1 3.25Å; G546-H550 PolarHBondContact O-ND1 3.5Å
547	V	86.5	Confident	85.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-66.7	177.2	-173.7	0	0	0	0	111.7	L519 P520 A523 F524 P543 V544 A545 H550	L519-V547 HydrophobicContact CB-CG1 4.01Å; L519-V547 HydrophobicContact CD1-CG1 4.03Å; P520-V547 WeakPolarHBondContact O-CG2 3.26Å; A523-V547 HydrophobicContact CB-CG1 4.41Å; F524-V547 HydrophobicContact CD2-CG1 3.8Å; F524-V547 HydrophobicContact CE2-CG1 3.81Å; P543-V547 HydrophobicContact CG-CB 4.48Å; P543-V547 HydrophobicContact CG-CG2 3.91Å; P543-V547 WeakPolarHBondContact O-CB 3.26Å; V544-V547 PolarHBondContact O-N 3.4Å; A545-V547 PolarHBondContact O-N 2.91Å; A545-V547 VanDerWaalsContact O-N 3.09Å; V547-H550 PolarHBondContact O-N 3.25Å
548	L	84.9	Confident	84.9	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-82.6	-23.3	-174.2	-57.1	176.3	0	0	0	112.5	L542 V544 H550 L551 F573 W576	L542-L548 HydrophobicContact CB-CD1 3.84Å; L542-L548 HydrophobicContact CD1-CD1 4.5Å; L542-L548 HydrophobicContact CD1-CD2 4.43Å; V544-L548 HydrophobicContact CG1-CB 4.48Å; V544-L548 HydrophobicContact CG2-CD1 4.14Å; V544-L548 PolarHBondContact O-N 3.39Å; L548-H550 PolarHBondContact O-N 3.04Å; L548-L551 HydrophobicContact CD2-CD1 3.71Å; L548-L551 WeakPolarHBondContact O-CB 3.37Å; L548-L551 PolarHBondContact O-N 3.17Å; L548-L551 VanDerWaalsContact O-N 3.1Å; L548-F573 HydrophobicContact CD1-CD2 3.56Å; L548-F573 HydrophobicContact CD1-CE2 3.78Å; L548-W576 HydrophobicContact CB-CD2 3.92Å; L548-W576 VanDerWaalsContact CB-CE2 3.46Å; L548-W576 HydrophobicContact CB-CE3 4.47Å; L548-W576 HydrophobicContact CB-CG 4.35Å; L548-W576 HydrophobicContact CB-CH2 4.25Å; L548-W576 HydrophobicContact CB-CZ2 3.64Å; L548-W576 HydrophobicContact CD1-CD2 4.05Å; L548-W576 HydrophobicContact CD1-CE3 3.87Å; L548-W576 HydrophobicContact CD1-CH2 4.32Å; L548-W576 HydrophobicContact CD1-CZ2 4.47Å; L548-W576 HydrophobicContact CD1-CZ3 4.03Å; L548-W576 HydrophobicContact CD2-CH2 4.04Å; L548-W576 HydrophobicContact CD2-CZ2 4.17Å; L548-W576 HydrophobicContact CD2-CZ3 4.47Å; L548-W576 HydrophobicContact CG-CH2 4.45Å; L548-W576 HydrophobicContact CG-CZ2 4.32Å; L548-W576 PolarHBondContact O-NE1 2.98Å; L548-W576 VanDerWaalsContact O-NE1 3.13Å
549	E	82.8	Confident	84.7	Confident	119 Å²	119	42.8 Å²	42.8	56%	0.556	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-56.9	-26.1	168.1	-174.4	-179.6	-176.4	0	0	113.1	V544 G546 N552	V544-E549 PolarHBondContact O-N 3.07Å; V544-E549 VanDerWaalsContact O-N 3.08Å; G546-E549 PolarHBondContact N-OE2 3.26Å; E549-N552 PolarHBondContact O-ND2 3.18Å
550	H	82.6	Confident	84.4	Confident	64 Å²	64	43.3 Å²	43.3	30%	0.296	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-76.9	-18.1	177.3	-71.4	118.1	0	0	0	113.7	D522 F524 G546 V547 L548 N552	D522-H550 IonicContact OD1-CE1 3.8Å; D522-H550 PolarHBondContact OD1-CE1 2.89Å; F524-H550 HydrophobicContact CB-CB 4.45Å; G546-H550 PolarHBondContact O-CE1 2.9Å; G546-H550 VanDerWaalsContact O-CE1 3.25Å; G546-H550 PolarHBondContact O-ND1 3.5Å; V547-H550 PolarHBondContact O-N 3.25Å; L548-H550 PolarHBondContact O-N 3.04Å; H550-N552 PolarHBondContact O-N 3.08Å
551	L	82.5	Confident	84.2	Confident	6 Å²	6	44 Å²	44	3%	0.031	24%	0.243	C	C	.	.			trans	-81.8	39.1	-169.8	-62.3	179.1	0	0	0	114.3	F524 L529 L532 L548 A553 I554 I557 W576	F524-L551 HydrophobicContact CB-CD2 4.03Å; F524-L551 HydrophobicContact CD2-CD1 4.22Å; F524-L551 HydrophobicContact CD2-CD2 3.77Å; F524-L551 HydrophobicContact CD2-CG 4.14Å; F524-L551 HydrophobicContact CE2-CD1 4.3Å; F524-L551 HydrophobicContact CE2-CD2 4.41Å; F524-L551 HydrophobicContact CG-CD2 3.92Å; L529-L551 HydrophobicContact CB-CD2 4.18Å; L529-L551 HydrophobicContact CD1-CD2 4.04Å; L532-L551 HydrophobicContact CD2-CD1 3.91Å; L548-L551 HydrophobicContact CD2-CD1 3.71Å; L548-L551 WeakPolarHBondContact O-CB 3.37Å; L548-L551 PolarHBondContact O-N 3.17Å; L548-L551 VanDerWaalsContact O-N 3.1Å; L551-A553 PolarHBondContact O-N 3.19Å; L551-I554 HydrophobicContact CB-CB 4.31Å; L551-I554 HydrophobicContact CB-CG2 4.46Å; L551-I554 WeakPolarHBondContact O-CB 3.35Å; L551-I554 VanDerWaalsContact O-CG2 3.27Å; L551-I554 WeakPolarHBondContact O-CG2 3.37Å; L551-I554 PolarHBondContact O-N 3.24Å; L551-I554 VanDerWaalsContact O-N 3.1Å; L551-I557 HydrophobicContact CD1-CD1 4.49Å; L551-W576 HydrophobicContact CB-CZ2 4.4Å; L551-W576 HydrophobicContact CD1-CH2 4.39Å; L551-W576 HydrophobicContact CD1-CZ2 4.16Å
552	N	79.9	Confident	84.4	Confident	148 Å²	148	40 Å²	40	79%	0.791	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-8.2	-172.9	-64.5	-68.7	0	0	0	115.5	E549 H550	E549-N552 PolarHBondContact O-ND2 3.18Å; H550-N552 PolarHBondContact O-N 3.08Å
553	A	82	Confident	84.6	Confident	43 Å²	43	41.5 Å²	41.5	36%	0.355	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	3.8	177.6	0	0	0	0	0	113.6	S528 L529 L551 V555	S528-A553 WeakPolarHBondContact OG-CB 3.28Å; L529-A553 CarbonylContact O-C 3.02Å; L551-A553 PolarHBondContact O-N 3.19Å; A553-V555 PolarHBondContact O-N 3.48Å
554	I	81.9	Confident	84.9	Confident	21 Å²	21	39.7 Å²	39.7	11%	0.108	23%	0.226	C	C	.	.			trans	-67.2	123	-169.5	-159.7	70.6	0	0	0	111.7	L529 L532 L551 Q556 I557 I580	L529-I554 WeakPolarHBondContact O-CA 3.32Å; L529-I554 PolarHBondContact O-N 3.18Å; L532-I554 HydrophobicContact CB-CD1 3.9Å; L551-I554 HydrophobicContact CB-CB 4.31Å; L551-I554 HydrophobicContact CB-CG2 4.46Å; L551-I554 WeakPolarHBondContact O-CB 3.35Å; L551-I554 VanDerWaalsContact O-CG2 3.27Å; L551-I554 WeakPolarHBondContact O-CG2 3.37Å; L551-I554 PolarHBondContact O-N 3.24Å; L551-I554 VanDerWaalsContact O-N 3.1Å; I554-Q556 WeakPolarHBondContact CD1-O 3.41Å; I554-I557 HydrophobicContact CG1-CB 4.13Å; I554-I580 HydrophobicContact CG2-CD1 3.95Å
555	V	75.1	Confident	85.1	Confident	94 Å²	94	40 Å²	40	57%	0.57	23%	0.227	S	C	*	.	S	Bend	trans	-95.4	-37.8	173.8	-178.5	0	0	0	0	109.8	A530 A553 S584	A530-V555 HydrophobicContact CB-CG2 4.22Å; A530-V555 WeakPolarHBondContact O-CA 3.37Å; A530-V555 WeakPolarHBondContact O-CB 3.37Å; A530-V555 PolarHBondContact O-N 3.45Å; A553-V555 PolarHBondContact O-N 3.48Å; V555-S584 VanDerWaalsContact O-CA 3.29Å; V555-S584 WeakPolarHBondContact O-CA 3.48Å; V555-S584 VanDerWaalsContact O-CB 3.26Å; V555-S584 WeakPolarHBondContact O-CB 3.46Å; V555-S584 PolarHBondContact O-OG 2.88Å
556	Q	79.3	Confident	85.4	Confident	50 Å²	50	36.7 Å²	36.7	23%	0.234	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	125.6	-173.1	-169.2	178.2	1.6	0	0	110.8	A530 R531 L532 I554 S584 V586	A530-Q556 PolarHBondContact O-N 2.82Å; A530-Q556 VanDerWaalsContact O-N 3.12Å; R531-Q556 VanDerWaalsContact CA-O 3.3Å; R531-Q556 WeakPolarHBondContact CA-O 3.32Å; R531-Q556 HydrophobicContact CG-CB 4.16Å; L532-Q556 PolarHBondContact N-O 3.25Å; I554-Q556 WeakPolarHBondContact CD1-O 3.41Å; Q556-S584 CarbonylContact C-O 3.57Å; Q556-S584 WeakPolarHBondContact CA-O 3.36Å; Q556-V586 HydrophobicContact CG-CG2 3.42Å; Q556-V586 VanDerWaalsContact CG-CG2 3.42Å
557	I	86.1	Confident	85.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129.1	171.8	-168.6	174.5	0	0	0	109.5	L532 L551 I554 L559 W576 S584 V585 V586	L532-I557 HydrophobicContact CB-CG1 4.22Å; L532-I557 HydrophobicContact CD2-CD1 3.97Å; L532-I557 HydrophobicContact CD2-CG1 4.31Å; L532-I557 HydrophobicContact CG-CD1 4.46Å; L532-I557 HydrophobicContact CG-CG1 4.27Å; L532-I557 VanDerWaalsContact O-CA 3.25Å; L532-I557 WeakPolarHBondContact O-CA 3.43Å; L551-I557 HydrophobicContact CD1-CD1 4.49Å; I554-I557 HydrophobicContact CG1-CB 4.13Å; I557-L559 HydrophobicContact CD1-CD1 4.36Å; I557-L559 HydrophobicContact CD1-CD2 4.03Å; I557-L559 HydrophobicContact CD1-CG 4.24Å; I557-L559 HydrophobicContact CG1-CD2 4.24Å; I557-L559 HydrophobicContact CG1-CG 4.12Å; I557-L559 HydrophobicContact CG2-CD1 4.43Å; I557-W576 HydrophobicContact CD1-CH2 3.94Å; I557-W576 HydrophobicContact CD1-CZ3 4.48Å; I557-S584 PolarHBondContact N-O 3.24Å; I557-S584 VanDerWaalsContact O-O 3.13Å; I557-V585 HydrophobicContact CG2-CG2 3.96Å; I557-V585 WeakPolarHBondContact O-CA 3.05Å; I557-V586 PolarHBondContact O-N 3.38Å
558	D	83.6	Confident	85.8	Confident	13 Å²	13	40.9 Å²	40.9	7%	0.07	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.5	175.7	-179.1	-2.6	0	0	0	108.9	L532 N533 L534 R535 N560 V586	L532-D558 PolarHBondContact O-N 2.89Å; N533-D558 HydrophobicContact CB-CB 4.39Å; N533-D558 PolarHBondContact ND2-OD2 2.93Å; N533-D558 WeakPolarHBondContact OD1-CB 3.17Å; N533-D558 PolarHBondContact OD1-OD2 3.48Å; L534-D558 CarbonylContact C-O 3.21Å; L534-D558 WeakPolarHBondContact CA-O 3.47Å; L534-D558 WeakPolarHBondContact CB-O 3.41Å; L534-D558 PolarHBondContact N-O 3.46Å; R535-D558 WeakPolarHBondContact CB-OD2 3.35Å; R535-D558 VanDerWaalsContact CD-OD2 3.3Å; R535-D558 WeakPolarHBondContact CD-OD2 3.48Å; R535-D558 PolarHBondContact N-O 3.06Å; D558-N560 WeakPolarHBondContact OD1-CB 3.43Å; D558-N560 VanDerWaalsContact OD1-CG 3.29Å; D558-N560 PolarHBondContact OD1-N 3.26Å; D558-N560 VanDerWaalsContact OD1-N 3.13Å; D558-N560 PolarHBondContact OD1-ND2 2.95Å; D558-V586 HydrophobicContact CB-CB 4.03Å; D558-V586 HydrophobicContact CB-CG2 4.25Å
559	L	90.3	Very high	85.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.254	C	S	.	.			trans	-123.7	7.2	-171.3	-69.8	169.8	0	0	0	112	L534 L542 I557 N562 W564 F573 I577 V585 V589	L534-L559 HydrophobicContact CB-CD2 4.38Å; L534-L559 HydrophobicContact CD1-CD2 4.09Å; L542-L559 HydrophobicContact CD1-CD2 4.04Å; I557-L559 HydrophobicContact CD1-CD1 4.36Å; I557-L559 HydrophobicContact CD1-CD2 4.03Å; I557-L559 HydrophobicContact CD1-CG 4.24Å; I557-L559 HydrophobicContact CG1-CD2 4.24Å; I557-L559 HydrophobicContact CG1-CG 4.12Å; I557-L559 HydrophobicContact CG2-CD1 4.43Å; L559-N562 PolarHBondContact O-ND2 3.17Å; L559-W564 HydrophobicContact CB-CZ2 4.06Å; L559-W564 HydrophobicContact CD2-CH2 4.19Å; L559-W564 HydrophobicContact CD2-CZ2 4.05Å; L559-W564 PolarHBondContact O-NE1 3.34Å; L559-F573 HydrophobicContact CD1-CE2 4.46Å; L559-F573 HydrophobicContact CD1-CZ 4Å; L559-I577 HydrophobicContact CD1-CD1 4.26Å; L559-V585 HydrophobicContact CD1-CG1 4.23Å; L559-V589 HydrophobicContact CB-CG2 4.11Å; L559-V589 HydrophobicContact CD1-CG2 4.24Å
560	N	88.3	Confident	86.1	Confident	10 Å²	10	40.8 Å²	40.8	5%	0.053	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	164.3	-164.7	-61.3	-17.7	0	0	0	112.8	R535 K536 D558 N562 V586 D588	R535-N560 CarbonylContact C-O 3.37Å; R535-N560 VanDerWaalsContact CA-O 3.27Å; R535-N560 WeakPolarHBondContact CA-O 3.41Å; R535-N560 HydrophobicContact CG-CB 4.08Å; K536-N560 PolarHBondContact N-O 3.35Å; D558-N560 WeakPolarHBondContact OD1-CB 3.43Å; D558-N560 VanDerWaalsContact OD1-CG 3.29Å; D558-N560 PolarHBondContact OD1-N 3.26Å; D558-N560 VanDerWaalsContact OD1-N 3.13Å; D558-N560 PolarHBondContact OD1-ND2 2.95Å; N560-N562 PolarHBondContact O-N 3.09Å; N560-N562 PolarHBondContact O-ND2 2.84Å; N560-N562 VanDerWaalsContact O-ND2 3.17Å; N560-V586 VanDerWaalsContact CG-O 3.23Å; N560-V586 PolarHBondContact ND2-O 3.22Å; N560-V586 PolarHBondContact OD1-O 3.29Å; N560-D588 PolarHBondContact OD1-N 2.92Å; N560-D588 PolarHBondContact OD1-O 3.5Å
561	E	87.3	Confident	86.4	Confident	104 Å²	104	38.8 Å²	38.8	49%	0.486	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	25.5	177.7	-63.6	176.1	-111.6	0	0	114.2	R535 K536	R535-E561 IonicContact CZ-OE1 2.79Å; R535-E561 IonicContact NE-OE1 3.43Å; R535-E561 PolarHBondContact NE-OE1 2.93Å; R535-E561 IonicContact NH2-OE1 3.8Å; R535-E561 PolarHBondContact NH2-OE1 3.25Å; K536-E561 HydrophobicContact CB-CB 3.93Å; K536-E561 VanDerWaalsContact CD-OE2 3.26Å; K536-E561 WeakPolarHBondContact CD-OE2 3.33Å; K536-E561 IonicContact NZ-OE2 3.63Å
562	N	93.1	Very high	86.7	Confident	10 Å²	10	41.6 Å²	41.6	5%	0.053	24%	0.238	C	C	.	.			trans	-99.1	145	173.3	-81.2	-76.1	0	0	0	111.3	L534 N537 Y538 F539 L559 N560 W564	L534-N562 PolarHBondContact O-ND2 2.81Å; N537-N562 VanDerWaalsContact CA-OD1 3.24Å; N537-N562 WeakPolarHBondContact CA-OD1 3.24Å; N537-N562 WeakPolarHBondContact CB-OD1 3.18Å; N537-N562 PolarHBondContact N-OD1 3.03Å; N537-N562 PolarHBondContact O-OD1 3.17Å; N537-N562 VanDerWaalsContact O-OD1 3.14Å; Y538-N562 PolarHBondContact N-OD1 2.85Å; F539-N562 HydrophobicContact CB-CB 4.4Å; F539-N562 VanDerWaalsContact CD2-OD1 3.28Å; F539-N562 WeakPolarHBondContact CD2-OD1 3.5Å; F539-N562 PolarHBondContact N-OD1 2.73Å; L559-N562 PolarHBondContact O-ND2 3.17Å; N560-N562 PolarHBondContact O-N 3.09Å; N560-N562 PolarHBondContact O-ND2 2.84Å; N560-N562 VanDerWaalsContact O-ND2 3.17Å; N562-W564 VanDerWaalsContact C-N 3.3Å; N562-W564 HydrophobicContact CB-CD2 4.33Å; N562-W564 HydrophobicContact CB-CZ2 3.76Å; N562-W564 VanDerWaalsContact O-CD1 3.28Å; N562-W564 PolarHBondContact O-N 3.47Å
563	P	93.1	Very high	87.2	Confident	37 Å²	37	34.6 Å²	34.6	24%	0.24	20%	0.201	C	C	.	.			trans	-84.8	60.7	-175.5	36.6	-38.2	0	0	0	112.9	N537 F539 L540 D565 R592	N537-P563 WeakPolarHBondContact O-CD 3.17Å; F539-P563 CarbonylContact O-C 3.5Å; F539-P563 WeakPolarHBondContact O-CD 3.33Å; L540-P563 HydrophobicContact CD2-CG 4.32Å; L540-P563 WeakPolarHBondContact CD2-O 3.2Å; P563-D565 PolarHBondContact O-N 3.05Å; P563-R592 HydrophobicContact CB-CB 4.06Å; P563-R592 HydrophobicContact CB-CG 4.05Å
564	W	93.1	Very high	87.5	Confident	1 Å²	1	33.3 Å²	33.3	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	131.5	-174.1	-59.3	103.2	0	0	0	113.3	F539 L540 L542 L559 N562 L570 F573 V589 R592 S593	F539-W564 HydrophobicContact CB-CE3 4.48Å; F539-W564 HydrophobicContact CB-CH2 3.74Å; F539-W564 HydrophobicContact CB-CZ2 4.32Å; F539-W564 HydrophobicContact CB-CZ3 3.85Å; F539-W564 HydrophobicContact CG-CH2 4.4Å; L540-W564 CarbonylContact O-C 3.6Å; L540-W564 WeakPolarHBondContact O-CA 3.48Å; L542-W564 HydrophobicContact CB-CZ3 4.47Å; L542-W564 HydrophobicContact CD1-CH2 3.75Å; L542-W564 HydrophobicContact CD1-CZ3 4.32Å; L542-W564 HydrophobicContact CG-CH2 3.85Å; L542-W564 HydrophobicContact CG-CZ3 3.95Å; L559-W564 HydrophobicContact CB-CZ2 4.06Å; L559-W564 HydrophobicContact CD2-CH2 4.19Å; L559-W564 HydrophobicContact CD2-CZ2 4.05Å; L559-W564 PolarHBondContact O-NE1 3.34Å; N562-W564 VanDerWaalsContact C-N 3.3Å; N562-W564 HydrophobicContact CB-CD2 4.33Å; N562-W564 HydrophobicContact CB-CZ2 3.76Å; N562-W564 VanDerWaalsContact O-CD1 3.28Å; N562-W564 PolarHBondContact O-N 3.47Å; W564-L570 HydrophobicContact CE3-CD1 4.27Å; W564-F573 HydrophobicContact CD2-CE1 4.22Å; W564-F573 HydrophobicContact CE3-CD1 4.44Å; W564-F573 AromaticContact CE3-CE1 3.72Å; W564-F573 HydrophobicContact CE3-CE1 3.72Å; W564-F573 HydrophobicContact CE3-CZ 4.26Å; W564-F573 AromaticContact CH2-CE1 3.86Å; W564-F573 HydrophobicContact CH2-CE1 3.86Å; W564-F573 HydrophobicContact CH2-CE2 4.45Å; W564-F573 AromaticContact CH2-CZ 3.52Å; W564-F573 HydrophobicContact CH2-CZ 3.52Å; W564-F573 HydrophobicContact CZ2-CE1 4.32Å; W564-F573 HydrophobicContact CZ2-CZ 4.08Å; W564-F573 HydrophobicContact CZ3-CD1 4.33Å; W564-F573 AromaticContact CZ3-CE1 3.52Å; W564-F573 HydrophobicContact CZ3-CE1 3.52Å; W564-F573 AromaticContact CZ3-CZ 3.61Å; W564-F573 HydrophobicContact CZ3-CZ 3.61Å; W564-V589 HydrophobicContact CD2-CG1 4.11Å; W564-V589 HydrophobicContact CG-CG1 4.08Å; W564-R592 PolarHBondContact O-N 3.05Å; W564-S593 PolarHBondContact O-N 2.96Å
565	D	90.9	Very high	87.8	Confident	33 Å²	33	36.9 Å²	36.9	18%	0.176	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	108.6	172.6	-175.9	54.6	0	0	0	109.6	L540 P563 T567 S593	L540-D565 HydrophobicContact CB-CB 4.16Å; L540-D565 PolarHBondContact O-N 2.78Å; P563-D565 PolarHBondContact O-N 3.05Å; D565-T567 VanDerWaalsContact C-N 3.28Å; D565-T567 PolarHBondContact O-N 2.91Å; D565-T567 VanDerWaalsContact O-N 3.15Å; D565-T567 WeakPolarHBondContact OD2-CG2 3.42Å; D565-T567 PolarHBondContact OD2-OG1 3.04Å; D565-S593 WeakPolarHBondContact OD1-CB 3.4Å; D565-S593 PolarHBondContact OD1-OG 3.2Å
566	C	90.3	Very high	88.4	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.014	18%	0.181	C	C	.	.			trans	-92.7	64.3	-173.5	-65	0	0	0	0	110.6	L570 C591 S593 P594 L597 L610	C566-L570 HydrophobicContact CB-CD2 4.24Å; C566-L570 VanDerWaalsContact SG-CD2 3.56Å; C566-C591 HydrophobicContact CB-CB 3.83Å; C566-C591 WeakPolarHBondContact CB-SG 3.32Å; C566-C591 VanDerWaalsContact SG-CA 3.54Å; C566-C591 WeakPolarHBondContact SG-CB 3.28Å; C566-C591 CovalentContact SG-SG 2.02Å; C566-C591 PolarHBondContact SG-SG 2.82Å; C566-S593 WeakPolarHBondContact CB-O 3.3Å; C566-S593 PolarHBondContact N-O 3.49Å; C566-P594 WeakPolarHBondContact O-CD 3.43Å; C566-L597 HydrophobicContact CB-CB 4.5Å; C566-L597 HydrophobicContact CB-CD1 4.11Å; C566-L597 WeakPolarHBondContact O-CD1 3.47Å; C566-L610 HydrophobicContact CB-CD2 3.92Å
567	T	88.5	Confident	88.8	Confident	46 Å²	46	31.3 Å²	31.3	28%	0.282	17%	0.17	S	C	.	.	S	Bend	trans	-108.6	-178.1	172.5	54.5	0	0	0	0	110.1	D565 D569 L570	D565-T567 VanDerWaalsContact C-N 3.28Å; D565-T567 PolarHBondContact O-N 2.91Å; D565-T567 VanDerWaalsContact O-N 3.15Å; D565-T567 WeakPolarHBondContact OD2-CG2 3.42Å; D565-T567 PolarHBondContact OD2-OG1 3.04Å; T567-D569 PolarHBondContact O-N 3.1Å; T567-L570 WeakPolarHBondContact O-CB 3.42Å; T567-L570 PolarHBondContact O-N 3.06Å
568	C	86.8	Confident	88.6	Confident	57 Å²	57	34.5 Å²	34.5	39%	0.385	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-59.2	-29.6	-176.6	-168.1	0	0	0	0	113.4	L570 V571 L610 C611	C568-L570 PolarHBondContact O-N 3.03Å; C568-L570 VanDerWaalsContact O-N 3.12Å; C568-V571 VanDerWaalsContact O-CB 3.29Å; C568-V571 WeakPolarHBondContact O-CB 3.43Å; C568-V571 VanDerWaalsContact O-CG2 3.26Å; C568-V571 WeakPolarHBondContact O-CG2 3.31Å; C568-V571 PolarHBondContact O-N 2.82Å; C568-L610 PolarHBondContact N-O 2.59Å; C568-C611 HydrophobicContact CB-CB 3.61Å; C568-C611 WeakPolarHBondContact CB-SG 3.47Å; C568-C611 WeakPolarHBondContact SG-CB 3.25Å; C568-C611 CovalentContact SG-SG 2.04Å; C568-C611 PolarHBondContact SG-SG 3.2Å
569	D	85.1	Confident	88.6	Confident	117 Å²	117	38.7 Å²	38.7	63%	0.626	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-62.1	-19.7	177.2	-69.9	-33.7	0	0	0	113.4	T567	T567-D569 PolarHBondContact O-N 3.1Å
570	L	89	Confident	88	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-83.2	-8.8	177.8	-153.5	69.8	0	0	0	113.5	W564 C566 T567 C568 F573 K574 V602	W564-L570 HydrophobicContact CE3-CD1 4.27Å; C566-L570 HydrophobicContact CB-CD2 4.24Å; C566-L570 VanDerWaalsContact SG-CD2 3.56Å; T567-L570 WeakPolarHBondContact O-CB 3.42Å; T567-L570 PolarHBondContact O-N 3.06Å; C568-L570 PolarHBondContact O-N 3.03Å; C568-L570 VanDerWaalsContact O-N 3.12Å; L570-F573 HydrophobicContact CD1-CB 4.16Å; L570-F573 HydrophobicContact CD1-CD1 3.53Å; L570-F573 HydrophobicContact CD1-CE1 4.29Å; L570-F573 HydrophobicContact CD1-CG 4.22Å; L570-F573 HydrophobicContact CG-CB 4.4Å; L570-F573 HydrophobicContact CG-CD1 3.94Å; L570-F573 WeakPolarHBondContact O-CB 3.48Å; L570-F573 PolarHBondContact O-N 3.09Å; L570-F573 VanDerWaalsContact O-N 3.13Å; L570-K574 PolarHBondContact O-N 3.17Å; L570-V602 HydrophobicContact CD2-CB 4.43Å; L570-V602 HydrophobicContact CD2-CG1 3.92Å; L570-V602 HydrophobicContact CD2-CG2 3.56Å; L570-V602 HydrophobicContact CG-CG1 4.46Å
571	V	88.8	Confident	86.7	Confident	23 Å²	23	41.1 Å²	41.1	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-55.1	-47	-177	164.3	0	0	0	0	113.7	C568 F573 K574 Q575 L607 L610 C611	C568-V571 VanDerWaalsContact O-CB 3.29Å; C568-V571 WeakPolarHBondContact O-CB 3.43Å; C568-V571 VanDerWaalsContact O-CG2 3.26Å; C568-V571 WeakPolarHBondContact O-CG2 3.31Å; C568-V571 PolarHBondContact O-N 2.82Å; V571-F573 VanDerWaalsContact C-N 3.32Å; V571-F573 PolarHBondContact O-N 3.33Å; V571-K574 WeakPolarHBondContact O-CB 3.29Å; V571-K574 PolarHBondContact O-N 3.39Å; V571-Q575 WeakPolarHBondContact O-CG 3.11Å; V571-Q575 PolarHBondContact O-N 2.94Å; V571-Q575 VanDerWaalsContact O-N 3.15Å; V571-L607 HydrophobicContact CB-CD1 4.24Å; V571-L607 HydrophobicContact CG1-CD1 3.67Å; V571-L607 HydrophobicContact CG2-CD1 3.65Å; V571-L610 HydrophobicContact CG2-CB 4.33Å; V571-C611 HydrophobicContact CG2-CB 4.34Å
572	P	88.4	Confident	85.2	Confident	64 Å²	64	36.6 Å²	36.6	42%	0.416	21%	0.206	S	C	.	.	H	α-helix	trans	-63.3	-39.5	177.7	-22.1	34.4	0	0	0	112.1	V544 Q575 W576	V544-P572 HydrophobicContact CB-CB 4.4Å; V544-P572 HydrophobicContact CG2-CB 4.09Å; V544-P572 WeakPolarHBondContact CG2-O 3.15Å; P572-Q575 PolarHBondContact O-N 3.47Å; P572-W576 WeakPolarHBondContact O-CB 3.34Å; P572-W576 PolarHBondContact O-N 3.34Å
573	F	89.6	Confident	83.1	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.009	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-41.2	-179.8	178.7	-118.5	0	0	0	112.1	L542 V544 L548 L559 W564 L570 V571 W576 I577 V589	L542-F573 HydrophobicContact CB-CD2 3.91Å; L542-F573 HydrophobicContact CB-CE2 3.83Å; L542-F573 HydrophobicContact CB-CZ 4.46Å; L542-F573 HydrophobicContact CD1-CE2 3.92Å; L542-F573 HydrophobicContact CD1-CZ 4.23Å; L542-F573 HydrophobicContact CG-CE2 4.35Å; V544-F573 HydrophobicContact CG2-CB 4.45Å; L548-F573 HydrophobicContact CD1-CD2 3.56Å; L548-F573 HydrophobicContact CD1-CE2 3.78Å; L559-F573 HydrophobicContact CD1-CE2 4.46Å; L559-F573 HydrophobicContact CD1-CZ 4Å; W564-F573 HydrophobicContact CD2-CE1 4.22Å; W564-F573 HydrophobicContact CE3-CD1 4.44Å; W564-F573 AromaticContact CE3-CE1 3.72Å; W564-F573 HydrophobicContact CE3-CE1 3.72Å; W564-F573 HydrophobicContact CE3-CZ 4.26Å; W564-F573 AromaticContact CH2-CE1 3.86Å; W564-F573 HydrophobicContact CH2-CE1 3.86Å; W564-F573 HydrophobicContact CH2-CE2 4.45Å; W564-F573 AromaticContact CH2-CZ 3.52Å; W564-F573 HydrophobicContact CH2-CZ 3.52Å; W564-F573 HydrophobicContact CZ2-CE1 4.32Å; W564-F573 HydrophobicContact CZ2-CZ 4.08Å; W564-F573 HydrophobicContact CZ3-CD1 4.33Å; W564-F573 AromaticContact CZ3-CE1 3.52Å; W564-F573 HydrophobicContact CZ3-CE1 3.52Å; W564-F573 AromaticContact CZ3-CZ 3.61Å; W564-F573 HydrophobicContact CZ3-CZ 3.61Å; L570-F573 HydrophobicContact CD1-CB 4.16Å; L570-F573 HydrophobicContact CD1-CD1 3.53Å; L570-F573 HydrophobicContact CD1-CE1 4.29Å; L570-F573 HydrophobicContact CD1-CG 4.22Å; L570-F573 HydrophobicContact CG-CB 4.4Å; L570-F573 HydrophobicContact CG-CD1 3.94Å; L570-F573 WeakPolarHBondContact O-CB 3.48Å; L570-F573 PolarHBondContact O-N 3.09Å; L570-F573 VanDerWaalsContact O-N 3.13Å; V571-F573 VanDerWaalsContact C-N 3.32Å; V571-F573 PolarHBondContact O-N 3.33Å; F573-W576 HydrophobicContact CD2-CE3 4.32Å; F573-W576 HydrophobicContact CE2-CE3 4.32Å; F573-W576 HydrophobicContact CE2-CZ3 4.32Å; F573-W576 PolarHBondContact O-N 2.97Å; F573-I577 HydrophobicContact CD1-CD1 4.05Å; F573-I577 HydrophobicContact CD2-CD1 4.47Å; F573-I577 HydrophobicContact CE1-CD1 3.61Å; F573-I577 HydrophobicContact CE2-CD1 4.04Å; F573-I577 HydrophobicContact CE2-CG1 4.34Å; F573-I577 HydrophobicContact CG-CD1 4.5Å; F573-I577 HydrophobicContact CZ-CD1 3.62Å; F573-I577 HydrophobicContact CZ-CG1 4.4Å; F573-I577 WeakPolarHBondContact O-CG1 3.43Å; F573-I577 PolarHBondContact O-N 3.18Å; F573-V589 HydrophobicContact CE1-CG1 4.11Å
574	K	88	Confident	82.1	Confident	16 Å²	16	36 Å²	36	7%	0.07	20%	0.203	C	C	.	.	H	α-helix	trans	-57.1	-52.9	171.5	-178.9	-176.5	-165.2	-64.4	0	111.7	L570 V571 W576 I577 E578 V602 I605 L610	L570-K574 PolarHBondContact O-N 3.17Å; V571-K574 WeakPolarHBondContact O-CB 3.29Å; V571-K574 PolarHBondContact O-N 3.39Å; K574-W576 VanDerWaalsContact C-N 3.25Å; K574-W576 PolarHBondContact O-N 3.05Å; K574-I577 PolarHBondContact O-N 3.36Å; K574-I577 VanDerWaalsContact O-N 3.12Å; K574-E578 WeakPolarHBondContact CG-OE1 3.4Å; K574-E578 IonicContact NZ-OE1 3.58Å; K574-E578 PolarHBondContact NZ-OE1 3.48Å; K574-E578 IonicContact NZ-OE2 3.58Å; K574-E578 WeakPolarHBondContact O-CG 3.33Å; K574-E578 PolarHBondContact O-N 2.89Å; K574-V602 HydrophobicContact CB-CG1 3.81Å; K574-V602 WeakPolarHBondContact CE-O 2.96Å; K574-V602 HydrophobicContact CG-CG1 4.04Å; K574-I605 WeakPolarHBondContact CE-O 3.47Å; K574-I605 PolarHBondContact NZ-O 3.08Å; K574-L610 HydrophobicContact CD-CD1 3.45Å; K574-L610 VanDerWaalsContact CD-CD1 3.45Å
575	Q	88.1	Confident	81.4	Confident	96 Å²	96	36.2 Å²	36.2	45%	0.449	20%	0.204	S	C	.	.	H	α-helix	trans	-59	-35.7	178.3	-69.1	173.4	-8.9	0	0	112.4	V571 P572 E578 T579	V571-Q575 WeakPolarHBondContact O-CG 3.11Å; V571-Q575 PolarHBondContact O-N 2.94Å; V571-Q575 VanDerWaalsContact O-N 3.15Å; P572-Q575 PolarHBondContact O-N 3.47Å; Q575-E578 PolarHBondContact O-N 2.95Å; Q575-T579 WeakPolarHBondContact O-CB 3.35Å; Q575-T579 PolarHBondContact O-N 3.5Å; Q575-T579 PolarHBondContact O-OG1 3.23Å
576	W	88.5	Confident	80.7	Confident	23 Å²	23	35.5 Å²	35.5	9%	0.087	20%	0.201	C	C	.	.	H	α-helix	trans	-70.6	-40.8	175.6	178	89.7	0	0	0	112.8	V544 L548 L551 I557 P572 F573 K574 E578 T579 I580	V544-W576 HydrophobicContact CG1-CB 4.03Å; V544-W576 HydrophobicContact CG1-CG 4.02Å; V544-W576 HydrophobicContact CG2-CB 3.6Å; V544-W576 HydrophobicContact CG2-CG 4.05Å; L548-W576 HydrophobicContact CB-CD2 3.92Å; L548-W576 VanDerWaalsContact CB-CE2 3.46Å; L548-W576 HydrophobicContact CB-CE3 4.47Å; L548-W576 HydrophobicContact CB-CG 4.35Å; L548-W576 HydrophobicContact CB-CH2 4.25Å; L548-W576 HydrophobicContact CB-CZ2 3.64Å; L548-W576 HydrophobicContact CD1-CD2 4.05Å; L548-W576 HydrophobicContact CD1-CE3 3.87Å; L548-W576 HydrophobicContact CD1-CH2 4.32Å; L548-W576 HydrophobicContact CD1-CZ2 4.47Å; L548-W576 HydrophobicContact CD1-CZ3 4.03Å; L548-W576 HydrophobicContact CD2-CH2 4.04Å; L548-W576 HydrophobicContact CD2-CZ2 4.17Å; L548-W576 HydrophobicContact CD2-CZ3 4.47Å; L548-W576 HydrophobicContact CG-CH2 4.45Å; L548-W576 HydrophobicContact CG-CZ2 4.32Å; L548-W576 PolarHBondContact O-NE1 2.98Å; L548-W576 VanDerWaalsContact O-NE1 3.13Å; L551-W576 HydrophobicContact CB-CZ2 4.4Å; L551-W576 HydrophobicContact CD1-CH2 4.39Å; L551-W576 HydrophobicContact CD1-CZ2 4.16Å; I557-W576 HydrophobicContact CD1-CH2 3.94Å; I557-W576 HydrophobicContact CD1-CZ3 4.48Å; P572-W576 WeakPolarHBondContact O-CB 3.34Å; P572-W576 PolarHBondContact O-N 3.34Å; F573-W576 HydrophobicContact CD2-CE3 4.32Å; F573-W576 HydrophobicContact CE2-CE3 4.32Å; F573-W576 HydrophobicContact CE2-CZ3 4.32Å; F573-W576 PolarHBondContact O-N 2.97Å; K574-W576 VanDerWaalsContact C-N 3.25Å; K574-W576 PolarHBondContact O-N 3.05Å; W576-E578 VanDerWaalsContact C-N 3.29Å; W576-E578 PolarHBondContact O-N 3.28Å; W576-T579 WeakPolarHBondContact O-CB 3.49Å; W576-T579 PolarHBondContact O-N 2.98Å; W576-I580 HydrophobicContact CD2-CD1 3.94Å; W576-I580 HydrophobicContact CE3-CD1 4.35Å; W576-I580 HydrophobicContact CH2-CD1 3.67Å; W576-I580 HydrophobicContact CZ2-CD1 3.15Å; W576-I580 HydrophobicContact CZ3-CD1 4.23Å; W576-I580 PolarHBondContact O-N 2.95Å
577	I	87.3	Confident	79.7	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-38.6	172.4	-74.2	178.2	0	0	0	111.2	L559 F573 K574 I580 V585 V589 R603	L559-I577 HydrophobicContact CD1-CD1 4.26Å; F573-I577 HydrophobicContact CD1-CD1 4.05Å; F573-I577 HydrophobicContact CD2-CD1 4.47Å; F573-I577 HydrophobicContact CE1-CD1 3.61Å; F573-I577 HydrophobicContact CE2-CD1 4.04Å; F573-I577 HydrophobicContact CE2-CG1 4.34Å; F573-I577 HydrophobicContact CG-CD1 4.5Å; F573-I577 HydrophobicContact CZ-CD1 3.62Å; F573-I577 HydrophobicContact CZ-CG1 4.4Å; F573-I577 WeakPolarHBondContact O-CG1 3.43Å; F573-I577 PolarHBondContact O-N 3.18Å; K574-I577 PolarHBondContact O-N 3.36Å; K574-I577 VanDerWaalsContact O-N 3.12Å; I577-I580 VanDerWaalsContact O-O 3.1Å; I577-V585 HydrophobicContact CG2-CG2 4.35Å; I577-V589 HydrophobicContact CD1-CG1 4.2Å; I577-V589 HydrophobicContact CD1-CG2 4.18Å; I577-R603 HydrophobicContact CG2-CG 3.5Å; I577-R603 VanDerWaalsContact CG2-CG 3.5Å
578	E	83.4	Confident	79.3	Confident	66 Å²	66	34 Å²	34	31%	0.308	19%	0.192	S	C	.	.	H	α-helix	trans	-73.5	-30.9	177.6	-69.4	163.3	168.1	0	0	112.8	K53 K574 Q575 W576	K53-E578 PolarHBondContact NZ-O 3.32Å; K574-E578 WeakPolarHBondContact CG-OE1 3.4Å; K574-E578 IonicContact NZ-OE1 3.58Å; K574-E578 PolarHBondContact NZ-OE1 3.48Å; K574-E578 IonicContact NZ-OE2 3.58Å; K574-E578 WeakPolarHBondContact O-CG 3.33Å; K574-E578 PolarHBondContact O-N 2.89Å; Q575-E578 PolarHBondContact O-N 2.95Å; W576-E578 VanDerWaalsContact C-N 3.29Å; W576-E578 PolarHBondContact O-N 3.28Å
579	T	83	Confident	79.3	Confident	102 Å²	102	31.3 Å²	31.3	63%	0.626	17%	0.174	S	C	*	.	H	α-helix	trans	-66.4	-47.1	173.5	-62.5	0	0	0	0	110.6	K53 Q575 W576	K53-T579 PolarHBondContact NZ-O 3.09Å; K53-T579 VanDerWaalsContact NZ-O 3.17Å; Q575-T579 WeakPolarHBondContact O-CB 3.35Å; Q575-T579 PolarHBondContact O-N 3.5Å; Q575-T579 PolarHBondContact O-OG1 3.23Å; W576-T579 WeakPolarHBondContact O-CB 3.49Å; W576-T579 PolarHBondContact O-N 2.98Å
580	I	76.9	Confident	79.5	Confident	29 Å²	29	28.4 Å²	28.4	15%	0.149	16%	0.158	C	C	.	.	S	Bend	trans	-70.8	157.2	176.7	-71.1	-178.4	0	0	0	110.8	I554 W576 I577	I554-I580 HydrophobicContact CG2-CD1 3.95Å; W576-I580 HydrophobicContact CD2-CD1 3.94Å; W576-I580 HydrophobicContact CE3-CD1 4.35Å; W576-I580 HydrophobicContact CH2-CD1 3.67Å; W576-I580 HydrophobicContact CZ2-CD1 3.15Å; W576-I580 HydrophobicContact CZ3-CD1 4.23Å; W576-I580 PolarHBondContact O-N 2.95Å; I577-I580 VanDerWaalsContact O-O 3.1Å
581	S	60.8	Low	79.6	Confident	31 Å²	31	28.5 Å²	28.5	22%	0.217	16%	0.158	C	C	.	.			trans	-72.8	135.8	176.9	82.9	0	0	0	0	110.8	V583 S584	S581-V583 PolarHBondContact O-N 3.38Å; S581-V583 VanDerWaalsContact O-N 3.12Å; S581-S584 WeakPolarHBondContact O-CA 3.29Å; S581-S584 VanDerWaalsContact O-CB 3.26Å; S581-S584 WeakPolarHBondContact O-CB 3.37Å; S581-S584 PolarHBondContact O-N 2.94Å; S581-S584 PolarHBondContact OG-OG 3.49Å; S581-S584 VanDerWaalsContact OG-OG 3.11Å
582	S	57.2	Low	79.7	Confident	9 Å²	9	34.5 Å²	34.5	6%	0.063	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-13.8	174.9	53	0	0	0	0	113.6	H60 Y83 S584	H60-S582 PolarHBondContact CE1-OG 2.94Å; H60-S582 PolarHBondContact ND1-OG 3.49Å; Y83-S582 VanDerWaalsContact CD1-OG 3.32Å; Y83-S582 WeakPolarHBondContact CD1-OG 3.31Å; Y83-S582 WeakPolarHBondContact CE1-OG 3.17Å; Y83-S582 WeakPolarHBondContact CE2-OG 3.36Å; S582-S584 PolarHBondContact O-N 3.46Å
583	V	48.9	Very low	79.6	Confident	26 Å²	26	33.8 Å²	33.8	16%	0.158	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-34.8	164.8	-168.3	0	0	0	0	111.5	K81 Y83 Y131 S581	K81-V583 HydrophobicContact CD-CG2 3.89Å; Y83-V583 HydrophobicContact CE1-CB 4.47Å; Y83-V583 HydrophobicContact CE1-CG2 3.55Å; Y83-V583 WeakPolarHBondContact OH-CG2 3.33Å; Y131-V583 HydrophobicContact CE1-CG1 4.49Å; Y131-V583 HydrophobicContact CE2-CG1 4.24Å; Y131-V583 WeakPolarHBondContact OH-CG1 3.28Å; S581-V583 PolarHBondContact O-N 3.38Å; S581-V583 VanDerWaalsContact O-N 3.12Å
584	S	70.6	Confident	79.4	Confident	10 Å²	10	35.8 Å²	35.8	7%	0.07	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-33	-174.4	-59	0	0	0	0	112.1	V555 Q556 I557 S581 S582 V586	V555-S584 VanDerWaalsContact O-CA 3.29Å; V555-S584 WeakPolarHBondContact O-CA 3.48Å; V555-S584 VanDerWaalsContact O-CB 3.26Å; V555-S584 WeakPolarHBondContact O-CB 3.46Å; V555-S584 PolarHBondContact O-OG 2.88Å; Q556-S584 CarbonylContact C-O 3.57Å; Q556-S584 WeakPolarHBondContact CA-O 3.36Å; I557-S584 PolarHBondContact N-O 3.24Å; I557-S584 VanDerWaalsContact O-O 3.13Å; S581-S584 WeakPolarHBondContact O-CA 3.29Å; S581-S584 VanDerWaalsContact O-CB 3.26Å; S581-S584 WeakPolarHBondContact O-CB 3.37Å; S581-S584 PolarHBondContact O-N 2.94Å; S581-S584 PolarHBondContact OG-OG 3.49Å; S581-S584 VanDerWaalsContact OG-OG 3.11Å; S582-S584 PolarHBondContact O-N 3.46Å; S584-V586 PolarHBondContact O-N 2.83Å
585	V	79.3	Confident	79.2	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.024	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	105.9	174.9	-177.4	0	0	0	0	109.1	I557 L559 I577 G587 V589	I557-V585 HydrophobicContact CG2-CG2 3.96Å; I557-V585 WeakPolarHBondContact O-CA 3.05Å; L559-V585 HydrophobicContact CD1-CG1 4.23Å; I577-V585 HydrophobicContact CG2-CG2 4.35Å; V585-G587 PolarHBondContact O-N 3.25Å; V585-V589 HydrophobicContact CG1-CG2 3.86Å
586	V	75.9	Confident	79	Confident	19 Å²	19	45.7 Å²	45.7	12%	0.115	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	113.4	176.9	-175.7	0	0	0	0	108.5	Q556 I557 D558 N560 S584	Q556-V586 HydrophobicContact CG-CG2 3.42Å; Q556-V586 VanDerWaalsContact CG-CG2 3.42Å; I557-V586 PolarHBondContact O-N 3.38Å; D558-V586 HydrophobicContact CB-CB 4.03Å; D558-V586 HydrophobicContact CB-CG2 4.25Å; N560-V586 VanDerWaalsContact CG-O 3.23Å; N560-V586 PolarHBondContact ND2-O 3.22Å; N560-V586 PolarHBondContact OD1-O 3.29Å; S584-V586 PolarHBondContact O-N 2.83Å
587	G	70.1	Confident	78.8	Confident	3 Å²	3	45.4 Å²	45.4	3%	0.031	24%	0.24	C	C	.	.	S	Bend	trans	71.4	-126.4	173.9	0	0	0	0	0	115.4	V585 R603	V585-G587 PolarHBondContact O-N 3.25Å; G587-R603 PolarHBondContact O-NH1 2.99Å; G587-R603 PolarHBondContact O-NH2 2.88Å
588	D	78.7	Confident	78.7	Confident	14 Å²	14	47.6 Å²	47.6	8%	0.075	25%	0.254	C	S	.	.			trans	-133.8	107.6	-139.1	-62.7	-173.1	0	0	0	112.7	R86 N110 N560 L590	R86-D588 VanDerWaalsContact CD-OD1 3.22Å; R86-D588 WeakPolarHBondContact CD-OD1 3.27Å; R86-D588 IonicContact CZ-OD1 3.68Å; R86-D588 IonicContact CZ-OD2 3.44Å; R86-D588 IonicContact NE-OD1 2.78Å; R86-D588 PolarHBondContact NE-OD1 3.47Å; R86-D588 IonicContact NE-OD2 3.31Å; R86-D588 PolarHBondContact NE-OD2 2.81Å; R86-D588 VanDerWaalsContact NH2-CG 3.26Å; R86-D588 IonicContact NH2-OD2 3.58Å; R86-D588 PolarHBondContact NH2-OD2 3.48Å; N110-D588 PolarHBondContact ND2-OD1 3.15Å; N560-D588 PolarHBondContact OD1-N 2.92Å; N560-D588 PolarHBondContact OD1-O 3.5Å; D588-L590 HydrophobicContact CB-CD2 4.23Å; D588-L590 HydrophobicContact CB-CG 4.09Å; D588-L590 PolarHBondContact O-N 3.14Å
589	V	87.4	Confident	78.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.			trans	-95.2	76.3	-177.4	-172.1	0	0	0	0	108.2	L559 W564 F573 I577 V585 D601 V602	L559-V589 HydrophobicContact CB-CG2 4.11Å; L559-V589 HydrophobicContact CD1-CG2 4.24Å; W564-V589 HydrophobicContact CD2-CG1 4.11Å; W564-V589 HydrophobicContact CG-CG1 4.08Å; F573-V589 HydrophobicContact CE1-CG1 4.11Å; I577-V589 HydrophobicContact CD1-CG1 4.2Å; I577-V589 HydrophobicContact CD1-CG2 4.18Å; V585-V589 HydrophobicContact CG1-CG2 3.86Å; V589-D601 PolarHBondContact N-OD2 2.87Å; V589-D601 VanDerWaalsContact N-OD2 3.13Å; V589-D601 WeakPolarHBondContact O-CA 3.15Å; V589-V602 HydrophobicContact CB-CB 4.47Å; V589-V602 HydrophobicContact CB-CG2 4.42Å; V589-V602 HydrophobicContact CG1-CB 4.06Å; V589-V602 HydrophobicContact CG1-CG2 3.67Å; V589-V602 WeakPolarHBondContact O-CG2 3.26Å; V589-V602 PolarHBondContact O-N 3.12Å
590	L	88.9	Confident	78.8	Confident	55 Å²	55	52.5 Å²	52.5	29%	0.288	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-87.1	126.7	-171	-57	-177.4	0	0	0	113	D588 R600 D601	D588-L590 HydrophobicContact CB-CD2 4.23Å; D588-L590 HydrophobicContact CB-CG 4.09Å; D588-L590 PolarHBondContact O-N 3.14Å; L590-R600 CarbonylContact C-O 3.56Å; L590-R600 WeakPolarHBondContact CA-O 3.25Å; L590-D601 HydrophobicContact CD2-CB 4.33Å
591	C	91.1	Very high	79.3	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.014	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	137.8	172.3	-62	0	0	0	0	111.9	C566 L597 T598 H599 R600 I605	C566-C591 HydrophobicContact CB-CB 3.83Å; C566-C591 WeakPolarHBondContact CB-SG 3.32Å; C566-C591 VanDerWaalsContact SG-CA 3.54Å; C566-C591 WeakPolarHBondContact SG-CB 3.28Å; C566-C591 CovalentContact SG-SG 2.02Å; C566-C591 PolarHBondContact SG-SG 2.82Å; C591-L597 HydrophobicContact CB-CB 4.42Å; C591-L597 WeakPolarHBondContact CB-O 3.39Å; C591-T598 WeakPolarHBondContact O-CA 3.36Å; C591-H599 PolarHBondContact O-N 3.18Å; C591-R600 PolarHBondContact N-O 3.28Å; C591-R600 PolarHBondContact SG-O 3.5Å; C591-I605 WeakPolarHBondContact SG-CD1 3.46Å
592	R	90.9	Very high	80.6	Confident	149 Å²	149	49.8 Å²	49.8	56%	0.562	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	-16.4	174.3	-171.7	54.3	-179.2	177.6	5.1	113.5	P563 W564 T598 H599	P563-R592 HydrophobicContact CB-CB 4.06Å; P563-R592 HydrophobicContact CB-CG 4.05Å; W564-R592 PolarHBondContact O-N 3.05Å; R592-T598 WeakPolarHBondContact O-CG2 3.45Å; R592-H599 PolarHBondContact NH1-NE2 3.24Å
593	S	87.3	Confident	82	Confident	49 Å²	49	50.4 Å²	50.4	34%	0.343	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.7	172.1	170	0	0	0	0	108.4	W564 D565 C566	W564-S593 PolarHBondContact O-N 2.96Å; D565-S593 WeakPolarHBondContact OD1-CB 3.4Å; D565-S593 PolarHBondContact OD1-OG 3.2Å; C566-S593 WeakPolarHBondContact CB-O 3.3Å; C566-S593 PolarHBondContact N-O 3.49Å
594	P	85.1	Confident	83.7	Confident	45 Å²	45	52 Å²	52	29%	0.292	26%	0.257	S	S	.	.	S	Bend	cis	-66.9	167.2	-15.1	31.4	-36.7	0	0	0	111.8	C566 N596 L597 T598	C566-P594 WeakPolarHBondContact O-CD 3.43Å; P594-N596 PolarHBondContact O-N 3.01Å; P594-N596 VanDerWaalsContact O-N 3.15Å; P594-L597 HydrophobicContact CG-CB 4.47Å; P594-L597 HydrophobicContact CG-CD1 4.24Å; P594-L597 HydrophobicContact CG-CG 4.4Å; P594-L597 PolarHBondContact O-N 3.46Å; P594-T598 PolarHBondContact O-N 3.13Å
595	E	83.5	Confident	84.3	Confident	169 Å²	169	52 Å²	52	79%	0.79	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-52.3	-41.5	-175.2	-65.2	-167.9	159.3	0	0	113.1	L597 T598	E595-L597 PolarHBondContact O-N 2.88Å; E595-L597 VanDerWaalsContact O-N 3.12Å; E595-T598 WeakPolarHBondContact O-CB 3.48Å; E595-T598 WeakPolarHBondContact O-CG2 3.05Å; E595-T598 PolarHBondContact O-N 2.67Å; E595-T598 VanDerWaalsContact O-N 3.1Å; E595-T598 PolarHBondContact O-OG1 3.06Å
596	N	83.3	Confident	84.5	Confident	151 Å²	151	58.6 Å²	58.6	81%	0.807	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-58.1	-23.7	178.6	-63.9	-12.2	0	0	0	114.9	P594	P594-N596 PolarHBondContact O-N 3.01Å; P594-N596 VanDerWaalsContact O-N 3.15Å
597	L	85.3	Confident	84.8	Confident	17 Å²	17	61 Å²	61	9%	0.089	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-109.7	1.7	-178.9	-66.3	177.6	0	0	0	113	C566 C591 P594 E595 H599 R600 I605 V609	C566-L597 HydrophobicContact CB-CB 4.5Å; C566-L597 HydrophobicContact CB-CD1 4.11Å; C566-L597 WeakPolarHBondContact O-CD1 3.47Å; C591-L597 HydrophobicContact CB-CB 4.42Å; C591-L597 WeakPolarHBondContact CB-O 3.39Å; P594-L597 HydrophobicContact CG-CB 4.47Å; P594-L597 HydrophobicContact CG-CD1 4.24Å; P594-L597 HydrophobicContact CG-CG 4.4Å; P594-L597 PolarHBondContact O-N 3.46Å; E595-L597 PolarHBondContact O-N 2.88Å; E595-L597 VanDerWaalsContact O-N 3.12Å; L597-H599 PolarHBondContact O-N 2.73Å; L597-R600 WeakPolarHBondContact O-CB 3.47Å; L597-R600 PolarHBondContact O-N 3.07Å; L597-I605 HydrophobicContact CB-CD1 4.5Å; L597-I605 HydrophobicContact CD1-CD1 4.41Å; L597-I605 HydrophobicContact CD2-CD1 4.26Å; L597-I605 HydrophobicContact CD2-CG1 4.48Å; L597-I605 HydrophobicContact CD2-CG2 4.35Å; L597-V609 HydrophobicContact CD2-CG1 3.96Å
598	T	85.3	Confident	85.2	Confident	50 Å²	50	67 Å²	67	31%	0.307	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	138.7	-179	51.2	0	0	0	0	112.9	C591 R592 P594 E595 R600	C591-T598 WeakPolarHBondContact O-CA 3.36Å; R592-T598 WeakPolarHBondContact O-CG2 3.45Å; P594-T598 PolarHBondContact O-N 3.13Å; E595-T598 WeakPolarHBondContact O-CB 3.48Å; E595-T598 WeakPolarHBondContact O-CG2 3.05Å; E595-T598 PolarHBondContact O-N 2.67Å; E595-T598 VanDerWaalsContact O-N 3.1Å; E595-T598 PolarHBondContact O-OG1 3.06Å; T598-R600 PolarHBondContact O-N 3.02Å; T598-R600 VanDerWaalsContact O-N 3.1Å
599	H	84.8	Confident	85.3	Confident	123 Å²	123	70.2 Å²	70.2	57%	0.569	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	7.4	179.6	-56.5	-81.9	0	0	0	116.2	C591 R592 L597	C591-H599 PolarHBondContact O-N 3.18Å; R592-H599 PolarHBondContact NH1-NE2 3.24Å; L597-H599 PolarHBondContact O-N 2.73Å
600	R	84.4	Confident	84.9	Confident	147 Å²	147	70.6 Å²	70.6	56%	0.555	35%	0.348	S	S	*	.			trans	-83.6	156	164.3	-64.4	-174.6	175.4	-92.6	-0.4	110.9	L590 C591 L597 T598 I605	L590-R600 CarbonylContact C-O 3.56Å; L590-R600 WeakPolarHBondContact CA-O 3.25Å; C591-R600 PolarHBondContact N-O 3.28Å; C591-R600 PolarHBondContact SG-O 3.5Å; L597-R600 WeakPolarHBondContact O-CB 3.47Å; L597-R600 PolarHBondContact O-N 3.07Å; T598-R600 PolarHBondContact O-N 3.02Å; T598-R600 VanDerWaalsContact O-N 3.1Å; R600-I605 HydrophobicContact CB-CD1 4Å; R600-I605 HydrophobicContact CB-CG1 4.12Å
601	D	87.2	Confident	84.6	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.011	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-90.9	138.8	177	-167.4	-72	0	0	0	111.3	R86 V589 L590 R603 T604 I605	R86-D601 IonicContact CZ-OD2 2.73Å; R86-D601 VanDerWaalsContact CZ-OD2 3.29Å; R86-D601 VanDerWaalsContact NH1-CB 3.28Å; R86-D601 IonicContact NH1-OD2 2.68Å; R86-D601 PolarHBondContact NH1-OD2 2.83Å; R86-D601 IonicContact NH2-OD2 3.48Å; R86-D601 PolarHBondContact NH2-OD2 2.03Å; V589-D601 PolarHBondContact N-OD2 2.87Å; V589-D601 VanDerWaalsContact N-OD2 3.13Å; V589-D601 WeakPolarHBondContact O-CA 3.15Å; L590-D601 HydrophobicContact CD2-CB 4.33Å; D601-R603 PolarHBondContact O-N 2.87Å; D601-R603 VanDerWaalsContact O-N 3.13Å; D601-R603 WeakPolarHBondContact OD1-CB 3.26Å; D601-R603 IonicContact OD1-CZ 2.78Å; D601-R603 PolarHBondContact OD1-N 3.1Å; D601-R603 IonicContact OD1-NE 3.76Å; D601-R603 PolarHBondContact OD1-NE 2.9Å; D601-R603 IonicContact OD1-NH2 3.11Å; D601-R603 PolarHBondContact OD1-NH2 3.06Å; D601-R603 IonicContact OD2-CZ 3.83Å; D601-R603 IonicContact OD2-NE 2.7Å; D601-R603 IonicContact OD2-NH2 2.93Å; D601-R603 PolarHBondContact OD2-NH2 2.99Å; D601-T604 HydrophobicContact CB-CG2 4.05Å; D601-T604 PolarHBondContact N-OG1 3.31Å; D601-T604 PolarHBondContact O-N 3.48Å; D601-T604 PolarHBondContact O-OG1 3.14Å; D601-I605 WeakPolarHBondContact O-CG1 3.34Å; D601-I605 PolarHBondContact O-N 3.15Å
602	V	88	Confident	83.6	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.006	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-51.5	-36.6	178.3	176.1	0	0	0	0	112.6	L570 K574 V589 T604	L570-V602 HydrophobicContact CD2-CB 4.43Å; L570-V602 HydrophobicContact CD2-CG1 3.92Å; L570-V602 HydrophobicContact CD2-CG2 3.56Å; L570-V602 HydrophobicContact CG-CG1 4.46Å; K574-V602 HydrophobicContact CB-CG1 3.81Å; K574-V602 WeakPolarHBondContact CE-O 2.96Å; K574-V602 HydrophobicContact CG-CG1 4.04Å; V589-V602 HydrophobicContact CB-CB 4.47Å; V589-V602 HydrophobicContact CB-CG2 4.42Å; V589-V602 HydrophobicContact CG1-CB 4.06Å; V589-V602 HydrophobicContact CG1-CG2 3.67Å; V589-V602 WeakPolarHBondContact O-CG2 3.26Å; V589-V602 PolarHBondContact O-N 3.12Å; V602-T604 VanDerWaalsContact C-N 3.33Å; V602-T604 PolarHBondContact O-N 2.92Å
603	R	85.1	Confident	82.2	Confident	22 Å²	22	73.8 Å²	73.8	8%	0.083	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-68.3	-29.6	176.6	-68.8	164.6	-75	-161.7	-5.4	113.5	I577 G587 D601	I577-R603 HydrophobicContact CG2-CG 3.5Å; I577-R603 VanDerWaalsContact CG2-CG 3.5Å; G587-R603 PolarHBondContact O-NH1 2.99Å; G587-R603 PolarHBondContact O-NH2 2.88Å; D601-R603 PolarHBondContact O-N 2.87Å; D601-R603 VanDerWaalsContact O-N 3.13Å; D601-R603 WeakPolarHBondContact OD1-CB 3.26Å; D601-R603 IonicContact OD1-CZ 2.78Å; D601-R603 PolarHBondContact OD1-N 3.1Å; D601-R603 IonicContact OD1-NE 3.76Å; D601-R603 PolarHBondContact OD1-NE 2.9Å; D601-R603 IonicContact OD1-NH2 3.11Å; D601-R603 PolarHBondContact OD1-NH2 3.06Å; D601-R603 IonicContact OD2-CZ 3.83Å; D601-R603 IonicContact OD2-NE 2.7Å; D601-R603 IonicContact OD2-NH2 2.93Å; D601-R603 PolarHBondContact OD2-NH2 2.99Å
604	T	84.5	Confident	80.6	Confident	60 Å²	60	78.5 Å²	78.5	37%	0.368	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-90.2	-3.7	-172.4	61.7	0	0	0	0	114.3	D601 V602	D601-T604 HydrophobicContact CB-CG2 4.05Å; D601-T604 PolarHBondContact N-OG1 3.31Å; D601-T604 PolarHBondContact O-N 3.48Å; D601-T604 PolarHBondContact O-OG1 3.14Å; V602-T604 VanDerWaalsContact C-N 3.33Å; V602-T604 PolarHBondContact O-N 2.92Å
605	I	85.2	Confident	78.8	Confident	10 Å²	10	81.9 Å²	81.9	5%	0.051	41%	0.41	C	S	.	.	S	Bend	trans	-95.2	139.1	-178.9	-60.4	162	0	0	0	109	K574 C591 L597 R600 D601 V609 L610	K574-I605 WeakPolarHBondContact CE-O 3.47Å; K574-I605 PolarHBondContact NZ-O 3.08Å; C591-I605 WeakPolarHBondContact SG-CD1 3.46Å; L597-I605 HydrophobicContact CB-CD1 4.5Å; L597-I605 HydrophobicContact CD1-CD1 4.41Å; L597-I605 HydrophobicContact CD2-CD1 4.26Å; L597-I605 HydrophobicContact CD2-CG1 4.48Å; L597-I605 HydrophobicContact CD2-CG2 4.35Å; R600-I605 HydrophobicContact CB-CD1 4Å; R600-I605 HydrophobicContact CB-CG1 4.12Å; D601-I605 WeakPolarHBondContact O-CG1 3.34Å; D601-I605 PolarHBondContact O-N 3.15Å; I605-V609 HydrophobicContact CG2-CB 4.03Å; I605-V609 HydrophobicContact CG2-CG1 4.18Å; I605-L610 HydrophobicContact CB-CD1 4.23Å; I605-L610 HydrophobicContact CB-CG 4.5Å; I605-L610 HydrophobicContact CG2-CD1 3.91Å; I605-L610 HydrophobicContact CG2-CD2 4.42Å; I605-L610 HydrophobicContact CG2-CG 3.74Å
606	E	82.9	Confident	77.1	Confident	142 Å²	142	81.8 Å²	81.8	66%	0.664	41%	0.409	S	S	*	.			trans	-77.1	149.1	176.8	-72	168	-178.3	0	0	111.3	E608 V609 L610	E606-E608 VanDerWaalsContact C-N 3.26Å; E606-E608 PolarHBondContact O-N 3.37Å; E606-V609 HydrophobicContact CB-CG2 4.23Å; E606-V609 PolarHBondContact O-N 3.4Å; E606-V609 VanDerWaalsContact O-N 3.12Å; E606-L610 PolarHBondContact O-N 2.86Å
607	L	81.9	Confident	75.2	Confident	70 Å²	70	81.7 Å²	81.7	37%	0.366	41%	0.414	S	S	.	.	H	α-helix	trans	-62.5	-35.2	-172.3	-170.4	66.1	0	0	0	112.6	V571 V609 L610 C611	V571-L607 HydrophobicContact CB-CD1 4.24Å; V571-L607 HydrophobicContact CG1-CD1 3.67Å; V571-L607 HydrophobicContact CG2-CD1 3.65Å; L607-V609 VanDerWaalsContact C-N 3.29Å; L607-V609 PolarHBondContact O-N 2.86Å; L607-L610 PolarHBondContact O-N 3.39Å; L607-C611 PolarHBondContact O-N 2.82Å
608	E	77.8	Confident	72.6	Confident	130 Å²	130	85.3 Å²	85.3	61%	0.607	45%	0.446	S	S	*	.	H	α-helix	trans	-64.9	-31.7	178.6	-58.2	-178.9	-171.9	0	0	112.5	E606 C611	E606-E608 VanDerWaalsContact C-N 3.26Å; E606-E608 PolarHBondContact O-N 3.37Å; E608-C611 CarbonylContact O-C 3.49Å
609	V	80.6	Confident	70.9	Confident	81 Å²	81	89.3 Å²	89.3	49%	0.491	47%	0.473	S	S	.	.	H	α-helix	trans	-76.7	-27.3	178.5	-175.6	0	0	0	0	111.6	L597 I605 E606 L607	L597-V609 HydrophobicContact CD2-CG1 3.96Å; I605-V609 HydrophobicContact CG2-CB 4.03Å; I605-V609 HydrophobicContact CG2-CG1 4.18Å; E606-V609 HydrophobicContact CB-CG2 4.23Å; E606-V609 PolarHBondContact O-N 3.4Å; E606-V609 VanDerWaalsContact O-N 3.12Å; L607-V609 VanDerWaalsContact C-N 3.29Å; L607-V609 PolarHBondContact O-N 2.86Å
610	L	80.3	Confident	68.6	Low	8 Å²	8	88.6 Å²	88.6	4%	0.042	49%	0.488	C	S	.	.	H	α-helix	trans	-80.9	-33.5	175	-76.3	153.1	0	0	0	113	C566 C568 V571 K574 I605 E606 L607	C566-L610 HydrophobicContact CB-CD2 3.92Å; C568-L610 PolarHBondContact N-O 2.59Å; V571-L610 HydrophobicContact CG2-CB 4.33Å; K574-L610 HydrophobicContact CD-CD1 3.45Å; K574-L610 VanDerWaalsContact CD-CD1 3.45Å; I605-L610 HydrophobicContact CB-CD1 4.23Å; I605-L610 HydrophobicContact CB-CG 4.5Å; I605-L610 HydrophobicContact CG2-CD1 3.91Å; I605-L610 HydrophobicContact CG2-CD2 4.42Å; I605-L610 HydrophobicContact CG2-CG 3.74Å; E606-L610 PolarHBondContact O-N 2.86Å; L607-L610 PolarHBondContact O-N 3.39Å
611	C	82.2	Confident	66.4	Low	14 Å²	14	85.4 Å²	85.4	10%	0.095	50%	0.502	C	S	.	.			trans	-146.1	83.2	-176.9	-158.6	0	0	0	0	113.2	C568 V571 L607 E608 E613	C568-C611 HydrophobicContact CB-CB 3.61Å; C568-C611 WeakPolarHBondContact CB-SG 3.47Å; C568-C611 WeakPolarHBondContact SG-CB 3.25Å; C568-C611 CovalentContact SG-SG 2.04Å; C568-C611 PolarHBondContact SG-SG 3.2Å; V571-C611 HydrophobicContact CG2-CB 4.34Å; L607-C611 PolarHBondContact O-N 2.82Å; E608-C611 CarbonylContact O-C 3.49Å; C611-E613 VanDerWaalsContact C-N 3.26Å; C611-E613 PolarHBondContact O-N 3.33Å
612	P	70.1	Confident	63.8	Low	90 Å²	90	90.3 Å²	90.3	58%	0.584	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-63.7	-23.4	-176.7	-25.3	35.5	0	0	0	115.4	M614	P612-M614 PolarHBondContact O-N 2.81Å
613	E	60.7	Low	61.2	Low	168 Å²	168	95.8 Å²	95.8	79%	0.785	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-70.4	-15	-173.6	-61.3	-167.8	143.4	0	0	114.1	C611 L615 H616	C611-E613 VanDerWaalsContact C-N 3.26Å; C611-E613 PolarHBondContact O-N 3.33Å; E613-L615 PolarHBondContact O-N 3.05Å; E613-H616 PolarHBondContact O-N 2.8Å
614	M	54.1	Low	59.9	Low	148 Å²	148	100.8 Å²	100.8	73%	0.729	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-59.8	-14.8	176.7	-75.2	-79.8	-73	0	0	114.1	P612	P612-M614 PolarHBondContact O-N 2.81Å
615	L	46.8	Very low	57.1	Low	117 Å²	117	102.9 Å²	102.9	61%	0.613	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-98.2	11.4	-176.4	-69	170.5	0	0	0	114.6	E613	E613-L615 PolarHBondContact O-N 3.05Å
616	H	47.9	Very low	54.6	Low	167 Å²	167	111.3 Å²	111.3	77%	0.773	68%	0.678	S	S	*	*			trans	-119.4	40.5	-171.9	-78.2	1.4	0	0	0	115.9	E613	E613-H616 PolarHBondContact O-N 2.8Å
617	V	43.3	Very low	52.9	Low	148 Å²	148	109.8 Å²	109.8	90%	0.897	68%	0.681	S	S	*	*			trans	-132.9	84.8	164.4	-170	0	0	0	0	112.2
618	A	32	Very low	50.4	Low	93 Å²	93	109.4 Å²	109.4	77%	0.769	69%	0.694	S	S	*	*			trans	-144.6	139.2	159.7	0	0	0	0	0	109.3
619	P	49.8	Very low	48.1	Very low	134 Å²	134	110.5 Å²	110.5	87%	0.87	70%	0.704	S	S	*	*			trans	-90.4	135.9	-161.7	33.4	-35.2	0	0	0	114.4
620	A	36.6	Very low	46.1	Very low	108 Å²	108	110.8 Å²	110.8	89%	0.893	71%	0.71	S	S	*	*			trans	-100.9	126.6	159.6	0	0	0	0	0	109.2
621	G	38.3	Very low	43.8	Very low	81 Å²	81	118.5 Å²	118.5	84%	0.835	75%	0.745	S	S	*	*			trans	-126.3	134.3	-179.1	0	0	0	0	0	113
622	A	32.4	Very low	41.5	Very low	104 Å²	104	124.5 Å²	124.5	86%	0.86	78%	0.775	S	S	*	*			trans	-158.8	140.2	158.1	0	0	0	0	0	110.6
623	S	33.6	Very low	39.9	Very low	117 Å²	117	128 Å²	128	82%	0.818	79%	0.787	S	S	*	*			trans	-98	-162.5	-176.7	-48.1	0	0	0	0	111
624	P	57.1	Low	38.3	Very low	127 Å²	127	123.7 Å²	123.7	83%	0.825	79%	0.788	S	S	*	*				-130.1	168.6	-61.7	31.8	-15.2	0	0	0	113.8
625	A	25.1	Very low	37.2	Very low	104 Å²	104	121.2 Å²	121.2	86%	0.86	79%	0.791	S	S	*	*			trans	-154.1	161.4	154.1	0	0	0	0	0	112.4
626	Q	32.2	Very low	36.8	Very low	187 Å²	187	121.1 Å²	121.1	87%	0.874	80%	0.797	S	S	*	*			trans	-145.8	-179.8	-166.6	-102	-173.7	-19.2	0	0	109.4
627	P	48.8	Very low	35.8	Very low	110 Å²	110	119.5 Å²	119.5	71%	0.714	80%	0.799	S	S	*	*			cis	-138.3	177.2	-32.3	37.4	-20.3	0	0	0	114.8
628	G	28	Very low	35.1	Very low	62 Å²	62	117.5 Å²	117.5	64%	0.639	79%	0.792	S	S	*	*			trans	104.8	157.4	139.2	0	0	0	0	0	118.8
629	D	31	Very low	34.8	Very low	153 Å²	153	117.8 Å²	117.8	82%	0.818	79%	0.794	S	S	*	*			cis	-176	160.8	-17.8	-99.8	-37.4	0	0	0	108
630	S	37.3	Very low	34.2	Very low	87 Å²	87	116.8 Å²	116.8	61%	0.608	79%	0.791	S	S	*	*			cis	-166.2	171.8	-20.8	67.9	0	0	0	0	107.9
631	H	31.7	Very low	34.3	Very low	169 Å²	169	115.7 Å²	115.7	78%	0.782	78%	0.775	S	S	*	*			trans	176.9	118.8	141.3	-98.3	-66.1	0	0	0	114.1
632	L	34.3	Very low	33.9	Very low	141 Å²	141	123.6 Å²	123.6	74%	0.738	78%	0.781	S	S	*	*			trans	41.9	146.4	133.3	-54.2	177	0	0	0	123
633	I	37.2	Very low	33.7	Very low	163 Å²	163	126.2 Å²	126.2	84%	0.836	78%	0.775	S	S	*	*			cis	-167.4	152.9	-31.4	-128.6	179.8	0	0	0	108
634	G	27.9	Very low	33.9	Very low	78 Å²	78	130.8 Å²	130.8	80%	0.804	78%	0.781	S	S	*	*			trans	149.7	94.1	165.8	0	0	0	0	0	116.1
635	A	30.6	Very low	32.6	Very low	96 Å²	96	129.7 Å²	129.7	79%	0.793	78%	0.776	S	S	*	*			trans	-134.7	172.2	173.3	0	0	0	0	0	109.9
636	P	38	Very low	33.2	Very low	114 Å²	114	130.2 Å²	130.2	74%	0.74	77%	0.771	S	S	*	*				-147.7	156.8	85.4	40.2	-23.7	0	0	0	117
637	T	27.3	Very low	33.7	Very low	133 Å²	133	127.8 Å²	127.8	82%	0.816	77%	0.771	S	S	*	*			trans	21	148	143.4	64.2	0	0	0	0	121.1
638	S	27.5	Very low	33.7	Very low	107 Å²	107	126.7 Å²	126.7	75%	0.748	78%	0.78	S	S	*	*			cis	-157.8	131.7	28.1	52.5	0	0	0	0	110.3
639	A	26.8	Very low	34.8	Very low	98 Å²	98	126.6 Å²	126.6	81%	0.81	78%	0.779	S	S	*	*				86.4	136	79.8	0	0	0	0	0	115.9
640	S	37.1	Very low	35.7	Very low	113 Å²	113	125.7 Å²	125.7	79%	0.79	78%	0.781	S	S	*	*			trans	-67.4	174.8	174.8	47.7	0	0	0	0	113.2
641	P	37.5	Very low	36.7	Very low	86 Å²	86	125.7 Å²	125.7	56%	0.558	78%	0.778	S	S	*	*			cis	-144.6	-178.1	23.7	44.3	-24.9	0	0	0	118.3	E643	P641-E643 HydrophobicContact CB-CG 4.49Å
642	Y	31.2	Very low	38.2	Very low	246 Å²	246	121.4 Å²	121.4	97%	0.965	76%	0.764	S	S	*	*			trans	-126.7	90	148.9	-89.6	-73.3	0	0	0	109.5
643	E	27.3	Very low	39.6	Very low	159 Å²	159	121 Å²	121	74%	0.743	76%	0.763	S	S	*	*			trans	-78.5	155	163.9	-70.9	177.3	105.2	0	0	110.4	P641	P641-E643 HydrophobicContact CB-CG 4.49Å
644	F	38.5	Very low	41	Very low	214 Å²	214	116.8 Å²	116.8	94%	0.939	75%	0.748	S	S	*	*			trans	-67.8	142	162	-103.6	-104.3	0	0	0	109.9
645	S	29.8	Very low	43	Very low	103 Å²	103	116.8 Å²	116.8	72%	0.72	73%	0.732	S	S	*	*			trans	-153.1	157	175.7	-92.1	0	0	0	0	111.4
646	P	36.6	Very low	44.8	Very low	115 Å²	115	116 Å²	116	75%	0.747	71%	0.713	S	S	*	*			trans	-77	159.9	-156.6	28.8	-36.4	0	0	0	115.1	G648	P646-G648 PolarHBondContact O-N 2.81Å
647	P	44.5	Very low	46.7	Very low	137 Å²	137	115.2 Å²	115.2	89%	0.89	70%	0.702	S	S	*	*	S	Bend	trans	-72.5	116.9	-178.2	29.3	-34.8	0	0	0	112
648	G	48.4	Very low	48.5	Very low	87 Å²	87	114.2 Å²	114.2	90%	0.897	69%	0.691	S	S	*	*			trans	-173.3	37.3	-176.5	0	0	0	0	0	116	P646	P646-G648 PolarHBondContact O-N 2.81Å
649	G	50.5	Low	50.6	Low	59 Å²	59	111.7 Å²	111.7	61%	0.608	67%	0.674	S	S	*	*	S	Bend	trans	-127.9	149.3	178.5	0	0	0	0	0	112.9	V651	G649-V651 PolarHBondContact O-N 2.9Å
650	P	49.7	Very low	52.9	Low	135 Å²	135	112.1 Å²	112.1	88%	0.877	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-69.5	121.3	-175.9	27.6	-34	0	0	0	112.1
651	V	59.2	Low	54.9	Low	87 Å²	87	110.5 Å²	110.5	53%	0.527	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-66.5	131.8	178.1	178.8	0	0	0	0	110.2	G649 V655	G649-V651 PolarHBondContact O-N 2.9Å; V651-V655 HydrophobicContact CG1-CB 4.02Å; V651-V655 HydrophobicContact CG1-CG1 4.15Å
652	P	63.5	Low	56.9	Low	78 Å²	78	111.3 Å²	111.3	51%	0.506	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-63.6	138	178.9	25	-34	0	0	0	111.8	S654 V655 L656	P652-S654 PolarHBondContact O-N 2.85Å; P652-V655 HydrophobicContact CG-CG2 4.03Å; P652-V655 PolarHBondContact O-N 2.92Å; P652-L656 PolarHBondContact O-N 3.23Å
653	L	62.3	Low	59.2	Low	134 Å²	134	104.7 Å²	104.7	70%	0.702	63%	0.628	S	S	*	*	H	α-helix	trans	-54	-30.7	-174.1	-80.5	162.2	0	0	0	114.1	V655 L656 I657	L653-V655 VanDerWaalsContact C-N 3.34Å; L653-V655 PolarHBondContact O-N 2.69Å; L653-L656 PolarHBondContact O-N 3.03Å; L653-I657 WeakPolarHBondContact O-CB 3.36Å; L653-I657 WeakPolarHBondContact O-CD1 3.45Å; L653-I657 VanDerWaalsContact O-CG1 3.25Å; L653-I657 WeakPolarHBondContact O-CG1 3.47Å; L653-I657 PolarHBondContact O-N 3.44Å
654	S	66.6	Low	61.9	Low	74 Å²	74	103.2 Å²	103.2	52%	0.517	62%	0.619	S	S	.	*	H	α-helix	trans	-59.4	-40.8	175.8	49	0	0	0	0	113.1	P652 L658	P652-S654 PolarHBondContact O-N 2.85Å; S654-L658 WeakPolarHBondContact O-CB 3.33Å; S654-L658 WeakPolarHBondContact O-CG 3.39Å; S654-L658 PolarHBondContact O-N 2.98Å
655	V	71.2	Confident	64	Low	78 Å²	78	98.4 Å²	98.4	47%	0.473	60%	0.598	S	S	.	*	H	α-helix	trans	-72.9	-35.9	178.6	178.5	0	0	0	0	111	V651 P652 L653 S659	V651-V655 HydrophobicContact CG1-CB 4.02Å; V651-V655 HydrophobicContact CG1-CG1 4.15Å; P652-V655 HydrophobicContact CG-CG2 4.03Å; P652-V655 PolarHBondContact O-N 2.92Å; L653-V655 VanDerWaalsContact C-N 3.34Å; L653-V655 PolarHBondContact O-N 2.69Å; V655-S659 WeakPolarHBondContact O-CB 3.36Å; V655-S659 PolarHBondContact O-N 2.65Å; V655-S659 PolarHBondContact O-OG 3.17Å
656	L	67.1	Low	66.1	Low	78 Å²	78	96.2 Å²	96.2	41%	0.408	58%	0.583	S	S	.	*	H	α-helix	trans	-66.1	-41.5	173.5	-102.5	164.4	0	0	0	112.3	P652 L653 S659 L660	P652-L656 PolarHBondContact O-N 3.23Å; L653-L656 PolarHBondContact O-N 3.03Å; L656-S659 PolarHBondContact O-OG 3.35Å; L656-L660 VanDerWaalsContact O-CB 3.28Å; L656-L660 WeakPolarHBondContact O-CB 3.21Å; L656-L660 WeakPolarHBondContact O-CD1 3.47Å; L656-L660 WeakPolarHBondContact O-CG 3.28Å; L656-L660 PolarHBondContact O-N 3.45Å
657	I	77.9	Confident	68.2	Low	98 Å²	98	93.6 Å²	93.6	50%	0.503	57%	0.57	S	S	.	*	H	α-helix	trans	-67.5	-42.8	177.5	-69.3	163	0	0	0	110.8	L653 L660 L661	L653-I657 WeakPolarHBondContact O-CB 3.36Å; L653-I657 WeakPolarHBondContact O-CD1 3.45Å; L653-I657 VanDerWaalsContact O-CG1 3.25Å; L653-I657 WeakPolarHBondContact O-CG1 3.47Å; L653-I657 PolarHBondContact O-N 3.44Å; I657-L660 PolarHBondContact O-N 3.02Å; I657-L661 HydrophobicContact CG2-CD1 4.09Å; I657-L661 WeakPolarHBondContact O-CB 3.3Å; I657-L661 WeakPolarHBondContact O-CG 3.24Å; I657-L661 PolarHBondContact O-N 2.88Å
658	L	66.2	Low	70.2	Confident	113 Å²	113	90.4 Å²	90.4	59%	0.592	55%	0.549	S	S	*	.	H	α-helix	trans	-66	-42.2	177.4	-74.3	168.3	0	0	0	112.5	S654 L661 V662	S654-L658 WeakPolarHBondContact O-CB 3.33Å; S654-L658 WeakPolarHBondContact O-CG 3.39Å; S654-L658 PolarHBondContact O-N 2.98Å; L658-L661 PolarHBondContact O-N 3.05Å; L658-V662 WeakPolarHBondContact O-CG2 3.33Å; L658-V662 PolarHBondContact O-N 3.48Å
659	S	70.2	Confident	71.6	Confident	54 Å²	54	93.6 Å²	93.6	38%	0.378	54%	0.538	S	S	.	.	H	α-helix	trans	-68.9	-37	177	61.3	0	0	0	0	112.6	V655 L656 V662 L663	V655-S659 WeakPolarHBondContact O-CB 3.36Å; V655-S659 PolarHBondContact O-N 2.65Å; V655-S659 PolarHBondContact O-OG 3.17Å; L656-S659 PolarHBondContact O-OG 3.35Å; S659-V662 PolarHBondContact O-N 2.7Å; S659-L663 WeakPolarHBondContact O-CB 3.31Å; S659-L663 WeakPolarHBondContact O-CG 3.25Å; S659-L663 PolarHBondContact O-N 2.96Å
660	L	76.4	Confident	73.2	Confident	107 Å²	107	95.2 Å²	95.2	56%	0.56	54%	0.536	S	S	*	.	H	α-helix	trans	-64.5	-37.5	171.8	-75.7	168.9	0	0	0	112.7	L656 I657 F664	L656-L660 VanDerWaalsContact O-CB 3.28Å; L656-L660 WeakPolarHBondContact O-CB 3.21Å; L656-L660 WeakPolarHBondContact O-CD1 3.47Å; L656-L660 WeakPolarHBondContact O-CG 3.28Å; L656-L660 PolarHBondContact O-N 3.45Å; I657-L660 PolarHBondContact O-N 3.02Å; L660-F664 VanDerWaalsContact O-CB 3.31Å; L660-F664 WeakPolarHBondContact O-CB 3.21Å; L660-F664 PolarHBondContact O-N 3.03Å
661	L	78.8	Confident	74.6	Confident	78 Å²	78	91.4 Å²	91.4	41%	0.408	52%	0.516	S	S	.	.	H	α-helix	trans	-64.6	-45.4	173.5	-79.1	166.5	0	0	0	111.7	I657 L658 L663 F664 F665	I657-L661 HydrophobicContact CG2-CD1 4.09Å; I657-L661 WeakPolarHBondContact O-CB 3.3Å; I657-L661 WeakPolarHBondContact O-CG 3.24Å; I657-L661 PolarHBondContact O-N 2.88Å; L658-L661 PolarHBondContact O-N 3.05Å; L661-L663 PolarHBondContact O-N 2.92Å; L661-F664 PolarHBondContact O-N 2.98Å; L661-F665 HydrophobicContact CD2-CE2 4.26Å; L661-F665 WeakPolarHBondContact O-CD2 3.18Å; L661-F665 PolarHBondContact O-N 3.3Å
662	V	79.1	Confident	75.6	Confident	103 Å²	103	90 Å²	90	62%	0.624	51%	0.513	S	S	*	.	H	α-helix	trans	-61.5	-43.7	176.5	171.3	0	0	0	0	111.3	L658 S659 F665 S666	L658-V662 WeakPolarHBondContact O-CG2 3.33Å; L658-V662 PolarHBondContact O-N 3.48Å; S659-V662 PolarHBondContact O-N 2.7Å; V662-F665 PolarHBondContact O-N 2.95Å; V662-S666 WeakPolarHBondContact O-CB 3.44Å; V662-S666 PolarHBondContact O-N 2.78Å; V662-S666 PolarHBondContact O-OG 3.04Å
663	L	79.6	Confident	76.5	Confident	108 Å²	108	88.2 Å²	88.2	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-63.5	-38.8	174.6	-76.4	168.1	0	0	0	112.7	S659 L661 S666 A667	S659-L663 WeakPolarHBondContact O-CB 3.31Å; S659-L663 WeakPolarHBondContact O-CG 3.25Å; S659-L663 PolarHBondContact O-N 2.96Å; L661-L663 PolarHBondContact O-N 2.92Å; L663-S666 PolarHBondContact O-OG 3.31Å; L663-S666 VanDerWaalsContact O-OG 3.09Å; L663-A667 VanDerWaalsContact O-CB 3.24Å; L663-A667 WeakPolarHBondContact O-CB 3.11Å; L663-A667 PolarHBondContact O-N 3.16Å
664	F	84.3	Confident	77.2	Confident	127 Å²	127	86.7 Å²	86.7	56%	0.557	50%	0.501	S	S	*	.	H	α-helix	trans	-64.8	-48.1	176.2	179.8	-99.4	0	0	0	111.6	L660 L661 A667 V668	L660-F664 VanDerWaalsContact O-CB 3.31Å; L660-F664 WeakPolarHBondContact O-CB 3.21Å; L660-F664 PolarHBondContact O-N 3.03Å; L661-F664 PolarHBondContact O-N 2.98Å; F664-A667 PolarHBondContact O-N 3.02Å; F664-V668 HydrophobicContact CD1-CG2 4.45Å; F664-V668 HydrophobicContact CE1-CG2 4.09Å; F664-V668 HydrophobicContact CE2-CG2 4.42Å; F664-V668 HydrophobicContact CZ-CG2 4.07Å; F664-V668 WeakPolarHBondContact O-CG2 3.34Å; F664-V668 PolarHBondContact O-N 2.8Å
665	F	81.4	Confident	77.5	Confident	114 Å²	114	90 Å²	90	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-64.6	-42.8	177.9	-73.6	-61	0	0	0	112.2	L661 V662 A667 V668 F669	L661-F665 HydrophobicContact CD2-CE2 4.26Å; L661-F665 WeakPolarHBondContact O-CD2 3.18Å; L661-F665 PolarHBondContact O-N 3.3Å; V662-F665 PolarHBondContact O-N 2.95Å; F665-A667 PolarHBondContact O-N 3.22Å; F665-V668 PolarHBondContact O-N 2.9Å; F665-F669 WeakPolarHBondContact O-CD2 3.44Å; F665-F669 PolarHBondContact O-N 3.26Å
666	S	73.9	Confident	77.6	Confident	57 Å²	57	89 Å²	89	40%	0.399	51%	0.506	S	S	.	.	H	α-helix	trans	-63.6	-40.8	177	67.6	0	0	0	0	112	V662 L663 V668 F669 V670	V662-S666 WeakPolarHBondContact O-CB 3.44Å; V662-S666 PolarHBondContact O-N 2.78Å; V662-S666 PolarHBondContact O-OG 3.04Å; L663-S666 PolarHBondContact O-OG 3.31Å; L663-S666 VanDerWaalsContact O-OG 3.09Å; S666-V668 PolarHBondContact O-N 2.86Å; S666-F669 PolarHBondContact O-N 3.33Å; S666-V670 WeakPolarHBondContact O-CG2 3Å; S666-V670 PolarHBondContact O-N 2.8Å
667	A	82.1	Confident	78.1	Confident	59 Å²	59	91.5 Å²	91.5	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-61.9	-40.4	174	0	0	0	0	0	112.7	L663 F664 F665 V670 A671	L663-A667 VanDerWaalsContact O-CB 3.24Å; L663-A667 WeakPolarHBondContact O-CB 3.11Å; L663-A667 PolarHBondContact O-N 3.16Å; F664-A667 PolarHBondContact O-N 3.02Å; F665-A667 PolarHBondContact O-N 3.22Å; A667-V670 PolarHBondContact O-N 3.27Å; A667-A671 VanDerWaalsContact O-CB 3.31Å; A667-A671 WeakPolarHBondContact O-CB 3.03Å; A667-A671 PolarHBondContact O-N 3.48Å
668	V	86.4	Confident	77.9	Confident	71 Å²	71	90 Å²	90	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-43.2	175.2	169.2	0	0	0	0	111.5	F664 F665 S666 A671 A672	F664-V668 HydrophobicContact CD1-CG2 4.45Å; F664-V668 HydrophobicContact CE1-CG2 4.09Å; F664-V668 HydrophobicContact CE2-CG2 4.42Å; F664-V668 HydrophobicContact CZ-CG2 4.07Å; F664-V668 WeakPolarHBondContact O-CG2 3.34Å; F664-V668 PolarHBondContact O-N 2.8Å; F665-V668 PolarHBondContact O-N 2.9Å; S666-V668 PolarHBondContact O-N 2.86Å; V668-A671 PolarHBondContact O-N 2.85Å; V668-A672 WeakPolarHBondContact O-CB 3.39Å; V668-A672 PolarHBondContact O-N 3.16Å
669	F	78.5	Confident	77.9	Confident	154 Å²	154	88.8 Å²	88.8	68%	0.675	50%	0.5	S	S	*	.	H	α-helix	trans	-67.1	-39.2	176.4	-77.1	-64.2	0	0	0	112.8	F665 S666 A672 G673	F665-F669 WeakPolarHBondContact O-CD2 3.44Å; F665-F669 PolarHBondContact O-N 3.26Å; S666-F669 PolarHBondContact O-N 3.33Å; F669-A672 PolarHBondContact O-N 3.42Å; F669-G673 PolarHBondContact O-N 3Å
670	V	82.6	Confident	77.5	Confident	92 Å²	92	95.6 Å²	95.6	56%	0.558	52%	0.517	S	S	*	.	H	α-helix	trans	-64.1	-43	173.5	170.3	0	0	0	0	111	S666 A667 A672 G673 L674	S666-V670 WeakPolarHBondContact O-CG2 3Å; S666-V670 PolarHBondContact O-N 2.8Å; A667-V670 PolarHBondContact O-N 3.27Å; V670-A672 PolarHBondContact O-N 3.35Å; V670-G673 PolarHBondContact O-N 3.14Å; V670-L674 HydrophobicContact CG1-CD1 3.96Å; V670-L674 HydrophobicContact CG1-CG 4.46Å; V670-L674 WeakPolarHBondContact O-CB 3.21Å; V670-L674 WeakPolarHBondContact O-CG 3.36Å; V670-L674 PolarHBondContact O-N 2.99Å
671	A	79.9	Confident	76.6	Confident	56 Å²	56	98 Å²	98	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-42.2	175.5	0	0	0	0	0	112.3	A667 V668 L674 F675	A667-A671 VanDerWaalsContact O-CB 3.31Å; A667-A671 WeakPolarHBondContact O-CB 3.03Å; A667-A671 PolarHBondContact O-N 3.48Å; V668-A671 PolarHBondContact O-N 2.85Å; A671-L674 PolarHBondContact O-N 3.21Å; A671-F675 WeakPolarHBondContact O-CB 3.26Å; A671-F675 PolarHBondContact O-N 3.15Å
672	A	80.2	Confident	75.3	Confident	56 Å²	56	103.2 Å²	103.2	46%	0.463	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-42.2	174.8	0	0	0	0	0	112.2	V668 F669 V670 F675 A676	V668-A672 WeakPolarHBondContact O-CB 3.39Å; V668-A672 PolarHBondContact O-N 3.16Å; F669-A672 PolarHBondContact O-N 3.42Å; V670-A672 PolarHBondContact O-N 3.35Å; A672-F675 PolarHBondContact O-N 3.36Å; A672-A676 WeakPolarHBondContact O-CB 3.35Å; A672-A676 PolarHBondContact O-N 3.29Å
673	G	82.8	Confident	74	Confident	41 Å²	41	109 Å²	109	42%	0.423	54%	0.544	S	S	.	.	H	α-helix	trans	-61.7	-44.8	174.6	0	0	0	0	0	112.7	F669 V670 A676 Y677	F669-G673 PolarHBondContact O-N 3Å; V670-G673 PolarHBondContact O-N 3.14Å; G673-A676 PolarHBondContact O-N 3.08Å; G673-Y677 WeakPolarHBondContact O-CB 3.45Å; G673-Y677 PolarHBondContact O-N 2.8Å
674	L	76.8	Confident	72.6	Confident	103 Å²	103	112.5 Å²	112.5	54%	0.539	56%	0.555	S	S	.	*	H	α-helix	trans	-63.9	-40.7	174.2	-74	169.8	0	0	0	112.1	V670 A671 Y677 V678	V670-L674 HydrophobicContact CG1-CD1 3.96Å; V670-L674 HydrophobicContact CG1-CG 4.46Å; V670-L674 WeakPolarHBondContact O-CB 3.21Å; V670-L674 WeakPolarHBondContact O-CG 3.36Å; V670-L674 PolarHBondContact O-N 2.99Å; A671-L674 PolarHBondContact O-N 3.21Å; L674-Y677 PolarHBondContact O-N 3.35Å; L674-V678 WeakPolarHBondContact O-CB 3.46Å; L674-V678 VanDerWaalsContact O-CG2 3.3Å; L674-V678 WeakPolarHBondContact O-CG2 3.46Å; L674-V678 PolarHBondContact O-N 3.13Å
675	F	73.3	Confident	70.6	Confident	143 Å²	143	115 Å²	115	63%	0.627	57%	0.565	S	S	*	*	H	α-helix	trans	-64.5	-44.8	176.3	-165.9	-102.1	0	0	0	111.6	A671 A672 Y677 V678 L679	A671-F675 WeakPolarHBondContact O-CB 3.26Å; A671-F675 PolarHBondContact O-N 3.15Å; A672-F675 PolarHBondContact O-N 3.36Å; F675-Y677 PolarHBondContact O-N 2.65Å; F675-V678 PolarHBondContact O-N 3.49Å; F675-L679 HydrophobicContact CD1-CD1 3.81Å; F675-L679 HydrophobicContact CD1-CG 4.39Å; F675-L679 HydrophobicContact CE1-CD1 3.71Å; F675-L679 HydrophobicContact CE1-CG 4.29Å; F675-L679 WeakPolarHBondContact O-CG 3.43Å; F675-L679 PolarHBondContact O-N 3.32Å
676	A	73	Confident	68.5	Low	56 Å²	56	116.9 Å²	116.9	46%	0.463	58%	0.58	S	S	.	*	H	α-helix	trans	-61.1	-42.2	173.5	0	0	0	0	0	112	A672 G673 L679 R680	A672-A676 WeakPolarHBondContact O-CB 3.35Å; A672-A676 PolarHBondContact O-N 3.29Å; G673-A676 PolarHBondContact O-N 3.08Å; A676-L679 PolarHBondContact O-N 2.87Å; A676-R680 WeakPolarHBondContact O-CB 3.17Å; A676-R680 PolarHBondContact O-N 2.03Å
677	Y	77.9	Confident	67	Low	131 Å²	131	119.3 Å²	119.3	51%	0.514	59%	0.594	S	S	.	*	H	α-helix	trans	-62.7	-44.2	174.9	179.2	-117.3	0	0	0	112.1	G673 L674 F675 L679 R680 R681	G673-Y677 WeakPolarHBondContact O-CB 3.45Å; G673-Y677 PolarHBondContact O-N 2.8Å; L674-Y677 PolarHBondContact O-N 3.35Å; F675-Y677 PolarHBondContact O-N 2.65Å; Y677-L679 PolarHBondContact O-N 3.29Å; Y677-R680 PolarHBondContact O-N 3.35Å; Y677-R681 VanDerWaalsContact O-CB 3.31Å; Y677-R681 WeakPolarHBondContact O-CB 3.21Å; Y677-R681 PolarHBondContact O-N 3.22Å
678	V	72.9	Confident	64.6	Low	67 Å²	67	125.1 Å²	125.1	41%	0.406	61%	0.609	S	S	.	*	H	α-helix	trans	-62.9	-41.3	175.8	168.3	0	0	0	0	111.5	L674 F675 R681 R682	L674-V678 WeakPolarHBondContact O-CB 3.46Å; L674-V678 VanDerWaalsContact O-CG2 3.3Å; L674-V678 WeakPolarHBondContact O-CG2 3.46Å; L674-V678 PolarHBondContact O-N 3.13Å; F675-V678 PolarHBondContact O-N 3.49Å; V678-R681 PolarHBondContact O-N 3.1Å; V678-R682 WeakPolarHBondContact O-CB 3.29Å; V678-R682 WeakPolarHBondContact O-CG 3.49Å; V678-R682 PolarHBondContact O-N 3.12Å
679	L	65.7	Low	61.9	Low	88 Å²	88	132.5 Å²	132.5	46%	0.461	63%	0.629	S	S	.	*	H	α-helix	trans	-61.8	-45	172.7	-72.2	171.8	0	0	0	111.8	F675 A676 Y677 R681 R682 R683	F675-L679 HydrophobicContact CD1-CD1 3.81Å; F675-L679 HydrophobicContact CD1-CG 4.39Å; F675-L679 HydrophobicContact CE1-CD1 3.71Å; F675-L679 HydrophobicContact CE1-CG 4.29Å; F675-L679 WeakPolarHBondContact O-CG 3.43Å; F675-L679 PolarHBondContact O-N 3.32Å; A676-L679 PolarHBondContact O-N 2.87Å; Y677-L679 PolarHBondContact O-N 3.29Å; L679-R681 VanDerWaalsContact C-N 3.31Å; L679-R681 PolarHBondContact O-N 3.21Å; L679-R682 PolarHBondContact O-N 2.96Å; L679-R683 PolarHBondContact O-N 3.01Å
680	R	61.7	Low	59.8	Low	197 Å²	197	130.8 Å²	130.8	74%	0.743	64%	0.636	S	S	*	*	H	α-helix	trans	-64.7	-34.4	177.5	-144.6	173.3	-169	-174.5	3.7	111.8	A676 Y677	A676-R680 WeakPolarHBondContact O-CB 3.17Å; A676-R680 PolarHBondContact O-N 2.03Å; Y677-R680 PolarHBondContact O-N 3.35Å
681	R	57.3	Low	57.3	Low	158 Å²	158	135.1 Å²	135.1	60%	0.596	65%	0.647	S	S	*	*	H	α-helix	trans	-76.5	-35.1	176.5	-156.8	173.8	-168.6	-169.3	5.4	112.4	Y677 V678 L679 K684	Y677-R681 VanDerWaalsContact O-CB 3.31Å; Y677-R681 WeakPolarHBondContact O-CB 3.21Å; Y677-R681 PolarHBondContact O-N 3.22Å; V678-R681 PolarHBondContact O-N 3.1Å; L679-R681 VanDerWaalsContact C-N 3.31Å; L679-R681 PolarHBondContact O-N 3.21Å; R681-K684 PolarHBondContact O-N 3.01Å
682	R	52.3	Low	54.8	Low	187 Å²	187	141.6 Å²	141.6	71%	0.706	66%	0.66	S	S	*	*	H	α-helix	trans	-64.6	-41.2	170.8	-77.3	-175.8	179.9	-157.8	0.9	111.8	V678 L679 K684 K685	V678-R682 WeakPolarHBondContact O-CB 3.29Å; V678-R682 WeakPolarHBondContact O-CG 3.49Å; V678-R682 PolarHBondContact O-N 3.12Å; L679-R682 PolarHBondContact O-N 2.96Å; R682-K684 PolarHBondContact O-N 3.41Å; R682-K684 VanDerWaalsContact O-N 3.14Å; R682-K685 PolarHBondContact O-N 2.83Å; R682-K685 VanDerWaalsContact O-N 3.11Å
683	R	52.2	Low	52.3	Low	223 Å²	223	147.8 Å²	147.8	84%	0.842	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-17.4	172.9	-74.7	-174.9	179	178.7	1.1	114.2	L679	L679-R683 PolarHBondContact O-N 3.01Å
684	K	49.2	Very low	49.8	Very low	183 Å²	183	153.2 Å²	153.2	80%	0.796	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	7.3	175.7	-71.9	-171.3	173.5	-170.7	0	114.6	R681 R682	R681-K684 PolarHBondContact O-N 3.01Å; R682-K684 PolarHBondContact O-N 3.41Å; R682-K684 VanDerWaalsContact O-N 3.14Å
685	K	42.2	Very low	47.5	Very low	178 Å²	178	152.1 Å²	152.1	77%	0.774	71%	0.707	S	S	*	*	S	Bend	trans	-121	35.7	-179.3	-77.2	-158.2	171.4	-166	0	114.6	R682	R682-K685 PolarHBondContact O-N 2.83Å; R682-K685 VanDerWaalsContact O-N 3.11Å
686	L	37.4	Very low	45.5	Very low	155 Å²	155	151.4 Å²	151.4	81%	0.812	71%	0.714	S	S	*	*			trans	-126.2	115.2	167.6	-79.9	164.5	0	0	0	109.4
687	P	43.7	Very low	43.5	Very low	108 Å²	108	155.4 Å²	155.4	70%	0.701	73%	0.728	S	S	*	*			trans	-82.9	140.4	169.9	33.1	-31.2	0	0	0	110.2
688	F	31.6	Very low	41.1	Very low	181 Å²	181	157.3 Å²	157.3	79%	0.794	75%	0.746	S	S	*	*				178.6	121.4	126.2	-114.6	-100.5	0	0	0	112.2
689	R	28.9	Very low	39.3	Very low	225 Å²	225	160.5 Å²	160.5	85%	0.849	77%	0.765	S	S	*	*			trans	48	111.4	133.5	-155.3	-179.1	-147.2	171.9	6.9	120
690	S	34.6	Very low	37.4	Very low	118 Å²	118	159.8 Å²	159.8	83%	0.825	78%	0.779	S	S	*	*			trans	-72.9	143.1	169.2	174.3	0	0	0	0	114.1
691	K	28.9	Very low	36.1	Very low	184 Å²	184	158 Å²	158	80%	0.8	78%	0.783	S	S	*	*			trans	-162.5	142.5	147.2	-122.7	171.6	-173.6	171.3	0	113.4
692	R	28.1	Very low	34.5	Very low	191 Å²	191	158.6 Å²	158.6	72%	0.721	79%	0.792	S	S	*	*			trans	-0	141.2	162.7	-63.1	-177.6	176.7	-164.3	-6.8	119.7
693	Q	28.6	Very low	33.3	Very low	186 Å²	186	159.2 Å²	159.2	87%	0.869	81%	0.806	S	S	*	*				-140.9	129.2	127	-163.7	74.9	9.5	0	0	108.7
694	E	30.2	Very low	32.1	Very low	156 Å²	156	156.7 Å²	156.7	73%	0.729	80%	0.804	S	S	*	*			trans	-103.2	147.1	161.2	-69.9	160.6	106.5	0	0	106.8
695	G	28.1	Very low	30.8	Very low	79 Å²	79	154 Å²	154	81%	0.814	81%	0.806	S	S	*	*			trans	174.7	114.2	178.5	0	0	0	0	0	112.7
696	V	31.1	Very low	30	Very low	128 Å²	128	152.1 Å²	152.1	78%	0.776	80%	0.8	S	S	*	*			trans	-106.6	142.3	173.1	170.6	0	0	0	0	108.2
697	D	30.4	Very low	29.5	Very low	141 Å²	141	154.1 Å²	154.1	75%	0.754	80%	0.797	S	S	*	*			trans	37	129.7	163.5	-55.1	-17	0	0	0	120.7
698	L	28.1	Very low	28.7	Very low	170 Å²	170	155 Å²	155	89%	0.89	80%	0.795	S	S	*	*				-168.3	163.3	99.1	-101.7	164.1	0	0	0	113.1
699	T	34.3	Very low	28.5	Very low	134 Å²	134	153.6 Å²	153.6	82%	0.822	79%	0.789	S	S	*	*			trans	-102.8	150	-171.4	52.8	0	0	0	0	113.7
700	G	26.8	Very low	28.7	Very low	73 Å²	73	150.9 Å²	150.9	75%	0.753	79%	0.786	S	S	*	*			trans	122.9	113.1	134.9	0	0	0	0	0	118.7
701	I	33.5	Very low	28.7	Very low	160 Å²	160	152.8 Å²	152.8	82%	0.821	79%	0.787	S	S	*	*			trans	-137.6	94.6	143.7	-60.6	-176.6	0	0	0	104.1
702	Q	24.8	Very low	29	Very low	170 Å²	170	147.5 Å²	147.5	79%	0.794	78%	0.784	S	S	*	*				68.4	106.9	89.7	-170	-172.8	9.1	0	0	113.8
703	M	26.2	Very low	29.4	Very low	201 Å²	201	142.6 Å²	142.6	99%	0.99	79%	0.793	S	S	*	*			trans	-144.8	108.7	147.6	-157.6	170.5	121	0	0	107.8
704	Q	27.1	Very low	29.7	Very low	170 Å²	170	138 Å²	138	79%	0.794	80%	0.796	S	S	*	*			trans	-145	122.2	-174.8	-170	-179.7	17.3	0	0	111.7
705	C	23	Very low	30	Very low	125 Å²	125	134.9 Å²	134.9	85%	0.845	81%	0.805	S	S	*	*			trans	-137.5	136.3	159.4	-85.7	0	0	0	0	106.1
706	H	24.6	Very low	30.3	Very low	139 Å²	139	135 Å²	135	64%	0.644	81%	0.807	S	S	*	*			cis	-164.9	141	-6.6	-166.4	31.9	0	0	0	108.8
707	R	26.6	Very low	30.7	Very low	198 Å²	198	133.2 Å²	133.2	75%	0.747	81%	0.814	S	S	*	*			trans	69.7	150.5	167.1	-60.6	178	177.9	-177.5	-2.9	117.2
708	L	27	Very low	31.1	Very low	125 Å²	125	130 Å²	130	65%	0.654	82%	0.815	S	S	*	*			cis	-162	161.6	-9.2	-115.3	168.5	0	0	0	112.6
709	F	28.5	Very low	31.6	Very low	153 Å²	153	128.5 Å²	128.5	67%	0.671	82%	0.818	S	S	*	*			trans	77.2	113.3	159	-72.8	-62.7	0	0	0	123.5
710	E	32.2	Very low	31.7	Very low	168 Å²	168	125.7 Å²	125.7	79%	0.785	82%	0.816	S	S	*	*				56.5	143	127.7	-76.3	167.2	-172.5	0	0	123.2
711	D	34.7	Very low	32	Very low	158 Å²	158	126.5 Å²	126.5	85%	0.845	82%	0.824	S	S	*	*			cis	-163.3	158.3	-9.8	-167.6	21	0	0	0	114.1
712	G	35.7	Very low	31.9	Very low	72 Å²	72	123 Å²	123	74%	0.742	83%	0.827	S	S	*	*			trans	66.1	139.7	159.6	0	0	0	0	0	122
713	G	34.9	Very low	32.2	Very low	89 Å²	89	118.6 Å²	118.6	92%	0.918	83%	0.828	S	S	*	*			cis	130.2	137.8	-5.1	0	0	0	0	0	114.1
714	G	36.3	Very low	32.2	Very low	90 Å²	90	119.7 Å²	119.7	93%	0.928	82%	0.821	S	S	*	*			cis	161.6	125.8	-14.3	0	0	0	0	0	115.5
715	G	35.1	Very low	33.2	Very low	89 Å²	89	116 Å²	116	92%	0.918	81%	0.812	S	S	*	*			trans	142	162.4	170.2	0	0	0	0	0	116.5
716	G	36.3	Very low	33.4	Very low	83 Å²	83	116.1 Å²	116.1	86%	0.856	81%	0.809	S	S	*	*			cis	166.8	143.4	-14.5	0	0	0	0	0	117.3
717	G	39.4	Very low	33.6	Very low	90 Å²	90	116.4 Å²	116.4	93%	0.928	81%	0.814	S	S	*	*			trans	76.9	152.1	150.2	0	0	0	0	0	122.2
718	G	37.3	Very low	33.7	Very low	74 Å²	74	112.1 Å²	112.1	76%	0.763	82%	0.815	S	S	*	*			cis	166.1	159	-12.1	0	0	0	0	0	116.8
719	S	39.8	Very low	33.5	Very low	137 Å²	137	111.3 Å²	111.3	96%	0.958	82%	0.819	S	S	*	*			trans	66.9	154.5	162.6	-63.5	0	0	0	0	121.9
720	G	35.7	Very low	34.3	Very low	76 Å²	76	109 Å²	109	78%	0.784	82%	0.82	S	S	*	*			cis	161.7	145.1	-13.5	0	0	0	0	0	117
721	G	33.3	Very low	34.1	Very low	89 Å²	89	108.3 Å²	108.3	92%	0.918	82%	0.817	S	S	*	*			trans	82.9	156.9	165.8	0	0	0	0	0	118.2
722	G	32	Very low	33.7	Very low	86 Å²	86	109.5 Å²	109.5	89%	0.887	81%	0.814	S	S	*	*			cis	156.8	122.3	-12.8	0	0	0	0	0	114.2
723	G	29.8	Very low	33.3	Very low	79 Å²	79	110.5 Å²	110.5	81%	0.814	82%	0.816	S	S	*	*			trans	173.8	160.8	177.2	0	0	0	0	0	118.2
724	R	26	Very low	34.6	Very low	223 Å²	223	111.9 Å²	111.9	84%	0.842	81%	0.808	S	S	*	*			trans	-173.6	174.9	-177.8	-123.8	-172.2	171.1	177.2	1.9	110.1
725	P	48.6	Very low	35.6	Very low	93 Å²	93	112.8 Å²	112.8	60%	0.604	80%	0.798	S	S	*	*			cis	-137.8	-173	-8.8	43.5	-25.6	0	0	0	116.4
726	T	27.5	Very low	35.4	Very low	128 Å²	128	114.8 Å²	114.8	79%	0.785	79%	0.792	S	S	*	*			trans	65.5	157.5	165.4	50	0	0	0	0	116.9
727	L	28.9	Very low	35.1	Very low	145 Å²	145	113.7 Å²	113.7	76%	0.759	78%	0.781	S	S	*	*			cis	-149.1	166.7	14	-167.7	67.6	0	0	0	111.5
728	S	28.5	Very low	34.7	Very low	108 Å²	108	117.3 Å²	117.3	76%	0.755	77%	0.773	S	S	*	*			trans	65.1	152.3	152.8	44.5	0	0	0	0	122.5
729	S	23.5	Very low	34.4	Very low	107 Å²	107	119.6 Å²	119.6	75%	0.748	77%	0.772	S	S	*	*			trans	-118.9	-173.9	167.8	61.1	0	0	0	0	108.6
730	P	45.4	Very low	34	Very low	105 Å²	105	123.1 Å²	123.1	68%	0.682	77%	0.766	S	S	*	*			cis	-134.5	-176.9	-6.8	41.2	-23.4	0	0	0	115.3
731	E	26.7	Very low	33.5	Very low	154 Å²	154	126.8 Å²	126.8	72%	0.72	76%	0.763	S	S	*	*			trans	71.4	153.2	144.6	-118.9	-167.1	111.9	0	0	124.2
732	K	26.3	Very low	33.3	Very low	183 Å²	183	132.4 Å²	132.4	80%	0.796	76%	0.758	S	S	*	*			trans	67.5	169.1	167.5	-67	-173	172.1	72.8	0	117.9
733	A	27.9	Very low	33.2	Very low	93 Å²	93	135 Å²	135	77%	0.769	75%	0.75	S	S	*	*			trans	-127.7	-150.6	-151	0	0	0	0	0	114.2
734	P	61.6	Low	33.7	Very low	118 Å²	118	135.9 Å²	135.9	77%	0.766	74%	0.741	S	S	*	*			trans	-89	-160.2	-130.4	47.2	-36.7	0	0	0	112.8
735	P	57.5	Low	34.1	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	74%	0.735	S	S	*	*			cis	-141.6	-160.9	2.4	28.3	-0.1	0	0	0	115.9
736	V	30.6	Very low	33.7	Very low	130 Å²	130	134 Å²	134	79%	0.788	74%	0.744	S	S	*	*			trans	88.2	136.9	155.3	-169.3	0	0	0	0	120.6
737	G	31.3	Very low	33.8	Very low	61 Å²	61	133.4 Å²	133.4	63%	0.629	74%	0.74	S	S	*	*			trans	98.2	161.4	154.2	0	0	0	0	0	117
738	H	30.9	Very low	33.9	Very low	166 Å²	166	132.6 Å²	132.6	77%	0.769	74%	0.742	S	S	*	*			cis	-156.3	142.1	-26.6	-88.5	-66	0	0	0	106
739	V	30.3	Very low	34	Very low	122 Å²	122	135 Å²	135	74%	0.739	74%	0.741	S	S	*	*				79.1	106.3	50.8	-179.7	0	0	0	0	115
740	Y	30.8	Very low	34.2	Very low	210 Å²	210	137 Å²	137	82%	0.824	74%	0.74	S	S	*	*			trans	-169.1	140.4	153	-98.4	-81.7	0	0	0	105.2
741	E	25.9	Very low	33.2	Very low	154 Å²	154	136.6 Å²	136.6	72%	0.72	74%	0.739	S	S	*	*			cis	-155.3	130.7	-6.9	-151.3	159.5	-157.1	0	0	105.9
742	Y	29.6	Very low	33.2	Very low	206 Å²	206	136.9 Å²	136.9	81%	0.808	75%	0.745	S	S	*	*				62.4	134.8	80.9	-110.1	-132.2	0	0	0	113.8
743	I	30.3	Very low	33.1	Very low	141 Å²	141	134.9 Å²	134.9	72%	0.723	74%	0.743	S	S	*	*			cis	-148.8	149.4	21	-40.6	-173.2	0	0	0	112.2
744	P	38.8	Very low	33.8	Very low	98 Å²	98	135.3 Å²	135.3	64%	0.636	74%	0.738	S	S	*	*			trans	-87.4	-156.8	163.5	39.2	-38.6	0	0	0	112.2
745	H	34.6	Very low	32.3	Very low	153 Å²	153	136 Å²	136	71%	0.708	73%	0.734	S	S	*	*			cis	-161.3	169.1	6.5	-135.7	135.1	0	0	0	109.2
746	P	40.1	Very low	30.9	Very low	122 Å²	122	140.4 Å²	140.4	79%	0.792	74%	0.738	S	S	*	*				-148	175.3	119.3	38.8	-23.1	0	0	0	116.3
747	V	30.6	Very low	30.7	Very low	117 Å²	117	141 Å²	141	71%	0.709	73%	0.73	S	S	*	*			trans	-137.7	148.5	-173.1	175.9	0	0	0	0	110.6
748	T	30.4	Very low	31.3	Very low	128 Å²	128	142.8 Å²	142.8	79%	0.785	73%	0.73	S	S	*	*			trans	163.6	170	155.9	30.7	0	0	0	0	110.4
749	Q	31.2	Very low	31.3	Very low	158 Å²	158	143 Å²	143	74%	0.738	73%	0.725	S	S	*	*				-168.3	153.9	-56.8	-127.9	-178.9	-19.1	0	0	110
750	M	26.6	Very low	31.4	Very low	149 Å²	149	142 Å²	142	73%	0.734	71%	0.711	S	S	*	*			trans	75.8	119.2	149.4	-68	178.9	74.4	0	0	124.4
751	C	25.6	Very low	31.2	Very low	96 Å²	96	139.3 Å²	139.3	65%	0.649	71%	0.706	S	S	*	*				94.2	118.3	123.1	-74.6	0	0	0	0	124.8
752	N	26	Very low	31.2	Very low	160 Å²	160	140 Å²	140	86%	0.856	71%	0.71	S	S	*	*				125.6	152.4	124.2	-77.8	-10.4	0	0	0	121.2
753	N	23.8	Very low	31	Very low	141 Å²	141	138.1 Å²	138.1	75%	0.754	71%	0.708	S	S	*	*			trans	-90.4	-176.6	-164	-132	-11.6	0	0	0	111.8
754	P	42.3	Very low	30.8	Very low	102 Å²	102	137.4 Å²	137.4	66%	0.662	71%	0.71	S	S	*	*			cis	-148.6	145.5	36.4	38.8	-15.7	0	0	0	121.6
755	I	30.3	Very low	30.2	Very low	133 Å²	133	137.3 Å²	137.3	68%	0.682	72%	0.718	S	S	*	*			trans	67.1	156.2	132.9	-66.7	172.9	0	0	0	117.9
756	Y	29.6	Very low	29.8	Very low	202 Å²	202	136.2 Å²	136.2	79%	0.792	72%	0.721	S	S	*	*			cis	-110.5	179.5	0.8	-126	-91.5	0	0	0	108.3
757	K	26.4	Very low	29.1	Very low	143 Å²	143	135.2 Å²	135.2	62%	0.622	72%	0.718	S	S	*	*			cis	68.2	161.6	23.7	-94	-152.3	167	-168.1	0	116.4	R759 E760	K757-R759 HydrophobicContact CD-CG 3.98Å; K757-R759 VanDerWaalsContact NZ-NE 3.12Å; K757-E760 IonicContact NZ-OE1 2.92Å
758	P	44	Very low	28.9	Very low	98 Å²	98	135 Å²	135	64%	0.636	72%	0.721	S	S	*	*			cis	-118.5	153.6	5.1	47.9	-35.1	0	0	0	113.6
759	R	30.6	Very low	28.8	Very low	171 Å²	171	133 Å²	133	65%	0.645	72%	0.718	S	S	*	*				75	144.6	93.4	-63.4	-174.3	125.2	-150.1	-31.7	114.9	K757	K757-R759 HydrophobicContact CD-CG 3.98Å; K757-R759 VanDerWaalsContact NZ-NE 3.12Å
760	E	31.1	Very low	28.7	Very low	99 Å²	99	134.4 Å²	134.4	46%	0.463	72%	0.724	S	S	.	*			cis	-170.2	-179	-8.8	-122	150.9	-163.4	0	0	112.9	K757	K757-E760 IonicContact NZ-OE1 2.92Å
761	E	26.6	Very low	28.6	Very low	154 Å²	154	136.5 Å²	136.5	72%	0.72	73%	0.732	S	S	*	*			trans	64.7	168.6	147.2	-74	149.2	-147.1	0	0	120.1
762	E	26.6	Very low	28.8	Very low	168 Å²	168	136.7 Å²	136.7	79%	0.785	74%	0.741	S	S	*	*				-160.1	179.9	-60.7	-135.7	168.9	-179.6	0	0	109.7
763	E	25.6	Very low	28.9	Very low	167 Å²	167	132.7 Å²	132.7	78%	0.78	74%	0.738	S	S	*	*			trans	39.4	121.1	160.1	-61.2	-156.6	136	0	0	121.5
764	V	26	Very low	29.3	Very low	127 Å²	127	132 Å²	132	77%	0.77	74%	0.744	S	S	*	*				83.9	103	61.5	173.4	0	0	0	0	115.4	V766	V764-V766 HydrophobicContact CG1-CG2 4.19Å
765	A	26.6	Very low	28.7	Very low	96 Å²	96	131.5 Å²	131.5	79%	0.793	75%	0.748	S	S	*	*			trans	-171.4	128.1	146.9	0	0	0	0	0	107.8
766	V	25	Very low	28.6	Very low	129 Å²	129	133.1 Å²	133.1	78%	0.782	75%	0.753	S	S	*	*			cis	89.6	92.2	19.1	-169.7	0	0	0	0	115.8	V764	V764-V766 HydrophobicContact CG1-CG2 4.19Å
767	S	26.6	Very low	28.8	Very low	102 Å²	102	130.7 Å²	130.7	71%	0.713	75%	0.753	S	S	*	*			trans	-167.7	121.6	138.6	42.1	0	0	0	0	107.7
768	S	25.7	Very low	28.8	Very low	112 Å²	112	127.2 Å²	127.2	78%	0.783	76%	0.757	S	S	*	*				66.4	137.7	57.6	76.9	0	0	0	0	112.7
769	A	28.7	Very low	28.1	Very low	87 Å²	87	126.1 Å²	126.1	72%	0.719	76%	0.764	S	S	*	*			cis	-149.6	157.3	5.5	0	0	0	0	0	107.8
770	Q	28.5	Very low	29.3	Very low	186 Å²	186	124.6 Å²	124.6	87%	0.869	78%	0.776	S	S	*	*			cis	83.6	105	34.3	-173.8	-174.2	-3.9	0	0	114.8
771	E	26	Very low	29.3	Very low	194 Å²	194	123.1 Å²	123.1	91%	0.907	79%	0.787	S	S	*	*			trans	-150	148.3	155.5	-106.3	-172.6	174.6	0	0	107.9
772	A	29.1	Very low	29.5	Very low	99 Å²	99	122.3 Å²	122.3	82%	0.818	79%	0.793	S	S	*	*			cis	-142.6	164.9	-3	0	0	0	0	0	110.9
773	G	28.7	Very low	29.8	Very low	77 Å²	77	123.4 Å²	123.4	79%	0.794	80%	0.798	S	S	*	*			trans	-168.5	164.1	174.9	0	0	0	0	0	111.8
774	S	31.4	Very low	31.1	Very low	126 Å²	126	120.6 Å²	120.6	88%	0.881	79%	0.794	S	S	*	*			trans	-163.8	149.7	-176.7	55.6	0	0	0	0	109.9
775	A	29.1	Very low	32.6	Very low	92 Å²	92	120.3 Å²	120.3	76%	0.76	80%	0.795	S	S	*	*			cis	-148.6	178.6	4.3	0	0	0	0	0	109.4
776	E	29.7	Very low	32.8	Very low	166 Å²	166	119.3 Å²	119.3	78%	0.776	79%	0.794	S	S	*	*			cis	-133.4	-126.2	-1.1	-152.2	-156.3	114	0	0	108.8
777	L	32	Very low	33	Very low	152 Å²	152	122.5 Å²	122.5	80%	0.796	80%	0.803	S	S	*	*			cis	-154.9	128.1	-3.5	-153.2	165.8	0	0	0	109.2
778	G	28.1	Very low	33.1	Very low	69 Å²	69	121.1 Å²	121.1	71%	0.711	80%	0.804	S	S	*	*			trans	97.7	135.8	165.3	0	0	0	0	0	118.3
779	G	28.9	Very low	33.2	Very low	75 Å²	75	124.9 Å²	124.9	77%	0.773	81%	0.81	S	S	*	*			trans	-125.1	-147.5	170.3	0	0	0	0	0	111.2
780	P	54.3	Low	33.3	Very low	140 Å²	140	124.3 Å²	124.3	91%	0.909	81%	0.805	S	S	*	*			cis	-135	178	-0.6	42.5	-26.6	0	0	0	115.3
781	G	32.3	Very low	33.2	Very low	67 Å²	67	122.7 Å²	122.7	69%	0.691	80%	0.801	S	S	*	*			trans	155.5	103.1	157.5	0	0	0	0	0	120.9
782	T	31.3	Very low	33.3	Very low	137 Å²	137	121.4 Å²	121.4	84%	0.84	80%	0.8	S	S	*	*			trans	48.2	94.1	143.5	54.7	0	0	0	0	123.9
783	Q	32.8	Very low	33.2	Very low	192 Å²	192	119.4 Å²	119.4	90%	0.897	79%	0.789	S	S	*	*				63.7	160.7	106.8	-82.3	-166.1	-16.1	0	0	123.9
784	P	53.3	Low	33.1	Very low	108 Å²	108	121.3 Å²	121.3	70%	0.701	79%	0.79	S	S	*	*			trans	-128.3	-140.5	-137.3	47.1	-29.6	0	0	0	113.2
785	P	56.9	Low	33	Very low	121 Å²	121	122.9 Å²	122.9	79%	0.786	78%	0.783	S	S	*	*			cis	-139.6	178.6	-17.1	38.7	-19.1	0	0	0	118.1
786	G	30.4	Very low	32.9	Very low	74 Å²	74	125.6 Å²	125.6	76%	0.763	78%	0.78	S	S	*	*			trans	94.5	169.6	143.7	0	0	0	0	0	119.2
787	M	29.7	Very low	32.7	Very low	197 Å²	197	127.1 Å²	127.1	97%	0.97	79%	0.785	S	S	*	*			cis	-172	136.2	-19.1	-164	175.8	-161	0	0	111.2
788	G	27.5	Very low	32.6	Very low	72 Å²	72	123.8 Å²	123.8	74%	0.742	78%	0.779	S	S	*	*			trans	67	179.5	164	0	0	0	0	0	118.4
789	E	29.4	Very low	32.5	Very low	192 Å²	192	128.9 Å²	128.9	90%	0.897	78%	0.784	S	S	*	*			cis	-166.1	164.7	-32	-142.3	-178.6	164.4	0	0	111.6
790	A	30.4	Very low	32.5	Very low	75 Å²	75	130.3 Å²	130.3	62%	0.62	78%	0.778	S	S	*	*			trans	67.1	117.6	144	0	0	0	0	0	125.5
791	L	26.5	Very low	31.9	Very low	152 Å²	152	129.7 Å²	129.7	80%	0.796	77%	0.774	S	S	*	*				80.9	134.8	120.5	-68.1	174	0	0	0	125.9
792	L	27.6	Very low	31.8	Very low	166 Å²	166	135.3 Å²	135.3	87%	0.869	78%	0.78	S	S	*	*			trans	67.8	151.6	146.8	-64.2	161.7	0	0	0	119.9
793	G	27.1	Very low	31.6	Very low	57 Å²	57	136.4 Å²	136.4	59%	0.588	78%	0.775	S	S	*	*			cis	173.1	-179.2	-3.3	0	0	0	0	0	113
794	S	27.3	Very low	31.4	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	76%	0.761	S	S	*	*			trans	65.9	124.9	179.6	53.9	0	0	0	0	117
795	E	29.4	Very low	30.2	Very low	160 Å²	160	135.2 Å²	135.2	75%	0.748	76%	0.764	S	S	*	*				76.4	145.1	71.8	-69.2	-168.5	99.7	0	0	114.2
796	Q	25.3	Very low	28.9	Very low	149 Å²	149	133.8 Å²	133.8	70%	0.696	76%	0.757	S	S	*	*			cis	-157.8	164.4	20.4	-134	154	47.1	0	0	112.8
797	F	27.2	Very low	28.9	Very low	197 Å²	197	137.2 Å²	137.2	86%	0.864	76%	0.757	S	S	*	*			trans	1.4	150.4	157.3	-80.2	-101.6	0	0	0	121.8
798	A	28.4	Very low	29.1	Very low	82 Å²	82	138.3 Å²	138.3	68%	0.678	75%	0.752	S	S	*	*			cis	-157.8	-164.1	7.2	0	0	0	0	0	109.9
799	E	27	Very low	29.6	Very low	177 Å²	177	143.8 Å²	143.8	83%	0.827	75%	0.75	S	S	*	*			cis	-151.4	-139.1	-0.9	-151.8	-176	-96	0	0	111.8
800	T	28.2	Very low	30.2	Very low	104 Å²	104	140 Å²	140	64%	0.638	74%	0.741	S	S	*	*			trans	-147.2	169.3	-174.2	67.6	0	0	0	0	114.2
801	P	42.5	Very low	30.6	Very low	128 Å²	128	143.8 Å²	143.8	83%	0.831	75%	0.75	S	S	*	*				-135.6	177.9	89.6	37	-23.5	0	0	0	115.2
802	K	29	Very low	31.4	Very low	184 Å²	184	142.9 Å²	142.9	80%	0.8	75%	0.745	S	S	*	*			trans	-103.9	159.1	-173.6	-59.8	178.2	179.7	175	0	111.7
803	E	27.7	Very low	32.2	Very low	161 Å²	161	139.4 Å²	139.4	75%	0.752	72%	0.724	S	S	*	*				-170.7	151.1	74.3	-85.9	-156.3	155.3	0	0	115
804	N	27.8	Very low	32.8	Very low	113 Å²	113	144 Å²	144	60%	0.604	73%	0.728	S	S	*	*			trans	49.6	141.3	137.2	-57.1	-26.8	0	0	0	121.7
805	H	28.6	Very low	33.5	Very low	162 Å²	162	145.8 Å²	145.8	75%	0.75	72%	0.723	S	S	*	*			cis	-154.1	134.5	13.1	-126.9	-58.3	0	0	0	113.6
806	S	29.9	Very low	34	Very low	91 Å²	91	146.7 Å²	146.7	64%	0.636	73%	0.725	S	S	*	*			trans	48.8	124.6	150.7	52.7	0	0	0	0	123.6
807	N	31	Very low	34.6	Very low	145 Å²	145	147 Å²	147	78%	0.775	73%	0.726	S	S	*	*			trans	-100.8	152.7	163.5	-70.4	-49	0	0	0	112.8
808	Y	32.6	Very low	35	Very low	220 Å²	220	149 Å²	149	86%	0.863	73%	0.728	S	S	*	*			trans	-139.8	108.3	150.4	-66	-79.3	0	0	0	107.3
809	R	38.1	Very low	35.3	Very low	188 Å²	188	149 Å²	149	71%	0.709	73%	0.728	S	S	*	*				72.1	134.1	63.3	-67.1	-174.6	111	142.8	2	113.8	E813	R809-E813 WeakPolarHBondContact CD-OE2 3.38Å; R809-E813 WeakPolarHBondContact CG-OE2 3.46Å; R809-E813 IonicContact CZ-OE1 3.68Å; R809-E813 VanDerWaalsContact CZ-OE1 3.3Å; R809-E813 IonicContact CZ-OE2 3.76Å; R809-E813 VanDerWaalsContact NE-CD 3.35Å; R809-E813 IonicContact NE-OE1 2.76Å; R809-E813 PolarHBondContact NE-OE1 3.18Å; R809-E813 IonicContact NE-OE2 2.67Å; R809-E813 PolarHBondContact NE-OE2 3.45Å; R809-E813 IonicContact NH2-OE1 3.8Å; R809-E813 PolarHBondContact NH2-OE1 2.6Å; R809-E813 IonicContact NH2-OE2 3.3Å
810	T	43.4	Very low	35.5	Very low	113 Å²	113	148.8 Å²	148.8	69%	0.693	73%	0.732	S	S	*	*			trans	-106.3	161.2	-163.2	47.9	0	0	0	0	113	L812 E813	T810-L812 PolarHBondContact O-N 3.14Å; T810-E813 PolarHBondContact O-N 2.96Å
811	L	38.6	Very low	35.6	Very low	154 Å²	154	147.9 Å²	147.9	81%	0.806	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-53.9	-24.2	-170.4	-103.9	153.3	0	0	0	116	E813 K814	L811-E813 VanDerWaalsContact C-N 3.32Å; L811-E813 PolarHBondContact O-N 2.98Å; L811-K814 PolarHBondContact O-N 3.09Å
812	L	42.7	Very low	35	Very low	133 Å²	133	148.4 Å²	148.4	70%	0.696	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-74.9	-15.8	-174.6	-155.1	70.1	0	0	0	114.2	T810 K814	T810-L812 PolarHBondContact O-N 3.14Å; L812-K814 VanDerWaalsContact C-N 3.34Å
813	E	45.2	Very low	34.8	Very low	92 Å²	92	144.8 Å²	144.8	43%	0.43	73%	0.734	S	S	.	*	G	3₁₀ helix	trans	-79.2	-16.9	174.1	-71.2	-179	118.3	0	0	112.6	R809 T810 L811	R809-E813 WeakPolarHBondContact CD-OE2 3.38Å; R809-E813 WeakPolarHBondContact CG-OE2 3.46Å; R809-E813 IonicContact CZ-OE1 3.68Å; R809-E813 VanDerWaalsContact CZ-OE1 3.3Å; R809-E813 IonicContact CZ-OE2 3.76Å; R809-E813 VanDerWaalsContact NE-CD 3.35Å; R809-E813 IonicContact NE-OE1 2.76Å; R809-E813 PolarHBondContact NE-OE1 3.18Å; R809-E813 IonicContact NE-OE2 2.67Å; R809-E813 PolarHBondContact NE-OE2 3.45Å; R809-E813 IonicContact NH2-OE1 3.8Å; R809-E813 PolarHBondContact NH2-OE1 2.6Å; R809-E813 IonicContact NH2-OE2 3.3Å; T810-E813 PolarHBondContact O-N 2.96Å; L811-E813 VanDerWaalsContact C-N 3.32Å; L811-E813 PolarHBondContact O-N 2.98Å
814	K	38.4	Very low	34.9	Very low	155 Å²	155	142 Å²	142	67%	0.674	73%	0.732	S	S	*	*	S	Bend	trans	-88.1	-17.9	-171.8	-151.2	172.5	-173.7	179	0	115	L811 L812	L811-K814 PolarHBondContact O-N 3.09Å; L812-K814 VanDerWaalsContact C-N 3.34Å
815	E	41.7	Very low	35	Very low	154 Å²	154	141 Å²	141	72%	0.72	73%	0.734	S	S	*	*	S	Bend	trans	-82.6	-14.3	178.1	-67.8	-174.7	127.8	0	0	113.5
816	K	40.3	Very low	34.9	Very low	179 Å²	179	141.6 Å²	141.6	78%	0.778	74%	0.737	S	S	*	*	S	Bend	trans	-93	-15.5	-175.7	-75.3	-171	174	-177.6	0	115.5
817	E	38.9	Very low	35	Very low	156 Å²	156	143.9 Å²	143.9	73%	0.729	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-17.6	177.5	-66.7	-172.3	137.7	0	0	113.5
818	W	34	Very low	34.8	Very low	238 Å²	238	143.7 Å²	143.7	90%	0.902	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-1.1	-174.2	-83	53.2	0	0	0	115
819	A	34.6	Very low	34.5	Very low	82 Å²	82	138.2 Å²	138.2	68%	0.678	73%	0.73	S	S	*	*	S	Bend	trans	-105.4	-20	-171	0	0	0	0	0	115.7
820	L	33	Very low	33.8	Very low	172 Å²	172	136.7 Å²	136.7	90%	0.901	73%	0.734	S	S	*	*	S	Bend	trans	-140.7	51.4	-168.1	-89.3	172.2	0	0	0	114.9
821	A	28.6	Very low	33	Very low	86 Å²	86	136.6 Å²	136.6	71%	0.711	73%	0.733	S	S	*	*			trans	-151.5	131.2	157.3	0	0	0	0	0	108.1
822	V	30.2	Very low	32.3	Very low	138 Å²	138	135.5 Å²	135.5	84%	0.836	73%	0.733	S	S	*	*			cis	-135.6	147.4	9.3	174	0	0	0	0	110
823	S	25.2	Very low	31.6	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	73%	0.734	S	S	*	*			trans	-144.3	144.6	161.3	-175.4	0	0	0	0	110.9
824	S	29.4	Very low	30.7	Very low	102 Å²	102	136.4 Å²	136.4	71%	0.713	75%	0.745	S	S	*	*			trans	66.5	152.7	179.4	84.2	0	0	0	0	116.4
825	S	29.6	Very low	30.2	Very low	92 Å²	92	135.8 Å²	135.8	64%	0.643	75%	0.745	S	S	*	*			cis	-167.4	151.2	-27.5	49.1	0	0	0	0	108.1
826	Q	28.4	Very low	29.5	Very low	175 Å²	175	135.6 Å²	135.6	82%	0.818	74%	0.744	S	S	*	*				159.1	169.4	92.7	-77.1	-161.2	11.1	0	0	107.6
827	L	30.2	Very low	28.8	Very low	139 Å²	139	133.6 Å²	133.6	73%	0.728	74%	0.737	S	S	*	*			cis	-169	171.4	-48.3	-124.3	165.9	0	0	0	108.4
828	N	27.1	Very low	28.6	Very low	140 Å²	140	132.1 Å²	132.1	75%	0.749	74%	0.74	S	S	*	*			trans	72.1	142.6	161.5	-77.6	-2.7	0	0	0	120.5
829	T	26.6	Very low	28.3	Very low	105 Å²	105	128.3 Å²	128.3	64%	0.644	73%	0.732	S	S	*	*			cis	-162.3	178.7	-18.3	-43.6	0	0	0	0	110.3
830	I	24.6	Very low	29.2	Very low	156 Å²	156	129.1 Å²	129.1	80%	0.8	73%	0.731	S	S	*	*			trans	91.4	118.5	164.3	-53.8	165.3	0	0	0	114.3
831	V	25.2	Very low	29	Very low	112 Å²	112	129.3 Å²	129.3	68%	0.679	73%	0.727	S	S	*	*			cis	113.2	107.3	7.2	177.2	0	0	0	0	114.9
832	T	24	Very low	28.8	Very low	130 Å²	130	133.6 Å²	133.6	80%	0.798	73%	0.732	S	S	*	*			trans	-174.3	130.8	138.7	30.5	0	0	0	0	107.5
833	V	28.4	Very low	29.8	Very low	120 Å²	120	132.5 Å²	132.5	73%	0.727	73%	0.727	S	S	*	*				72.6	121.9	52.6	175	0	0	0	0	110.5
834	N	26.9	Very low	29.9	Very low	124 Å²	124	131.4 Å²	131.4	66%	0.663	73%	0.725	S	S	*	*			cis	-161.7	-174.6	7.5	-133.9	4.1	0	0	0	109.4
835	H	28.1	Very low	29.9	Very low	143 Å²	143	133.6 Å²	133.6	66%	0.662	73%	0.734	S	S	*	*			cis	-166.7	-173.4	-6.5	-137.7	24.3	0	0	0	107
836	H	26	Very low	29.8	Very low	150 Å²	150	133 Å²	133	69%	0.694	74%	0.742	S	S	*	*			cis	-158.4	-174.4	-5.7	-163.8	64.5	0	0	0	110
837	H	26.4	Very low	29.7	Very low	137 Å²	137	128.4 Å²	128.4	63%	0.634	74%	0.742	S	S	*	*			trans	-88.8	170.9	171.1	-104	-71.7	0	0	0	113.7
838	P	35.1	Very low	29.8	Very low	124 Å²	124	128.2 Å²	128.2	81%	0.805	75%	0.746	S	S	*	*				-151.4	172	90.7	38.8	-18.4	0	0	0	118.2
839	H	26.5	Very low	29.9	Very low	158 Å²	158	127.2 Å²	127.2	73%	0.731	75%	0.75	S	S	*	*			trans	-104.8	-165.8	168.2	-67.9	-92.6	0	0	0	110.3
840	P	54.8	Low	30.1	Very low	100 Å²	100	125.5 Å²	125.5	65%	0.649	75%	0.753	S	S	*	*			cis	-128.2	-165.7	-34.5	20.8	3.9	0	0	0	113.5
841	H	26.8	Very low	30.4	Very low	176 Å²	176	124.6 Å²	124.6	82%	0.815	75%	0.754	S	S	*	*			trans	109	157.5	157.7	-61.6	-72.1	0	0	0	120.5
842	H	26.3	Very low	30.8	Very low	176 Å²	176	126 Å²	126	82%	0.815	76%	0.763	S	S	*	*			trans	-74.5	179.2	-179.4	-67.1	-82.6	0	0	0	113.9
843	P	49.3	Very low	31.1	Very low	114 Å²	114	123.1 Å²	123.1	74%	0.74	76%	0.759	S	S	*	*			cis	-135.5	-166.8	-44.7	38.1	-20.5	0	0	0	112.9
844	A	27.8	Very low	31.2	Very low	87 Å²	87	120.9 Å²	120.9	72%	0.719	76%	0.761	S	S	*	*			trans	84.5	130.3	147.7	0	0	0	0	0	122.8
845	V	28.8	Very low	31.5	Very low	148 Å²	148	122 Å²	122	90%	0.897	77%	0.772	S	S	*	*			trans	58.9	114.3	139.9	-178	0	0	0	0	122.1
846	G	28.1	Very low	31.5	Very low	80 Å²	80	119.3 Å²	119.3	83%	0.825	78%	0.783	S	S	*	*				97.7	159.8	128.8	0	0	0	0	0	119.8
847	G	27.8	Very low	31.8	Very low	78 Å²	78	115.7 Å²	115.7	80%	0.804	79%	0.786	S	S	*	*			trans	124.7	70.5	154.9	0	0	0	0	0	120.7
848	V	30.4	Very low	32.1	Very low	134 Å²	134	116.5 Å²	116.5	81%	0.812	80%	0.795	S	S	*	*			trans	10.7	126.4	138.9	179.8	0	0	0	0	121
849	S	30	Very low	32.1	Very low	120 Å²	120	117.9 Å²	117.9	84%	0.839	80%	0.795	S	S	*	*			trans	29.8	141.6	142.1	-49.6	0	0	0	0	124.6
850	G	30.2	Very low	32.3	Very low	68 Å²	68	115 Å²	115	70%	0.701	80%	0.798	S	S	*	*				150.8	103.8	119.1	0	0	0	0	0	123.2
851	V	31.6	Very low	31.1	Very low	137 Å²	137	113.1 Å²	113.1	83%	0.83	80%	0.798	S	S	*	*				48.6	147.5	129.3	-135.8	0	0	0	0	124.7
852	V	32.9	Very low	31.3	Very low	142 Å²	142	114.1 Å²	114.1	86%	0.861	80%	0.8	S	S	*	*			trans	77.4	142.4	161.1	-166.3	0	0	0	0	117.1
853	G	30.4	Very low	31.8	Very low	70 Å²	70	115.9 Å²	115.9	72%	0.722	80%	0.799	S	S	*	*			cis	150.4	157.6	-11.1	0	0	0	0	0	115.2
854	G	31.8	Very low	30.9	Very low	73 Å²	73	118.3 Å²	118.3	75%	0.753	80%	0.8	S	S	*	*			trans	95.8	161.9	172.3	0	0	0	0	0	116.9
855	T	32.9	Very low	31.2	Very low	147 Å²	147	120.9 Å²	120.9	90%	0.902	80%	0.797	S	S	*	*			cis	-169.1	144.3	-11.3	29.3	0	0	0	0	111.6
856	G	28.5	Very low	31.4	Very low	87 Å²	87	120 Å²	120	90%	0.897	78%	0.783	S	S	*	*			trans	78	161.2	160.9	0	0	0	0	0	118.2
857	G	32.2	Very low	31.8	Very low	73 Å²	73	123.2 Å²	123.2	75%	0.753	77%	0.774	S	S	*	*			cis	173.7	133.9	-10.9	0	0	0	0	0	115.6
858	D	32.6	Very low	32.1	Very low	155 Å²	155	126.5 Å²	126.5	83%	0.829	77%	0.774	S	S	*	*			trans	70.6	130.9	149.8	-76.3	-16.2	0	0	0	128.1
859	L	33.5	Very low	32.1	Very low	152 Å²	152	123.9 Å²	123.9	80%	0.796	77%	0.774	S	S	*	*			trans	80.7	115.5	133.3	-70.7	167.2	0	0	0	125.9
860	A	31.7	Very low	32.2	Very low	97 Å²	97	121.7 Å²	121.7	80%	0.802	77%	0.771	S	S	*	*			trans	25.9	155.4	130.9	0	0	0	0	0	123.5
861	G	30.4	Very low	32.4	Very low	62 Å²	62	125.2 Å²	125.2	64%	0.639	78%	0.778	S	S	*	*			cis	160.1	179.6	-1.8	0	0	0	0	0	113.9
862	F	30.1	Very low	32.6	Very low	196 Å²	196	124.4 Å²	124.4	86%	0.86	77%	0.773	S	S	*	*			trans	68.5	165.9	175.3	-65.3	-100.5	0	0	0	119
863	R	35.9	Very low	32.4	Very low	214 Å²	214	124.4 Å²	124.4	81%	0.808	77%	0.767	S	S	*	*			cis	178.7	144	-49.9	-147.8	-177.3	-162.4	-171.5	7	109.6
864	H	31	Very low	32.3	Very low	164 Å²	164	129.7 Å²	129.7	76%	0.759	77%	0.771	S	S	*	*			trans	-179.6	148.7	146.7	-101.1	-69.3	0	0	0	113.8
865	H	33.6	Very low	33.8	Very low	142 Å²	142	131.5 Å²	131.5	66%	0.657	77%	0.77	S	S	*	*			trans	32.8	151.2	156.6	-59.2	-61.4	0	0	0	122.7
866	E	34.7	Very low	35	Very low	129 Å²	129	130.1 Å²	130.1	60%	0.603	76%	0.763	S	S	*	*			cis	-176.3	-177.4	-10.5	-106.3	-176.9	175.1	0	0	108.5
867	K	35.1	Very low	35.3	Very low	147 Å²	147	130 Å²	130	64%	0.639	76%	0.762	S	S	*	*			cis	-155.6	172.3	-3.1	-130.9	172.9	-174.6	119.2	0	110.3
868	N	34.3	Very low	35.4	Very low	147 Å²	147	130.7 Å²	130.7	79%	0.786	77%	0.769	S	S	*	*			trans	29.9	140.1	152.4	-60.7	-5.6	0	0	0	123.2
869	G	30.3	Very low	35.4	Very low	79 Å²	79	126.6 Å²	126.6	81%	0.814	76%	0.763	S	S	*	*			cis	165.4	151.2	-8.4	0	0	0	0	0	116.8
870	G	33.1	Very low	35.4	Very low	75 Å²	75	126.3 Å²	126.3	77%	0.773	77%	0.772	S	S	*	*			trans	95.2	-180	172.3	0	0	0	0	0	115.4
871	V	34.1	Very low	35.4	Very low	142 Å²	142	125.5 Å²	125.5	86%	0.861	77%	0.773	S	S	*	*			cis	176	142.6	-23.5	126	0	0	0	0	105.8
872	V	35.3	Very low	35.5	Very low	120 Å²	120	126.8 Å²	126.8	73%	0.727	79%	0.787	S	S	*	*			cis	-163.4	170	-13.9	77.2	0	0	0	0	105
873	L	28.4	Very low	35.7	Very low	141 Å²	141	121.1 Å²	121.1	74%	0.738	78%	0.784	S	S	*	*			cis	-151.1	-143.4	35.2	-137.6	-175.5	0	0	0	111.9
874	F	29.2	Very low	35.5	Very low	181 Å²	181	116.7 Å²	116.7	79%	0.794	79%	0.786	S	S	*	*			trans	-167.4	-173.6	-159.5	-88.8	-81.9	0	0	0	109.8
875	P	63.3	Low	35.5	Very low	112 Å²	112	116.8 Å²	116.8	73%	0.727	79%	0.788	S	S	*	*			cis	-118.8	-137.4	-18.6	39.5	-20.7	0	0	0	108.6
876	P	58.1	Low	35.3	Very low	117 Å²	117	116.5 Å²	116.5	76%	0.76	79%	0.791	S	S	*	*			cis	-128.7	162.7	-29.1	35.3	-18.1	0	0	0	116.1
877	G	35.1	Very low	35.1	Very low	86 Å²	86	117.2 Å²	117.2	89%	0.887	80%	0.798	S	S	*	*			trans	83.4	169.4	160.4	0	0	0	0	0	116.8
878	G	33.9	Very low	34.7	Very low	86 Å²	86	117 Å²	117	89%	0.887	80%	0.804	S	S	*	*			cis	143.6	130	-11.9	0	0	0	0	0	113.5
879	G	33.1	Very low	34.4	Very low	69 Å²	69	119.7 Å²	119.7	71%	0.711	80%	0.803	S	S	*	*			cis	176.4	171.2	-6.2	0	0	0	0	0	113.2
880	C	33.6	Very low	34.1	Very low	146 Å²	146	123.2 Å²	123.2	99%	0.986	80%	0.799	S	S	*	*			trans	66.7	135.4	178.4	-56.9	0	0	0	0	117.2
881	G	31.6	Very low	33.7	Very low	80 Å²	80	131 Å²	131	83%	0.825	81%	0.805	S	S	*	*			cis	168.5	139.3	-13.7	0	0	0	0	0	115.3
882	G	32.2	Very low	33.8	Very low	90 Å²	90	130.1 Å²	130.1	93%	0.928	80%	0.802	S	S	*	*			trans	77.9	149.7	166.1	0	0	0	0	0	118.4
883	G	32.8	Very low	33.6	Very low	77 Å²	77	132.8 Å²	132.8	79%	0.794	81%	0.806	S	S	*	*			cis	169.6	153.5	-13	0	0	0	0	0	115.7
884	S	32	Very low	33.9	Very low	121 Å²	121	131.9 Å²	131.9	85%	0.846	81%	0.809	S	S	*	*			trans	83.7	101.6	156.2	-139.3	0	0	0	0	124.5
885	M	30.8	Very low	33.9	Very low	165 Å²	165	127.2 Å²	127.2	81%	0.813	80%	0.804	S	S	*	*				50.8	137.2	120.1	-92.3	-174.1	172.5	0	0	128
886	L	30.8	Very low	32.9	Very low	136 Å²	136	127.2 Å²	127.2	71%	0.712	80%	0.804	S	S	*	*			trans	93.7	126.4	134.2	-72.7	166.7	0	0	0	125.2
887	L	30.9	Very low	31.3	Very low	145 Å²	145	127.1 Å²	127.1	76%	0.759	80%	0.804	S	S	*	*			trans	73.3	160.3	137.9	-78.9	169.6	0	0	0	124.8
888	D	25.4	Very low	31	Very low	141 Å²	141	129.6 Å²	129.6	75%	0.754	80%	0.802	S	S	*	*			trans	-66.8	165.1	-171.9	-55	-79.6	0	0	0	116.3
889	R	27.7	Very low	30.7	Very low	204 Å²	204	132 Å²	132	77%	0.77	80%	0.799	S	S	*	*				148.7	134.9	104.1	-170.3	167.1	168.7	137.8	14	116.1
890	E	24.7	Very low	30.2	Very low	154 Å²	154	131.5 Å²	131.5	72%	0.72	80%	0.795	S	S	*	*			trans	67.6	165.2	154.7	-80.7	165	171	0	0	124.3
891	R	24.8	Very low	30	Very low	238 Å²	238	134.3 Å²	134.3	90%	0.898	79%	0.791	S	S	*	*			trans	-81	174.5	177.3	-65.8	179	180	176.8	0.3	110.2
892	P	37	Very low	30	Very low	123 Å²	123	136 Å²	136	80%	0.799	79%	0.785	S	S	*	*			cis	-146.6	-162.7	24.8	43	-20	0	0	0	117.9
893	Q	30.4	Very low	29.7	Very low	177 Å²	177	138.2 Å²	138.2	83%	0.827	78%	0.775	S	S	*	*			trans	-55.7	171.7	168.1	-64.1	176.8	-10.4	0	0	113.2
894	P	35.2	Very low	29.4	Very low	122 Å²	122	139.1 Å²	139.1	79%	0.792	77%	0.768	S	S	*	*			cis	-144	-168.9	22.4	41.3	-19	0	0	0	117.8
895	A	28.1	Very low	29.2	Very low	83 Å²	83	140.4 Å²	140.4	69%	0.686	77%	0.765	S	S	*	*			trans	-77.4	-175.5	162.3	0	0	0	0	0	110.8
896	P	43.6	Very low	29.1	Very low	111 Å²	111	143 Å²	143	72%	0.721	77%	0.767	S	S	*	*			cis	-146.1	178	14.7	44.4	-24	0	0	0	119
897	C	23.4	Very low	28.9	Very low	115 Å²	115	139.4 Å²	139.4	78%	0.777	76%	0.763	S	S	*	*			trans	39	134.5	148.1	-63.2	0	0	0	0	123.3
898	T	28.1	Very low	28.8	Very low	138 Å²	138	139.7 Å²	139.7	85%	0.847	77%	0.771	S	S	*	*				-178.2	143.6	110.7	26	0	0	0	0	116.5
899	V	27.8	Very low	29.1	Very low	136 Å²	136	139.4 Å²	139.4	82%	0.824	77%	0.774	S	S	*	*			trans	30.7	107.4	144.5	-168.9	0	0	0	0	123
900	G	23.9	Very low	29.7	Very low	60 Å²	60	135.1 Å²	135.1	62%	0.619	77%	0.773	S	S	*	*				59.9	135.7	98.2	0	0	0	0	0	125.3
901	F	28	Very low	29.8	Very low	205 Å²	205	137 Å²	137	90%	0.899	78%	0.778	S	S	*	*			trans	70.2	151.5	153.3	-85	-78.6	0	0	0	118.6
902	V	32	Very low	29.9	Very low	114 Å²	114	132.6 Å²	132.6	69%	0.691	77%	0.772	S	S	*	*			cis	-144.8	160.5	4	-158	0	0	0	0	110.8
903	D	27.4	Very low	29.2	Very low	137 Å²	137	136.7 Å²	136.7	73%	0.733	78%	0.777	S	S	*	*				115.1	141.6	125.8	-111.2	-34.6	0	0	0	126.6
904	C	24.7	Very low	29.1	Very low	96 Å²	96	135.7 Å²	135.7	65%	0.649	77%	0.772	S	S	*	*			trans	41.9	132.6	152.9	-84.2	0	0	0	0	125.2
905	L	29.3	Very low	28.6	Very low	148 Å²	148	138.1 Å²	138.1	78%	0.775	78%	0.778	S	S	*	*				179.4	142.6	92.2	-82.2	176.3	0	0	0	113.2
906	Y	28.3	Very low	28.5	Very low	220 Å²	220	141.9 Å²	141.9	86%	0.863	78%	0.781	S	S	*	*			trans	5	152.5	161.8	-60.2	-102.2	0	0	0	123.1
907	G	27.3	Very low	27.6	Very low	60 Å²	60	143.4 Å²	143.4	62%	0.619	79%	0.788	S	S	*	*			cis	130.6	140	-6.6	0	0	0	0	0	115.6
908	T	27.9	Very low	27.6	Very low	151 Å²	151	146.7 Å²	146.7	93%	0.926	79%	0.791	S	S	*	*			trans	178.3	157.1	148.9	23.7	0	0	0	0	112.7
909	V	32.3	Very low	28.8	Very low	136 Å²	136	145.1 Å²	145.1	82%	0.824	78%	0.784	S	S	*	*			trans	-151.4	160.8	-175.1	-174.1	0	0	0	0	109.5
910	P	39.6	Very low	29	Very low	114 Å²	114	144.9 Å²	144.9	74%	0.74	79%	0.785	S	S	*	*			trans	-136.9	118.5	148.4	34.9	-19.6	0	0	0	116.8
911	K	26.2	Very low	29.1	Very low	192 Å²	192	145 Å²	145	84%	0.835	79%	0.786	S	S	*	*			trans	65.2	130.9	147.9	-56.8	176.7	-178.4	178.3	0	119.4
912	L	27.1	Very low	29	Very low	147 Å²	147	143.7 Å²	143.7	77%	0.77	79%	0.785	S	S	*	*			cis	96.6	110.5	37	-98.3	152.7	0	0	0	115.4
913	K	23.8	Very low	28.6	Very low	208 Å²	208	145.2 Å²	145.2	90%	0.904	78%	0.784	S	S	*	*				-160.9	139.7	127.8	-124.2	-179.1	-179.7	-175.3	0	111.7
914	E	26.4	Very low	29	Very low	156 Å²	156	149.6 Å²	149.6	73%	0.729	79%	0.792	S	S	*	*			trans	-98.3	163.6	171.4	-56.4	166.8	113.2	0	0	110.6
915	L	24.6	Very low	29.6	Very low	174 Å²	174	149.6 Å²	149.6	91%	0.911	79%	0.791	S	S	*	*			trans	-159.4	159.6	131.5	-134.6	72.4	0	0	0	111.8
916	H	26.3	Very low	29.8	Very low	162 Å²	162	149.7 Å²	149.7	75%	0.75	79%	0.792	S	S	*	*			trans	-84.2	165.6	-178.8	-59.5	5.3	0	0	0	113.2
917	V	24.8	Very low	30	Very low	142 Å²	142	146.1 Å²	146.1	86%	0.861	79%	0.787	S	S	*	*				174.8	152.8	113.1	152.9	0	0	0	0	110.9
918	H	24.3	Very low	30.1	Very low	184 Å²	184	150.2 Å²	150.2	85%	0.852	79%	0.79	S	S	*	*			trans	-104.6	176.2	-176.1	-107	-41.2	0	0	0	112.7
919	P	51.9	Low	30.2	Very low	105 Å²	105	150.5 Å²	150.5	68%	0.682	78%	0.781	S	S	*	*			trans	-90.6	-176.9	-159.2	40.5	-41.3	0	0	0	114.7
920	P	33.7	Very low	30	Very low	132 Å²	132	150.6 Å²	150.6	86%	0.857	78%	0.777	S	S	*	*				-134.9	173.5	95.9	39	-28.7	0	0	0	112.7
921	G	25.1	Very low	29.4	Very low	62 Å²	62	149.9 Å²	149.9	64%	0.639	78%	0.781	S	S	*	*			cis	157.5	168.4	-2.2	0	0	0	0	0	110.8
922	M	25.4	Very low	29.5	Very low	177 Å²	177	151.9 Å²	151.9	87%	0.872	78%	0.783	S	S	*	*			trans	69.4	138.4	178.6	-70.7	179.4	163	0	0	117.6
923	Q	23.7	Very low	29.5	Very low	146 Å²	146	152.6 Å²	152.6	68%	0.682	79%	0.787	S	S	*	*			cis	-161	146.2	-20.3	-152.3	159.6	-5.8	0	0	112.6
924	Y	36.3	Very low	29.6	Very low	230 Å²	230	150.1 Å²	150.1	90%	0.902	78%	0.776	S	S	*	*			trans	-145.7	149.6	156.2	-100.5	-80.2	0	0	0	107
925	P	38.2	Very low	29.8	Very low	95 Å²	95	149.4 Å²	149.4	62%	0.617	77%	0.773	S	S	*	*			trans	-138.4	126.3	156	32.8	-16.1	0	0	0	114.2
926	D	32.3	Very low	29.9	Very low	151 Å²	151	146.9 Å²	146.9	81%	0.807	77%	0.765	S	S	*	*			trans	53.1	148	131.2	-57.8	-16.3	0	0	0	120.8
927	L	32.1	Very low	29.9	Very low	144 Å²	144	146.2 Å²	146.2	75%	0.754	77%	0.766	S	S	*	*				-145.1	141.2	54.5	-97.8	84	0	0	0	115.2
928	Q	30.2	Very low	29.9	Very low	146 Å²	146	145.9 Å²	145.9	68%	0.682	76%	0.759	S	S	*	*				45.1	155.3	127.7	-76.2	171.3	-54.2	0	0	121.7
929	Q	29.2	Very low	30.1	Very low	157 Å²	157	146.2 Å²	146.2	73%	0.734	76%	0.758	S	S	*	*			cis	-154.6	171.6	24.5	-147.2	149.4	9.1	0	0	114.8
930	D	29.1	Very low	28.8	Very low	138 Å²	138	145.9 Å²	145.9	74%	0.738	76%	0.759	S	S	*	*			trans	-46.3	172.5	-176.4	-53.9	-79.2	0	0	0	119.1
931	A	26.8	Very low	28.5	Very low	100 Å²	100	144.8 Å²	144.8	83%	0.826	76%	0.76	S	S	*	*			cis	-153.2	-172.1	17.6	0	0	0	0	0	114.5
932	R	27	Very low	28.6	Very low	234 Å²	234	145.3 Å²	145.3	88%	0.883	77%	0.766	S	S	*	*			trans	-126.7	170.5	-175.8	-83.1	-178.7	168.4	-176.9	-1.8	114.7
933	L	28.6	Very low	28.7	Very low	162 Å²	162	147.3 Å²	147.3	85%	0.848	77%	0.77	S	S	*	*			trans	115	135.1	158.6	-78.6	95.4	0	0	0	114.3
934	K	26.2	Very low	28.8	Very low	155 Å²	155	144.1 Å²	144.1	67%	0.674	78%	0.776	S	S	*	*			cis	100.2	109.8	11.5	-153	-169	-164.9	-73.6	0	115.8
935	E	29	Very low	28.4	Very low	142 Å²	142	143 Å²	143	66%	0.664	78%	0.776	S	S	*	*			trans	87.2	118.8	144	-102.5	154.8	-146.9	0	0	125.7
936	T	27	Very low	27.7	Very low	121 Å²	121	144.4 Å²	144.4	74%	0.742	78%	0.783	S	S	*	*			trans	84.6	141.5	132.6	28.6	0	0	0	0	126.8
937	L	26.6	Very low	27.3	Very low	147 Å²	147	143.7 Å²	143.7	77%	0.77	78%	0.779	S	S	*	*			trans	84.9	100.6	143.3	-73	167.2	0	0	0	123.9
938	L	25.8	Very low	27.1	Very low	136 Å²	136	144.6 Å²	144.6	71%	0.712	78%	0.779	S	S	*	*				39	145	118.9	-84.9	170.2	0	0	0	124.4
939	F	28	Very low	27.1	Very low	190 Å²	190	145.6 Å²	145.6	83%	0.833	78%	0.784	S	S	*	*			trans	69.4	149.7	163.2	-74.4	-63.4	0	0	0	117.1
940	S	25.4	Very low	27.2	Very low	99 Å²	99	144 Å²	144	69%	0.692	79%	0.785	S	S	*	*			cis	-160.2	165.8	-8.6	58.9	0	0	0	0	111.6
941	A	25.6	Very low	27.1	Very low	108 Å²	108	146.2 Å²	146.2	89%	0.893	79%	0.791	S	S	*	*			trans	60.9	150.4	160.3	0	0	0	0	0	118.7
942	G	27.5	Very low	27.3	Very low	74 Å²	74	150.3 Å²	150.3	76%	0.763	79%	0.79	S	S	*	*			trans	-148.7	168.1	-178.3	0	0	0	0	0	113.9
943	K	27.1	Very low	27.5	Very low	218 Å²	218	143 Å²	143	95%	0.948	78%	0.775	S	S	*	*			trans	-166.1	139.4	171.9	-118.1	179.7	-178.4	179.8	0	110.8
944	G	25.9	Very low	27.7	Very low	79 Å²	79	140.8 Å²	140.8	81%	0.814	76%	0.764	S	S	*	*			trans	88.4	135.1	157.8	0	0	0	0	0	117.4
945	F	28.2	Very low	28	Very low	207 Å²	207	142.3 Å²	142.3	91%	0.908	77%	0.767	S	S	*	*			trans	-60.8	159.5	162.6	-80.7	-108.2	0	0	0	110.4
946	T	23.7	Very low	28.2	Very low	125 Å²	125	141 Å²	141	77%	0.767	76%	0.764	S	S	*	*			cis	-149.7	148.4	46.7	50.8	0	0	0	0	116.7
947	D	23.8	Very low	28.6	Very low	135 Å²	135	140.9 Å²	140.9	72%	0.722	76%	0.755	S	S	*	*			trans	80.4	155.5	145.4	-114.1	-42.3	0	0	0	123.8
948	H	29.4	Very low	28.9	Very low	163 Å²	163	139.8 Å²	139.8	76%	0.755	75%	0.749	S	S	*	*			trans	63.2	99.6	169.4	-70.3	-57.6	0	0	0	122.2
949	Q	29.7	Very low	29.2	Very low	168 Å²	168	141.4 Å²	141.4	79%	0.785	75%	0.746	S	S	*	*				-22	155.9	128.7	-65.5	175	-22.3	0	0	116.2
950	T	30.4	Very low	29.5	Very low	122 Å²	122	135.6 Å²	135.6	75%	0.748	73%	0.733	S	S	*	*			cis	-172.9	153.2	-7.5	30	0	0	0	0	108.4
951	Q	28.4	Very low	29.7	Very low	185 Å²	185	138.1 Å²	138.1	86%	0.864	73%	0.731	S	S	*	*			trans	-147.5	112.7	152.7	-124.2	176.4	0.4	0	0	111.2
952	K	29.7	Very low	30.1	Very low	186 Å²	186	139.4 Å²	139.4	81%	0.809	72%	0.723	S	S	*	*			trans	-155	29.9	179.2	-154.5	-179.4	178.6	179.2	0	112.9
953	S	32.2	Very low	30.4	Very low	81 Å²	81	143.7 Å²	143.7	57%	0.566	72%	0.723	S	S	*	*			trans	-82.6	-47.3	-174.5	-164.3	0	0	0	0	112.3	Y955 L956	S953-Y955 VanDerWaalsContact C-N 3.25Å; S953-Y955 PolarHBondContact O-N 3.12Å; S953-Y955 VanDerWaalsContact O-N 3.1Å; S953-L956 PolarHBondContact O-N 3.24Å
954	D	33	Very low	30.8	Very low	115 Å²	115	138.9 Å²	138.9	62%	0.615	71%	0.712	S	S	*	*	H	α-helix	trans	-65.4	-26.5	-160.4	-50.8	16.3	0	0	0	113.3	L956	D954-L956 VanDerWaalsContact C-N 3.33Å; D954-L956 PolarHBondContact O-N 3.29Å
955	Y	31.3	Very low	31.3	Very low	187 Å²	187	142.5 Å²	142.5	73%	0.733	71%	0.705	S	S	*	*	H	α-helix	trans	-70.1	-25.8	178	-167.2	-98.8	0	0	0	113.5	S953	S953-Y955 VanDerWaalsContact C-N 3.25Å; S953-Y955 PolarHBondContact O-N 3.12Å; S953-Y955 VanDerWaalsContact O-N 3.1Å
956	L	33.7	Very low	31.5	Very low	115 Å²	115	136.5 Å²	136.5	60%	0.602	69%	0.687	S	S	*	*	H	α-helix	trans	-84.2	-33.9	-179.8	-74.4	165.5	0	0	0	112.4	S953 D954 R959 A960	S953-L956 PolarHBondContact O-N 3.24Å; D954-L956 VanDerWaalsContact C-N 3.33Å; D954-L956 PolarHBondContact O-N 3.29Å; L956-R959 WeakPolarHBondContact O-CB 3.48Å; L956-R959 PolarHBondContact O-N 2.99Å; L956-R959 VanDerWaalsContact O-N 3.17Å; L956-A960 PolarHBondContact O-N 3.24Å
957	E	34.8	Very low	31.9	Very low	118 Å²	118	135.7 Å²	135.7	55%	0.551	68%	0.678	S	S	*	*	H	α-helix	trans	-71.5	-33.3	-177.5	-146.1	-162.8	135.4	0	0	112.8	R959 K961	E957-R959 VanDerWaalsContact C-N 3.34Å; E957-K961 IonicContact OE1-NZ 3.13Å; E957-K961 PolarHBondContact OE1-NZ 3.47Å
958	L	32.6	Very low	32.6	Very low	124 Å²	124	137.4 Å²	137.4	65%	0.649	68%	0.675	S	S	*	*	H	α-helix	trans	-66	-34.1	169.4	-90.1	126.3	0	0	0	112.6	A960 K961	L958-A960 VanDerWaalsContact C-N 3.34Å; L958-A960 PolarHBondContact O-N 3.24Å; L958-K961 PolarHBondContact O-N 2.87Å
959	R	33.4	Very low	33	Very low	170 Å²	170	133.6 Å²	133.6	64%	0.642	66%	0.66	S	S	*	*	H	α-helix	trans	-67.9	-33.7	178.6	-169.4	172.1	179.7	163.8	0.1	112.2	L956 E957	L956-R959 WeakPolarHBondContact O-CB 3.48Å; L956-R959 PolarHBondContact O-N 2.99Å; L956-R959 VanDerWaalsContact O-N 3.17Å; E957-R959 VanDerWaalsContact C-N 3.34Å
960	A	33.4	Very low	33.3	Very low	69 Å²	69	129.4 Å²	129.4	57%	0.57	64%	0.641	S	S	*	*	H	α-helix	trans	-71.7	-32.6	178.3	0	0	0	0	0	113.8	L956 L958 L962	L956-A960 PolarHBondContact O-N 3.24Å; L958-A960 VanDerWaalsContact C-N 3.34Å; L958-A960 PolarHBondContact O-N 3.24Å; A960-L962 VanDerWaalsContact C-N 3.29Å; A960-L962 PolarHBondContact O-N 3.34Å
961	K	30.2	Very low	33.8	Very low	151 Å²	151	126.9 Å²	126.9	66%	0.657	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	2.2	-176.9	-80	165.8	177	154.8	0	115	E957 L958	E957-K961 IonicContact OE1-NZ 3.13Å; E957-K961 PolarHBondContact OE1-NZ 3.47Å; L958-K961 PolarHBondContact O-N 2.87Å
962	L	33.8	Very low	34.4	Very low	136 Å²	136	121 Å²	121	71%	0.712	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.5	-1.5	-179	-81	163.1	0	0	0	114.5	A960 T964	A960-L962 VanDerWaalsContact C-N 3.29Å; A960-L962 PolarHBondContact O-N 3.34Å; L962-T964 PolarHBondContact O-N 3.42Å; L962-T964 VanDerWaalsContact O-N 3.08Å
963	Q	33.3	Very low	34.6	Very low	164 Å²	164	117.9 Å²	117.9	77%	0.766	59%	0.587	S	S	*	*			trans	-85.5	43.5	-177	-68.7	-166.3	-66.6	0	0	114.5
964	T	35.4	Very low	34.8	Very low	117 Å²	117	120.5 Å²	120.5	72%	0.718	59%	0.589	S	S	*	*	S	Bend	trans	-126.6	112.8	165.5	53.1	0	0	0	0	109.1	L962	L962-T964 PolarHBondContact O-N 3.42Å; L962-T964 VanDerWaalsContact O-N 3.08Å
965	K	37.4	Very low	34.9	Very low	155 Å²	155	119.1 Å²	119.1	67%	0.674	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-55.9	126.4	171.4	-68.7	176	174.5	175.7	0	108.7	E54	E54-K965 IonicContact OE1-NZ 2.59Å; E54-K965 PolarHBondContact OE1-NZ 2.99Å; E54-K965 IonicContact OE2-NZ 2.64Å; E54-K965 PolarHBondContact OE2-NZ 3.32Å
966	P	31.4	Very low	35.1	Very low	80 Å²	80	115.1 Å²	115.1	52%	0.519	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-70.4	145.9	171.1	31.5	-34.6	0	0	0	109.5	V971	P966-V971 HydrophobicContact CB-CG2 3.69Å; P966-V971 HydrophobicContact CG-CG2 3.55Å
967	D	33.4	Very low	34.8	Very low	108 Å²	108	119.7 Å²	119.7	58%	0.578	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-64.7	143.2	170.4	-165.6	-25	0	0	0	109	L969 E970 V971	D967-L969 PolarHBondContact O-N 3.47Å; D967-L969 PolarHBondContact OD1-N 3.03Å; D967-E970 HydrophobicContact CB-CB 4.26Å; D967-E970 WeakPolarHBondContact O-CA 3.44Å; D967-E970 WeakPolarHBondContact O-CB 3.46Å; D967-E970 PolarHBondContact O-N 3.11Å; D967-V971 PolarHBondContact O-N 2.91Å; D967-V971 VanDerWaalsContact O-N 3.13Å
968	Y	37.2	Very low	34.6	Very low	171 Å²	171	124.6 Å²	124.6	67%	0.671	60%	0.604	S	S	*	*	H	α-helix	trans	-62.1	-27.7	-178.4	-167.5	-100.5	0	0	0	112	L972	Y968-L972 HydrophobicContact CD1-CD1 4.02Å; Y968-L972 HydrophobicContact CE1-CD1 3.9Å; Y968-L972 WeakPolarHBondContact O-CD1 3.25Å; Y968-L972 WeakPolarHBondContact O-CG 3.41Å
969	L	39.2	Very low	34.6	Very low	83 Å²	83	131.5 Å²	131.5	44%	0.435	63%	0.629	S	S	.	*	H	α-helix	trans	-68.9	-40.3	168.3	-107	73.9	0	0	0	112.6	D967 V971 L972 E973	D967-L969 PolarHBondContact O-N 3.47Å; D967-L969 PolarHBondContact OD1-N 3.03Å; L969-V971 VanDerWaalsContact C-N 3.34Å; L969-V971 PolarHBondContact O-N 3.31Å; L969-L972 WeakPolarHBondContact O-CB 3.14Å; L969-L972 PolarHBondContact O-N 3.47Å; L969-L972 VanDerWaalsContact O-N 3.13Å; L969-E973 PolarHBondContact O-N 3.33Å
970	E	35.6	Very low	34.7	Very low	81 Å²	81	129.6 Å²	129.6	38%	0.379	63%	0.629	S	S	.	*	H	α-helix	trans	-68.3	-33.4	-176.4	-158.5	-164.1	159.4	0	0	112.1	D967 L972 K974	D967-E970 HydrophobicContact CB-CB 4.26Å; D967-E970 WeakPolarHBondContact O-CA 3.44Å; D967-E970 WeakPolarHBondContact O-CB 3.46Å; D967-E970 PolarHBondContact O-N 3.11Å; E970-L972 VanDerWaalsContact C-N 3.34Å; E970-K974 HydrophobicContact CG-CD 4.38Å; E970-K974 VanDerWaalsContact O-CB 3.3Å; E970-K974 WeakPolarHBondContact O-CB 3.28Å; E970-K974 WeakPolarHBondContact O-CG 3.46Å; E970-K974 PolarHBondContact O-N 3.38Å; E970-K974 WeakPolarHBondContact OE1-CE 3.39Å; E970-K974 IonicContact OE1-NZ 3.98Å; E970-K974 PolarHBondContact OE1-NZ 3.32Å
971	V	40.9	Very low	34.7	Very low	69 Å²	69	132.7 Å²	132.7	42%	0.418	63%	0.632	S	S	.	*	H	α-helix	trans	-65.6	-37.6	172	-177.3	0	0	0	0	111.5	P966 D967 L969 T975	P966-V971 HydrophobicContact CB-CG2 3.69Å; P966-V971 HydrophobicContact CG-CG2 3.55Å; D967-V971 PolarHBondContact O-N 2.91Å; D967-V971 VanDerWaalsContact O-N 3.13Å; L969-V971 VanDerWaalsContact C-N 3.34Å; L969-V971 PolarHBondContact O-N 3.31Å; V971-T975 PolarHBondContact O-N 3.3Å; V971-T975 PolarHBondContact O-OG1 3.12Å
972	L	39.6	Very low	35	Very low	62 Å²	62	131.7 Å²	131.7	33%	0.325	63%	0.63	S	S	.	*	H	α-helix	trans	-72.3	-44.8	176.7	-70.6	168	0	0	0	111.6	Y968 L969 E970 K974 T975 T976	Y968-L972 HydrophobicContact CD1-CD1 4.02Å; Y968-L972 HydrophobicContact CE1-CD1 3.9Å; Y968-L972 WeakPolarHBondContact O-CD1 3.25Å; Y968-L972 WeakPolarHBondContact O-CG 3.41Å; L969-L972 WeakPolarHBondContact O-CB 3.14Å; L969-L972 PolarHBondContact O-N 3.47Å; L969-L972 VanDerWaalsContact O-N 3.13Å; E970-L972 VanDerWaalsContact C-N 3.34Å; L972-K974 VanDerWaalsContact C-N 3.34Å; L972-K974 PolarHBondContact O-N 2.82Å; L972-T975 WeakPolarHBondContact CA-OG1 3.41Å; L972-T975 PolarHBondContact O-N 3.18Å; L972-T975 VanDerWaalsContact O-N 3.09Å; L972-T975 PolarHBondContact O-OG1 3.07Å; L972-T976 PolarHBondContact O-N 3.18Å; L972-T976 PolarHBondContact O-OG1 3.14Å
973	E	35.2	Very low	35.1	Very low	119 Å²	119	131.5 Å²	131.5	56%	0.556	63%	0.625	S	S	*	*	H	α-helix	trans	-62.2	-40.6	176.8	-72.9	-172.7	152.8	0	0	112	L969 T975 T976 Y977	L969-E973 PolarHBondContact O-N 3.33Å; E973-T975 PolarHBondContact O-N 2.89Å; E973-T976 WeakPolarHBondContact CA-OG1 3.36Å; E973-T976 PolarHBondContact O-N 3.41Å; E973-T976 PolarHBondContact O-OG1 3.17Å; E973-Y977 PolarHBondContact O-N 3.5Å
974	K	35.1	Very low	35.2	Very low	136 Å²	136	129.4 Å²	129.4	59%	0.591	62%	0.617	S	S	*	*	H	α-helix	trans	-68.4	-17.4	175.1	-79	171.3	170.9	166.9	0	114.4	E970 L972	E970-K974 HydrophobicContact CG-CD 4.38Å; E970-K974 VanDerWaalsContact O-CB 3.3Å; E970-K974 WeakPolarHBondContact O-CB 3.28Å; E970-K974 WeakPolarHBondContact O-CG 3.46Å; E970-K974 PolarHBondContact O-N 3.38Å; E970-K974 WeakPolarHBondContact OE1-CE 3.39Å; E970-K974 IonicContact OE1-NZ 3.98Å; E970-K974 PolarHBondContact OE1-NZ 3.32Å; L972-K974 VanDerWaalsContact C-N 3.34Å; L972-K974 PolarHBondContact O-N 2.82Å
975	T	35.7	Very low	35.2	Very low	86 Å²	86	130.3 Å²	130.3	53%	0.528	61%	0.61	S	S	.	*	H	α-helix	trans	-91.6	-26.3	172.5	39.4	0	0	0	0	113	V971 L972 E973	V971-T975 PolarHBondContact O-N 3.3Å; V971-T975 PolarHBondContact O-OG1 3.12Å; L972-T975 WeakPolarHBondContact CA-OG1 3.41Å; L972-T975 PolarHBondContact O-N 3.18Å; L972-T975 VanDerWaalsContact O-N 3.09Å; L972-T975 PolarHBondContact O-OG1 3.07Å; E973-T975 PolarHBondContact O-N 2.89Å
976	T	35.2	Very low	35	Very low	104 Å²	104	128.5 Å²	128.5	64%	0.638	61%	0.605	S	S	*	*	H	α-helix	trans	-71.5	-22.8	171.8	38.2	0	0	0	0	115.1	L972 E973	L972-T976 PolarHBondContact O-N 3.18Å; L972-T976 PolarHBondContact O-OG1 3.14Å; E973-T976 WeakPolarHBondContact CA-OG1 3.36Å; E973-T976 PolarHBondContact O-N 3.41Å; E973-T976 PolarHBondContact O-OG1 3.17Å
977	Y	28.8	Very low	35.3	Very low	211 Å²	211	132.2 Å²	132.2	83%	0.827	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	22.1	-177.6	-86.4	-72.6	0	0	0	114.8	E973	E973-Y977 PolarHBondContact O-N 3.5Å
978	R	30.8	Very low	35.4	Very low	221 Å²	221	134.3 Å²	134.3	83%	0.834	62%	0.615	S	S	*	*			trans	-141.1	22.7	-176.8	-132.1	179.5	-168	-169.4	3.1	116.6
979	F	31.9	Very low	35.3	Very low	268 Å²	268	130.9 Å²	130.9	100%	1.175	61%	0.61	S	S	*	*			trans	-136.1	0	166.5	-78.3	-77.1	0	0	0	109.5

Retrieved 979 of 979 residues in 287.3 ms (Link to these results)

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