A0A096N6E3_PAPAN Loading...

Hyaluronan and proteoglycan link protein 1

Stabilizes the aggregates of proteoglycan monomers with hyaluronic acid in the extracellular cartilage matrix.

AlphaFold DB (G7MV77), UniProt , Accession A0A096N6E3, Species PAPAN (Papio anubis, Olive baboon), Gene HAPLN1, Length 354 aa.

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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	41.7	Very low	40.3	Very low	229 Å²	229	151.6 Å²	151.6	100%	1.128	81%	0.813	S	S	*	*				0	130.5	0	-81.1	163.1	62.4	0	0	108.9
2	K	37.2	Very low	40.6	Very low	196 Å²	196	149.5 Å²	149.5	85%	0.852	80%	0.8	S	S	*	*			trans	71.3	94.2	172.7	-56.3	-177.4	180	-177.5	0	114.7
3	S	39.6	Very low	40.1	Very low	103 Å²	103	147.1 Å²	147.1	72%	0.72	80%	0.799	S	S	*	*				63.1	106.2	69.3	-160.1	0	0	0	0	113.6
4	L	40.1	Very low	39.6	Very low	166 Å²	166	152.9 Å²	152.9	87%	0.869	80%	0.804	S	S	*	*			trans	-143.2	106.8	154.9	-106.4	126.8	0	0	0	107.5
5	L	41.4	Very low	39.4	Very low	138 Å²	138	149.3 Å²	149.3	72%	0.723	81%	0.805	S	S	*	*			trans	-76.6	133.7	166.7	-86.9	99.2	0	0	0	109.1	L7	L5-L7 HydrophobicContact CD2-CD1 4.49Å
6	L	41.6	Very low	39.1	Very low	158 Å²	158	149.5 Å²	149.5	83%	0.827	81%	0.806	S	S	*	*			trans	-122.2	114	155.6	-102.5	120.4	0	0	0	107.8
7	L	39.1	Very low	38.9	Very low	141 Å²	141	151.8 Å²	151.8	74%	0.738	81%	0.81	S	S	*	*			trans	-76	130.4	168.8	-84.2	103.6	0	0	0	109.5	L5	L5-L7 HydrophobicContact CD2-CD1 4.49Å
8	V	40.1	Very low	38.6	Very low	122 Å²	122	151.8 Å²	151.8	74%	0.739	81%	0.809	S	S	*	*			trans	-122.2	115.4	159.7	179	0	0	0	0	107.4
9	L	38.5	Very low	38.3	Very low	165 Å²	165	149.7 Å²	149.7	86%	0.864	81%	0.807	S	S	*	*			trans	-79	113.8	173.2	-75.4	158.8	0	0	0	108.6
10	I	43.1	Very low	38	Very low	140 Å²	140	148 Å²	148	72%	0.718	80%	0.798	S	S	*	*			trans	-96.5	103.2	167.4	-56.6	175.2	0	0	0	106.6	I12	I10-I12 HydrophobicContact CG2-CD1 4.35Å; I10-I12 HydrophobicContact CG2-CG1 3.76Å; I10-I12 PolarHBondContact O-N 3.4Å
11	S	41.2	Very low	37.8	Very low	110 Å²	110	148.2 Å²	148.2	77%	0.769	80%	0.799	S	S	*	*			trans	-79.6	109.4	168.4	-174.2	0	0	0	0	108.1
12	I	43.8	Very low	37.2	Very low	126 Å²	126	146.5 Å²	146.5	65%	0.646	78%	0.781	S	S	*	*			trans	-100	101.9	173.5	-50.5	173.4	0	0	0	105.6	I10 W14	I10-I12 HydrophobicContact CG2-CD1 4.35Å; I10-I12 HydrophobicContact CG2-CG1 3.76Å; I10-I12 PolarHBondContact O-N 3.4Å; I12-W14 PolarHBondContact O-N 2.01Å
13	C	34.1	Very low	37	Very low	118 Å²	118	143 Å²	143	80%	0.797	78%	0.776	S	S	*	*			trans	-70.1	117.5	169.6	-85.6	0	0	0	0	108.9
14	W	33.3	Very low	36.9	Very low	228 Å²	228	145.5 Å²	145.5	86%	0.864	78%	0.781	S	S	*	*			trans	-79	122.2	161.7	-65.6	-11.2	0	0	0	108	I12	I12-W14 PolarHBondContact O-N 2.01Å
15	A	36.3	Very low	36.6	Very low	99 Å²	99	144.5 Å²	144.5	82%	0.818	78%	0.776	S	S	*	*			trans	-90.8	114.2	167.5	0	0	0	0	0	107.5
16	D	34.3	Very low	36.6	Very low	153 Å²	153	145.2 Å²	145.2	82%	0.818	78%	0.776	S	S	*	*			trans	-64.8	132.9	173	-76.7	-40.5	0	0	0	110.5	L18	D16-L18 PolarHBondContact O-N 2.93Å
17	H	35.1	Very low	36.5	Very low	189 Å²	189	144.9 Å²	144.9	88%	0.875	78%	0.775	S	S	*	*			trans	-72.8	106.8	172.9	-115.7	-73.5	0	0	0	109.1
18	L	33.7	Very low	36.4	Very low	151 Å²	151	148.8 Å²	148.8	79%	0.791	78%	0.78	S	S	*	*			trans	-100.2	119.6	161.8	-130.9	81.6	0	0	0	109.1	D16 D20	D16-L18 PolarHBondContact O-N 2.93Å; L18-D20 PolarHBondContact O-N 3.07Å
19	S	33.2	Very low	36.6	Very low	112 Å²	112	148.2 Å²	148.2	78%	0.783	78%	0.776	S	S	*	*			trans	-76	100.3	175.3	53.5	0	0	0	0	110.2	N21	S19-N21 PolarHBondContact O-N 3.15Å
20	D	33.5	Very low	36.6	Very low	115 Å²	115	146.5 Å²	146.5	62%	0.615	77%	0.767	S	S	*	*			trans	-80.1	109.4	169.4	-91.9	-13.1	0	0	0	110.1	L18 Y22	L18-D20 PolarHBondContact O-N 3.07Å; D20-Y22 VanDerWaalsContact C-N 3.34Å; D20-Y22 HydrophobicContact CB-CD2 3.77Å; D20-Y22 HydrophobicContact CB-CE2 3.62Å; D20-Y22 PolarHBondContact O-N 2.78Å; D20-Y22 VanDerWaalsContact O-N 3.17Å
21	N	32.3	Very low	36.4	Very low	154 Å²	154	147.6 Å²	147.6	82%	0.824	77%	0.768	S	S	*	*			trans	-82.9	78.1	172.9	-157.5	16.1	0	0	0	108.4	S19 T23	S19-N21 PolarHBondContact O-N 3.15Å; N21-T23 PolarHBondContact O-N 3.44Å; N21-T23 VanDerWaalsContact O-N 3.11Å
22	Y	29.3	Very low	36.6	Very low	192 Å²	192	149.6 Å²	149.6	75%	0.753	77%	0.77	S	S	*	*			trans	-73.6	102.3	170.5	-81.8	-84.4	0	0	0	108.7	D20 L24	D20-Y22 VanDerWaalsContact C-N 3.34Å; D20-Y22 HydrophobicContact CB-CD2 3.77Å; D20-Y22 HydrophobicContact CB-CE2 3.62Å; D20-Y22 PolarHBondContact O-N 2.78Å; D20-Y22 VanDerWaalsContact O-N 3.17Å; Y22-L24 PolarHBondContact O-N 2.8Å
23	T	33.1	Very low	36.5	Very low	122 Å²	122	151.6 Å²	151.6	75%	0.748	78%	0.776	S	S	*	*			trans	-58.5	125.7	164.4	31.5	0	0	0	0	108.1	N21 D25	N21-T23 PolarHBondContact O-N 3.44Å; N21-T23 VanDerWaalsContact O-N 3.11Å; T23-D25 VanDerWaalsContact C-N 3.27Å; T23-D25 PolarHBondContact O-N 3.27Å
24	L	38.3	Very low	37.1	Very low	157 Å²	157	149.8 Å²	149.8	82%	0.822	77%	0.77	S	S	*	*			trans	-65.6	90	174.8	-147.7	108.5	0	0	0	107.1	Y22 H26	Y22-L24 PolarHBondContact O-N 2.8Å; L24-H26 PolarHBondContact O-N 2.82Å
25	D	33.4	Very low	38	Very low	144 Å²	144	147.8 Å²	147.8	77%	0.77	77%	0.77	S	S	*	*			trans	-59.4	112.7	171.2	-162.9	18.3	0	0	0	106.1	T23 D27	T23-D25 VanDerWaalsContact C-N 3.27Å; T23-D25 PolarHBondContact O-N 3.27Å; D25-D27 VanDerWaalsContact C-N 3.35Å; D25-D27 PolarHBondContact O-N 2.72Å
26	H	41.1	Very low	39.2	Very low	154 Å²	154	148.1 Å²	148.1	71%	0.713	76%	0.758	S	S	*	*			trans	-60.2	107.5	170.4	-96.8	53.7	0	0	0	105.4	L24 R28	L24-H26 PolarHBondContact O-N 2.82Å; H26-R28 PolarHBondContact O-N 2.9Å
27	D	38.8	Very low	40.3	Very low	151 Å²	151	143.4 Å²	143.4	81%	0.807	75%	0.745	S	S	*	*			trans	-50.5	94.5	159.1	-93.2	-27.7	0	0	0	106.5	D25 V29	D25-D27 VanDerWaalsContact C-N 3.35Å; D25-D27 PolarHBondContact O-N 2.72Å; D27-V29 PolarHBondContact O-N 3.49Å
28	R	38.1	Very low	41.7	Very low	222 Å²	222	139 Å²	139	84%	0.838	73%	0.734	S	S	*	*			trans	-65.2	92.6	165.4	-81.6	-177.2	172.1	-173.7	-1.2	104.1	H26 I30	H26-R28 PolarHBondContact O-N 2.9Å; R28-I30 PolarHBondContact O-N 2.96Å
29	V	43.7	Very low	43.9	Very low	110 Å²	110	136.6 Å²	136.6	67%	0.667	71%	0.714	S	S	*	*			trans	-59.3	94.5	155.2	179.7	0	0	0	0	104.8	D27 H31	D27-V29 PolarHBondContact O-N 3.49Å; V29-H31 PolarHBondContact O-N 2.82Å
30	I	39.5	Very low	46.6	Very low	129 Å²	129	131.5 Å²	131.5	66%	0.662	68%	0.678	S	S	*	*			trans	-66.5	96.5	166.4	-57.1	175.5	0	0	0	103.9	R28 L32	R28-I30 PolarHBondContact O-N 2.96Å; I30-L32 HydrophobicContact CG2-CD2 3.76Å; I30-L32 HydrophobicContact CG2-CG 3.89Å; I30-L32 PolarHBondContact O-N 2.88Å
31	H	38.9	Very low	49.4	Very low	163 Å²	163	129.1 Å²	129.1	76%	0.755	67%	0.665	S	S	*	*			trans	-61.9	92.9	154.4	-81.9	-73.9	0	0	0	105.8	V29 Q33	V29-H31 PolarHBondContact O-N 2.82Å; H31-Q33 PolarHBondContact O-N 3Å
32	L	45	Very low	52.3	Low	152 Å²	152	122.1 Å²	122.1	80%	0.796	63%	0.628	S	S	*	*			trans	-64.6	85.9	157.6	-68.9	173.9	0	0	0	105	I30 A34	I30-L32 HydrophobicContact CG2-CD2 3.76Å; I30-L32 HydrophobicContact CG2-CG 3.89Å; I30-L32 PolarHBondContact O-N 2.88Å; L32-A34 PolarHBondContact O-N 2.66Å
33	Q	40.8	Very low	55.5	Low	169 Å²	169	117.2 Å²	117.2	79%	0.79	61%	0.612	S	S	*	*			trans	-65.3	93.3	161.3	-161.8	153.4	-18.9	0	0	104	H31 E35	H31-Q33 PolarHBondContact O-N 3Å; Q33-E35 VanDerWaalsContact C-N 3.33Å; Q33-E35 PolarHBondContact O-N 2.74Å
34	A	47.9	Very low	58.4	Low	79 Å²	79	112.8 Å²	112.8	65%	0.653	59%	0.587	S	S	*	*			trans	-57.2	105.1	173.3	0	0	0	0	0	105.8	L32 N36	L32-A34 PolarHBondContact O-N 2.66Å; A34-N36 PolarHBondContact O-N 3.27Å
35	E	51.8	Low	60.8	Low	187 Å²	187	110.8 Å²	110.8	87%	0.874	57%	0.574	S	S	*	*	S	Bend	trans	-65.5	-1.9	-178.7	-70.9	-151.8	148.6	0	0	112.7	Q33	Q33-E35 VanDerWaalsContact C-N 3.33Å; Q33-E35 PolarHBondContact O-N 2.74Å
36	N	61.5	Low	63.6	Low	106 Å²	106	109.1 Å²	109.1	57%	0.567	56%	0.561	S	S	*	*	S	Bend	trans	-132.4	132.4	170.6	-63	-54.7	0	0	0	108.5	A34	A34-N36 PolarHBondContact O-N 3.27Å
37	G	58.6	Low	66.1	Low	53 Å²	53	105.2 Å²	105.2	55%	0.546	56%	0.555	S	S	.	*			trans	-62.9	179.2	174.2	0	0	0	0	0	113	R39	G37-R39 PolarHBondContact O-N 2.75Å
38	P	63.3	Low	68.8	Low	98 Å²	98	101.9 Å²	101.9	64%	0.636	53%	0.534	S	S	*	.			trans	-58.3	126	178	24.1	-32	0	0	0	110.3	L40	P38-L40 VanDerWaalsContact C-N 3.25Å; P38-L40 PolarHBondContact O-N 2.55Å
39	R	80.7	Confident	71.6	Confident	100 Å²	100	91.7 Å²	91.7	38%	0.377	50%	0.496	S	S	.	.	S	Bend	trans	-74.1	-20.7	-176.8	-67	176.6	178.6	152.8	-4.1	112.9	G37 D66 A69 E146	G37-R39 PolarHBondContact O-N 2.75Å; R39-D66 PolarHBondContact O-N 3.09Å; R39-A69 HydrophobicContact CB-CB 4.22Å; R39-A69 HydrophobicContact CG-CB 3.9Å; R39-E146 HydrophobicContact CB-CG 4.18Å; R39-E146 WeakPolarHBondContact CD-OE1 2.9Å; R39-E146 IonicContact CZ-OE1 3.47Å; R39-E146 IonicContact NE-OE1 3.14Å; R39-E146 IonicContact NH1-OE1 2.75Å; R39-E146 PolarHBondContact NH1-OE1 2.9Å
40	L	88.4	Confident	74	Confident	5 Å²	5	93.1 Å²	93.1	3%	0.026	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.1	175.3	-178	64.6	0	0	0	107.5	P38 F63 Y64 R65 V141 E143 E146	P38-L40 VanDerWaalsContact C-N 3.25Å; P38-L40 PolarHBondContact O-N 2.55Å; L40-F63 HydrophobicContact CD1-CB 4.33Å; L40-F63 HydrophobicContact CD1-CD2 3.78Å; L40-F63 HydrophobicContact CD1-CG 4.49Å; L40-Y64 WeakPolarHBondContact CA-O 3.11Å; L40-R65 HydrophobicContact CD1-CG 4.33Å; L40-V141 HydrophobicContact CD1-CG1 4.38Å; L40-V141 HydrophobicContact CD2-CB 4.28Å; L40-V141 HydrophobicContact CD2-CG1 4.12Å; L40-V141 WeakPolarHBondContact CD2-O 3.44Å; L40-E143 HydrophobicContact CD2-CB 4.45Å; L40-E146 HydrophobicContact CB-CB 4.4Å
41	L	92.4	Very high	76.7	Confident	64 Å²	64	87.7 Å²	87.7	34%	0.335	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.1	177	175.5	66.7	0	0	0	108.9	E43 F63 Y64 D148	L41-E43 HydrophobicContact CD1-CG 4.46Å; L41-E43 HydrophobicContact CD2-CG 4.19Å; L41-E43 HydrophobicContact CG-CG 4.06Å; L41-F63 CarbonylContact O-C 3.56Å; L41-F63 WeakPolarHBondContact O-CA 2.91Å; L41-F63 WeakPolarHBondContact O-CB 3.38Å; L41-Y64 HydrophobicContact CD2-CD2 4.4Å; L41-Y64 PolarHBondContact N-O 3.06Å; L41-Y64 PolarHBondContact O-N 3.12Å; L41-D148 WeakPolarHBondContact CA-OD2 3.3Å
42	V	95	Very high	79.4	Confident	8 Å²	8	83.7 Å²	83.7	5%	0.048	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.1	177.6	-179.7	0	0	0	0	109.6	C61 K62 F63 V141 D148 A150	V42-C61 WeakPolarHBondContact CG1-SG 3.35Å; V42-K62 CarbonylContact C-O 3.18Å; V42-K62 WeakPolarHBondContact CA-O 3.13Å; V42-F63 HydrophobicContact CG2-CB 3.9Å; V42-V141 HydrophobicContact CG1-CG2 4.25Å; V42-V141 HydrophobicContact CG2-CB 3.6Å; V42-V141 HydrophobicContact CG2-CG2 3.62Å; V42-D148 HydrophobicContact CB-CB 4.21Å; V42-D148 HydrophobicContact CG2-CB 3.87Å; V42-D148 WeakPolarHBondContact CG2-O 3.15Å; V42-D148 PolarHBondContact N-OD2 2.56Å; V42-A150 HydrophobicContact CG1-CB 3.77Å
43	E	95	Very high	81.7	Confident	89 Å²	89	80.4 Å²	80.4	42%	0.416	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.5	-178.4	-66.2	-173.6	157.4	0	0	111.4	L41 K62 Y64	L41-E43 HydrophobicContact CD1-CG 4.46Å; L41-E43 HydrophobicContact CD2-CG 4.19Å; L41-E43 HydrophobicContact CG-CG 4.06Å; E43-K62 PolarHBondContact N-O 3.08Å; E43-K62 PolarHBondContact O-N 2.66Å; E43-Y64 HydrophobicContact CB-CE2 4.44Å; E43-Y64 HydrophobicContact CG-CE2 4.34Å; E43-Y64 WeakPolarHBondContact OE2-CE2 3.25Å
44	A	93.6	Very high	84.3	Confident	28 Å²	28	74.4 Å²	74.4	23%	0.231	41%	0.41	C	S	.	.			trans	-96.5	107.6	164.3	0	0	0	0	0	109	Q46 A150 V152	A44-Q46 PolarHBondContact O-N 3.29Å; A44-A150 HydrophobicContact CB-CB 3.89Å; A44-V152 HydrophobicContact CB-CG2 3.7Å
45	E	90.1	Very high	86.5	Confident	116 Å²	116	71 Å²	71	54%	0.542	38%	0.383	S	S	.	.	S	Bend	trans	-54.2	-30.1	177.1	-66.4	-176.7	159.1	0	0	112.5	P60 K62	E45-P60 HydrophobicContact CB-CB 4.46Å; E45-K62 HydrophobicContact CG-CD 4.46Å; E45-K62 WeakPolarHBondContact OE1-CD 3.48Å; E45-K62 WeakPolarHBondContact OE1-CE 3.3Å; E45-K62 IonicContact OE1-NZ 3.31Å; E45-K62 PolarHBondContact OE1-NZ 3.44Å; E45-K62 IonicContact OE2-NZ 3.5Å
46	Q	92.6	Very high	88.7	Confident	109 Å²	109	67 Å²	67	51%	0.509	37%	0.367	S	S	.	.			trans	-129.9	115.6	174.6	-55.5	170.1	16.9	0	0	108.9	A44 K48 V49 P60	A44-Q46 PolarHBondContact O-N 3.29Å; Q46-K48 PolarHBondContact O-N 3.26Å; Q46-V49 HydrophobicContact CB-CG1 4.3Å; Q46-P60 HydrophobicContact CB-CG 3.93Å
47	A	93	Very high	90.4	Very high	71 Å²	71	62.5 Å²	62.5	59%	0.587	34%	0.343	S	S	*	.	S	Bend	trans	-69.5	-17.1	176.4	0	0	0	0	0	113	A153	A47-A153 PolarHBondContact O-N 3.22Å
48	K	95.4	Very high	92.3	Very high	81 Å²	81	62.5 Å²	62.5	35%	0.352	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	129.1	-178.4	-170.7	171.6	-172.4	174.3	0	110.9	Q46 F50 A153 D155	Q46-K48 PolarHBondContact O-N 3.26Å; K48-F50 HydrophobicContact CD-CE1 4.48Å; K48-F50 HydrophobicContact CD-CE2 4.1Å; K48-F50 HydrophobicContact CD-CZ 3.73Å; K48-F50 VanDerWaalsContact CE-CZ 3.41Å; K48-F50 HydrophobicContact CG-CE2 4Å; K48-F50 HydrophobicContact CG-CZ 4.06Å; K48-A153 CarbonylContact C-O 3.56Å; K48-A153 WeakPolarHBondContact CA-O 3.42Å; K48-A153 HydrophobicContact CB-CB 4.38Å; K48-A153 HydrophobicContact CG-CB 4.15Å; K48-D155 WeakPolarHBondContact CE-OD1 3.42Å; K48-D155 WeakPolarHBondContact CE-OD2 3.17Å; K48-D155 VanDerWaalsContact NZ-CG 3.3Å; K48-D155 IonicContact NZ-OD1 3.3Å; K48-D155 IonicContact NZ-OD2 2.91Å; K48-D155 PolarHBondContact NZ-OD2 2.62Å
49	V	96.7	Very high	93.9	Very high	9 Å²	9	57.8 Å²	57.8	6%	0.055	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	149.5	176.6	-62.7	0	0	0	0	110.4	Q46 V57 L59 P60 V152 A153 L154 D155	Q46-V49 HydrophobicContact CB-CG1 4.3Å; V49-V57 HydrophobicContact CB-CG2 4.09Å; V49-V57 HydrophobicContact CG2-CG2 3.67Å; V49-L59 HydrophobicContact CG2-CD2 3.67Å; V49-P60 HydrophobicContact CG1-CG 4.45Å; V49-V152 HydrophobicContact CG1-CG1 4.28Å; V49-V152 HydrophobicContact CG2-CG1 4.06Å; V49-A153 PolarHBondContact N-O 2.89Å; V49-L154 HydrophobicContact CG2-CB 4.41Å; V49-L154 HydrophobicContact CG2-CD1 3.95Å; V49-D155 PolarHBondContact O-N 3.45Å
50	F	95.1	Very high	94.7	Very high	140 Å²	140	53.6 Å²	53.6	61%	0.614	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.6	-177.9	-65.2	-91.1	0	0	0	110.7	K48 D155	K48-F50 HydrophobicContact CD-CE1 4.48Å; K48-F50 HydrophobicContact CD-CE2 4.1Å; K48-F50 HydrophobicContact CD-CZ 3.73Å; K48-F50 VanDerWaalsContact CE-CZ 3.41Å; K48-F50 HydrophobicContact CG-CE2 4Å; K48-F50 HydrophobicContact CG-CZ 4.06Å; F50-D155 WeakPolarHBondContact CA-O 3.21Å; F50-D155 HydrophobicContact CD1-CB 3.43Å; F50-D155 VanDerWaalsContact CD1-CB 3.43Å; F50-D155 HydrophobicContact CE1-CB 3.54Å; F50-D155 HydrophobicContact CG-CB 4.28Å; F50-D155 HydrophobicContact CZ-CB 4.46Å
51	S	95.8	Very high	95.1	Very high	15 Å²	15	53.4 Å²	53.4	11%	0.105	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	-164.7	170.6	-164.1	0	0	0	0	110.3	N56 L129 D155 L156 Q157	S51-N56 PolarHBondContact OG-O 3.16Å; S51-N56 VanDerWaalsContact OG-O 3.04Å; S51-L129 VanDerWaalsContact CB-CD1 3.44Å; S51-L129 WeakPolarHBondContact OG-CD1 3.42Å; S51-D155 PolarHBondContact N-O 3.28Å; S51-L156 CarbonylContact O-C 3.55Å; S51-L156 WeakPolarHBondContact O-CA 3.47Å; S51-Q157 PolarHBondContact O-N 3.37Å
52	H	93.9	Very high	95.2	Very high	79 Å²	79	53.4 Å²	53.4	37%	0.366	28%	0.284	S	S	.	.			trans	-138.9	160	177.5	57.3	-83.5	0	0	0	109.9	G54 G55	H52-G54 PolarHBondContact O-N 3.39Å; H52-G55 WeakPolarHBondContact O-CA 3.46Å; H52-G55 PolarHBondContact O-N 2.98Å
53	R	95.3	Very high	95.2	Very high	82 Å²	82	53.1 Å²	53.1	31%	0.309	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	135.4	176.6	-179.8	-175.5	-174.7	-178.3	2.2	111.1	G55 L129 L131 D185 S255 N256	R53-G55 PolarHBondContact O-N 2.8Å; R53-L129 CarbonylContact C-O 3.33Å; R53-L129 WeakPolarHBondContact CA-O 3.43Å; R53-L129 WeakPolarHBondContact CG-O 3.27Å; R53-L131 HydrophobicContact CB-CD2 4.45Å; R53-D185 IonicContact CZ-OD1 3.93Å; R53-D185 VanDerWaalsContact NH1-CG 3.27Å; R53-D185 IonicContact NH1-OD1 3.48Å; R53-D185 PolarHBondContact NH1-OD1 3.07Å; R53-D185 IonicContact NH1-OD2 3.78Å; R53-D185 PolarHBondContact NH1-OD2 2.64Å; R53-D185 IonicContact NH2-OD1 2.89Å; R53-D185 PolarHBondContact NH2-OD1 3.31Å; R53-S255 PolarHBondContact N-OG 2.86Å; R53-N256 WeakPolarHBondContact CB-O 3.41Å; R53-N256 WeakPolarHBondContact CD-O 3.24Å
54	G	94.5	Very high	95	Very high	44 Å²	44	53.7 Å²	53.7	45%	0.454	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-8.2	-173.1	0	0	0	0	0	114.3	H52 L129	H52-G54 PolarHBondContact O-N 3.39Å; G54-L129 PolarHBondContact N-O 2.97Å
55	G	94.8	Very high	94.7	Very high	8 Å²	8	55.6 Å²	55.6	8%	0.082	28%	0.283	C	S	.	.			trans	-79.9	178.9	175.4	0	0	0	0	0	112.8	H52 R53 D128 L129	H52-G55 WeakPolarHBondContact O-CA 3.46Å; H52-G55 PolarHBondContact O-N 2.98Å; R53-G55 PolarHBondContact O-N 2.8Å; G55-D128 PolarHBondContact O-N 2.91Å; G55-L129 WeakPolarHBondContact O-CB 3.24Å; G55-L129 WeakPolarHBondContact O-CG 3.26Å; G55-L129 PolarHBondContact O-N 3.3Å
56	N	97	Very high	94.2	Very high	101 Å²	101	52.1 Å²	52.1	54%	0.54	27%	0.267	S	S	.	.			trans	-113.4	157	172.8	-59.3	-17.4	0	0	0	109.4	S51 I126 T127 D128	S51-N56 PolarHBondContact OG-O 3.16Å; S51-N56 VanDerWaalsContact OG-O 3.04Å; N56-I126 CarbonylContact C-O 3.52Å; N56-I126 WeakPolarHBondContact CA-O 3.14Å; N56-T127 WeakPolarHBondContact OD1-CA 3.24Å; N56-T127 WeakPolarHBondContact OD1-CB 3.31Å; N56-D128 PolarHBondContact OD1-N 3.46Å; N56-D128 VanDerWaalsContact OD1-N 3.14Å
57	V	97.3	Very high	93.2	Very high	13 Å²	13	52.4 Å²	52.4	8%	0.079	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	152.4	173.6	70.1	0	0	0	0	110.8	V49 L59 V125 I126 L129 L154	V49-V57 HydrophobicContact CB-CG2 4.09Å; V49-V57 HydrophobicContact CG2-CG2 3.67Å; V57-L59 HydrophobicContact CG1-CD2 4.3Å; V57-V125 WeakPolarHBondContact O-CA 3.28Å; V57-I126 HydrophobicContact CG1-CB 4.1Å; V57-I126 PolarHBondContact N-O 2.76Å; V57-I126 PolarHBondContact O-N 3.29Å; V57-L129 HydrophobicContact CB-CD1 4.03Å; V57-L129 HydrophobicContact CG1-CD1 3.86Å; V57-L129 HydrophobicContact CG1-CD2 4.03Å; V57-L129 HydrophobicContact CG1-CG 4.38Å; V57-L154 HydrophobicContact CB-CD1 4.24Å; V57-L154 HydrophobicContact CG1-CD1 3.91Å; V57-L154 HydrophobicContact CG1-CD2 3.96Å; V57-L154 HydrophobicContact CG2-CD1 3.95Å
58	T	97.6	Very high	92.1	Very high	52 Å²	52	54.7 Å²	54.7	32%	0.319	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.8	167.2	-58.5	0	0	0	0	108.2	P60 K115 L124 V125	T58-P60 WeakPolarHBondContact O-CD 3.41Å; T58-K115 HydrophobicContact CG2-CD 4.01Å; T58-L124 CarbonylContact C-O 3.52Å; T58-L124 WeakPolarHBondContact CA-O 3.47Å; T58-V125 HydrophobicContact CG2-CG2 4.44Å
59	L	98	Very high	90.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	109.6	169.8	-52	-176.2	0	0	0	107.7	V49 V57 C61 W81 S123 L124 I126 Y137 V152 L154	V49-L59 HydrophobicContact CG2-CD2 3.67Å; V57-L59 HydrophobicContact CG1-CD2 4.3Å; L59-C61 PolarHBondContact O-N 3.32Å; L59-W81 HydrophobicContact CB-CH2 3.44Å; L59-W81 VanDerWaalsContact CB-CH2 3.44Å; L59-W81 HydrophobicContact CB-CZ2 4.07Å; L59-W81 HydrophobicContact CB-CZ3 3.88Å; L59-W81 HydrophobicContact CD1-CE3 4.15Å; L59-W81 HydrophobicContact CD1-CH2 4.21Å; L59-W81 HydrophobicContact CD1-CZ3 3.76Å; L59-W81 HydrophobicContact CG-CH2 4.49Å; L59-W81 HydrophobicContact CG-CZ3 4.5Å; L59-S123 CarbonylContact O-C 3.52Å; L59-S123 WeakPolarHBondContact O-CA 3.27Å; L59-S123 WeakPolarHBondContact O-CB 3.48Å; L59-L124 HydrophobicContact CB-CB 4.42Å; L59-L124 HydrophobicContact CD1-CD2 4.37Å; L59-L124 PolarHBondContact N-O 2.87Å; L59-L124 PolarHBondContact O-N 3.39Å; L59-I126 HydrophobicContact CD1-CD1 3.91Å; L59-I126 HydrophobicContact CG-CD1 4.38Å; L59-Y137 HydrophobicContact CD1-CD1 3.84Å; L59-Y137 HydrophobicContact CD1-CD2 3.83Å; L59-Y137 HydrophobicContact CD1-CE1 4.46Å; L59-Y137 HydrophobicContact CD1-CE2 4.47Å; L59-Y137 HydrophobicContact CD1-CG 3.48Å; L59-Y137 VanDerWaalsContact CD1-CG 3.48Å; L59-V152 HydrophobicContact CB-CB 4.44Å; L59-V152 HydrophobicContact CB-CG1 4.29Å; L59-V152 HydrophobicContact CD2-CG1 4Å; L59-L154 HydrophobicContact CD2-CB 4.22Å
60	P	97	Very high	89	Confident	12 Å²	12	61 Å²	61	8%	0.078	32%	0.316	C	S	.	.			trans	-70.2	131.8	-175.8	27.7	-33.3	0	0	0	110.8	E45 Q46 V49 T58 S123 V152	E45-P60 HydrophobicContact CB-CB 4.46Å; Q46-P60 HydrophobicContact CB-CG 3.93Å; V49-P60 HydrophobicContact CG1-CG 4.45Å; T58-P60 WeakPolarHBondContact O-CD 3.41Å; P60-S123 WeakPolarHBondContact CA-OG 3.29Å; P60-V152 WeakPolarHBondContact O-CG2 3.1Å
61	C	96.8	Very high	87.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.298	C	S	.	.			trans	-151.9	112.3	171.2	-178.8	0	0	0	0	108.6	V42 L59 W81 A122 S123 C139	V42-C61 WeakPolarHBondContact CG1-SG 3.35Å; L59-C61 PolarHBondContact O-N 3.32Å; C61-W81 HydrophobicContact CB-CH2 3.98Å; C61-W81 HydrophobicContact CB-CZ2 3.44Å; C61-W81 VanDerWaalsContact CB-CZ2 3.44Å; C61-A122 HydrophobicContact CB-CB 4.2Å; C61-A122 CarbonylContact O-C 3.58Å; C61-A122 WeakPolarHBondContact O-CA 3.35Å; C61-A122 PolarHBondContact O-N 3.07Å; C61-S123 PolarHBondContact N-OG 2.85Å; C61-S123 PolarHBondContact O-N 2.95Å; C61-S123 VanDerWaalsContact O-N 3.12Å; C61-S123 PolarHBondContact O-OG 3.46Å; C61-C139 HydrophobicContact CB-CB 3.71Å; C61-C139 WeakPolarHBondContact CB-SG 3.44Å; C61-C139 WeakPolarHBondContact SG-CB 3.36Å; C61-C139 CovalentContact SG-SG 2.04Å; C61-C139 PolarHBondContact SG-SG 3.04Å
62	K	95.4	Very high	86.1	Confident	64 Å²	64	56.6 Å²	56.6	28%	0.278	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	152	173.9	-70.4	-174.3	178.2	175	0	109	V42 E43 E45 Y64 N120	V42-K62 CarbonylContact C-O 3.18Å; V42-K62 WeakPolarHBondContact CA-O 3.13Å; E43-K62 PolarHBondContact N-O 3.08Å; E43-K62 PolarHBondContact O-N 2.66Å; E45-K62 HydrophobicContact CG-CD 4.46Å; E45-K62 WeakPolarHBondContact OE1-CD 3.48Å; E45-K62 WeakPolarHBondContact OE1-CE 3.3Å; E45-K62 IonicContact OE1-NZ 3.31Å; E45-K62 PolarHBondContact OE1-NZ 3.44Å; E45-K62 IonicContact OE2-NZ 3.5Å; K62-Y64 HydrophobicContact CB-CE2 4.49Å; K62-N120 WeakPolarHBondContact CA-O 3.37Å
63	F	93.6	Very high	84.9	Confident	3 Å²	3	55.6 Å²	55.6	1%	0.013	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.1	177	68.6	-85.6	0	0	0	112	L40 L41 V42 R65 I77 D119 N120 A122 V141	L40-F63 HydrophobicContact CD1-CB 4.33Å; L40-F63 HydrophobicContact CD1-CD2 3.78Å; L40-F63 HydrophobicContact CD1-CG 4.49Å; L41-F63 CarbonylContact O-C 3.56Å; L41-F63 WeakPolarHBondContact O-CA 2.91Å; L41-F63 WeakPolarHBondContact O-CB 3.38Å; V42-F63 HydrophobicContact CG2-CB 3.9Å; F63-R65 VanDerWaalsContact CE2-CZ 3.48Å; F63-I77 HydrophobicContact CE2-CD1 4.09Å; F63-I77 HydrophobicContact CE2-CG1 4.01Å; F63-I77 HydrophobicContact CE2-CG2 4.42Å; F63-I77 HydrophobicContact CZ-CG1 4.07Å; F63-I77 HydrophobicContact CZ-CG2 4.09Å; F63-D119 VanDerWaalsContact CZ-O 3.29Å; F63-D119 WeakPolarHBondContact CZ-O 3.49Å; F63-N120 VanDerWaalsContact CD1-O 3.24Å; F63-N120 WeakPolarHBondContact CD1-O 3.4Å; F63-N120 VanDerWaalsContact CE1-C 3.41Å; F63-N120 VanDerWaalsContact CE1-CA 3.49Å; F63-N120 PolarHBondContact N-O 2.88Å; F63-N120 VanDerWaalsContact O-CB 3.3Å; F63-N120 WeakPolarHBondContact O-CB 3.44Å; F63-A122 HydrophobicContact CD1-CB 3.97Å; F63-A122 HydrophobicContact CE1-CB 4.21Å; F63-V141 HydrophobicContact CB-CB 4.49Å; F63-V141 HydrophobicContact CB-CG1 4.32Å; F63-V141 HydrophobicContact CB-CG2 4.2Å; F63-V141 HydrophobicContact CD1-CG1 4.13Å; F63-V141 HydrophobicContact CD1-CG2 4.17Å; F63-V141 HydrophobicContact CD2-CG1 3.97Å; F63-V141 HydrophobicContact CE1-CG1 4.43Å; F63-V141 HydrophobicContact CE2-CG1 4.25Å; F63-V141 HydrophobicContact CG-CG1 3.89Å; F63-V141 HydrophobicContact CG-CG2 4.28Å; F63-V141 HydrophobicContact CZ-CG1 4.49Å
64	Y	91.2	Very high	84	Confident	100 Å²	100	57.9 Å²	57.9	39%	0.392	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.6	-177	-54.6	-83.4	0	0	0	108.9	L40 L41 E43 K62	L40-Y64 WeakPolarHBondContact CA-O 3.11Å; L41-Y64 HydrophobicContact CD2-CD2 4.4Å; L41-Y64 PolarHBondContact N-O 3.06Å; L41-Y64 PolarHBondContact O-N 3.12Å; E43-Y64 HydrophobicContact CB-CE2 4.44Å; E43-Y64 HydrophobicContact CG-CE2 4.34Å; E43-Y64 WeakPolarHBondContact OE2-CE2 3.25Å; K62-Y64 HydrophobicContact CB-CE2 4.49Å
65	R	86.9	Confident	83.4	Confident	69 Å²	69	60.7 Å²	60.7	26%	0.26	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	143.7	174.8	-60.4	-178.4	-168.6	81.5	-7.2	109.1	L40 F63 P67 N120 E143	L40-R65 HydrophobicContact CD1-CG 4.33Å; F63-R65 VanDerWaalsContact CE2-CZ 3.48Å; R65-P67 VanDerWaalsContact O-CD 3.27Å; R65-P67 WeakPolarHBondContact O-CD 3.35Å; R65-N120 PolarHBondContact NH1-OD1 3.12Å; R65-E143 WeakPolarHBondContact CD-OE2 3.36Å; R65-E143 IonicContact NE-OE1 3.94Å; R65-E143 IonicContact NE-OE2 3.04Å; R65-E143 PolarHBondContact NE-OE2 2.96Å
66	D	81.1	Confident	82.9	Confident	42 Å²	42	67.7 Å²	67.7	23%	0.225	36%	0.364	C	S	.	.			trans	-72.4	114.8	161.5	-175.6	-9.9	0	0	0	108.9	R39 T68 A69 S72	R39-D66 PolarHBondContact O-N 3.09Å; D66-T68 PolarHBondContact O-N 2.8Å; D66-T68 WeakPolarHBondContact OD1-CB 3.48Å; D66-T68 PolarHBondContact OD1-N 3.04Å; D66-T68 PolarHBondContact OD1-OG1 2.89Å; D66-T68 PolarHBondContact OD2-OG1 2.89Å; D66-A69 HydrophobicContact CB-CB 4.1Å; D66-A69 PolarHBondContact O-N 2.84Å; D66-S72 WeakPolarHBondContact O-CB 3.21Å; D66-S72 PolarHBondContact O-OG 2.94Å
67	P	70.1	Confident	82.7	Confident	116 Å²	116	64.1 Å²	64.1	75%	0.753	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-15.1	179.3	29.3	-34.3	0	0	0	112.8	R65	R65-P67 VanDerWaalsContact O-CD 3.27Å; R65-P67 WeakPolarHBondContact O-CD 3.35Å
68	T	70.3	Confident	82.6	Confident	118 Å²	118	68.5 Å²	68.5	72%	0.724	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-7.9	-179	68.9	0	0	0	0	113.4	D66	D66-T68 PolarHBondContact O-N 2.8Å; D66-T68 WeakPolarHBondContact OD1-CB 3.48Å; D66-T68 PolarHBondContact OD1-N 3.04Å; D66-T68 PolarHBondContact OD1-OG1 2.89Å; D66-T68 PolarHBondContact OD2-OG1 2.89Å
69	A	67.6	Low	82.5	Confident	17 Å²	17	66.7 Å²	66.7	14%	0.14	35%	0.347	C	S	.	.	S	Bend	trans	-71	133.1	179.6	0	0	0	0	0	112.4	R39 D66 G71 S72	R39-A69 HydrophobicContact CB-CB 4.22Å; R39-A69 HydrophobicContact CG-CB 3.9Å; D66-A69 HydrophobicContact CB-CB 4.1Å; D66-A69 PolarHBondContact O-N 2.84Å; A69-G71 PolarHBondContact O-N 3.44Å; A69-S72 WeakPolarHBondContact O-CB 3.39Å; A69-S72 PolarHBondContact O-N 3.27Å; A69-S72 VanDerWaalsContact O-N 3.08Å
70	F	60.8	Low	82.5	Confident	206 Å²	206	68.8 Å²	68.8	90%	0.904	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	118	175.5	-168.8	-93.4	0	0	0	110.3
71	G	63.2	Low	82.6	Confident	22 Å²	22	68.2 Å²	68.2	23%	0.227	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.9	-2.6	-177.2	0	0	0	0	0	115.8	A69 G73 I74	A69-G71 PolarHBondContact O-N 3.44Å; G71-G73 PolarHBondContact O-N 2.97Å; G71-I74 WeakPolarHBondContact O-CB 3.42Å; G71-I74 PolarHBondContact O-N 3.48Å; G71-I74 VanDerWaalsContact O-N 3.07Å
72	S	66.3	Low	82.6	Confident	40 Å²	40	68.2 Å²	68.2	28%	0.28	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	123.4	175.1	-168.1	0	0	0	0	110.9	D66 A69 I74	D66-S72 WeakPolarHBondContact O-CB 3.21Å; D66-S72 PolarHBondContact O-OG 2.94Å; A69-S72 WeakPolarHBondContact O-CB 3.39Å; A69-S72 PolarHBondContact O-N 3.27Å; A69-S72 VanDerWaalsContact O-N 3.08Å; S72-I74 VanDerWaalsContact C-N 3.27Å; S72-I74 PolarHBondContact O-N 3.27Å
73	G	67.6	Low	82.7	Confident	59 Å²	59	67 Å²	67	61%	0.608	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-1.2	-178.3	0	0	0	0	0	115.6	G71 E143	G71-G73 PolarHBondContact O-N 2.97Å; G73-E143 WeakPolarHBondContact CA-OE1 3.43Å; G73-E143 PolarHBondContact N-OE1 3.44Å
74	I	76.7	Confident	82.8	Confident	129 Å²	129	68.4 Å²	68.4	66%	0.662	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-39.9	173.2	-58.2	-171.3	0	0	0	110.4	G71 S72	G71-I74 WeakPolarHBondContact O-CB 3.42Å; G71-I74 PolarHBondContact O-N 3.48Å; G71-I74 VanDerWaalsContact O-N 3.07Å; S72-I74 VanDerWaalsContact C-N 3.27Å; S72-I74 PolarHBondContact O-N 3.27Å
75	H	81.3	Confident	82.7	Confident	103 Å²	103	65.4 Å²	65.4	48%	0.477	35%	0.347	S	S	.	.	S	Bend	trans	-89.6	145	-178	-62.9	-62.8	0	0	0	111.4	E143	H75-E143 HydrophobicContact CB-CG 3.93Å
76	K	86.3	Confident	82.5	Confident	156 Å²	156	65.2 Å²	65.2	68%	0.678	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-72.4	133.8	173.5	-67.6	-178.2	-178.9	176.5	0	109.2	R78	K76-R78 PolarHBondContact O-N 3.13Å
77	I	91.4	Very high	82.5	Confident	25 Å²	25	66.8 Å²	66.8	13%	0.128	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-66.9	131.7	172.3	-60.2	-57.7	0	0	0	110.3	F63 I79 V141 E143	F63-I77 HydrophobicContact CE2-CD1 4.09Å; F63-I77 HydrophobicContact CE2-CG1 4.01Å; F63-I77 HydrophobicContact CE2-CG2 4.42Å; F63-I77 HydrophobicContact CZ-CG1 4.07Å; F63-I77 HydrophobicContact CZ-CG2 4.09Å; I77-I79 HydrophobicContact CG2-CD1 4.49Å; I77-I79 HydrophobicContact CG2-CG1 3.87Å; I77-V141 HydrophobicContact CG2-CG1 3.54Å; I77-E143 HydrophobicContact CD1-CB 3.58Å; I77-E143 HydrophobicContact CD1-CG 3.72Å; I77-E143 WeakPolarHBondContact CD1-OE2 3.18Å
78	R	94.8	Very high	83	Confident	106 Å²	106	67.1 Å²	67.1	40%	0.4	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	124	165.1	178.1	177.8	-179.4	158.1	-1.4	108.8	K76 V96 S97 M98 I142	K76-R78 PolarHBondContact O-N 3.13Å; R78-V96 HydrophobicContact CG-CG1 4.48Å; R78-S97 CarbonylContact C-O 3.47Å; R78-S97 VanDerWaalsContact CA-O 3.31Å; R78-S97 WeakPolarHBondContact CA-O 3.34Å; R78-M98 HydrophobicContact CB-CB 4.44Å; R78-M98 HydrophobicContact CB-CG 4.43Å; R78-M98 HydrophobicContact CG-CB 4.49Å; R78-I142 HydrophobicContact CB-CB 4.3Å; R78-I142 PolarHBondContact N-O 2.85Å; R78-I142 PolarHBondContact O-N 3.25Å
79	I	96.6	Very high	83.8	Confident	13 Å²	13	68.2 Å²	68.2	7%	0.067	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.7	174.2	-59.4	162.5	0	0	0	107.3	I77 V96 S97 L114 A122	I77-I79 HydrophobicContact CG2-CD1 4.49Å; I77-I79 HydrophobicContact CG2-CG1 3.87Å; I79-V96 CarbonylContact O-C 3.55Å; I79-V96 WeakPolarHBondContact O-CA 3.46Å; I79-S97 PolarHBondContact N-O 2.85Å; I79-S97 PolarHBondContact O-N 3.43Å; I79-L114 HydrophobicContact CD1-CD1 3.75Å; I79-L114 HydrophobicContact CG2-CD2 4.36Å; I79-A122 HydrophobicContact CD1-CB 3.66Å; I79-A122 HydrophobicContact CG1-CB 3.97Å; I79-A122 HydrophobicContact CG2-CB 3.92Å
80	K	98.1	Very high	84.9	Confident	45 Å²	45	74.5 Å²	74.5	20%	0.196	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.2	175.1	-179.9	178.3	-176	-151.1	0	109	T82 D93 V96 E140	K80-T82 HydrophobicContact CD-CG2 4.2Å; K80-T82 VanDerWaalsContact CE-CG2 3.43Å; K80-T82 HydrophobicContact CG-CG2 4.06Å; K80-D93 WeakPolarHBondContact CE-OD1 3.33Å; K80-D93 IonicContact NZ-OD1 3.64Å; K80-V96 HydrophobicContact CB-CG2 4.4Å; K80-V96 HydrophobicContact CG-CG2 4.02Å; K80-E140 HydrophobicContact CB-CB 4.28Å; K80-E140 PolarHBondContact N-O 2.93Å; K80-E140 PolarHBondContact O-N 2.82Å
81	W	98.3	Very high	86.5	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.9	169.4	-80.6	92.2	0	0	0	109.2	L59 C61 V94 F95 A122 L124 K138 C139 V152	L59-W81 HydrophobicContact CB-CH2 3.44Å; L59-W81 VanDerWaalsContact CB-CH2 3.44Å; L59-W81 HydrophobicContact CB-CZ2 4.07Å; L59-W81 HydrophobicContact CB-CZ3 3.88Å; L59-W81 HydrophobicContact CD1-CE3 4.15Å; L59-W81 HydrophobicContact CD1-CH2 4.21Å; L59-W81 HydrophobicContact CD1-CZ3 3.76Å; L59-W81 HydrophobicContact CG-CH2 4.49Å; L59-W81 HydrophobicContact CG-CZ3 4.5Å; C61-W81 HydrophobicContact CB-CH2 3.98Å; C61-W81 HydrophobicContact CB-CZ2 3.44Å; C61-W81 VanDerWaalsContact CB-CZ2 3.44Å; W81-V94 HydrophobicContact CB-CB 4.37Å; W81-V94 WeakPolarHBondContact O-CB 3.45Å; W81-V94 PolarHBondContact O-N 3.49Å; W81-F95 HydrophobicContact CB-CB 4.23Å; W81-F95 PolarHBondContact N-O 3.43Å; W81-F95 PolarHBondContact O-N 3.43Å; W81-F95 VanDerWaalsContact O-N 3.15Å; W81-A122 PolarHBondContact NE1-O 3.26Å; W81-L124 HydrophobicContact CB-CD2 3.92Å; W81-L124 HydrophobicContact CD2-CB 3.9Å; W81-L124 HydrophobicContact CD2-CD2 4.02Å; W81-L124 HydrophobicContact CE3-CD2 4.46Å; W81-L124 HydrophobicContact CG-CB 4.1Å; W81-L124 HydrophobicContact CG-CD1 4.5Å; W81-L124 HydrophobicContact CG-CD2 3.79Å; W81-L124 HydrophobicContact CG-CG 4.36Å; W81-L124 HydrophobicContact CZ2-CB 3.89Å; W81-K138 VanDerWaalsContact CA-O 3.32Å; W81-K138 WeakPolarHBondContact CA-O 3.41Å; W81-C139 HydrophobicContact CD2-CB 4.04Å; W81-C139 HydrophobicContact CE3-CB 4.06Å; W81-C139 HydrophobicContact CH2-CB 3.64Å; W81-C139 HydrophobicContact CZ2-CB 3.6Å; W81-C139 HydrophobicContact CZ3-CB 3.86Å; W81-V152 HydrophobicContact CH2-CG2 4.15Å
82	T	98.1	Very high	88.1	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	153.6	173.1	62.1	0	0	0	0	110.5	K80 E91 V92 Y137 K138	K80-T82 HydrophobicContact CD-CG2 4.2Å; K80-T82 VanDerWaalsContact CE-CG2 3.43Å; K80-T82 HydrophobicContact CG-CG2 4.06Å; T82-E91 HydrophobicContact CG2-CB 4.26Å; T82-E91 PolarHBondContact OG1-OE2 2.49Å; T82-V92 CarbonylContact C-O 3.56Å; T82-V92 VanDerWaalsContact CA-O 3.29Å; T82-V92 WeakPolarHBondContact CA-O 3.19Å; T82-Y137 CarbonylContact O-C 3.58Å; T82-Y137 VanDerWaalsContact O-CA 3.24Å; T82-Y137 WeakPolarHBondContact O-CA 3.4Å; T82-K138 PolarHBondContact N-O 3.49Å; T82-K138 PolarHBondContact O-N 3.31Å
83	K	97.5	Very high	89.5	Confident	39 Å²	39	72.3 Å²	72.3	17%	0.17	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.9	170.4	-174.7	-177.3	177.5	-165.1	0	109.1	E91 V92 V94 Y108 E132 Y134 Y137	K83-E91 WeakPolarHBondContact O-CA 3.25Å; K83-V92 PolarHBondContact N-O 3.03Å; K83-V92 PolarHBondContact O-N 2.04Å; K83-V94 HydrophobicContact CB-CG2 3.84Å; K83-Y108 VanDerWaalsContact CD-OH 3.31Å; K83-Y108 WeakPolarHBondContact CD-OH 3.39Å; K83-E132 PolarHBondContact NZ-O 3.4Å; K83-Y134 WeakPolarHBondContact CE-O 3.45Å; K83-Y134 PolarHBondContact NZ-O 2.99Å; K83-Y137 HydrophobicContact CB-CD1 4.04Å; K83-Y137 HydrophobicContact CB-CE1 3.89Å; K83-Y137 HydrophobicContact CD-CE1 4.21Å; K83-Y137 HydrophobicContact CG-CD1 4.36Å; K83-Y137 HydrophobicContact CG-CE1 4.05Å; K83-Y137 HydrophobicContact CG-CE2 4.48Å
84	L	94.9	Very high	91	Very high	31 Å²	31	69.5 Å²	69.5	16%	0.162	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	136.2	174.4	-53.1	-176.3	0	0	0	109.8	Y88 E91 R136 K138 V151	L84-Y88 HydrophobicContact CB-CD1 4.18Å; L84-Y88 HydrophobicContact CD1-CD1 4.18Å; L84-E91 HydrophobicContact CD2-CG 3.76Å; L84-R136 HydrophobicContact CB-CB 4.36Å; L84-R136 HydrophobicContact CD1-CB 4Å; L84-R136 HydrophobicContact CG-CB 4.33Å; L84-R136 PolarHBondContact N-O 3.5Å; L84-K138 HydrophobicContact CD2-CB 4.4Å; L84-V151 HydrophobicContact CD1-CG1 4.44Å
85	T	89.9	Confident	92	Very high	37 Å²	37	63.5 Å²	63.5	23%	0.227	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-66	160.8	171.4	49.8	0	0	0	0	111.4	D87 Y88 L89 K90 V92	T85-D87 VanDerWaalsContact CB-OD1 3.24Å; T85-D87 WeakPolarHBondContact CB-OD1 3.48Å; T85-D87 PolarHBondContact O-N 2.84Å; T85-D87 VanDerWaalsContact O-N 3.16Å; T85-D87 PolarHBondContact OG1-OD1 2.9Å; T85-Y88 WeakPolarHBondContact O-CA 3.25Å; T85-Y88 PolarHBondContact O-N 3.23Å; T85-L89 PolarHBondContact OG1-N 3.23Å; T85-K90 HydrophobicContact CG2-CB 3.74Å; T85-K90 PolarHBondContact N-O 2.83Å; T85-K90 PolarHBondContact OG1-N 3.49Å; T85-K90 PolarHBondContact OG1-O 3.46Å; T85-K90 VanDerWaalsContact OG1-O 3.09Å; T85-V92 HydrophobicContact CG2-CG2 4.2Å
86	S	82.6	Confident	92.8	Very high	65 Å²	65	59.3 Å²	59.3	46%	0.455	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.3	-177.6	-52.6	0	0	0	0	114.1
87	D	80.1	Confident	93.2	Very high	76 Å²	76	52.2 Å²	52.2	41%	0.406	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-3.1	173.8	61	2	0	0	0	113.1	T85 L89	T85-D87 VanDerWaalsContact CB-OD1 3.24Å; T85-D87 WeakPolarHBondContact CB-OD1 3.48Å; T85-D87 PolarHBondContact O-N 2.84Å; T85-D87 VanDerWaalsContact O-N 3.16Å; T85-D87 PolarHBondContact OG1-OD1 2.9Å; D87-L89 HydrophobicContact CB-CD1 4.26Å; D87-L89 HydrophobicContact CB-CG 4.08Å; D87-L89 WeakPolarHBondContact O-CG 3.34Å; D87-L89 PolarHBondContact O-N 2.78Å; D87-L89 VanDerWaalsContact O-N 3.16Å; D87-L89 PolarHBondContact OD1-N 2.81Å; D87-L89 VanDerWaalsContact OD1-N 3.12Å
88	Y	81.9	Confident	93.2	Very high	123 Å²	123	55.1 Å²	55.1	48%	0.482	27%	0.272	S	S	.	.	S	Bend	trans	60	14.7	-176.3	-51.7	-75	0	0	0	115.1	L84 T85 R136	L84-Y88 HydrophobicContact CB-CD1 4.18Å; L84-Y88 HydrophobicContact CD1-CD1 4.18Å; T85-Y88 WeakPolarHBondContact O-CA 3.25Å; T85-Y88 PolarHBondContact O-N 3.23Å; Y88-R136 HydrophobicContact CE1-CG 4.25Å; Y88-R136 PolarHBondContact OH-NE 3.31Å
89	L	85.4	Confident	92.7	Very high	141 Å²	141	52.2 Å²	52.2	74%	0.738	28%	0.275	S	S	*	.	S	Bend	trans	-91	-18.5	-175.7	-60.5	-178.1	0	0	0	113.5	T85 D87	T85-L89 PolarHBondContact OG1-N 3.23Å; D87-L89 HydrophobicContact CB-CD1 4.26Å; D87-L89 HydrophobicContact CB-CG 4.08Å; D87-L89 WeakPolarHBondContact O-CG 3.34Å; D87-L89 PolarHBondContact O-N 2.78Å; D87-L89 VanDerWaalsContact O-N 3.16Å; D87-L89 PolarHBondContact OD1-N 2.81Å; D87-L89 VanDerWaalsContact OD1-N 3.12Å
90	K	90.7	Very high	92.2	Very high	148 Å²	148	62.4 Å²	62.4	64%	0.643	31%	0.314	S	S	*	.			trans	-135.6	151.5	-175	-65.6	178.8	-178.1	175.8	0	111.1	T85	T85-K90 HydrophobicContact CG2-CB 3.74Å; T85-K90 PolarHBondContact N-O 2.83Å; T85-K90 PolarHBondContact OG1-N 3.49Å; T85-K90 PolarHBondContact OG1-O 3.46Å; T85-K90 VanDerWaalsContact OG1-O 3.09Å
91	E	95.2	Very high	91.8	Very high	82 Å²	82	67 Å²	67	38%	0.383	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.4	174.6	-60.2	-164.9	-173.7	0	0	110	T82 K83 L84 K138	T82-E91 HydrophobicContact CG2-CB 4.26Å; T82-E91 PolarHBondContact OG1-OE2 2.49Å; K83-E91 WeakPolarHBondContact O-CA 3.25Å; L84-E91 HydrophobicContact CD2-CG 3.76Å; E91-K138 VanDerWaalsContact OE1-CE 3.23Å; E91-K138 WeakPolarHBondContact OE1-CE 3.39Å; E91-K138 IonicContact OE1-NZ 2.64Å; E91-K138 PolarHBondContact OE1-NZ 2.85Å; E91-K138 WeakPolarHBondContact OE2-CE 3.49Å; E91-K138 IonicContact OE2-NZ 3.38Å; E91-K138 PolarHBondContact OE2-NZ 3.17Å
92	V	95.9	Very high	91.7	Very high	79 Å²	79	73.7 Å²	73.7	48%	0.479	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124	175.7	179.3	0	0	0	0	107.8	T82 K83 T85 V94	T82-V92 CarbonylContact C-O 3.56Å; T82-V92 VanDerWaalsContact CA-O 3.29Å; T82-V92 WeakPolarHBondContact CA-O 3.19Å; K83-V92 PolarHBondContact N-O 3.03Å; K83-V92 PolarHBondContact O-N 2.04Å; T85-V92 HydrophobicContact CG2-CG2 4.2Å; V92-V94 PolarHBondContact O-N 3.19Å
93	D	97.1	Very high	91.6	Very high	61 Å²	61	79.4 Å²	79.4	33%	0.326	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	133.8	178.1	-72.4	-36.9	0	0	0	111.1	K80 Y105	K80-D93 WeakPolarHBondContact CE-OD1 3.33Å; K80-D93 IonicContact NZ-OD1 3.64Å; D93-Y105 HydrophobicContact CB-CD1 3.97Å; D93-Y105 HydrophobicContact CB-CD2 3.94Å; D93-Y105 HydrophobicContact CB-CE1 4.28Å; D93-Y105 HydrophobicContact CB-CE2 4.3Å; D93-Y105 HydrophobicContact CB-CG 3.76Å; D93-Y105 VanDerWaalsContact O-CB 3.26Å; D93-Y105 WeakPolarHBondContact O-CB 3.36Å
94	V	97.8	Very high	91.5	Very high	0 Å²	0	79.3 Å²	79.3	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-56.2	178	175.3	0	0	0	0	109.8	W81 K83 V92 Y105 Y108 V112 L124 Y137	W81-V94 HydrophobicContact CB-CB 4.37Å; W81-V94 WeakPolarHBondContact O-CB 3.45Å; W81-V94 PolarHBondContact O-N 3.49Å; K83-V94 HydrophobicContact CB-CG2 3.84Å; V92-V94 PolarHBondContact O-N 3.19Å; V94-Y105 PolarHBondContact O-N 2.9Å; V94-Y105 VanDerWaalsContact O-N 3.07Å; V94-Y108 HydrophobicContact CB-CD2 4.24Å; V94-Y108 HydrophobicContact CB-CE2 4.41Å; V94-Y108 HydrophobicContact CG1-CD1 3.87Å; V94-Y108 HydrophobicContact CG1-CD2 3.94Å; V94-Y108 HydrophobicContact CG1-CE1 4.19Å; V94-Y108 HydrophobicContact CG1-CE2 4.28Å; V94-Y108 HydrophobicContact CG1-CG 3.73Å; V94-Y108 HydrophobicContact CG2-CD2 4.05Å; V94-Y108 HydrophobicContact CG2-CE2 3.73Å; V94-V112 HydrophobicContact CG1-CG1 4.46Å; V94-V112 HydrophobicContact CG1-CG2 4.42Å; V94-L124 HydrophobicContact CG1-CD2 3.87Å; V94-Y137 HydrophobicContact CG2-CD1 4.18Å; V94-Y137 HydrophobicContact CG2-CE1 4Å
95	F	98	Very high	91.6	Very high	4 Å²	4	80.6 Å²	80.6	2%	0.018	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	141.9	-175.2	178	-92.1	0	0	0	111.2	W81 K102 K103 T104 V112 L114 L124	W81-F95 HydrophobicContact CB-CB 4.23Å; W81-F95 PolarHBondContact N-O 3.43Å; W81-F95 PolarHBondContact O-N 3.43Å; W81-F95 VanDerWaalsContact O-N 3.15Å; F95-K102 HydrophobicContact CE2-CB 4.23Å; F95-K102 HydrophobicContact CZ-CB 4.24Å; F95-K102 HydrophobicContact CZ-CD 4.32Å; F95-K102 HydrophobicContact CZ-CG 4.22Å; F95-K103 CarbonylContact C-O 3.49Å; F95-K103 WeakPolarHBondContact CA-O 3.36Å; F95-T104 HydrophobicContact CD2-CG2 3.81Å; F95-T104 HydrophobicContact CE2-CG2 4.27Å; F95-V112 HydrophobicContact CB-CG2 4.11Å; F95-V112 HydrophobicContact CD2-CG2 4.09Å; F95-L114 HydrophobicContact CD1-CD2 4.25Å; F95-L114 HydrophobicContact CE1-CD1 4.05Å; F95-L114 HydrophobicContact CE1-CD2 3.76Å; F95-L114 HydrophobicContact CE1-CG 3.58Å; F95-L114 HydrophobicContact CZ-CD1 4.4Å; F95-L114 HydrophobicContact CZ-CD2 4.48Å; F95-L114 HydrophobicContact CZ-CG 3.88Å; F95-L124 HydrophobicContact CB-CD1 3.88Å; F95-L124 HydrophobicContact CD1-CD1 4.05Å; F95-L124 HydrophobicContact CD2-CD1 4.4Å; F95-L124 HydrophobicContact CG-CD1 3.85Å
96	V	97.4	Very high	91.8	Very high	15 Å²	15	81.6 Å²	81.6	9%	0.091	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.3	170.9	177.8	0	0	0	0	109.2	R78 I79 K80 K102 K103 Y105	R78-V96 HydrophobicContact CG-CG1 4.48Å; I79-V96 CarbonylContact O-C 3.55Å; I79-V96 WeakPolarHBondContact O-CA 3.46Å; K80-V96 HydrophobicContact CB-CG2 4.4Å; K80-V96 HydrophobicContact CG-CG2 4.02Å; V96-K102 CarbonylContact O-C 3.56Å; V96-K102 WeakPolarHBondContact O-CA 3.19Å; V96-K103 PolarHBondContact N-O 2.95Å; V96-K103 PolarHBondContact O-N 2.88Å; V96-Y105 HydrophobicContact CB-CE2 4.27Å; V96-Y105 HydrophobicContact CG2-CE2 3.87Å
97	S	95.4	Very high	92.3	Very high	7 Å²	7	81.3 Å²	81.3	5%	0.049	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	144	168.1	63.5	0	0	0	0	112.6	R78 I79 H101 L114	R78-S97 CarbonylContact C-O 3.47Å; R78-S97 VanDerWaalsContact CA-O 3.31Å; R78-S97 WeakPolarHBondContact CA-O 3.34Å; I79-S97 PolarHBondContact N-O 2.85Å; I79-S97 PolarHBondContact O-N 3.43Å; S97-H101 CarbonylContact C-O 3.57Å; S97-H101 VanDerWaalsContact CA-O 3.28Å; S97-H101 WeakPolarHBondContact CA-O 3.19Å; S97-L114 WeakPolarHBondContact OG-CD1 3.46Å
98	M	92.3	Very high	93.1	Very high	85 Å²	85	78.6 Å²	78.6	42%	0.419	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	100.5	171.5	-177.1	177.2	58.4	0	0	108.6	R78 Y100 H101	R78-M98 HydrophobicContact CB-CB 4.44Å; R78-M98 HydrophobicContact CB-CG 4.43Å; R78-M98 HydrophobicContact CG-CB 4.49Å; M98-Y100 PolarHBondContact O-N 2.86Å; M98-H101 PolarHBondContact N-O 3.06Å; M98-H101 PolarHBondContact O-N 2.93Å
99	G	83.9	Confident	93.7	Very high	46 Å²	46	78.9 Å²	78.9	47%	0.474	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	-124.1	-168.4	0	0	0	0	0	111.8	H101	G99-H101 VanDerWaalsContact C-N 3.33Å
100	Y	85	Confident	94.1	Very high	226 Å²	226	76 Å²	76	89%	0.886	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.3	179.4	-59.5	-70.6	0	0	0	114.1	M98 K102	M98-Y100 PolarHBondContact O-N 2.86Å; Y100-K102 PolarHBondContact O-N 2.88Å
101	H	91.1	Very high	94.4	Very high	143 Å²	143	70.5 Å²	70.5	66%	0.662	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	119.5	179.6	-60.2	-75.7	0	0	0	109.5	S97 M98 G99	S97-H101 CarbonylContact C-O 3.57Å; S97-H101 VanDerWaalsContact CA-O 3.28Å; S97-H101 WeakPolarHBondContact CA-O 3.19Å; M98-H101 PolarHBondContact N-O 3.06Å; M98-H101 PolarHBondContact O-N 2.93Å; G99-H101 VanDerWaalsContact C-N 3.33Å
102	K	94.6	Very high	94.5	Very high	139 Å²	139	67 Å²	67	60%	0.604	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.8	140	178.3	-59.5	178.6	-175.7	178.6	0	109.1	F95 V96 Y100	F95-K102 HydrophobicContact CE2-CB 4.23Å; F95-K102 HydrophobicContact CZ-CB 4.24Å; F95-K102 HydrophobicContact CZ-CD 4.32Å; F95-K102 HydrophobicContact CZ-CG 4.22Å; V96-K102 CarbonylContact O-C 3.56Å; V96-K102 WeakPolarHBondContact O-CA 3.19Å; Y100-K102 PolarHBondContact O-N 2.88Å
103	K	96	Very high	94.5	Very high	121 Å²	121	68 Å²	68	53%	0.526	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	131.6	177.6	-171	168.8	173.4	-177.7	0	110.2	F95 V96 Y105	F95-K103 CarbonylContact C-O 3.49Å; F95-K103 WeakPolarHBondContact CA-O 3.36Å; V96-K103 PolarHBondContact N-O 2.95Å; V96-K103 PolarHBondContact O-N 2.88Å; K103-Y105 HydrophobicContact CB-CE2 4.04Å; K103-Y105 HydrophobicContact CD-CE1 4.11Å; K103-Y105 HydrophobicContact CD-CE2 4.11Å; K103-Y105 WeakPolarHBondContact CD-OH 3.15Å; K103-Y105 HydrophobicContact CG-CD2 4.36Å; K103-Y105 HydrophobicContact CG-CE1 4.38Å; K103-Y105 HydrophobicContact CG-CE2 3.71Å
104	T	96.9	Very high	94.4	Very high	37 Å²	37	66.6 Å²	66.6	23%	0.227	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	147.1	177.8	53.9	0	0	0	0	109.1	F95 Q109 V112	F95-T104 HydrophobicContact CD2-CG2 3.81Å; F95-T104 HydrophobicContact CE2-CG2 4.27Å; T104-Q109 PolarHBondContact O-NE2 2.91Å; T104-V112 HydrophobicContact CG2-CG2 3.69Å
105	Y	96.5	Very high	94.3	Very high	58 Å²	58	72.5 Å²	72.5	23%	0.227	39%	0.391	C	S	.	.			trans	-125.9	152.8	-170	-65.3	-100.3	0	0	0	112.5	D93 V94 V96 K103 Y108	D93-Y105 HydrophobicContact CB-CD1 3.97Å; D93-Y105 HydrophobicContact CB-CD2 3.94Å; D93-Y105 HydrophobicContact CB-CE1 4.28Å; D93-Y105 HydrophobicContact CB-CE2 4.3Å; D93-Y105 HydrophobicContact CB-CG 3.76Å; D93-Y105 VanDerWaalsContact O-CB 3.26Å; D93-Y105 WeakPolarHBondContact O-CB 3.36Å; V94-Y105 PolarHBondContact O-N 2.9Å; V94-Y105 VanDerWaalsContact O-N 3.07Å; V96-Y105 HydrophobicContact CB-CE2 4.27Å; V96-Y105 HydrophobicContact CG2-CE2 3.87Å; K103-Y105 HydrophobicContact CB-CE2 4.04Å; K103-Y105 HydrophobicContact CD-CE1 4.11Å; K103-Y105 HydrophobicContact CD-CE2 4.11Å; K103-Y105 WeakPolarHBondContact CD-OH 3.15Å; K103-Y105 HydrophobicContact CG-CD2 4.36Å; K103-Y105 HydrophobicContact CG-CE1 4.38Å; K103-Y105 HydrophobicContact CG-CE2 3.71Å; Y105-Y108 WeakPolarHBondContact O-CB 3.2Å; Y105-Y108 WeakPolarHBondContact O-CD2 3.36Å; Y105-Y108 PolarHBondContact O-N 2.99Å; Y105-Y108 VanDerWaalsContact O-N 3.1Å
106	G	94.1	Very high	93.3	Very high	58 Å²	58	74.4 Å²	74.4	60%	0.598	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	52.1	-139.6	173.9	0	0	0	0	0	114	Y108 Q109	G106-Y108 PolarHBondContact O-N 3.19Å; G106-Y108 VanDerWaalsContact O-N 3.09Å; G106-Q109 WeakPolarHBondContact O-CG 3.38Å; G106-Q109 PolarHBondContact O-N 2.97Å
107	G	93.5	Very high	92	Very high	59 Å²	59	77.7 Å²	77.7	61%	0.608	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-66.5	-3.6	178.6	0	0	0	0	0	115.1	R111	G107-R111 VanDerWaalsContact O-CZ 3.22Å; G107-R111 PolarHBondContact O-NE 2.93Å; G107-R111 PolarHBondContact O-NH2 3.23Å
108	Y	96.3	Very high	91.3	Very high	19 Å²	19	80.3 Å²	80.3	8%	0.075	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-89.6	-7.3	179.4	-59.1	-80.4	0	0	0	113.4	K83 V94 Y105 G106 G110 R111 V112 D133 Y137	K83-Y108 VanDerWaalsContact CD-OH 3.31Å; K83-Y108 WeakPolarHBondContact CD-OH 3.39Å; V94-Y108 HydrophobicContact CB-CD2 4.24Å; V94-Y108 HydrophobicContact CB-CE2 4.41Å; V94-Y108 HydrophobicContact CG1-CD1 3.87Å; V94-Y108 HydrophobicContact CG1-CD2 3.94Å; V94-Y108 HydrophobicContact CG1-CE1 4.19Å; V94-Y108 HydrophobicContact CG1-CE2 4.28Å; V94-Y108 HydrophobicContact CG1-CG 3.73Å; V94-Y108 HydrophobicContact CG2-CD2 4.05Å; V94-Y108 HydrophobicContact CG2-CE2 3.73Å; Y105-Y108 WeakPolarHBondContact O-CB 3.2Å; Y105-Y108 WeakPolarHBondContact O-CD2 3.36Å; Y105-Y108 PolarHBondContact O-N 2.99Å; Y105-Y108 VanDerWaalsContact O-N 3.1Å; G106-Y108 PolarHBondContact O-N 3.19Å; G106-Y108 VanDerWaalsContact O-N 3.09Å; Y108-G110 PolarHBondContact O-N 3.15Å; Y108-R111 PolarHBondContact O-N 3.25Å; Y108-V112 HydrophobicContact CD1-CG1 3.71Å; Y108-V112 HydrophobicContact CG-CG1 4.16Å; Y108-V112 PolarHBondContact O-N 2.73Å; Y108-D133 VanDerWaalsContact CE1-OD1 3.28Å; Y108-D133 WeakPolarHBondContact CE1-OD1 3.48Å; Y108-Y137 HydrophobicContact CE1-CE1 4.25Å; Y108-Y137 PolarHBondContact OH-OH 3.43Å; Y108-Y137 VanDerWaalsContact OH-OH 3.12Å
109	Q	95.2	Very high	90.9	Very high	128 Å²	128	83.6 Å²	83.6	60%	0.598	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	126.8	179.2	-71.5	-178.5	-13.6	0	0	111.5	T104 G106 R111	T104-Q109 PolarHBondContact O-NE2 2.91Å; G106-Q109 WeakPolarHBondContact O-CG 3.38Å; G106-Q109 PolarHBondContact O-N 2.97Å; Q109-R111 PolarHBondContact O-N 3.4Å
110	G	93.6	Very high	91.3	Very high	80 Å²	80	84 Å²	84	83%	0.825	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	-3.7	-178.5	0	0	0	0	0	115.6	Y108	Y108-G110 PolarHBondContact O-N 3.15Å
111	R	96.6	Very high	91.7	Very high	33 Å²	33	74.2 Å²	74.2	13%	0.125	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-9.1	-176.6	-56.4	-170.6	-57.6	113.8	-3.2	114.5	G107 Y108 Q109 I126 T127 D128 D133	G107-R111 VanDerWaalsContact O-CZ 3.22Å; G107-R111 PolarHBondContact O-NE 2.93Å; G107-R111 PolarHBondContact O-NH2 3.23Å; Y108-R111 PolarHBondContact O-N 3.25Å; Q109-R111 PolarHBondContact O-N 3.4Å; R111-I126 WeakPolarHBondContact O-CA 3.34Å; R111-T127 WeakPolarHBondContact CA-OG1 3.45Å; R111-T127 PolarHBondContact NH1-O 2.88Å; R111-T127 VanDerWaalsContact NH1-O 3.12Å; R111-T127 PolarHBondContact O-N 3.41Å; R111-T127 PolarHBondContact O-OG1 3.32Å; R111-T127 VanDerWaalsContact O-OG1 3.1Å; R111-D128 PolarHBondContact NH1-O 3.14Å; R111-D133 IonicContact CZ-OD2 2.62Å; R111-D133 IonicContact NH1-OD1 3.07Å; R111-D133 IonicContact NH1-OD2 2.74Å; R111-D133 PolarHBondContact NH1-OD2 3.25Å; R111-D133 IonicContact NH2-OD1 3.22Å; R111-D133 PolarHBondContact NH2-OD1 2.86Å; R111-D133 VanDerWaalsContact NH2-OD1 3.14Å; R111-D133 IonicContact NH2-OD2 3.28Å; R111-D133 PolarHBondContact NH2-OD2 2.8Å
112	V	97.4	Very high	91.9	Very high	8 Å²	8	67.4 Å²	67.4	5%	0.048	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	137.7	-176.8	-53.3	0	0	0	0	112.9	V94 F95 T104 Y108 L124 V125 I126	V94-V112 HydrophobicContact CG1-CG1 4.46Å; V94-V112 HydrophobicContact CG1-CG2 4.42Å; F95-V112 HydrophobicContact CB-CG2 4.11Å; F95-V112 HydrophobicContact CD2-CG2 4.09Å; T104-V112 HydrophobicContact CG2-CG2 3.69Å; Y108-V112 HydrophobicContact CD1-CG1 3.71Å; Y108-V112 HydrophobicContact CG-CG1 4.16Å; Y108-V112 PolarHBondContact O-N 2.73Å; V112-L124 HydrophobicContact CB-CD1 4.15Å; V112-L124 HydrophobicContact CB-CG 4.48Å; V112-V125 VanDerWaalsContact CA-O 3.24Å; V112-V125 WeakPolarHBondContact CA-O 3.44Å; V112-I126 HydrophobicContact CG1-CB 4.15Å; V112-I126 HydrophobicContact CG1-CG1 3.84Å; V112-I126 HydrophobicContact CG1-CG2 3.91Å
113	F	96.1	Very high	92.1	Very high	101 Å²	101	61 Å²	61	44%	0.443	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	155.3	179.6	51.9	-88.2	0	0	0	110.5	V125 T127	F113-V125 HydrophobicContact CD2-CB 4Å; F113-V125 HydrophobicContact CD2-CG2 4.33Å; F113-V125 HydrophobicContact CE1-CB 4.41Å; F113-V125 HydrophobicContact CE1-CG1 4.17Å; F113-V125 HydrophobicContact CE2-CB 3.67Å; F113-V125 HydrophobicContact CE2-CG1 3.83Å; F113-V125 HydrophobicContact CE2-CG2 3.96Å; F113-V125 HydrophobicContact CG-CB 4.49Å; F113-V125 HydrophobicContact CZ-CB 3.9Å; F113-V125 HydrophobicContact CZ-CG1 3.58Å; F113-V125 PolarHBondContact N-O 3.17Å; F113-V125 VanDerWaalsContact N-O 3.1Å; F113-V125 PolarHBondContact O-N 3.37Å; F113-T127 HydrophobicContact CE1-CG2 3.75Å; F113-T127 HydrophobicContact CZ-CG2 4.07Å
114	L	95.8	Very high	92.1	Very high	32 Å²	32	55.3 Å²	55.3	17%	0.168	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	136.4	171.4	-63.4	179.8	0	0	0	109.8	I79 F95 S97 G116 S123 L124	I79-L114 HydrophobicContact CD1-CD1 3.75Å; I79-L114 HydrophobicContact CG2-CD2 4.36Å; F95-L114 HydrophobicContact CD1-CD2 4.25Å; F95-L114 HydrophobicContact CE1-CD1 4.05Å; F95-L114 HydrophobicContact CE1-CD2 3.76Å; F95-L114 HydrophobicContact CE1-CG 3.58Å; F95-L114 HydrophobicContact CZ-CD1 4.4Å; F95-L114 HydrophobicContact CZ-CD2 4.48Å; F95-L114 HydrophobicContact CZ-CG 3.88Å; S97-L114 WeakPolarHBondContact OG-CD1 3.46Å; L114-G116 PolarHBondContact O-N 2.69Å; L114-S123 WeakPolarHBondContact CA-O 3.31Å; L114-L124 HydrophobicContact CD2-CD1 4.5Å
115	K	93.7	Very high	92.2	Very high	124 Å²	124	54.2 Å²	54.2	54%	0.539	35%	0.35	S	S	.	.			trans	-53	-41.6	-180	-174.9	-178.4	177.6	-178.2	0	112.2	T58 S123 V125	T58-K115 HydrophobicContact CG2-CD 4.01Å; K115-S123 PolarHBondContact N-O 3.25Å; K115-V125 HydrophobicContact CB-CG2 3.75Å; K115-V125 HydrophobicContact CG-CG2 4.18Å
116	G	77.8	Confident	92.3	Very high	44 Å²	44	51.5 Å²	51.5	45%	0.454	34%	0.339	S	S	.	.			trans	70.5	153.6	-171.4	0	0	0	0	0	111.9	L114	L114-G116 PolarHBondContact O-N 2.69Å
117	G	71.2	Confident	92.4	Very high	83 Å²	83	50.2 Å²	50.2	86%	0.856	32%	0.32	S	S	*	.	S	Bend	trans	144.8	-31.7	176.5	0	0	0	0	0	114.2
118	S	80.6	Confident	92.5	Very high	63 Å²	63	51.9 Å²	51.9	44%	0.441	32%	0.315	S	S	.	.	S	Bend	trans	-143.9	158.7	169.5	81.1	0	0	0	0	110.9	N120 D121	S118-N120 PolarHBondContact O-N 3.3Å; S118-N120 PolarHBondContact OG-N 2.78Å; S118-D121 PolarHBondContact O-N 2.83Å; S118-D121 WeakPolarHBondContact OG-CB 3.41Å; S118-D121 PolarHBondContact OG-N 2.86Å
119	D	83.7	Confident	92.5	Very high	153 Å²	153	51 Å²	51	82%	0.818	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-13	178.7	-67.2	-18.8	0	0	0	113.4	F63	F63-D119 VanDerWaalsContact CZ-O 3.29Å; F63-D119 WeakPolarHBondContact CZ-O 3.49Å
120	N	91.1	Very high	92.6	Very high	55 Å²	55	47.2 Å²	47.2	29%	0.294	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	10.9	-176.6	-72	8.9	0	0	0	112.7	K62 F63 R65 S118	K62-N120 WeakPolarHBondContact CA-O 3.37Å; F63-N120 VanDerWaalsContact CD1-O 3.24Å; F63-N120 WeakPolarHBondContact CD1-O 3.4Å; F63-N120 VanDerWaalsContact CE1-C 3.41Å; F63-N120 VanDerWaalsContact CE1-CA 3.49Å; F63-N120 PolarHBondContact N-O 2.88Å; F63-N120 VanDerWaalsContact O-CB 3.3Å; F63-N120 WeakPolarHBondContact O-CB 3.44Å; R65-N120 PolarHBondContact NH1-OD1 3.12Å; S118-N120 PolarHBondContact O-N 3.3Å; S118-N120 PolarHBondContact OG-N 2.78Å
121	D	94	Very high	92.6	Very high	21 Å²	21	44 Å²	44	11%	0.112	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-102.9	109	179.5	-169.1	-3.7	0	0	0	110.5	S118 S123	S118-D121 PolarHBondContact O-N 2.83Å; S118-D121 WeakPolarHBondContact OG-CB 3.41Å; S118-D121 PolarHBondContact OG-N 2.86Å; D121-S123 WeakPolarHBondContact OD1-CB 2.95Å; D121-S123 PolarHBondContact OD1-N 3.45Å; D121-S123 PolarHBondContact OD1-OG 2.93Å
122	A	95.9	Very high	92.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.285	C	S	.	.			trans	-100	13.3	176.2	0	0	0	0	0	112.4	C61 F63 I79 W81 L124 V141	C61-A122 HydrophobicContact CB-CB 4.2Å; C61-A122 CarbonylContact O-C 3.58Å; C61-A122 WeakPolarHBondContact O-CA 3.35Å; C61-A122 PolarHBondContact O-N 3.07Å; F63-A122 HydrophobicContact CD1-CB 3.97Å; F63-A122 HydrophobicContact CE1-CB 4.21Å; I79-A122 HydrophobicContact CD1-CB 3.66Å; I79-A122 HydrophobicContact CG1-CB 3.97Å; I79-A122 HydrophobicContact CG2-CB 3.92Å; W81-A122 PolarHBondContact NE1-O 3.26Å; A122-L124 PolarHBondContact O-N 2.96Å; A122-V141 HydrophobicContact CB-CG2 4.1Å
123	S	97.3	Very high	92.4	Very high	5 Å²	5	48.6 Å²	48.6	4%	0.035	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-62.4	131.6	-176.7	-57.3	0	0	0	0	112.2	L59 P60 C61 L114 K115 D121	L59-S123 CarbonylContact O-C 3.52Å; L59-S123 WeakPolarHBondContact O-CA 3.27Å; L59-S123 WeakPolarHBondContact O-CB 3.48Å; P60-S123 WeakPolarHBondContact CA-OG 3.29Å; C61-S123 PolarHBondContact N-OG 2.85Å; C61-S123 PolarHBondContact O-N 2.95Å; C61-S123 VanDerWaalsContact O-N 3.12Å; C61-S123 PolarHBondContact O-OG 3.46Å; L114-S123 WeakPolarHBondContact CA-O 3.31Å; K115-S123 PolarHBondContact N-O 3.25Å; D121-S123 WeakPolarHBondContact OD1-CB 2.95Å; D121-S123 PolarHBondContact OD1-N 3.45Å; D121-S123 PolarHBondContact OD1-OG 2.93Å
124	L	97.8	Very high	92.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	125.7	-179.3	-172.1	71.2	0	0	0	110.6	T58 L59 W81 V94 F95 V112 L114 A122 I126	T58-L124 CarbonylContact C-O 3.52Å; T58-L124 WeakPolarHBondContact CA-O 3.47Å; L59-L124 HydrophobicContact CB-CB 4.42Å; L59-L124 HydrophobicContact CD1-CD2 4.37Å; L59-L124 PolarHBondContact N-O 2.87Å; L59-L124 PolarHBondContact O-N 3.39Å; W81-L124 HydrophobicContact CB-CD2 3.92Å; W81-L124 HydrophobicContact CD2-CB 3.9Å; W81-L124 HydrophobicContact CD2-CD2 4.02Å; W81-L124 HydrophobicContact CE3-CD2 4.46Å; W81-L124 HydrophobicContact CG-CB 4.1Å; W81-L124 HydrophobicContact CG-CD1 4.5Å; W81-L124 HydrophobicContact CG-CD2 3.79Å; W81-L124 HydrophobicContact CG-CG 4.36Å; W81-L124 HydrophobicContact CZ2-CB 3.89Å; V94-L124 HydrophobicContact CG1-CD2 3.87Å; F95-L124 HydrophobicContact CB-CD1 3.88Å; F95-L124 HydrophobicContact CD1-CD1 4.05Å; F95-L124 HydrophobicContact CD2-CD1 4.4Å; F95-L124 HydrophobicContact CG-CD1 3.85Å; V112-L124 HydrophobicContact CB-CD1 4.15Å; V112-L124 HydrophobicContact CB-CG 4.48Å; L114-L124 HydrophobicContact CD2-CD1 4.5Å; A122-L124 PolarHBondContact O-N 2.96Å; L124-I126 HydrophobicContact CD2-CD1 4.31Å; L124-I126 HydrophobicContact CD2-CG1 4.14Å; L124-I126 HydrophobicContact CG-CG1 4.32Å
125	V	97.8	Very high	92.2	Very high	15 Å²	15	44.5 Å²	44.5	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132	168.1	-176.2	0	0	0	0	108.6	V57 T58 V112 F113 K115 T127	V57-V125 WeakPolarHBondContact O-CA 3.28Å; T58-V125 HydrophobicContact CG2-CG2 4.44Å; V112-V125 VanDerWaalsContact CA-O 3.24Å; V112-V125 WeakPolarHBondContact CA-O 3.44Å; F113-V125 HydrophobicContact CD2-CB 4Å; F113-V125 HydrophobicContact CD2-CG2 4.33Å; F113-V125 HydrophobicContact CE1-CB 4.41Å; F113-V125 HydrophobicContact CE1-CG1 4.17Å; F113-V125 HydrophobicContact CE2-CB 3.67Å; F113-V125 HydrophobicContact CE2-CG1 3.83Å; F113-V125 HydrophobicContact CE2-CG2 3.96Å; F113-V125 HydrophobicContact CG-CB 4.49Å; F113-V125 HydrophobicContact CZ-CB 3.9Å; F113-V125 HydrophobicContact CZ-CG1 3.58Å; F113-V125 PolarHBondContact N-O 3.17Å; F113-V125 VanDerWaalsContact N-O 3.1Å; F113-V125 PolarHBondContact O-N 3.37Å; K115-V125 HydrophobicContact CB-CG2 3.75Å; K115-V125 HydrophobicContact CG-CG2 4.18Å; V125-T127 HydrophobicContact CG1-CG2 4.22Å
126	I	98.2	Very high	92.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.3	170.8	-49.5	-178.7	0	0	0	107.5	N56 V57 L59 R111 V112 L124 L129 Y137	N56-I126 CarbonylContact C-O 3.52Å; N56-I126 WeakPolarHBondContact CA-O 3.14Å; V57-I126 HydrophobicContact CG1-CB 4.1Å; V57-I126 PolarHBondContact N-O 2.76Å; V57-I126 PolarHBondContact O-N 3.29Å; L59-I126 HydrophobicContact CD1-CD1 3.91Å; L59-I126 HydrophobicContact CG-CD1 4.38Å; R111-I126 WeakPolarHBondContact O-CA 3.34Å; V112-I126 HydrophobicContact CG1-CB 4.15Å; V112-I126 HydrophobicContact CG1-CG1 3.84Å; V112-I126 HydrophobicContact CG1-CG2 3.91Å; L124-I126 HydrophobicContact CD2-CD1 4.31Å; L124-I126 HydrophobicContact CD2-CG1 4.14Å; L124-I126 HydrophobicContact CG-CG1 4.32Å; I126-L129 HydrophobicContact CB-CD2 4.08Å; I126-L129 HydrophobicContact CG2-CD2 3.6Å; I126-Y137 HydrophobicContact CD1-CE1 4.02Å
127	T	97.6	Very high	93.3	Very high	31 Å²	31	41 Å²	41	19%	0.19	24%	0.237	C	C	.	.			trans	-105.3	156.4	177.3	61.7	0	0	0	0	111.7	N56 R111 F113 V125	N56-T127 WeakPolarHBondContact OD1-CA 3.24Å; N56-T127 WeakPolarHBondContact OD1-CB 3.31Å; R111-T127 WeakPolarHBondContact CA-OG1 3.45Å; R111-T127 PolarHBondContact NH1-O 2.88Å; R111-T127 VanDerWaalsContact NH1-O 3.12Å; R111-T127 PolarHBondContact O-N 3.41Å; R111-T127 PolarHBondContact O-OG1 3.32Å; R111-T127 VanDerWaalsContact O-OG1 3.1Å; F113-T127 HydrophobicContact CE1-CG2 3.75Å; F113-T127 HydrophobicContact CZ-CG2 4.07Å; V125-T127 HydrophobicContact CG1-CG2 4.22Å
128	D	95.5	Very high	94.6	Very high	95 Å²	95	38.6 Å²	38.6	51%	0.508	20%	0.203	S	C	.	.	S	Bend	trans	51.4	64.6	177.7	-173.9	30.8	0	0	0	111.6	G55 N56 R111 T130	G55-D128 PolarHBondContact O-N 2.91Å; N56-D128 PolarHBondContact OD1-N 3.46Å; N56-D128 VanDerWaalsContact OD1-N 3.14Å; R111-D128 PolarHBondContact NH1-O 3.14Å; D128-T130 PolarHBondContact O-N 3.21Å
129	L	96.8	Very high	95.4	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.182	C	C	.	.			trans	-64.2	130.9	-175	-75.2	172.1	0	0	0	112.3	S51 R53 G54 G55 V57 I126 D133 L154 L156	S51-L129 VanDerWaalsContact CB-CD1 3.44Å; S51-L129 WeakPolarHBondContact OG-CD1 3.42Å; R53-L129 CarbonylContact C-O 3.33Å; R53-L129 WeakPolarHBondContact CA-O 3.43Å; R53-L129 WeakPolarHBondContact CG-O 3.27Å; G54-L129 PolarHBondContact N-O 2.97Å; G55-L129 WeakPolarHBondContact O-CB 3.24Å; G55-L129 WeakPolarHBondContact O-CG 3.26Å; G55-L129 PolarHBondContact O-N 3.3Å; V57-L129 HydrophobicContact CB-CD1 4.03Å; V57-L129 HydrophobicContact CG1-CD1 3.86Å; V57-L129 HydrophobicContact CG1-CD2 4.03Å; V57-L129 HydrophobicContact CG1-CG 4.38Å; I126-L129 HydrophobicContact CB-CD2 4.08Å; I126-L129 HydrophobicContact CG2-CD2 3.6Å; L129-D133 WeakPolarHBondContact CA-OD2 3.28Å; L129-D133 HydrophobicContact CD2-CB 3.7Å; L129-L154 HydrophobicContact CD2-CD2 3.8Å; L129-L156 HydrophobicContact CD1-CD2 4.1Å
130	T	95.6	Very high	96.1	Very high	47 Å²	47	29.7 Å²	29.7	29%	0.288	15%	0.149	S	C	.	.			trans	-97.3	166.3	172.3	74.4	0	0	0	0	110.8	D128 E132 D133 L156	D128-T130 PolarHBondContact O-N 3.21Å; T130-E132 PolarHBondContact O-N 3.45Å; T130-E132 PolarHBondContact OG1-N 2.8Å; T130-D133 PolarHBondContact N-OD2 3.18Å; T130-D133 WeakPolarHBondContact O-CB 3.08Å; T130-D133 PolarHBondContact O-N 3.43Å; T130-D133 VanDerWaalsContact O-N 3.11Å; T130-D133 VanDerWaalsContact OG1-CG 3.32Å; T130-D133 PolarHBondContact OG1-N 3.06Å; T130-D133 PolarHBondContact OG1-OD1 2.77Å; T130-D133 PolarHBondContact OG1-OD2 3.39Å; T130-L156 WeakPolarHBondContact O-CD1 3.48Å
131	L	95.4	Very high	96.3	Very high	14 Å²	14	27 Å²	27	7%	0.073	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-62.6	-27.4	173.4	-64.7	179.5	0	0	0	112.4	R53 D133 L156 V187 F253 S255	R53-L131 HydrophobicContact CB-CD2 4.45Å; L131-D133 VanDerWaalsContact C-N 3.27Å; L131-D133 PolarHBondContact O-N 3.32Å; L131-L156 HydrophobicContact CD2-CD1 4.41Å; L131-V187 HydrophobicContact CB-CB 4.49Å; L131-V187 HydrophobicContact CB-CG1 3.69Å; L131-V187 HydrophobicContact CB-CG2 3.98Å; L131-V187 HydrophobicContact CD1-CG1 4.23Å; L131-F253 HydrophobicContact CD2-CD1 4.34Å; L131-F253 HydrophobicContact CD2-CE1 4.04Å; L131-S255 VanDerWaalsContact CD2-CB 3.48Å
132	E	93	Very high	96.3	Very high	132 Å²	132	27.9 Å²	27.9	62%	0.617	14%	0.139	S	C	*	.	G	3₁₀ helix	trans	-76	-15.1	177.4	-63.4	-174.8	179.6	0	0	112.6	K83 T130 Y134 V187	K83-E132 PolarHBondContact NZ-O 3.4Å; T130-E132 PolarHBondContact O-N 3.45Å; T130-E132 PolarHBondContact OG1-N 2.8Å; E132-Y134 PolarHBondContact O-N 3.41Å; E132-V187 HydrophobicContact CG-CG1 4.45Å
133	D	95.3	Very high	96	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.021	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-75.7	-13.1	177.4	-63.9	-30.6	0	0	0	111.4	Y108 R111 L129 T130 L131 G135 Y137 L154	Y108-D133 VanDerWaalsContact CE1-OD1 3.28Å; Y108-D133 WeakPolarHBondContact CE1-OD1 3.48Å; R111-D133 IonicContact CZ-OD2 2.62Å; R111-D133 IonicContact NH1-OD1 3.07Å; R111-D133 IonicContact NH1-OD2 2.74Å; R111-D133 PolarHBondContact NH1-OD2 3.25Å; R111-D133 IonicContact NH2-OD1 3.22Å; R111-D133 PolarHBondContact NH2-OD1 2.86Å; R111-D133 VanDerWaalsContact NH2-OD1 3.14Å; R111-D133 IonicContact NH2-OD2 3.28Å; R111-D133 PolarHBondContact NH2-OD2 2.8Å; L129-D133 WeakPolarHBondContact CA-OD2 3.28Å; L129-D133 HydrophobicContact CD2-CB 3.7Å; T130-D133 PolarHBondContact N-OD2 3.18Å; T130-D133 WeakPolarHBondContact O-CB 3.08Å; T130-D133 PolarHBondContact O-N 3.43Å; T130-D133 VanDerWaalsContact O-N 3.11Å; T130-D133 VanDerWaalsContact OG1-CG 3.32Å; T130-D133 PolarHBondContact OG1-N 3.06Å; T130-D133 PolarHBondContact OG1-OD1 2.77Å; T130-D133 PolarHBondContact OG1-OD2 3.39Å; L131-D133 VanDerWaalsContact C-N 3.27Å; L131-D133 PolarHBondContact O-N 3.32Å; D133-G135 PolarHBondContact O-N 3.49Å; D133-Y137 WeakPolarHBondContact CA-OH 3.47Å; D133-Y137 VanDerWaalsContact O-CE2 3.3Å; D133-Y137 WeakPolarHBondContact O-CE2 3.44Å; D133-Y137 PolarHBondContact O-OH 3.25Å; D133-L154 HydrophobicContact CB-CD2 4.44Å; D133-L154 WeakPolarHBondContact O-CD2 2.99Å
134	Y	94.6	Very high	95.5	Very high	35 Å²	35	30.2 Å²	30.2	14%	0.137	16%	0.16	C	C	.	.			trans	-56.9	134.6	171.7	170.4	-95.3	0	0	0	111.6	K83 E132 L154 S190 Q193	K83-Y134 WeakPolarHBondContact CE-O 3.45Å; K83-Y134 PolarHBondContact NZ-O 2.99Å; E132-Y134 PolarHBondContact O-N 3.41Å; Y134-L154 WeakPolarHBondContact CD2-O 3.33Å; Y134-S190 VanDerWaalsContact CE1-OG 3.27Å; Y134-S190 WeakPolarHBondContact CE1-OG 3.28Å; Y134-S190 PolarHBondContact OH-OG 2.96Å; Y134-Q193 HydrophobicContact CE1-CG 4.44Å; Y134-Q193 HydrophobicContact CE2-CG 4.2Å
135	G	94.5	Very high	94.9	Very high	13 Å²	13	38.2 Å²	38.2	13%	0.134	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.6	-166.9	173	0	0	0	0	0	113.5	D133 L154	D133-G135 PolarHBondContact O-N 3.49Å; G135-L154 PolarHBondContact N-O 2.83Å; G135-L154 PolarHBondContact O-N 3.5Å
136	R	95.7	Very high	94.5	Very high	94 Å²	94	40.8 Å²	40.8	36%	0.355	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136.3	179.7	-58.6	-169.3	-169.6	-117.3	-8	110.6	L84 Y88 V151 A153 D192	L84-R136 HydrophobicContact CB-CB 4.36Å; L84-R136 HydrophobicContact CD1-CB 4Å; L84-R136 HydrophobicContact CG-CB 4.33Å; L84-R136 PolarHBondContact N-O 3.5Å; Y88-R136 HydrophobicContact CE1-CG 4.25Å; Y88-R136 PolarHBondContact OH-NE 3.31Å; R136-V151 HydrophobicContact CB-CG1 4Å; R136-A153 HydrophobicContact CG-CB 4.26Å; R136-D192 IonicContact NH2-OD2 3.66Å; R136-D192 PolarHBondContact NH2-OD2 3.43Å
137	Y	97.8	Very high	94.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.4	-177.2	-69.1	-97.6	0	0	0	109.3	L59 T82 K83 V94 Y108 I126 D133 V151 V152 L154	L59-Y137 HydrophobicContact CD1-CD1 3.84Å; L59-Y137 HydrophobicContact CD1-CD2 3.83Å; L59-Y137 HydrophobicContact CD1-CE1 4.46Å; L59-Y137 HydrophobicContact CD1-CE2 4.47Å; L59-Y137 HydrophobicContact CD1-CG 3.48Å; L59-Y137 VanDerWaalsContact CD1-CG 3.48Å; T82-Y137 CarbonylContact O-C 3.58Å; T82-Y137 VanDerWaalsContact O-CA 3.24Å; T82-Y137 WeakPolarHBondContact O-CA 3.4Å; K83-Y137 HydrophobicContact CB-CD1 4.04Å; K83-Y137 HydrophobicContact CB-CE1 3.89Å; K83-Y137 HydrophobicContact CD-CE1 4.21Å; K83-Y137 HydrophobicContact CG-CD1 4.36Å; K83-Y137 HydrophobicContact CG-CE1 4.05Å; K83-Y137 HydrophobicContact CG-CE2 4.48Å; V94-Y137 HydrophobicContact CG2-CD1 4.18Å; V94-Y137 HydrophobicContact CG2-CE1 4Å; Y108-Y137 HydrophobicContact CE1-CE1 4.25Å; Y108-Y137 PolarHBondContact OH-OH 3.43Å; Y108-Y137 VanDerWaalsContact OH-OH 3.12Å; I126-Y137 HydrophobicContact CD1-CE1 4.02Å; D133-Y137 WeakPolarHBondContact CA-OH 3.47Å; D133-Y137 VanDerWaalsContact O-CE2 3.3Å; D133-Y137 WeakPolarHBondContact O-CE2 3.44Å; D133-Y137 PolarHBondContact O-OH 3.25Å; Y137-V151 CarbonylContact O-C 3.44Å; Y137-V151 VanDerWaalsContact O-CA 3.31Å; Y137-V151 WeakPolarHBondContact O-CA 3.05Å; Y137-V152 PolarHBondContact N-O 2.83Å; Y137-V152 PolarHBondContact O-N 3.33Å; Y137-L154 HydrophobicContact CD2-CB 4.14Å; Y137-L154 HydrophobicContact CE2-CB 3.85Å; Y137-L154 HydrophobicContact CE2-CD2 4.03Å
138	K	97.8	Very high	94.1	Very high	32 Å²	32	46 Å²	46	14%	0.139	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	121.8	176.1	-169.5	-176.2	73.8	172.2	0	109	W81 T82 L84 E91 E140 T149 A150 V151	W81-K138 VanDerWaalsContact CA-O 3.32Å; W81-K138 WeakPolarHBondContact CA-O 3.41Å; T82-K138 PolarHBondContact N-O 3.49Å; T82-K138 PolarHBondContact O-N 3.31Å; L84-K138 HydrophobicContact CD2-CB 4.4Å; E91-K138 VanDerWaalsContact OE1-CE 3.23Å; E91-K138 WeakPolarHBondContact OE1-CE 3.39Å; E91-K138 IonicContact OE1-NZ 2.64Å; E91-K138 PolarHBondContact OE1-NZ 2.85Å; E91-K138 WeakPolarHBondContact OE2-CE 3.49Å; E91-K138 IonicContact OE2-NZ 3.38Å; E91-K138 PolarHBondContact OE2-NZ 3.17Å; K138-E140 IonicContact NZ-OE2 3.69Å; K138-E140 PolarHBondContact NZ-OE2 3.34Å; K138-T149 HydrophobicContact CD-CG2 4.3Å; K138-A150 WeakPolarHBondContact CA-O 3.4Å; K138-V151 HydrophobicContact CB-CG2 4.34Å; K138-V151 HydrophobicContact CG-CG2 4.18Å
139	C	98	Very high	94.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	124.5	165.3	-173.2	0	0	0	0	108	C61 W81 T149 A150	C61-C139 HydrophobicContact CB-CB 3.71Å; C61-C139 WeakPolarHBondContact CB-SG 3.44Å; C61-C139 WeakPolarHBondContact SG-CB 3.36Å; C61-C139 CovalentContact SG-SG 2.04Å; C61-C139 PolarHBondContact SG-SG 3.04Å; W81-C139 HydrophobicContact CD2-CB 4.04Å; W81-C139 HydrophobicContact CE3-CB 4.06Å; W81-C139 HydrophobicContact CH2-CB 3.64Å; W81-C139 HydrophobicContact CZ2-CB 3.6Å; W81-C139 HydrophobicContact CZ3-CB 3.86Å; C139-T149 CarbonylContact O-C 3.4Å; C139-T149 WeakPolarHBondContact O-CA 3.46Å; C139-T149 WeakPolarHBondContact O-CB 3.47Å; C139-A150 PolarHBondContact N-O 2.88Å; C139-A150 PolarHBondContact O-N 3.01Å
140	E	97.8	Very high	94.2	Very high	29 Å²	29	44.6 Å²	44.6	14%	0.136	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	119.7	177.8	176.5	-177.7	169.1	0	0	107.6	K80 K138 I142 T149	K80-E140 HydrophobicContact CB-CB 4.28Å; K80-E140 PolarHBondContact N-O 2.93Å; K80-E140 PolarHBondContact O-N 2.82Å; K138-E140 IonicContact NZ-OE2 3.69Å; K138-E140 PolarHBondContact NZ-OE2 3.34Å; E140-I142 HydrophobicContact CG-CD1 4.14Å; E140-I142 HydrophobicContact CG-CG1 4.02Å; E140-T149 HydrophobicContact CB-CG2 3.92Å; E140-T149 HydrophobicContact CG-CG2 3.92Å
141	V	96.1	Very high	94.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.4	178.6	-174.1	0	0	0	0	107.7	L40 V42 F63 I77 A122 D147 D148	L40-V141 HydrophobicContact CD1-CG1 4.38Å; L40-V141 HydrophobicContact CD2-CB 4.28Å; L40-V141 HydrophobicContact CD2-CG1 4.12Å; L40-V141 WeakPolarHBondContact CD2-O 3.44Å; V42-V141 HydrophobicContact CG1-CG2 4.25Å; V42-V141 HydrophobicContact CG2-CB 3.6Å; V42-V141 HydrophobicContact CG2-CG2 3.62Å; F63-V141 HydrophobicContact CB-CB 4.49Å; F63-V141 HydrophobicContact CB-CG1 4.32Å; F63-V141 HydrophobicContact CB-CG2 4.2Å; F63-V141 HydrophobicContact CD1-CG1 4.13Å; F63-V141 HydrophobicContact CD1-CG2 4.17Å; F63-V141 HydrophobicContact CD2-CG1 3.97Å; F63-V141 HydrophobicContact CE1-CG1 4.43Å; F63-V141 HydrophobicContact CE2-CG1 4.25Å; F63-V141 HydrophobicContact CG-CG1 3.89Å; F63-V141 HydrophobicContact CG-CG2 4.28Å; F63-V141 HydrophobicContact CZ-CG1 4.49Å; I77-V141 HydrophobicContact CG2-CG1 3.54Å; A122-V141 HydrophobicContact CB-CG2 4.1Å; V141-D147 VanDerWaalsContact O-CA 3.31Å; V141-D147 WeakPolarHBondContact O-CA 3.46Å; V141-D148 PolarHBondContact N-O 3.01Å; V141-D148 PolarHBondContact O-N 3.28Å; V141-D148 VanDerWaalsContact O-N 3.14Å
142	I	93.9	Very high	94.4	Very high	38 Å²	38	44.6 Å²	44.6	20%	0.195	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.3	-173.2	-52.9	161.1	0	0	0	109.1	R78 E140 E146 D147	R78-I142 HydrophobicContact CB-CB 4.3Å; R78-I142 PolarHBondContact N-O 2.85Å; R78-I142 PolarHBondContact O-N 3.25Å; E140-I142 HydrophobicContact CG-CD1 4.14Å; E140-I142 HydrophobicContact CG-CG1 4.02Å; I142-E146 WeakPolarHBondContact CA-O 3.1Å; I142-D147 HydrophobicContact CB-CB 4.44Å; I142-D147 HydrophobicContact CG1-CB 3.91Å; I142-D147 HydrophobicContact CG2-CB 4.45Å
143	E	89.9	Confident	94.5	Very high	16 Å²	16	38.8 Å²	38.8	8%	0.075	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	102.5	173.1	-169.1	169.1	-169.9	0	0	110.4	L40 R65 G73 H75 I77 L145 E146	L40-E143 HydrophobicContact CD2-CB 4.45Å; R65-E143 WeakPolarHBondContact CD-OE2 3.36Å; R65-E143 IonicContact NE-OE1 3.94Å; R65-E143 IonicContact NE-OE2 3.04Å; R65-E143 PolarHBondContact NE-OE2 2.96Å; G73-E143 WeakPolarHBondContact CA-OE1 3.43Å; G73-E143 PolarHBondContact N-OE1 3.44Å; H75-E143 HydrophobicContact CB-CG 3.93Å; I77-E143 HydrophobicContact CD1-CB 3.58Å; I77-E143 HydrophobicContact CD1-CG 3.72Å; I77-E143 WeakPolarHBondContact CD1-OE2 3.18Å; E143-L145 PolarHBondContact O-N 2.85Å; E143-E146 PolarHBondContact N-O 3.26Å; E143-E146 PolarHBondContact O-N 3.16Å
144	G	86.4	Confident	94.6	Very high	38 Å²	38	38.6 Å²	38.6	39%	0.392	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	-106.2	-177.5	0	0	0	0	0	111.7
145	L	85.6	Confident	94.6	Very high	169 Å²	169	37.6 Å²	37.6	89%	0.885	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-4.9	177.3	-60.4	179.5	0	0	0	113.1	E143	E143-L145 PolarHBondContact O-N 2.85Å
146	E	88.5	Confident	94.7	Very high	69 Å²	69	37.5 Å²	37.5	32%	0.322	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	133.1	179	-56	-70.9	160.8	0	0	108.9	R39 L40 I142 E143	R39-E146 HydrophobicContact CB-CG 4.18Å; R39-E146 WeakPolarHBondContact CD-OE1 2.9Å; R39-E146 IonicContact CZ-OE1 3.47Å; R39-E146 IonicContact NE-OE1 3.14Å; R39-E146 IonicContact NH1-OE1 2.75Å; R39-E146 PolarHBondContact NH1-OE1 2.9Å; L40-E146 HydrophobicContact CB-CB 4.4Å; I142-E146 WeakPolarHBondContact CA-O 3.1Å; E143-E146 PolarHBondContact N-O 3.26Å; E143-E146 PolarHBondContact O-N 3.16Å
147	D	92.4	Very high	94.6	Very high	94 Å²	94	38.3 Å²	38.3	50%	0.503	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.4	174.6	68.2	-55.1	0	0	0	111	V141 I142	V141-D147 VanDerWaalsContact O-CA 3.31Å; V141-D147 WeakPolarHBondContact O-CA 3.46Å; I142-D147 HydrophobicContact CB-CB 4.44Å; I142-D147 HydrophobicContact CG1-CB 3.91Å; I142-D147 HydrophobicContact CG2-CB 4.45Å
148	D	95.8	Very high	94.6	Very high	46 Å²	46	39.4 Å²	39.4	25%	0.246	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	162.3	168.9	-170.9	24.8	0	0	0	109.9	L41 V42 V141	L41-D148 WeakPolarHBondContact CA-OD2 3.3Å; V42-D148 HydrophobicContact CB-CB 4.21Å; V42-D148 HydrophobicContact CG2-CB 3.87Å; V42-D148 WeakPolarHBondContact CG2-O 3.15Å; V42-D148 PolarHBondContact N-OD2 2.56Å; V141-D148 PolarHBondContact N-O 3.01Å; V141-D148 PolarHBondContact O-N 3.28Å; V141-D148 VanDerWaalsContact O-N 3.14Å
149	T	96.8	Very high	94.6	Very high	55 Å²	55	38.4 Å²	38.4	34%	0.337	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	148.6	-170.6	71.1	0	0	0	0	113.6	K138 C139 E140	K138-T149 HydrophobicContact CD-CG2 4.3Å; C139-T149 CarbonylContact O-C 3.4Å; C139-T149 WeakPolarHBondContact O-CA 3.46Å; C139-T149 WeakPolarHBondContact O-CB 3.47Å; E140-T149 HydrophobicContact CB-CG2 3.92Å; E140-T149 HydrophobicContact CG-CG2 3.92Å
150	A	97.1	Very high	94.6	Very high	11 Å²	11	39 Å²	39	9%	0.091	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149.7	167.4	0	0	0	0	0	110.7	V42 A44 K138 C139	V42-A150 HydrophobicContact CG1-CB 3.77Å; A44-A150 HydrophobicContact CB-CB 3.89Å; K138-A150 WeakPolarHBondContact CA-O 3.4Å; C139-A150 PolarHBondContact N-O 2.88Å; C139-A150 PolarHBondContact O-N 3.01Å
151	V	97	Very high	94.6	Very high	61 Å²	61	37.7 Å²	37.7	37%	0.37	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.8	178.7	178.5	0	0	0	0	110.4	L84 R136 Y137 K138	L84-V151 HydrophobicContact CD1-CG1 4.44Å; R136-V151 HydrophobicContact CB-CG1 4Å; Y137-V151 CarbonylContact O-C 3.44Å; Y137-V151 VanDerWaalsContact O-CA 3.31Å; Y137-V151 WeakPolarHBondContact O-CA 3.05Å; K138-V151 HydrophobicContact CB-CG2 4.34Å; K138-V151 HydrophobicContact CG-CG2 4.18Å
152	V	97.7	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.8	176	-176.7	0	0	0	0	109.3	A44 V49 L59 P60 W81 Y137	A44-V152 HydrophobicContact CB-CG2 3.7Å; V49-V152 HydrophobicContact CG1-CG1 4.28Å; V49-V152 HydrophobicContact CG2-CG1 4.06Å; L59-V152 HydrophobicContact CB-CB 4.44Å; L59-V152 HydrophobicContact CB-CG1 4.29Å; L59-V152 HydrophobicContact CD2-CG1 4Å; P60-V152 WeakPolarHBondContact O-CG2 3.1Å; W81-V152 HydrophobicContact CH2-CG2 4.15Å; Y137-V152 PolarHBondContact N-O 2.83Å; Y137-V152 PolarHBondContact O-N 3.33Å
153	A	96.4	Very high	94.9	Very high	10 Å²	10	37.3 Å²	37.3	8%	0.083	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	127	170.2	0	0	0	0	0	110.7	A47 K48 V49 R136	A47-A153 PolarHBondContact O-N 3.22Å; K48-A153 CarbonylContact C-O 3.56Å; K48-A153 WeakPolarHBondContact CA-O 3.42Å; K48-A153 HydrophobicContact CB-CB 4.38Å; K48-A153 HydrophobicContact CG-CB 4.15Å; V49-A153 PolarHBondContact N-O 2.89Å; R136-A153 HydrophobicContact CG-CB 4.26Å
154	L	96.7	Very high	95.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	112.5	170.8	172.1	57.1	0	0	0	109.8	V49 V57 L59 L129 D133 Y134 G135 Y137	V49-L154 HydrophobicContact CG2-CB 4.41Å; V49-L154 HydrophobicContact CG2-CD1 3.95Å; V57-L154 HydrophobicContact CB-CD1 4.24Å; V57-L154 HydrophobicContact CG1-CD1 3.91Å; V57-L154 HydrophobicContact CG1-CD2 3.96Å; V57-L154 HydrophobicContact CG2-CD1 3.95Å; L59-L154 HydrophobicContact CD2-CB 4.22Å; L129-L154 HydrophobicContact CD2-CD2 3.8Å; D133-L154 HydrophobicContact CB-CD2 4.44Å; D133-L154 WeakPolarHBondContact O-CD2 2.99Å; Y134-L154 WeakPolarHBondContact CD2-O 3.33Å; G135-L154 PolarHBondContact N-O 2.83Å; G135-L154 PolarHBondContact O-N 3.5Å; Y137-L154 HydrophobicContact CD2-CB 4.14Å; Y137-L154 HydrophobicContact CE2-CB 3.85Å; Y137-L154 HydrophobicContact CE2-CD2 4.03Å
155	D	94.9	Very high	95.7	Very high	15 Å²	15	37 Å²	37	8%	0.08	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	142.9	173.6	-89.7	40	0	0	0	111.8	K48 V49 F50 S51	K48-D155 WeakPolarHBondContact CE-OD1 3.42Å; K48-D155 WeakPolarHBondContact CE-OD2 3.17Å; K48-D155 VanDerWaalsContact NZ-CG 3.3Å; K48-D155 IonicContact NZ-OD1 3.3Å; K48-D155 IonicContact NZ-OD2 2.91Å; K48-D155 PolarHBondContact NZ-OD2 2.62Å; V49-D155 PolarHBondContact O-N 3.45Å; F50-D155 WeakPolarHBondContact CA-O 3.21Å; F50-D155 HydrophobicContact CD1-CB 3.43Å; F50-D155 VanDerWaalsContact CD1-CB 3.43Å; F50-D155 HydrophobicContact CE1-CB 3.54Å; F50-D155 HydrophobicContact CG-CB 4.28Å; F50-D155 HydrophobicContact CZ-CB 4.46Å; S51-D155 PolarHBondContact N-O 3.28Å
156	L	95.6	Very high	96.1	Very high	10 Å²	10	36.8 Å²	36.8	5%	0.052	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.6	173.3	-60.8	-179.4	0	0	0	109.5	S51 L129 T130 L131 G158 F253	S51-L156 CarbonylContact O-C 3.55Å; S51-L156 WeakPolarHBondContact O-CA 3.47Å; L129-L156 HydrophobicContact CD1-CD2 4.1Å; T130-L156 WeakPolarHBondContact O-CD1 3.48Å; L131-L156 HydrophobicContact CD2-CD1 4.41Å; L156-G158 PolarHBondContact O-N 3.28Å; L156-F253 HydrophobicContact CB-CE1 4.08Å; L156-F253 HydrophobicContact CB-CZ 3.93Å; L156-F253 WeakPolarHBondContact O-CZ 3.38Å
157	Q	95.2	Very high	96.3	Very high	111 Å²	111	40.8 Å²	40.8	52%	0.519	21%	0.214	S	C	.	.			trans	-60.7	125.3	167	-174.2	-179.9	31.8	0	0	108.6	S51 S255 L298	S51-Q157 PolarHBondContact O-N 3.37Å; Q157-S255 WeakPolarHBondContact O-CB 3.47Å; Q157-S255 PolarHBondContact O-OG 3.12Å; Q157-L298 HydrophobicContact CG-CD2 4.15Å
158	G	96.2	Very high	96.4	Very high	23 Å²	23	37.4 Å²	37.4	24%	0.237	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	-163.2	-174.4	0	0	0	0	0	113.6	L156 T254	L156-G158 PolarHBondContact O-N 3.28Å; G158-T254 CarbonylContact C-O 3.49Å; G158-T254 WeakPolarHBondContact CA-O 3.42Å
159	V	97.7	Very high	96.4	Very high	11 Å²	11	41 Å²	41	7%	0.067	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	132.7	-177.9	61.1	0	0	0	0	110.2	F253 T254 F293 W296 K297	V159-F253 WeakPolarHBondContact O-CA 3.35Å; V159-T254 HydrophobicContact CG1-CG2 3.59Å; V159-T254 PolarHBondContact N-O 3.36Å; V159-T254 PolarHBondContact O-N 3.47Å; V159-F293 HydrophobicContact CG1-CB 3.87Å; V159-W296 HydrophobicContact CG2-CZ3 4.23Å; V159-K297 HydrophobicContact CB-CB 3.94Å; V159-K297 HydrophobicContact CB-CG 3.93Å; V159-K297 HydrophobicContact CG1-CB 4.38Å; V159-K297 HydrophobicContact CG2-CB 3.87Å; V159-K297 HydrophobicContact CG2-CG 3.87Å
160	V	98.5	Very high	96.4	Very high	14 Å²	14	42.9 Å²	42.9	9%	0.085	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	135.1	167.4	177.5	0	0	0	0	109	A189 Q193 L194 A197 L202 F251 C252 F253	V160-A189 HydrophobicContact CG1-CB 4.11Å; V160-A189 HydrophobicContact CG2-CB 4.09Å; V160-Q193 HydrophobicContact CG2-CB 3.79Å; V160-Q193 WeakPolarHBondContact CG2-O 3.46Å; V160-L194 HydrophobicContact CG1-CD1 4.09Å; V160-A197 HydrophobicContact CB-CB 3.76Å; V160-A197 HydrophobicContact CG1-CB 4.43Å; V160-A197 HydrophobicContact CG2-CB 4.09Å; V160-L202 HydrophobicContact CG1-CD2 4.3Å; V160-F251 HydrophobicContact CG1-CB 3.97Å; V160-F251 HydrophobicContact CG1-CD1 4.04Å; V160-F251 HydrophobicContact CG1-CG 4.41Å; V160-C252 CarbonylContact C-O 3.54Å; V160-C252 VanDerWaalsContact CA-O 3.27Å; V160-C252 WeakPolarHBondContact CA-O 3.27Å; V160-F253 HydrophobicContact CG2-CB 4.46Å; V160-F253 HydrophobicContact CG2-CD2 4.03Å
161	F	98.4	Very high	96.4	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	143.3	174.7	64	-88.2	0	0	0	111.9	Y163 A186 C252 T254 V289 F293	F161-Y163 HydrophobicContact CE2-CD2 4.44Å; F161-A186 HydrophobicContact CE1-CB 3.89Å; F161-A186 HydrophobicContact CZ-CB 3.78Å; F161-C252 HydrophobicContact CD1-CB 4.29Å; F161-C252 HydrophobicContact CD2-CB 4.21Å; F161-C252 HydrophobicContact CE1-CB 3.76Å; F161-C252 HydrophobicContact CE2-CB 3.67Å; F161-C252 HydrophobicContact CZ-CB 3.42Å; F161-C252 VanDerWaalsContact CZ-CB 3.42Å; F161-C252 PolarHBondContact N-O 2.9Å; F161-C252 PolarHBondContact O-N 3.12Å; F161-T254 HydrophobicContact CD1-CG2 4.22Å; F161-T254 HydrophobicContact CE1-CG2 3.81Å; F161-V289 HydrophobicContact CD2-CG1 4.02Å; F161-V289 HydrophobicContact CE2-CB 4.46Å; F161-V289 HydrophobicContact CE2-CG1 3.67Å; F161-V289 HydrophobicContact CZ-CG1 4.37Å; F161-F293 HydrophobicContact CB-CB 4.39Å; F161-F293 HydrophobicContact CB-CD1 3.55Å; F161-F293 HydrophobicContact CB-CD2 3.55Å; F161-F293 HydrophobicContact CB-CE1 3.53Å; F161-F293 HydrophobicContact CB-CE2 3.54Å; F161-F293 HydrophobicContact CB-CG 3.57Å; F161-F293 HydrophobicContact CB-CZ 3.53Å; F161-F293 HydrophobicContact CD1-CB 4Å; F161-F293 AromaticContact CD1-CD2 3.92Å; F161-F293 HydrophobicContact CD1-CD2 3.92Å; F161-F293 AromaticContact CD1-CG 3.98Å; F161-F293 HydrophobicContact CD1-CG 3.98Å; F161-F293 AromaticContact CD2-CD2 3.66Å; F161-F293 HydrophobicContact CD2-CD2 3.66Å; F161-F293 AromaticContact CD2-CE2 3.64Å; F161-F293 HydrophobicContact CD2-CE2 3.64Å; F161-F293 HydrophobicContact CD2-CG 4.44Å; F161-F293 HydrophobicContact CD2-CZ 4.4Å; F161-F293 HydrophobicContact CE2-CD2 4.31Å; F161-F293 HydrophobicContact CE2-CE2 4.5Å; F161-F293 HydrophobicContact CG-CB 4.3Å; F161-F293 HydrophobicContact CG-CD1 4.27Å; F161-F293 AromaticContact CG-CD2 3.43Å; F161-F293 HydrophobicContact CG-CD2 3.43Å; F161-F293 VanDerWaalsContact CG-CD2 3.43Å; F161-F293 HydrophobicContact CG-CE1 4.47Å; F161-F293 AromaticContact CG-CE2 3.7Å; F161-F293 HydrophobicContact CG-CE2 3.7Å; F161-F293 AromaticContact CG-CG 3.76Å; F161-F293 HydrophobicContact CG-CG 3.76Å; F161-F293 HydrophobicContact CG-CZ 4.23Å
162	P	98.1	Very high	96.4	Very high	13 Å²	13	43.2 Å²	43.2	8%	0.084	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	143.6	173	30.7	-33.7	0	0	0	110.8	W204 F251	P162-W204 HydrophobicContact CB-CD2 3.7Å; P162-W204 HydrophobicContact CB-CE3 4.41Å; P162-W204 HydrophobicContact CB-CG 3.9Å; P162-W204 HydrophobicContact CB-CH2 4.44Å; P162-W204 HydrophobicContact CB-CZ2 3.76Å; P162-W204 VanDerWaalsContact CB-NE1 3.32Å; P162-W204 HydrophobicContact CG-CD2 3.47Å; P162-W204 VanDerWaalsContact CG-CD2 3.47Å; P162-W204 VanDerWaalsContact CG-CE2 3.46Å; P162-W204 HydrophobicContact CG-CE3 3.68Å; P162-W204 HydrophobicContact CG-CG 4.03Å; P162-W204 HydrophobicContact CG-CH2 3.83Å; P162-W204 HydrophobicContact CG-CZ2 3.65Å; P162-W204 HydrophobicContact CG-CZ3 3.84Å; P162-F251 HydrophobicContact CB-CD1 4.18Å; P162-F251 HydrophobicContact CB-CE1 3.9Å
163	Y	98.5	Very high	96.5	Very high	17 Å²	17	44.1 Å²	44.1	7%	0.067	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	139	178.5	-176	-91.8	0	0	0	111.7	F161 A180 Q184 V250 V289 D311	F161-Y163 HydrophobicContact CE2-CD2 4.44Å; Y163-A180 HydrophobicContact CD1-CB 4.06Å; Y163-A180 HydrophobicContact CE1-CB 3.74Å; Y163-Q184 HydrophobicContact CD2-CG 4.12Å; Y163-Q184 HydrophobicContact CE2-CG 3.59Å; Y163-V250 HydrophobicContact CD1-CG1 4.05Å; Y163-V250 PolarHBondContact N-O 3.26Å; Y163-V250 PolarHBondContact O-N 3.48Å; Y163-V289 HydrophobicContact CD2-CG1 4.34Å; Y163-V289 HydrophobicContact CE2-CG2 4.23Å; Y163-D311 HydrophobicContact CE2-CB 4.48Å
164	F	97.3	Very high	96.5	Very high	25 Å²	25	44.4 Å²	44.4	11%	0.11	22%	0.215	C	C	.	.			trans	-142.8	147	168.6	62.4	-90.7	0	0	0	108.8	R169 D249 F334 F337	F164-R169 HydrophobicContact CB-CG 4.38Å; F164-R169 HydrophobicContact CD1-CG 4.18Å; F164-R169 HydrophobicContact CD2-CG 4.08Å; F164-R169 HydrophobicContact CE2-CG 4.42Å; F164-R169 HydrophobicContact CG-CG 3.96Å; F164-D249 HydrophobicContact CB-CB 4.5Å; F164-D249 WeakPolarHBondContact CB-OD1 3.45Å; F164-F334 HydrophobicContact CE1-CE1 4.43Å; F164-F334 HydrophobicContact CE2-CE1 4.18Å; F164-F334 HydrophobicContact CE2-CZ 4.01Å; F164-F334 HydrophobicContact CZ-CD1 4.18Å; F164-F334 AromaticContact CZ-CE1 3.5Å; F164-F334 HydrophobicContact CZ-CE1 3.5Å; F164-F334 VanDerWaalsContact CZ-CE1 3.5Å; F164-F334 HydrophobicContact CZ-CE2 4.5Å; F164-F334 AromaticContact CZ-CZ 3.67Å; F164-F334 HydrophobicContact CZ-CZ 3.67Å; F164-F337 HydrophobicContact CD2-CE2 4.14Å; F164-F337 HydrophobicContact CE2-CD2 4.4Å; F164-F337 AromaticContact CE2-CE2 3.82Å; F164-F337 HydrophobicContact CE2-CE2 3.82Å
165	P	95.6	Very high	96.6	Very high	21 Å²	21	48.8 Å²	48.8	14%	0.136	24%	0.236	C	C	.	.			trans	-78.5	171.3	-175.3	34.7	-36.9	0	0	0	111.6	L167 G168 N171 L172	P165-L167 PolarHBondContact O-N 2.89Å; P165-L167 VanDerWaalsContact O-N 3.08Å; P165-G168 PolarHBondContact O-N 3.27Å; P165-N171 HydrophobicContact CG-CB 4.38Å; P165-L172 HydrophobicContact CG-CD1 4.43Å; P165-L172 HydrophobicContact CG-CD2 3.91Å; P165-L172 HydrophobicContact CG-CG 4.05Å
166	R	94.5	Very high	96.8	Very high	165 Å²	165	51.7 Å²	51.7	62%	0.623	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-29.3	175.9	175.3	176.2	164	-154.2	-4.6	114.1	G168 F337	R166-G168 PolarHBondContact O-N 2.97Å; R166-G168 VanDerWaalsContact O-N 3.14Å; R166-F337 HydrophobicContact CB-CB 4.36Å; R166-F337 HydrophobicContact CB-CD1 3.67Å; R166-F337 HydrophobicContact CB-CD2 4.29Å; R166-F337 HydrophobicContact CB-CE1 3.93Å; R166-F337 HydrophobicContact CB-CG 3.86Å; R166-F337 HydrophobicContact CB-CZ 4.36Å; R166-F337 HydrophobicContact CG-CB 3.9Å; R166-F337 HydrophobicContact CG-CD1 4.08Å; R166-F337 HydrophobicContact CG-CG 3.98Å
167	L	93.1	Very high	96.9	Very high	153 Å²	153	51.2 Å²	51.2	80%	0.801	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-12.4	178.1	-67.3	168.9	0	0	0	113	P165 N171	P165-L167 PolarHBondContact O-N 2.89Å; P165-L167 VanDerWaalsContact O-N 3.08Å; L167-N171 PolarHBondContact O-ND2 2.91Å; L167-N171 VanDerWaalsContact O-ND2 3.14Å
168	G	93.6	Very high	97.1	Very high	23 Å²	23	50.1 Å²	50.1	24%	0.237	24%	0.241	C	C	.	.			trans	109.7	-178.4	178.6	0	0	0	0	0	112	P165 R166 N171	P165-G168 PolarHBondContact O-N 3.27Å; R166-G168 PolarHBondContact O-N 2.97Å; R166-G168 VanDerWaalsContact O-N 3.14Å; G168-N171 VanDerWaalsContact C-ND2 3.26Å; G168-N171 PolarHBondContact O-ND2 2.82Å
169	R	95.6	Very high	97.2	Very high	123 Å²	123	53.7 Å²	53.7	46%	0.464	25%	0.252	S	S	.	.	S	Bend	trans	-71.8	154.5	-179	-63.5	-179.1	-178.2	-176.5	-3.8	112.1	F164 N171 N206 D249	F164-R169 HydrophobicContact CB-CG 4.38Å; F164-R169 HydrophobicContact CD1-CG 4.18Å; F164-R169 HydrophobicContact CD2-CG 4.08Å; F164-R169 HydrophobicContact CE2-CG 4.42Å; F164-R169 HydrophobicContact CG-CG 3.96Å; R169-N171 VanDerWaalsContact C-N 3.32Å; R169-N171 PolarHBondContact O-N 3.37Å; R169-N171 PolarHBondContact O-ND2 2.88Å; R169-N206 VanDerWaalsContact CZ-OD1 3.32Å; R169-N206 VanDerWaalsContact NH1-CG 3.33Å; R169-N206 PolarHBondContact NH1-ND2 3.07Å; R169-N206 PolarHBondContact NH1-OD1 3.21Å; R169-D249 VanDerWaalsContact CA-OD1 3.23Å; R169-D249 WeakPolarHBondContact CA-OD1 3.3Å; R169-D249 WeakPolarHBondContact CB-OD1 3.13Å
170	Y	96.5	Very high	97.2	Very high	94 Å²	94	53.6 Å²	53.6	37%	0.369	25%	0.252	S	S	.	.	S	Bend	trans	57.7	41.3	175.6	-50.7	-30.8	0	0	0	113.8	N206 A207 R247 Y248 D249	Y170-N206 HydrophobicContact CE1-CB 4.05Å; Y170-N206 WeakPolarHBondContact OH-CA 3.23Å; Y170-N206 PolarHBondContact OH-ND2 2.86Å; Y170-N206 VanDerWaalsContact OH-ND2 3.08Å; Y170-A207 HydrophobicContact CE1-CB 4.46Å; Y170-A207 WeakPolarHBondContact CE1-O 3.47Å; Y170-A207 PolarHBondContact OH-N 2.82Å; Y170-R247 VanDerWaalsContact O-CB 3.25Å; Y170-R247 WeakPolarHBondContact O-CB 3.38Å; Y170-Y248 HydrophobicContact CD1-CD1 4.39Å; Y170-D249 PolarHBondContact N-OD1 2.89Å
171	N	97.3	Very high	97.2	Very high	65 Å²	65	52.9 Å²	52.9	35%	0.348	25%	0.248	S	C	.	.			trans	-116.3	2.3	-178.7	-78.4	-58.6	0	0	0	114	P165 L167 G168 R169	P165-N171 HydrophobicContact CG-CB 4.38Å; L167-N171 PolarHBondContact O-ND2 2.91Å; L167-N171 VanDerWaalsContact O-ND2 3.14Å; G168-N171 VanDerWaalsContact C-ND2 3.26Å; G168-N171 PolarHBondContact O-ND2 2.82Å; R169-N171 VanDerWaalsContact C-N 3.32Å; R169-N171 PolarHBondContact O-N 3.37Å; R169-N171 PolarHBondContact O-ND2 2.88Å
172	L	98.1	Very high	97.2	Very high	13 Å²	13	56 Å²	56	7%	0.068	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-108.1	124	-179.1	-59.4	170	0	0	0	110.3	P165 E176 A177 A180 W209 R247 Y248 V250	P165-L172 HydrophobicContact CG-CD1 4.43Å; P165-L172 HydrophobicContact CG-CD2 3.91Å; P165-L172 HydrophobicContact CG-CG 4.05Å; L172-E176 WeakPolarHBondContact CA-OE2 3.43Å; L172-E176 HydrophobicContact CB-CB 4.33Å; L172-E176 HydrophobicContact CD2-CB 3.88Å; L172-A177 HydrophobicContact CB-CB 4.04Å; L172-A177 HydrophobicContact CD1-CB 4.41Å; L172-A180 HydrophobicContact CD1-CB 4.09Å; L172-A180 HydrophobicContact CD2-CB 4.43Å; L172-W209 PolarHBondContact O-NE1 3.2Å; L172-R247 VanDerWaalsContact O-CA 3.28Å; L172-R247 WeakPolarHBondContact O-CA 3.19Å; L172-Y248 WeakPolarHBondContact CB-O 3.32Å; L172-Y248 PolarHBondContact N-O 2.84Å; L172-Y248 PolarHBondContact O-N 3.1Å; L172-V250 HydrophobicContact CD1-CG1 3.97Å
173	N	98.1	Very high	97.2	Very high	19 Å²	19	59.2 Å²	59.2	10%	0.102	28%	0.281	C	S	.	.			trans	-72.5	176.8	158.4	74.5	18	0	0	0	110.5	H175 E176 A177 K243 D244 S246	N173-H175 VanDerWaalsContact C-N 3.34Å; N173-H175 PolarHBondContact O-N 3.08Å; N173-H175 PolarHBondContact OD1-N 2Å; N173-E176 VanDerWaalsContact CG-CD 3.49Å; N173-E176 PolarHBondContact N-OE2 2.76Å; N173-E176 PolarHBondContact O-N 2.65Å; N173-E176 VanDerWaalsContact OD1-CB 3.32Å; N173-E176 WeakPolarHBondContact OD1-CB 3.45Å; N173-E176 WeakPolarHBondContact OD1-CG 3.35Å; N173-E176 PolarHBondContact OD1-N 2.82Å; N173-A177 WeakPolarHBondContact O-CB 2.9Å; N173-A177 PolarHBondContact O-N 2.95Å; N173-K243 WeakPolarHBondContact CB-O 3.19Å; N173-D244 PolarHBondContact ND2-O 2.91Å; N173-S246 VanDerWaalsContact CA-O 3.3Å; N173-S246 WeakPolarHBondContact CA-O 3.5Å
174	F	98.2	Very high	97.2	Very high	16 Å²	16	58.9 Å²	58.9	7%	0.07	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-41.3	-173.9	177.9	-94.3	0	0	0	112.5	A177 Q178 I188 W209 L210 K243	F174-A177 WeakPolarHBondContact O-CB 3.43Å; F174-A177 PolarHBondContact O-N 3.49Å; F174-Q178 PolarHBondContact O-N 3.29Å; F174-I188 HydrophobicContact CD2-CD1 4.36Å; F174-I188 HydrophobicContact CE2-CD1 3.89Å; F174-W209 HydrophobicContact CB-CD2 4.23Å; F174-W209 HydrophobicContact CB-CE3 4.32Å; F174-W209 HydrophobicContact CB-CH2 4.4Å; F174-W209 HydrophobicContact CB-CZ2 4.31Å; F174-W209 HydrophobicContact CB-CZ3 4.41Å; F174-W209 HydrophobicContact CD2-CB 4.47Å; F174-W209 HydrophobicContact CD2-CD2 4.15Å; F174-W209 AromaticContact CD2-CE3 3.86Å; F174-W209 HydrophobicContact CD2-CE3 3.86Å; F174-W209 HydrophobicContact CD2-CG 4.46Å; F174-W209 HydrophobicContact CD2-CZ3 4.42Å; F174-L210 WeakPolarHBondContact CE2-O 3.42Å; F174-K243 HydrophobicContact CB-CB 3.71Å; F174-K243 HydrophobicContact CB-CD 4.47Å; F174-K243 HydrophobicContact CB-CG 3.85Å; F174-K243 WeakPolarHBondContact CB-O 3.28Å; F174-K243 HydrophobicContact CD1-CB 4.36Å; F174-K243 HydrophobicContact CD1-CD 3.85Å; F174-K243 HydrophobicContact CD1-CG 4.17Å; F174-K243 HydrophobicContact CD2-CG 4.44Å; F174-K243 HydrophobicContact CE1-CD 4.22Å; F174-K243 HydrophobicContact CG-CB 4.19Å; F174-K243 HydrophobicContact CG-CD 4.03Å; F174-K243 HydrophobicContact CG-CG 3.89Å; F174-K243 PolarHBondContact N-O 2.88Å; F174-K243 VanDerWaalsContact N-O 3.07Å
175	H	98.1	Very high	97.2	Very high	93 Å²	93	59 Å²	59	43%	0.431	28%	0.281	S	S	.	.	H	α-helix	trans	-70.5	-42.2	-178.6	-64.4	-65.1	0	0	0	112.1	N173 A177 Q178 Q179 D244	N173-H175 VanDerWaalsContact C-N 3.34Å; N173-H175 PolarHBondContact O-N 3.08Å; N173-H175 PolarHBondContact OD1-N 2Å; H175-A177 VanDerWaalsContact C-N 3.31Å; H175-A177 PolarHBondContact O-N 3.46Å; H175-Q178 PolarHBondContact O-N 3.04Å; H175-Q179 PolarHBondContact O-N 3.38Å; H175-D244 IonicContact CD2-OD1 3.37Å; H175-D244 IonicContact NE2-OD1 3.5Å
176	E	98.4	Very high	97.3	Very high	76 Å²	76	58 Å²	58	36%	0.355	28%	0.275	S	S	.	.	H	α-helix	trans	-63.2	-38.1	172.4	-68.1	160.7	179.5	0	0	111.2	L172 N173 Q179 A180 R247	L172-E176 WeakPolarHBondContact CA-OE2 3.43Å; L172-E176 HydrophobicContact CB-CB 4.33Å; L172-E176 HydrophobicContact CD2-CB 3.88Å; N173-E176 VanDerWaalsContact CG-CD 3.49Å; N173-E176 PolarHBondContact N-OE2 2.76Å; N173-E176 PolarHBondContact O-N 2.65Å; N173-E176 VanDerWaalsContact OD1-CB 3.32Å; N173-E176 WeakPolarHBondContact OD1-CB 3.45Å; N173-E176 WeakPolarHBondContact OD1-CG 3.35Å; N173-E176 PolarHBondContact OD1-N 2.82Å; E176-Q179 PolarHBondContact O-N 2.93Å; E176-A180 WeakPolarHBondContact O-CB 2.94Å; E176-A180 PolarHBondContact O-N 2.79Å; E176-R247 VanDerWaalsContact CD-NH1 3.31Å; E176-R247 IonicContact OE1-NH1 2.64Å; E176-R247 PolarHBondContact OE1-NH1 2.89Å; E176-R247 VanDerWaalsContact OE1-NH1 3.1Å; E176-R247 IonicContact OE2-NH1 3.72Å; E176-R247 PolarHBondContact OE2-NH1 3.36Å
177	A	98.4	Very high	97.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.6	-43	175.9	0	0	0	0	0	112.5	L172 N173 F174 H175 A180 C181 W209 V250	L172-A177 HydrophobicContact CB-CB 4.04Å; L172-A177 HydrophobicContact CD1-CB 4.41Å; N173-A177 WeakPolarHBondContact O-CB 2.9Å; N173-A177 PolarHBondContact O-N 2.95Å; F174-A177 WeakPolarHBondContact O-CB 3.43Å; F174-A177 PolarHBondContact O-N 3.49Å; H175-A177 VanDerWaalsContact C-N 3.31Å; H175-A177 PolarHBondContact O-N 3.46Å; A177-A180 PolarHBondContact O-N 3.44Å; A177-C181 PolarHBondContact O-N 3.21Å; A177-C181 VanDerWaalsContact O-N 3.11Å; A177-W209 HydrophobicContact CB-CB 4.24Å; A177-W209 HydrophobicContact CB-CG 4.16Å; A177-V250 HydrophobicContact CB-CB 3.79Å; A177-V250 HydrophobicContact CB-CG1 4.33Å; A177-V250 HydrophobicContact CB-CG2 3.87Å
178	Q	98.1	Very high	97.7	Very high	88 Å²	88	44.9 Å²	44.9	41%	0.411	22%	0.219	S	C	.	.	H	α-helix	trans	-59.8	-49.7	173.6	-175.3	176.6	20.9	0	0	110.9	F174 H175 A180 C181 L182	F174-Q178 PolarHBondContact O-N 3.29Å; H175-Q178 PolarHBondContact O-N 3.04Å; Q178-A180 VanDerWaalsContact C-N 3.33Å; Q178-A180 PolarHBondContact O-N 2.95Å; Q178-C181 PolarHBondContact O-N 2.8Å; Q178-L182 WeakPolarHBondContact O-CG 3.46Å; Q178-L182 PolarHBondContact O-N 2.74Å; Q178-L182 VanDerWaalsContact O-N 3.17Å
179	Q	98.3	Very high	97.9	Very high	98 Å²	98	43.8 Å²	43.8	46%	0.458	21%	0.208	S	C	.	.	H	α-helix	trans	-62.5	-40.8	178.5	-171.8	59.1	47.7	0	0	112	H175 E176 C181 L182 D183	H175-Q179 PolarHBondContact O-N 3.38Å; E176-Q179 PolarHBondContact O-N 2.93Å; Q179-C181 VanDerWaalsContact C-N 3.31Å; Q179-C181 PolarHBondContact O-N 2.6Å; Q179-L182 WeakPolarHBondContact O-CB 3.44Å; Q179-L182 PolarHBondContact O-N 3.22Å; Q179-L182 VanDerWaalsContact O-N 3.12Å; Q179-D183 PolarHBondContact NE2-OD1 2.92Å; Q179-D183 VanDerWaalsContact O-CG 3.28Å; Q179-D183 PolarHBondContact O-N 3.03Å
180	A	98.3	Very high	97.9	Very high	8 Å²	8	38.5 Å²	38.5	7%	0.066	19%	0.19	C	C	.	.	H	α-helix	trans	-59	-40.4	177.5	0	0	0	0	0	112.4	Y163 L172 E176 A177 Q178 Q184	Y163-A180 HydrophobicContact CD1-CB 4.06Å; Y163-A180 HydrophobicContact CE1-CB 3.74Å; L172-A180 HydrophobicContact CD1-CB 4.09Å; L172-A180 HydrophobicContact CD2-CB 4.43Å; E176-A180 WeakPolarHBondContact O-CB 2.94Å; E176-A180 PolarHBondContact O-N 2.79Å; A177-A180 PolarHBondContact O-N 3.44Å; Q178-A180 VanDerWaalsContact C-N 3.33Å; Q178-A180 PolarHBondContact O-N 2.95Å; A180-Q184 WeakPolarHBondContact O-CG 3.35Å; A180-Q184 PolarHBondContact O-N 3.03Å
181	C	98.6	Very high	97.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.9	-44.1	173.6	-66.3	0	0	0	0	111.9	A177 Q178 Q179 D183 Q184 D185 A186 V250 C252	A177-C181 PolarHBondContact O-N 3.21Å; A177-C181 VanDerWaalsContact O-N 3.11Å; Q178-C181 PolarHBondContact O-N 2.8Å; Q179-C181 VanDerWaalsContact C-N 3.31Å; Q179-C181 PolarHBondContact O-N 2.6Å; C181-D183 VanDerWaalsContact C-N 3.34Å; C181-D183 PolarHBondContact O-N 3.39Å; C181-Q184 CarbonylContact O-C 3.58Å; C181-Q184 WeakPolarHBondContact O-CA 3.41Å; C181-Q184 PolarHBondContact O-N 3.26Å; C181-D185 PolarHBondContact O-N 3.06Å; C181-A186 CarbonylContact C-O 3.56Å; C181-A186 HydrophobicContact CB-CB 4.26Å; C181-A186 CarbonylContact O-C 3.49Å; C181-A186 WeakPolarHBondContact O-CA 3.34Å; C181-A186 WeakPolarHBondContact O-CB 3.44Å; C181-A186 PolarHBondContact O-N 2.75Å; C181-V250 VanDerWaalsContact SG-CG2 3.57Å; C181-C252 WeakPolarHBondContact CA-SG 3.37Å; C181-C252 HydrophobicContact CB-CB 3.82Å; C181-C252 WeakPolarHBondContact CB-SG 3.04Å; C181-C252 VanDerWaalsContact SG-CA 3.51Å; C181-C252 WeakPolarHBondContact SG-CB 3.33Å; C181-C252 CovalentContact SG-SG 2.04Å; C181-C252 PolarHBondContact SG-SG 3.06Å
182	L	98.2	Very high	97.7	Very high	66 Å²	66	36.9 Å²	36.9	35%	0.346	18%	0.184	S	C	.	.	H	α-helix	trans	-59.4	-44.1	178.7	-67.8	172.4	0	0	0	111.8	Q178 Q179 Q184 D185 A186 V187	Q178-L182 WeakPolarHBondContact O-CG 3.46Å; Q178-L182 PolarHBondContact O-N 2.74Å; Q178-L182 VanDerWaalsContact O-N 3.17Å; Q179-L182 WeakPolarHBondContact O-CB 3.44Å; Q179-L182 PolarHBondContact O-N 3.22Å; Q179-L182 VanDerWaalsContact O-N 3.12Å; L182-Q184 PolarHBondContact O-N 2.74Å; L182-Q184 VanDerWaalsContact O-N 3.11Å; L182-D185 PolarHBondContact O-N 2.9Å; L182-A186 VanDerWaalsContact CA-O 3.25Å; L182-A186 WeakPolarHBondContact CA-O 3.21Å; L182-A186 PolarHBondContact N-O 2.88Å; L182-V187 HydrophobicContact CD2-CG1 4.3Å
183	D	98.1	Very high	97.7	Very high	81 Å²	81	37 Å²	37	43%	0.433	18%	0.184	S	C	.	.	H	α-helix	trans	-58.2	-28.2	176.5	-69.5	-11.9	0	0	0	111.8	Q179 C181 K288	Q179-D183 PolarHBondContact NE2-OD1 2.92Å; Q179-D183 VanDerWaalsContact O-CG 3.28Å; Q179-D183 PolarHBondContact O-N 3.03Å; C181-D183 VanDerWaalsContact C-N 3.34Å; C181-D183 PolarHBondContact O-N 3.39Å; D183-K288 WeakPolarHBondContact O-CD 3.39Å; D183-K288 WeakPolarHBondContact O-CE 3.17Å; D183-K288 PolarHBondContact O-NZ 3.1Å
184	Q	98.4	Very high	97.7	Very high	10 Å²	10	36 Å²	36	5%	0.047	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	16.4	178.9	-59.2	-42.9	-56.3	0	0	115.1	Y163 A180 C181 L182 V289 G290	Y163-Q184 HydrophobicContact CD2-CG 4.12Å; Y163-Q184 HydrophobicContact CE2-CG 3.59Å; A180-Q184 WeakPolarHBondContact O-CG 3.35Å; A180-Q184 PolarHBondContact O-N 3.03Å; C181-Q184 CarbonylContact O-C 3.58Å; C181-Q184 WeakPolarHBondContact O-CA 3.41Å; C181-Q184 PolarHBondContact O-N 3.26Å; L182-Q184 PolarHBondContact O-N 2.74Å; L182-Q184 VanDerWaalsContact O-N 3.11Å; Q184-V289 HydrophobicContact CB-CB 4.15Å; Q184-V289 HydrophobicContact CG-CB 4.06Å; Q184-V289 HydrophobicContact CG-CG2 4.38Å; Q184-V289 VanDerWaalsContact OE1-CG2 3.31Å; Q184-G290 WeakPolarHBondContact O-CA 3.38Å; Q184-G290 PolarHBondContact O-N 2.89Å
185	D	97.8	Very high	97.6	Very high	26 Å²	26	39.5 Å²	39.5	14%	0.139	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	45.6	-177.8	-169.9	46.1	0	0	0	112.3	R53 C181 L182 T254 K288 Q291	R53-D185 IonicContact CZ-OD1 3.93Å; R53-D185 VanDerWaalsContact NH1-CG 3.27Å; R53-D185 IonicContact NH1-OD1 3.48Å; R53-D185 PolarHBondContact NH1-OD1 3.07Å; R53-D185 IonicContact NH1-OD2 3.78Å; R53-D185 PolarHBondContact NH1-OD2 2.64Å; R53-D185 IonicContact NH2-OD1 2.89Å; R53-D185 PolarHBondContact NH2-OD1 3.31Å; C181-D185 PolarHBondContact O-N 3.06Å; L182-D185 PolarHBondContact O-N 2.9Å; D185-T254 WeakPolarHBondContact O-CB 3.44Å; D185-T254 PolarHBondContact O-OG1 2.78Å; D185-K288 HydrophobicContact CB-CB 4.47Å; D185-K288 HydrophobicContact CB-CD 3.8Å; D185-Q291 HydrophobicContact CB-CG 4.45Å
186	A	98.3	Very high	97.5	Very high	2 Å²	2	37.6 Å²	37.6	2%	0.017	19%	0.185	C	C	.	.			trans	-146	169.6	-178.1	0	0	0	0	0	110.7	F161 C181 L182 C252 F253	F161-A186 HydrophobicContact CE1-CB 3.89Å; F161-A186 HydrophobicContact CZ-CB 3.78Å; C181-A186 CarbonylContact C-O 3.56Å; C181-A186 HydrophobicContact CB-CB 4.26Å; C181-A186 CarbonylContact O-C 3.49Å; C181-A186 WeakPolarHBondContact O-CA 3.34Å; C181-A186 WeakPolarHBondContact O-CB 3.44Å; C181-A186 PolarHBondContact O-N 2.75Å; L182-A186 VanDerWaalsContact CA-O 3.25Å; L182-A186 WeakPolarHBondContact CA-O 3.21Å; L182-A186 PolarHBondContact N-O 2.88Å; A186-C252 HydrophobicContact CB-CB 3.81Å; A186-F253 CarbonylContact C-O 3.55Å; A186-F253 VanDerWaalsContact CA-O 3.28Å; A186-F253 WeakPolarHBondContact CA-O 3.27Å; A186-F253 VanDerWaalsContact CB-O 3.27Å; A186-F253 WeakPolarHBondContact CB-O 3.42Å
187	V	97.8	Very high	97.5	Very high	25 Å²	25	35 Å²	35	15%	0.152	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	164	167.4	-66.2	0	0	0	0	109.1	L131 E132 L182 A189 C252 F253	L131-V187 HydrophobicContact CB-CB 4.49Å; L131-V187 HydrophobicContact CB-CG1 3.69Å; L131-V187 HydrophobicContact CB-CG2 3.98Å; L131-V187 HydrophobicContact CD1-CG1 4.23Å; E132-V187 HydrophobicContact CG-CG1 4.45Å; L182-V187 HydrophobicContact CD2-CG1 4.3Å; V187-A189 PolarHBondContact O-N 2.04Å; V187-C252 CarbonylContact O-C 3.44Å; V187-C252 WeakPolarHBondContact O-CA 3.25Å; V187-F253 HydrophobicContact CG2-CB 4.43Å; V187-F253 HydrophobicContact CG2-CD1 4.18Å; V187-F253 PolarHBondContact N-O 3.03Å; V187-F253 PolarHBondContact O-N 3.43Å
188	I	98	Very high	97.4	Very high	17 Å²	17	37.2 Å²	37.2	9%	0.087	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	132.9	172.1	-170.4	166	0	0	0	109.7	F174 W209 L210 V250	F174-I188 HydrophobicContact CD2-CD1 4.36Å; F174-I188 HydrophobicContact CE2-CD1 3.89Å; I188-W209 HydrophobicContact CD1-CB 3.77Å; I188-L210 VanDerWaalsContact CD1-C 3.47Å; I188-L210 WeakPolarHBondContact CD1-O 3.37Å; I188-V250 HydrophobicContact CD1-CG2 3.91Å; I188-V250 HydrophobicContact CG1-CG2 3.83Å
189	A	98	Very high	97.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-70.7	144.1	-177.4	0	0	0	0	0	110.9	V160 V187 Q193 L210 S211 F251 F253	V160-A189 HydrophobicContact CG1-CB 4.11Å; V160-A189 HydrophobicContact CG2-CB 4.09Å; V187-A189 PolarHBondContact O-N 2.04Å; A189-Q193 HydrophobicContact CB-CB 4.48Å; A189-L210 HydrophobicContact CB-CD2 4.31Å; A189-L210 CarbonylContact O-C 3.37Å; A189-L210 WeakPolarHBondContact O-CA 3.07Å; A189-L210 WeakPolarHBondContact O-CD2 3.38Å; A189-S211 PolarHBondContact O-N 2.84Å; A189-F251 HydrophobicContact CB-CB 4.1Å; A189-F251 WeakPolarHBondContact CB-O 3.18Å; A189-F251 PolarHBondContact N-O 3.47Å; A189-F253 HydrophobicContact CB-CB 4.02Å
190	S	96.1	Very high	97.2	Very high	12 Å²	12	38.7 Å²	38.7	8%	0.084	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-78	164.8	167	65.2	0	0	0	0	111.9	Y134 D192 Q193 L194 S211	Y134-S190 VanDerWaalsContact CE1-OG 3.27Å; Y134-S190 WeakPolarHBondContact CE1-OG 3.28Å; Y134-S190 PolarHBondContact OH-OG 2.96Å; S190-D192 VanDerWaalsContact C-N 3.33Å; S190-D192 PolarHBondContact O-N 3.32Å; S190-Q193 PolarHBondContact O-N 2.8Å; S190-Q193 WeakPolarHBondContact OG-CG 3.47Å; S190-Q193 PolarHBondContact OG-N 3.08Å; S190-Q193 PolarHBondContact OG-OE1 3.14Å; S190-L194 PolarHBondContact O-N 2.98Å; S190-S211 VanDerWaalsContact CA-OG 3.28Å; S190-S211 WeakPolarHBondContact CA-OG 3.37Å; S190-S211 WeakPolarHBondContact CB-OG 3.27Å
191	F	95.4	Very high	97	Very high	74 Å²	74	40.7 Å²	40.7	33%	0.325	22%	0.222	S	C	.	.	H	α-helix	trans	-57.3	-46.2	172	174.8	-98.9	0	0	0	112	Q193 L194 Y195 L210 Q216 V235	F191-Q193 VanDerWaalsContact C-N 3.28Å; F191-Q193 PolarHBondContact O-N 3.11Å; F191-L194 PolarHBondContact O-N 2.96Å; F191-L194 VanDerWaalsContact O-N 3.11Å; F191-Y195 HydrophobicContact CZ-CD2 4.18Å; F191-Y195 VanDerWaalsContact O-CB 3.32Å; F191-Y195 WeakPolarHBondContact O-CB 3.41Å; F191-Y195 PolarHBondContact O-N 3.45Å; F191-L210 HydrophobicContact CB-CD1 4.22Å; F191-L210 HydrophobicContact CD2-CD1 4.31Å; F191-Q216 VanDerWaalsContact CD2-OE1 3.32Å; F191-V235 HydrophobicContact CE2-CB 4.34Å; F191-V235 HydrophobicContact CE2-CG1 4.11Å
192	D	94.1	Very high	96.9	Very high	51 Å²	51	42.4 Å²	42.4	27%	0.273	23%	0.231	S	C	.	.	H	α-helix	trans	-57.3	-43	179.5	-70.6	-16.4	0	0	0	111	R136 S190 Y195 D196	R136-D192 IonicContact NH2-OD2 3.66Å; R136-D192 PolarHBondContact NH2-OD2 3.43Å; S190-D192 VanDerWaalsContact C-N 3.33Å; S190-D192 PolarHBondContact O-N 3.32Å; D192-Y195 PolarHBondContact O-N 3.31Å; D192-D196 WeakPolarHBondContact O-CB 2.84Å; D192-D196 VanDerWaalsContact O-CG 3.32Å; D192-D196 PolarHBondContact O-N 3.04Å
193	Q	96.8	Very high	96.8	Very high	14 Å²	14	41.2 Å²	41.2	7%	0.065	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-42.4	175.3	-72.8	167.7	-31.6	0	0	112.8	Y134 V160 A189 S190 F191 Y195 D196 A197 F253	Y134-Q193 HydrophobicContact CE1-CG 4.44Å; Y134-Q193 HydrophobicContact CE2-CG 4.2Å; V160-Q193 HydrophobicContact CG2-CB 3.79Å; V160-Q193 WeakPolarHBondContact CG2-O 3.46Å; A189-Q193 HydrophobicContact CB-CB 4.48Å; S190-Q193 PolarHBondContact O-N 2.8Å; S190-Q193 WeakPolarHBondContact OG-CG 3.47Å; S190-Q193 PolarHBondContact OG-N 3.08Å; S190-Q193 PolarHBondContact OG-OE1 3.14Å; F191-Q193 VanDerWaalsContact C-N 3.28Å; F191-Q193 PolarHBondContact O-N 3.11Å; Q193-Y195 VanDerWaalsContact C-N 3.34Å; Q193-D196 PolarHBondContact O-N 3.14Å; Q193-A197 WeakPolarHBondContact O-CB 3.09Å; Q193-A197 PolarHBondContact O-N 2.98Å; Q193-F253 HydrophobicContact CB-CD2 4.39Å; Q193-F253 HydrophobicContact CG-CD2 4.07Å; Q193-F253 HydrophobicContact CG-CE2 4.32Å; Q193-F253 VanDerWaalsContact NE2-CD1 3.28Å; Q193-F253 VanDerWaalsContact NE2-CG 3.28Å
194	L	97.9	Very high	96.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.7	-41.8	176.8	-178.2	66.3	0	0	0	111.2	V160 S190 F191 D196 A197 W198 L202 L210 Q216 P218 V235 F251	V160-L194 HydrophobicContact CG1-CD1 4.09Å; S190-L194 PolarHBondContact O-N 2.98Å; F191-L194 PolarHBondContact O-N 2.96Å; F191-L194 VanDerWaalsContact O-N 3.11Å; L194-D196 VanDerWaalsContact C-N 3.35Å; L194-A197 WeakPolarHBondContact O-CB 3.35Å; L194-A197 PolarHBondContact O-N 3.41Å; L194-W198 PolarHBondContact O-N 2.8Å; L194-L202 HydrophobicContact CD1-CD2 4.08Å; L194-L210 HydrophobicContact CB-CD2 4.1Å; L194-L210 HydrophobicContact CD2-CD1 3.96Å; L194-L210 HydrophobicContact CD2-CD2 3.99Å; L194-L210 HydrophobicContact CD2-CG 4.45Å; L194-Q216 HydrophobicContact CD2-CB 4.14Å; L194-P218 HydrophobicContact CD1-CB 4.49Å; L194-P218 HydrophobicContact CD1-CG 3.93Å; L194-V235 HydrophobicContact CD2-CG1 3.77Å; L194-V235 HydrophobicContact CG-CG1 4.48Å; L194-F251 HydrophobicContact CD1-CB 4.37Å; L194-F251 HydrophobicContact CD1-CD1 3.69Å; L194-F251 HydrophobicContact CD1-CD2 4.14Å; L194-F251 HydrophobicContact CD1-CE1 3.95Å; L194-F251 HydrophobicContact CD1-CE2 4.39Å; L194-F251 HydrophobicContact CD1-CG 3.79Å; L194-F251 HydrophobicContact CD1-CZ 4.3Å; L194-F251 HydrophobicContact CD2-CD2 4.29Å; L194-F251 HydrophobicContact CD2-CE2 4.45Å
195	Y	97	Very high	96.6	Very high	89 Å²	89	41.6 Å²	41.6	35%	0.349	22%	0.224	S	C	.	.	H	α-helix	trans	-62.1	-44.2	178	-175.8	-100	0	0	0	110.9	F191 D192 Q193 A197 W198 R199 V235	F191-Y195 HydrophobicContact CZ-CD2 4.18Å; F191-Y195 VanDerWaalsContact O-CB 3.32Å; F191-Y195 WeakPolarHBondContact O-CB 3.41Å; F191-Y195 PolarHBondContact O-N 3.45Å; D192-Y195 PolarHBondContact O-N 3.31Å; Q193-Y195 VanDerWaalsContact C-N 3.34Å; Y195-A197 VanDerWaalsContact C-N 3.35Å; Y195-A197 PolarHBondContact O-N 3.31Å; Y195-W198 AromaticContact CD2-CE3 4Å; Y195-W198 HydrophobicContact CD2-CE3 4Å; Y195-W198 HydrophobicContact CD2-CZ3 4.3Å; Y195-W198 AromaticContact CE2-CE3 3.8Å; Y195-W198 HydrophobicContact CE2-CE3 3.8Å; Y195-W198 AromaticContact CE2-CZ3 3.62Å; Y195-W198 HydrophobicContact CE2-CZ3 3.62Å; Y195-W198 AromaticContact CZ-CZ3 3.93Å; Y195-W198 WeakPolarHBondContact O-CB 3.42Å; Y195-W198 PolarHBondContact O-N 2.78Å; Y195-R199 HydrophobicContact CD1-CG 4.29Å; Y195-R199 VanDerWaalsContact CE1-CD 3.46Å; Y195-R199 HydrophobicContact CE1-CG 3.98Å; Y195-R199 WeakPolarHBondContact O-CG 3.36Å; Y195-R199 PolarHBondContact O-N 3.06Å; Y195-V235 HydrophobicContact CD2-CG2 4.07Å
196	D	96.1	Very high	96.5	Very high	53 Å²	53	41.1 Å²	41.1	28%	0.283	22%	0.222	S	C	.	.	H	α-helix	trans	-63.5	-39.8	174.6	-74.8	-5.8	0	0	0	112.6	D192 Q193 L194 R199 G200	D192-D196 WeakPolarHBondContact O-CB 2.84Å; D192-D196 VanDerWaalsContact O-CG 3.32Å; D192-D196 PolarHBondContact O-N 3.04Å; Q193-D196 PolarHBondContact O-N 3.14Å; L194-D196 VanDerWaalsContact C-N 3.35Å; D196-R199 PolarHBondContact O-N 3Å; D196-R199 IonicContact OD1-CZ 2.73Å; D196-R199 VanDerWaalsContact OD1-CZ 3.31Å; D196-R199 IonicContact OD1-NE 2.69Å; D196-R199 PolarHBondContact OD1-NE 2.91Å; D196-R199 IonicContact OD1-NH2 3.16Å; D196-R199 PolarHBondContact OD1-NH2 2.94Å; D196-G200 PolarHBondContact O-N 3Å
197	A	97.4	Very high	96.4	Very high	21 Å²	21	41.1 Å²	41.1	17%	0.174	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-41.6	174.6	0	0	0	0	0	112.1	V160 Q193 L194 Y195 G200 G201 L202	V160-A197 HydrophobicContact CB-CB 3.76Å; V160-A197 HydrophobicContact CG1-CB 4.43Å; V160-A197 HydrophobicContact CG2-CB 4.09Å; Q193-A197 WeakPolarHBondContact O-CB 3.09Å; Q193-A197 PolarHBondContact O-N 2.98Å; L194-A197 WeakPolarHBondContact O-CB 3.35Å; L194-A197 PolarHBondContact O-N 3.41Å; Y195-A197 VanDerWaalsContact C-N 3.35Å; Y195-A197 PolarHBondContact O-N 3.31Å; A197-G200 CarbonylContact O-C 3.51Å; A197-G200 WeakPolarHBondContact O-CA 3.45Å; A197-G200 PolarHBondContact O-N 3.44Å; A197-G200 VanDerWaalsContact O-N 3.15Å; A197-G201 PolarHBondContact O-N 3.04Å; A197-L202 HydrophobicContact CB-CB 4.09Å; A197-L202 HydrophobicContact CB-CD2 3.74Å; A197-L202 WeakPolarHBondContact O-CB 3.33Å; A197-L202 PolarHBondContact O-N 3.28Å
198	W	97.8	Very high	96.4	Very high	47 Å²	47	39.9 Å²	39.9	18%	0.178	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-45.6	174.1	168.6	73.5	0	0	0	112	L194 Y195 G200 G201 P218 I219 P233 G234 V235	L194-W198 PolarHBondContact O-N 2.8Å; Y195-W198 AromaticContact CD2-CE3 4Å; Y195-W198 HydrophobicContact CD2-CE3 4Å; Y195-W198 HydrophobicContact CD2-CZ3 4.3Å; Y195-W198 AromaticContact CE2-CE3 3.8Å; Y195-W198 HydrophobicContact CE2-CE3 3.8Å; Y195-W198 AromaticContact CE2-CZ3 3.62Å; Y195-W198 HydrophobicContact CE2-CZ3 3.62Å; Y195-W198 AromaticContact CZ-CZ3 3.93Å; Y195-W198 WeakPolarHBondContact O-CB 3.42Å; Y195-W198 PolarHBondContact O-N 2.78Å; W198-G200 PolarHBondContact O-N 3.25Å; W198-G201 WeakPolarHBondContact O-CA 3.08Å; W198-G201 PolarHBondContact O-N 2.64Å; W198-P218 HydrophobicContact CB-CB 3.68Å; W198-P218 HydrophobicContact CG-CB 4Å; W198-I219 PolarHBondContact NE1-O 3.14Å; W198-P233 HydrophobicContact CZ2-CB 4.2Å; W198-G234 VanDerWaalsContact CZ2-CA 3.48Å; W198-V235 HydrophobicContact CB-CG2 3.97Å; W198-V235 HydrophobicContact CD2-CG2 4.28Å; W198-V235 HydrophobicContact CE3-CG2 4.49Å; W198-V235 HydrophobicContact CG-CG2 4.03Å
199	R	97.1	Very high	96.5	Very high	159 Å²	159	39.1 Å²	39.1	60%	0.6	21%	0.21	S	C	*	.	H	α-helix	trans	-58.3	-32.8	172.7	-69.6	-164.6	-65.1	178.6	0.8	111.7	Y195 D196 G201	Y195-R199 HydrophobicContact CD1-CG 4.29Å; Y195-R199 VanDerWaalsContact CE1-CD 3.46Å; Y195-R199 HydrophobicContact CE1-CG 3.98Å; Y195-R199 WeakPolarHBondContact O-CG 3.36Å; Y195-R199 PolarHBondContact O-N 3.06Å; D196-R199 PolarHBondContact O-N 3Å; D196-R199 IonicContact OD1-CZ 2.73Å; D196-R199 VanDerWaalsContact OD1-CZ 3.31Å; D196-R199 IonicContact OD1-NE 2.69Å; D196-R199 PolarHBondContact OD1-NE 2.91Å; D196-R199 IonicContact OD1-NH2 3.16Å; D196-R199 PolarHBondContact OD1-NH2 2.94Å; R199-G201 PolarHBondContact O-N 2.89Å
200	G	94.2	Very high	96.5	Very high	58 Å²	58	39.1 Å²	39.1	60%	0.598	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	4	172.4	0	0	0	0	0	115.5	D196 A197 W198	D196-G200 PolarHBondContact O-N 3Å; A197-G200 CarbonylContact O-C 3.51Å; A197-G200 WeakPolarHBondContact O-CA 3.45Å; A197-G200 PolarHBondContact O-N 3.44Å; A197-G200 VanDerWaalsContact O-N 3.15Å; W198-G200 PolarHBondContact O-N 3.25Å
201	G	95.1	Very high	96.4	Very high	50 Å²	50	39.7 Å²	39.7	52%	0.515	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.6	9.8	175.3	0	0	0	0	0	115.7	A197 W198 R199 D203	A197-G201 PolarHBondContact O-N 3.04Å; W198-G201 WeakPolarHBondContact O-CA 3.08Å; W198-G201 PolarHBondContact O-N 2.64Å; R199-G201 PolarHBondContact O-N 2.89Å; G201-D203 PolarHBondContact O-N 3.11Å
202	L	96.3	Very high	96.3	Very high	36 Å²	36	37.8 Å²	37.8	19%	0.188	21%	0.207	C	C	.	.			trans	-65.6	119.7	175.2	-179.4	63.2	0	0	0	110.6	V160 L194 A197 P218 T220 F251	V160-L202 HydrophobicContact CG1-CD2 4.3Å; L194-L202 HydrophobicContact CD1-CD2 4.08Å; A197-L202 HydrophobicContact CB-CB 4.09Å; A197-L202 HydrophobicContact CB-CD2 3.74Å; A197-L202 WeakPolarHBondContact O-CB 3.33Å; A197-L202 PolarHBondContact O-N 3.28Å; L202-P218 HydrophobicContact CD2-CG 3.92Å; L202-P218 HydrophobicContact CG-CG 3.86Å; L202-T220 WeakPolarHBondContact O-CG2 3.19Å; L202-F251 HydrophobicContact CD2-CE1 4.36Å
203	D	95.7	Very high	96.3	Very high	40 Å²	40	35.4 Å²	35.4	21%	0.214	20%	0.195	C	C	.	.			trans	-122.3	113.4	175.6	-168.6	-67.8	0	0	0	109.5	G201 T220 K221 R223	G201-D203 PolarHBondContact O-N 3.11Å; D203-T220 HydrophobicContact CB-CG2 4.19Å; D203-T220 WeakPolarHBondContact CB-OG1 3.4Å; D203-T220 WeakPolarHBondContact OD2-CA 3.49Å; D203-T220 PolarHBondContact OD2-N 3.39Å; D203-T220 PolarHBondContact OD2-OG1 2.85Å; D203-K221 PolarHBondContact OD2-N 3Å; D203-R223 IonicContact OD1-CZ 3.1Å; D203-R223 IonicContact OD1-NH1 2.77Å; D203-R223 PolarHBondContact OD1-NH1 2.8Å; D203-R223 IonicContact OD1-NH2 3.65Å; D203-R223 PolarHBondContact OD1-NH2 2.95Å; D203-R223 IonicContact OD2-NH1 3.93Å; D203-R223 PolarHBondContact OD2-NH1 3.41Å
204	W	96.4	Very high	96.3	Very high	68 Å²	68	34.8 Å²	34.8	26%	0.258	19%	0.192	S	C	.	.			trans	-145.1	119.5	-176.9	-162.4	-102.9	0	0	0	111.4	P162 N206 Y217 P218 F251	P162-W204 HydrophobicContact CB-CD2 3.7Å; P162-W204 HydrophobicContact CB-CE3 4.41Å; P162-W204 HydrophobicContact CB-CG 3.9Å; P162-W204 HydrophobicContact CB-CH2 4.44Å; P162-W204 HydrophobicContact CB-CZ2 3.76Å; P162-W204 VanDerWaalsContact CB-NE1 3.32Å; P162-W204 HydrophobicContact CG-CD2 3.47Å; P162-W204 VanDerWaalsContact CG-CD2 3.47Å; P162-W204 VanDerWaalsContact CG-CE2 3.46Å; P162-W204 HydrophobicContact CG-CE3 3.68Å; P162-W204 HydrophobicContact CG-CG 4.03Å; P162-W204 HydrophobicContact CG-CH2 3.83Å; P162-W204 HydrophobicContact CG-CZ2 3.65Å; P162-W204 HydrophobicContact CG-CZ3 3.84Å; W204-N206 PolarHBondContact O-N 3.11Å; W204-Y217 WeakPolarHBondContact O-CB 3.32Å; W204-Y217 WeakPolarHBondContact O-CD2 3.48Å; W204-P218 HydrophobicContact CB-CG 4.23Å; W204-P218 PolarHBondContact N-O 3.44Å; W204-F251 HydrophobicContact CB-CE1 4.14Å; W204-F251 HydrophobicContact CB-CZ 4.18Å; W204-F251 AromaticContact CD1-CE1 3.98Å; W204-F251 AromaticContact CD1-CZ 3.73Å; W204-F251 HydrophobicContact CG-CE1 4.21Å; W204-F251 HydrophobicContact CG-CZ 4.24Å
205	C	94.9	Very high	96.3	Very high	31 Å²	31	34.8 Å²	34.8	21%	0.209	19%	0.192	C	C	.	.			trans	-100.1	45.4	-173.8	-178.2	0	0	0	0	112.5	I219 P225 C226	C205-I219 HydrophobicContact CB-CD1 3.95Å; C205-P225 PolarHBondContact SG-O 3.3Å; C205-C226 HydrophobicContact CB-CB 3.85Å; C205-C226 WeakPolarHBondContact CB-SG 3.42Å; C205-C226 WeakPolarHBondContact SG-CA 3.5Å; C205-C226 WeakPolarHBondContact SG-CB 3.48Å; C205-C226 CovalentContact SG-SG 2Å; C205-C226 PolarHBondContact SG-SG 2.84Å
206	N	95.6	Very high	96.3	Very high	17 Å²	17	31 Å²	31	9%	0.091	18%	0.178	C	C	.	.	S	Bend	trans	-138.1	129.4	170.4	-63.5	97	0	0	0	108.7	R169 Y170 W204 Y217 D249	R169-N206 VanDerWaalsContact CZ-OD1 3.32Å; R169-N206 VanDerWaalsContact NH1-CG 3.33Å; R169-N206 PolarHBondContact NH1-ND2 3.07Å; R169-N206 PolarHBondContact NH1-OD1 3.21Å; Y170-N206 HydrophobicContact CE1-CB 4.05Å; Y170-N206 WeakPolarHBondContact OH-CA 3.23Å; Y170-N206 PolarHBondContact OH-ND2 2.86Å; Y170-N206 VanDerWaalsContact OH-ND2 3.08Å; W204-N206 PolarHBondContact O-N 3.11Å; N206-Y217 VanDerWaalsContact O-CB 3.24Å; N206-Y217 WeakPolarHBondContact O-CB 3.34Å; N206-D249 WeakPolarHBondContact CB-OD2 3.29Å
207	A	97.3	Very high	96.4	Very high	1 Å²	1	29 Å²	29	1%	0.008	17%	0.166	C	C	.	.			trans	-67.6	131.6	178.7	0	0	0	0	0	110.1	Y170 V215 Y217 Y238 Y248 D249	Y170-A207 HydrophobicContact CE1-CB 4.46Å; Y170-A207 WeakPolarHBondContact CE1-O 3.47Å; Y170-A207 PolarHBondContact OH-N 2.82Å; A207-V215 HydrophobicContact CB-CG1 3.72Å; A207-Y217 HydrophobicContact CB-CD1 4.18Å; A207-Y238 HydrophobicContact CB-CD1 3.75Å; A207-Y238 HydrophobicContact CB-CE1 3.73Å; A207-Y238 HydrophobicContact CB-CG 4.41Å; A207-Y248 HydrophobicContact CB-CD1 3.96Å; A207-Y248 HydrophobicContact CB-CE1 4.33Å; A207-D249 PolarHBondContact O-N 3.39Å; A207-D249 VanDerWaalsContact O-N 3.17Å
208	G	98.3	Very high	96.4	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	151.5	-178.9	0	0	0	0	0	113	V215 Q216 D249	G208-V215 WeakPolarHBondContact O-CA 3.33Å; G208-Q216 PolarHBondContact N-O 3.27Å; G208-Q216 PolarHBondContact O-N 3.35Å; G208-D249 CarbonylContact C-O 3.49Å; G208-D249 WeakPolarHBondContact CA-O 3.2Å
209	W	98.6	Very high	96.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	146	175.8	-66.4	109.7	0	0	0	112.6	L172 F174 A177 I188 G213 V215 W241 S246 Y248 D249 V250 F251	L172-W209 PolarHBondContact O-NE1 3.2Å; F174-W209 HydrophobicContact CB-CD2 4.23Å; F174-W209 HydrophobicContact CB-CE3 4.32Å; F174-W209 HydrophobicContact CB-CH2 4.4Å; F174-W209 HydrophobicContact CB-CZ2 4.31Å; F174-W209 HydrophobicContact CB-CZ3 4.41Å; F174-W209 HydrophobicContact CD2-CB 4.47Å; F174-W209 HydrophobicContact CD2-CD2 4.15Å; F174-W209 AromaticContact CD2-CE3 3.86Å; F174-W209 HydrophobicContact CD2-CE3 3.86Å; F174-W209 HydrophobicContact CD2-CG 4.46Å; F174-W209 HydrophobicContact CD2-CZ3 4.42Å; A177-W209 HydrophobicContact CB-CB 4.24Å; A177-W209 HydrophobicContact CB-CG 4.16Å; I188-W209 HydrophobicContact CD1-CB 3.77Å; W209-G213 WeakPolarHBondContact CZ3-O 3.41Å; W209-V215 HydrophobicContact CD2-CG2 3.76Å; W209-V215 HydrophobicContact CE3-CG2 3.33Å; W209-V215 HydrophobicContact CH2-CG2 4.04Å; W209-V215 HydrophobicContact CZ2-CG2 4.4Å; W209-V215 HydrophobicContact CZ3-CG2 3.49Å; W209-V215 VanDerWaalsContact CZ3-CG2 3.49Å; W209-W241 HydrophobicContact CH2-CB 3.74Å; W209-W241 HydrophobicContact CZ3-CB 4.08Å; W209-S246 WeakPolarHBondContact CZ2-O 3.24Å; W209-Y248 HydrophobicContact CD2-CD2 4.49Å; W209-Y248 AromaticContact CE2-CD2 3.85Å; W209-Y248 HydrophobicContact CH2-CD2 4.35Å; W209-Y248 AromaticContact CZ2-CD2 3.79Å; W209-Y248 HydrophobicContact CZ2-CD2 3.79Å; W209-Y248 HydrophobicContact CZ2-CE2 4.4Å; W209-D249 VanDerWaalsContact CD1-O 3.26Å; W209-D249 PolarHBondContact N-O 2.55Å; W209-V250 HydrophobicContact CB-CG2 4.23Å; W209-F251 PolarHBondContact O-N 2.81Å
210	L	97.9	Very high	96.3	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.132	C	C	.	.			trans	-122.5	164.8	170.2	-64.1	179.7	0	0	0	111.5	F174 I188 A189 F191 L194 D212 G213 S214 Q216 F251	F174-L210 WeakPolarHBondContact CE2-O 3.42Å; I188-L210 VanDerWaalsContact CD1-C 3.47Å; I188-L210 WeakPolarHBondContact CD1-O 3.37Å; A189-L210 HydrophobicContact CB-CD2 4.31Å; A189-L210 CarbonylContact O-C 3.37Å; A189-L210 WeakPolarHBondContact O-CA 3.07Å; A189-L210 WeakPolarHBondContact O-CD2 3.38Å; F191-L210 HydrophobicContact CB-CD1 4.22Å; F191-L210 HydrophobicContact CD2-CD1 4.31Å; L194-L210 HydrophobicContact CB-CD2 4.1Å; L194-L210 HydrophobicContact CD2-CD1 3.96Å; L194-L210 HydrophobicContact CD2-CD2 3.99Å; L194-L210 HydrophobicContact CD2-CG 4.45Å; L210-D212 PolarHBondContact O-N 2.99Å; L210-D212 VanDerWaalsContact O-N 3.12Å; L210-G213 WeakPolarHBondContact O-CA 3.38Å; L210-G213 PolarHBondContact O-N 3.42Å; L210-S214 PolarHBondContact N-O 3Å; L210-Q216 HydrophobicContact CD1-CB 3.93Å; L210-Q216 HydrophobicContact CD1-CG 3.8Å; L210-F251 HydrophobicContact CD2-CB 4.07Å; L210-F251 HydrophobicContact CD2-CD2 4.37Å
211	S	95.4	Very high	96.3	Very high	25 Å²	25	23.6 Å²	23.6	18%	0.175	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.6	-170.4	67.3	0	0	0	0	115.4	A189 S190 G213	A189-S211 PolarHBondContact O-N 2.84Å; S190-S211 VanDerWaalsContact CA-OG 3.28Å; S190-S211 WeakPolarHBondContact CA-OG 3.37Å; S190-S211 WeakPolarHBondContact CB-OG 3.27Å; S211-G213 VanDerWaalsContact C-N 3.28Å
212	D	93.4	Very high	96.3	Very high	33 Å²	33	23.2 Å²	23.2	18%	0.176	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-7.9	175.7	63.6	-10.8	0	0	0	112.7	L210 S214 F240	L210-D212 PolarHBondContact O-N 2.99Å; L210-D212 VanDerWaalsContact O-N 3.12Å; D212-S214 VanDerWaalsContact CG-OG 3.32Å; D212-S214 VanDerWaalsContact OD1-CB 3.3Å; D212-S214 WeakPolarHBondContact OD1-CB 3.36Å; D212-S214 PolarHBondContact OD1-N 3.41Å; D212-S214 PolarHBondContact OD1-OG 2.89Å; D212-S214 PolarHBondContact OD2-OG 3.12Å; D212-F240 HydrophobicContact CB-CE1 4.34Å
213	G	94	Very high	96.2	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.01	13%	0.125	C	C	.	.	S	Bend	trans	86.3	8	-174.2	0	0	0	0	0	113.8	W209 L210 S211	W209-G213 WeakPolarHBondContact CZ3-O 3.41Å; L210-G213 WeakPolarHBondContact O-CA 3.38Å; L210-G213 PolarHBondContact O-N 3.42Å; S211-G213 VanDerWaalsContact C-N 3.28Å
214	S	96.3	Very high	96.1	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	158.5	167	70.3	0	0	0	0	110.7	L210 D212 Q216 G239	L210-S214 PolarHBondContact N-O 3Å; D212-S214 VanDerWaalsContact CG-OG 3.32Å; D212-S214 VanDerWaalsContact OD1-CB 3.3Å; D212-S214 WeakPolarHBondContact OD1-CB 3.36Å; D212-S214 PolarHBondContact OD1-N 3.41Å; D212-S214 PolarHBondContact OD1-OG 2.89Å; D212-S214 PolarHBondContact OD2-OG 3.12Å; S214-Q216 PolarHBondContact OG-NE2 3.11Å; S214-G239 WeakPolarHBondContact CA-O 3.22Å
215	V	98	Very high	95.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	124.1	173.9	176.4	0	0	0	0	107.9	A207 G208 W209 Y238 G239 W241 Y248	A207-V215 HydrophobicContact CB-CG1 3.72Å; G208-V215 WeakPolarHBondContact O-CA 3.33Å; W209-V215 HydrophobicContact CD2-CG2 3.76Å; W209-V215 HydrophobicContact CE3-CG2 3.33Å; W209-V215 HydrophobicContact CH2-CG2 4.04Å; W209-V215 HydrophobicContact CZ2-CG2 4.4Å; W209-V215 HydrophobicContact CZ3-CG2 3.49Å; W209-V215 VanDerWaalsContact CZ3-CG2 3.49Å; V215-Y238 HydrophobicContact CG1-CD1 4.42Å; V215-Y238 WeakPolarHBondContact O-CA 3.27Å; V215-Y238 VanDerWaalsContact O-CB 3.27Å; V215-Y238 WeakPolarHBondContact O-CB 3.49Å; V215-Y238 PolarHBondContact O-N 3.28Å; V215-G239 PolarHBondContact N-O 3.17Å; V215-W241 HydrophobicContact CG2-CB 4.46Å; V215-W241 HydrophobicContact CG2-CG 4.37Å; V215-Y248 HydrophobicContact CB-CD2 4.32Å; V215-Y248 HydrophobicContact CB-CE2 4.39Å; V215-Y248 HydrophobicContact CG1-CD1 3.77Å; V215-Y248 HydrophobicContact CG1-CD2 3.92Å; V215-Y248 HydrophobicContact CG1-CE1 4.03Å; V215-Y248 HydrophobicContact CG1-CE2 4.15Å; V215-Y248 HydrophobicContact CG1-CG 3.71Å; V215-Y248 HydrophobicContact CG2-CD2 3.51Å; V215-Y248 HydrophobicContact CG2-CE2 3.74Å; V215-Y248 HydrophobicContact CG2-CG 4.11Å
216	Q	97.8	Very high	95.8	Very high	9 Å²	9	29.5 Å²	29.5	4%	0.042	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	168.4	-174	-52.3	-163.3	38.1	0	0	111.7	F191 L194 G208 L210 S214 V235 R236 F251	F191-Q216 VanDerWaalsContact CD2-OE1 3.32Å; L194-Q216 HydrophobicContact CD2-CB 4.14Å; G208-Q216 PolarHBondContact N-O 3.27Å; G208-Q216 PolarHBondContact O-N 3.35Å; L210-Q216 HydrophobicContact CD1-CB 3.93Å; L210-Q216 HydrophobicContact CD1-CG 3.8Å; S214-Q216 PolarHBondContact OG-NE2 3.11Å; Q216-V235 HydrophobicContact CB-CG1 3.92Å; Q216-R236 CarbonylContact C-O 3.6Å; Q216-R236 WeakPolarHBondContact CA-O 3.34Å; Q216-R236 VanDerWaalsContact CB-O 3.3Å; Q216-R236 WeakPolarHBondContact CB-O 3.38Å; Q216-F251 VanDerWaalsContact O-CE2 3.29Å; Q216-F251 WeakPolarHBondContact O-CE2 3.39Å
217	Y	97.5	Very high	95.2	Very high	11 Å²	11	30.9 Å²	30.9	4%	0.043	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	142.6	168.2	66.6	-83.9	0	0	0	113.6	W204 N206 A207 I219 R236 Y238	W204-Y217 WeakPolarHBondContact O-CB 3.32Å; W204-Y217 WeakPolarHBondContact O-CD2 3.48Å; N206-Y217 VanDerWaalsContact O-CB 3.24Å; N206-Y217 WeakPolarHBondContact O-CB 3.34Å; A207-Y217 HydrophobicContact CB-CD1 4.18Å; Y217-I219 HydrophobicContact CD2-CD1 3.77Å; Y217-I219 HydrophobicContact CD2-CG1 3.63Å; Y217-I219 HydrophobicContact CE2-CD1 3.77Å; Y217-I219 HydrophobicContact CE2-CG1 3.44Å; Y217-I219 VanDerWaalsContact CE2-CG1 3.44Å; Y217-R236 HydrophobicContact CD1-CB 3.87Å; Y217-R236 HydrophobicContact CD2-CB 4.3Å; Y217-R236 HydrophobicContact CD2-CG 4.3Å; Y217-R236 HydrophobicContact CE1-CB 3.5Å; Y217-R236 VanDerWaalsContact CE1-CB 3.5Å; Y217-R236 HydrophobicContact CE1-CG 4.09Å; Y217-R236 HydrophobicContact CE2-CB 3.99Å; Y217-R236 HydrophobicContact CE2-CG 3.72Å; Y217-R236 HydrophobicContact CG-CB 4.26Å; Y217-R236 PolarHBondContact N-O 2.82Å; Y217-R236 PolarHBondContact O-N 2.76Å; Y217-Y238 HydrophobicContact CD1-CD2 4.45Å; Y217-Y238 HydrophobicContact CD1-CE2 4.19Å; Y217-Y238 AromaticContact CE1-CD2 3.97Å; Y217-Y238 HydrophobicContact CE1-CD2 3.97Å; Y217-Y238 AromaticContact CE1-CE2 3.37Å; Y217-Y238 HydrophobicContact CE1-CE2 3.37Å; Y217-Y238 AromaticContact CE1-CZ 3.71Å
218	P	97.6	Very high	94.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	130.5	-175.7	35.6	-34.8	0	0	0	112.9	L194 W198 L202 W204 V235 F251	L194-P218 HydrophobicContact CD1-CB 4.49Å; L194-P218 HydrophobicContact CD1-CG 3.93Å; W198-P218 HydrophobicContact CB-CB 3.68Å; W198-P218 HydrophobicContact CG-CB 4Å; L202-P218 HydrophobicContact CD2-CG 3.92Å; L202-P218 HydrophobicContact CG-CG 3.86Å; W204-P218 HydrophobicContact CB-CG 4.23Å; W204-P218 PolarHBondContact N-O 3.44Å; P218-V235 HydrophobicContact CB-CG2 4.36Å; P218-F251 VanDerWaalsContact CD-CZ 3.46Å; P218-F251 HydrophobicContact CG-CE1 4.35Å; P218-F251 HydrophobicContact CG-CZ 4.31Å
219	I	97.3	Very high	94.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.5	174.6	-61.6	-63.3	0	0	0	110.3	W198 C205 Y217 K221 C226 P233 G234 R236	W198-I219 PolarHBondContact NE1-O 3.14Å; C205-I219 HydrophobicContact CB-CD1 3.95Å; Y217-I219 HydrophobicContact CD2-CD1 3.77Å; Y217-I219 HydrophobicContact CD2-CG1 3.63Å; Y217-I219 HydrophobicContact CE2-CD1 3.77Å; Y217-I219 HydrophobicContact CE2-CG1 3.44Å; Y217-I219 VanDerWaalsContact CE2-CG1 3.44Å; I219-K221 WeakPolarHBondContact CG2-O 3.38Å; I219-C226 HydrophobicContact CD1-CB 3.72Å; I219-C226 HydrophobicContact CG1-CB 4.28Å; I219-P233 CarbonylContact O-C 3.57Å; I219-P233 WeakPolarHBondContact O-CA 3.09Å; I219-G234 PolarHBondContact N-O 3.17Å; I219-G234 PolarHBondContact O-N 2.99Å; I219-R236 HydrophobicContact CG1-CG 4.47Å
220	T	95.7	Very high	93.9	Very high	39 Å²	39	45.3 Å²	45.3	24%	0.239	25%	0.248	C	C	.	.	S	Bend	trans	-93.9	-32	171.8	68.4	0	0	0	0	111.4	L202 D203	L202-T220 WeakPolarHBondContact O-CG2 3.19Å; D203-T220 HydrophobicContact CB-CG2 4.19Å; D203-T220 WeakPolarHBondContact CB-OG1 3.4Å; D203-T220 WeakPolarHBondContact OD2-CA 3.49Å; D203-T220 PolarHBondContact OD2-N 3.39Å; D203-T220 PolarHBondContact OD2-OG1 2.85Å
221	K	94.1	Very high	93.5	Very high	133 Å²	133	47.4 Å²	47.4	58%	0.578	26%	0.261	S	S	*	.	S	Bend	trans	-119.2	97.5	-179.4	-66.5	176.6	-172.6	170.3	0	110.2	D203 I219 R223	D203-K221 PolarHBondContact OD2-N 3Å; I219-K221 WeakPolarHBondContact CG2-O 3.38Å; K221-R223 PolarHBondContact O-NH1 3.38Å
222	P	94.1	Very high	93.4	Very high	42 Å²	42	51.6 Å²	51.6	27%	0.273	29%	0.285	S	S	.	.			trans	-52.6	138.3	176.7	-26.8	35	0	0	0	112.2	T231 P233	P222-T231 VanDerWaalsContact CB-O 3.27Å; P222-T231 WeakPolarHBondContact CB-O 3.17Å; P222-T231 WeakPolarHBondContact CG-O 3.25Å; P222-P233 HydrophobicContact CG-CG 4.02Å
223	R	95.2	Very high	93.5	Very high	78 Å²	78	53.2 Å²	53.2	29%	0.294	30%	0.298	S	S	.	.			trans	-162.6	152.2	-177.7	57.5	-168.5	179.8	-91.6	7.3	110.9	D203 K221 C226 G228	D203-R223 IonicContact OD1-CZ 3.1Å; D203-R223 IonicContact OD1-NH1 2.77Å; D203-R223 PolarHBondContact OD1-NH1 2.8Å; D203-R223 IonicContact OD1-NH2 3.65Å; D203-R223 PolarHBondContact OD1-NH2 2.95Å; D203-R223 IonicContact OD2-NH1 3.93Å; D203-R223 PolarHBondContact OD2-NH1 3.41Å; K221-R223 PolarHBondContact O-NH1 3.38Å; R223-C226 HydrophobicContact CG-CB 3.66Å; R223-C226 VanDerWaalsContact CG-SG 3.52Å; R223-C226 PolarHBondContact NE-SG 2.84Å; R223-C226 CarbonylContact O-C 3.52Å; R223-C226 WeakPolarHBondContact O-CA 3.37Å; R223-C226 PolarHBondContact O-N 3.3Å; R223-G228 CarbonylContact O-C 3.59Å; R223-G228 PolarHBondContact O-N 3.19Å
224	E	92.6	Very high	93.6	Very high	113 Å²	113	53.7 Å²	53.7	53%	0.528	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-48.9	-50.8	-173.2	-79.8	-47.6	116.5	0	0	114.1	C226 G228 Q229	E224-C226 PolarHBondContact O-N 3.48Å; E224-G228 PolarHBondContact O-N 2.91Å; E224-Q229 HydrophobicContact CG-CG 3.83Å; E224-Q229 VanDerWaalsContact OE1-CB 3.31Å; E224-Q229 WeakPolarHBondContact OE1-CB 3.49Å; E224-Q229 VanDerWaalsContact OE1-CG 3.29Å; E224-Q229 WeakPolarHBondContact OE1-CG 3.32Å; E224-Q229 PolarHBondContact OE1-N 3.18Å
225	P	92.6	Very high	93.6	Very high	115 Å²	115	54.9 Å²	54.9	75%	0.747	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-67.7	-6.5	-177.1	-19	33.5	0	0	0	114.4	C205	C205-P225 PolarHBondContact SG-O 3.3Å
226	C	92.1	Very high	93.5	Very high	2 Å²	2	57 Å²	57	1%	0.014	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-128.5	42.5	-165.7	-51.3	0	0	0	0	111.7	C205 I219 R223 E224	C205-C226 HydrophobicContact CB-CB 3.85Å; C205-C226 WeakPolarHBondContact CB-SG 3.42Å; C205-C226 WeakPolarHBondContact SG-CA 3.5Å; C205-C226 WeakPolarHBondContact SG-CB 3.48Å; C205-C226 CovalentContact SG-SG 2Å; C205-C226 PolarHBondContact SG-SG 2.84Å; I219-C226 HydrophobicContact CD1-CB 3.72Å; I219-C226 HydrophobicContact CG1-CB 4.28Å; R223-C226 HydrophobicContact CG-CB 3.66Å; R223-C226 VanDerWaalsContact CG-SG 3.52Å; R223-C226 PolarHBondContact NE-SG 2.84Å; R223-C226 CarbonylContact O-C 3.52Å; R223-C226 WeakPolarHBondContact O-CA 3.37Å; R223-C226 PolarHBondContact O-N 3.3Å; E224-C226 PolarHBondContact O-N 3.48Å
227	G	84.6	Confident	93.3	Very high	46 Å²	46	61.3 Å²	61.3	47%	0.474	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.8	2.5	179.4	0	0	0	0	0	115.2	T231	G227-T231 WeakPolarHBondContact O-CG2 3.46Å
228	G	88.6	Confident	93	Very high	14 Å²	14	66 Å²	66	14%	0.144	36%	0.359	C	S	.	.			trans	103.7	147.1	177.6	0	0	0	0	0	114	R223 E224 N230 T231	R223-G228 CarbonylContact O-C 3.59Å; R223-G228 PolarHBondContact O-N 3.19Å; E224-G228 PolarHBondContact O-N 2.91Å; G228-N230 VanDerWaalsContact C-N 3.33Å; G228-N230 PolarHBondContact O-N 2.94Å; G228-T231 PolarHBondContact O-OG1 3.17Å
229	Q	88.1	Confident	92.8	Very high	123 Å²	123	67 Å²	67	58%	0.575	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-32.7	179.7	-75	176.1	18.8	0	0	113.3	E224 T231	E224-Q229 HydrophobicContact CG-CG 3.83Å; E224-Q229 VanDerWaalsContact OE1-CB 3.31Å; E224-Q229 WeakPolarHBondContact OE1-CB 3.49Å; E224-Q229 VanDerWaalsContact OE1-CG 3.29Å; E224-Q229 WeakPolarHBondContact OE1-CG 3.32Å; E224-Q229 PolarHBondContact OE1-N 3.18Å; Q229-T231 PolarHBondContact O-N 3.42Å
230	N	89.3	Confident	92.6	Very high	166 Å²	166	74 Å²	74	89%	0.888	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	25.3	-174.7	-62.6	-34.2	0	0	0	113.4	G228	G228-N230 VanDerWaalsContact C-N 3.33Å; G228-N230 PolarHBondContact O-N 2.94Å
231	T	90	Very high	92.6	Very high	45 Å²	45	77.5 Å²	77.5	28%	0.276	41%	0.41	S	S	.	.	S	Bend	trans	-103.6	153.1	-179.4	61	0	0	0	0	112.1	P222 G227 G228 Q229 R236	P222-T231 VanDerWaalsContact CB-O 3.27Å; P222-T231 WeakPolarHBondContact CB-O 3.17Å; P222-T231 WeakPolarHBondContact CG-O 3.25Å; G227-T231 WeakPolarHBondContact O-CG2 3.46Å; G228-T231 PolarHBondContact O-OG1 3.17Å; Q229-T231 PolarHBondContact O-N 3.42Å; T231-R236 PolarHBondContact OG1-NH2 3.23Å
232	V	92.9	Very high	92.7	Very high	112 Å²	112	74.2 Å²	74.2	68%	0.679	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-77.8	138.3	178.2	-64.9	0	0	0	0	111.1	G234 R236	V232-G234 PolarHBondContact O-N 3Å; V232-R236 PolarHBondContact O-NH1 2.84Å; V232-R236 PolarHBondContact O-NH2 3.1Å
233	P	95.6	Very high	92.8	Very high	68 Å²	68	76.1 Å²	76.1	44%	0.442	40%	0.402	S	S	.	.	S	Bend	trans	-49.9	141.9	172.6	-25.8	33.6	0	0	0	112.2	W198 I219 P222	W198-P233 HydrophobicContact CZ2-CB 4.2Å; I219-P233 CarbonylContact O-C 3.57Å; I219-P233 WeakPolarHBondContact O-CA 3.09Å; P222-P233 HydrophobicContact CG-CG 4.02Å
234	G	96	Very high	92.9	Very high	10 Å²	10	77.4 Å²	77.4	10%	0.103	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.8	174.8	-178.4	0	0	0	0	0	113.8	W198 I219 V232	W198-G234 VanDerWaalsContact CZ2-CA 3.48Å; I219-G234 PolarHBondContact N-O 3.17Å; I219-G234 PolarHBondContact O-N 2.99Å; V232-G234 PolarHBondContact O-N 3Å
235	V	97.1	Very high	93.1	Very high	27 Å²	27	79.7 Å²	79.7	16%	0.164	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.7	167.7	-174.1	0	0	0	0	108.2	F191 L194 Y195 W198 Q216 P218	F191-V235 HydrophobicContact CE2-CB 4.34Å; F191-V235 HydrophobicContact CE2-CG1 4.11Å; L194-V235 HydrophobicContact CD2-CG1 3.77Å; L194-V235 HydrophobicContact CG-CG1 4.48Å; Y195-V235 HydrophobicContact CD2-CG2 4.07Å; W198-V235 HydrophobicContact CB-CG2 3.97Å; W198-V235 HydrophobicContact CD2-CG2 4.28Å; W198-V235 HydrophobicContact CE3-CG2 4.49Å; W198-V235 HydrophobicContact CG-CG2 4.03Å; Q216-V235 HydrophobicContact CB-CG1 3.92Å; P218-V235 HydrophobicContact CB-CG2 4.36Å
236	R	95.3	Very high	93.3	Very high	44 Å²	44	75.3 Å²	75.3	17%	0.166	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	125.4	179.4	-61.2	-60.7	-172.7	-126.3	-8.1	109.4	Q216 Y217 I219 T231 V232	Q216-R236 CarbonylContact C-O 3.6Å; Q216-R236 WeakPolarHBondContact CA-O 3.34Å; Q216-R236 VanDerWaalsContact CB-O 3.3Å; Q216-R236 WeakPolarHBondContact CB-O 3.38Å; Y217-R236 HydrophobicContact CD1-CB 3.87Å; Y217-R236 HydrophobicContact CD2-CB 4.3Å; Y217-R236 HydrophobicContact CD2-CG 4.3Å; Y217-R236 HydrophobicContact CE1-CB 3.5Å; Y217-R236 VanDerWaalsContact CE1-CB 3.5Å; Y217-R236 HydrophobicContact CE1-CG 4.09Å; Y217-R236 HydrophobicContact CE2-CB 3.99Å; Y217-R236 HydrophobicContact CE2-CG 3.72Å; Y217-R236 HydrophobicContact CG-CB 4.26Å; Y217-R236 PolarHBondContact N-O 2.82Å; Y217-R236 PolarHBondContact O-N 2.76Å; I219-R236 HydrophobicContact CG1-CG 4.47Å; T231-R236 PolarHBondContact OG1-NH2 3.23Å; V232-R236 PolarHBondContact O-NH1 2.84Å; V232-R236 PolarHBondContact O-NH2 3.1Å
237	N	93.4	Very high	93.6	Very high	100 Å²	100	80.3 Å²	80.3	54%	0.535	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	119.9	179.8	-169.4	-4.7	0	0	0	110.3	G239	N237-G239 WeakPolarHBondContact OD1-CA 3.43Å; N237-G239 PolarHBondContact OD1-N 3.43Å
238	Y	91.4	Very high	94.2	Very high	109 Å²	109	79.9 Å²	79.9	43%	0.427	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-7.6	171.1	-84.7	-154.9	0	0	0	112.5	A207 V215 Y217 W241 Y248	A207-Y238 HydrophobicContact CB-CD1 3.75Å; A207-Y238 HydrophobicContact CB-CE1 3.73Å; A207-Y238 HydrophobicContact CB-CG 4.41Å; V215-Y238 HydrophobicContact CG1-CD1 4.42Å; V215-Y238 WeakPolarHBondContact O-CA 3.27Å; V215-Y238 VanDerWaalsContact O-CB 3.27Å; V215-Y238 WeakPolarHBondContact O-CB 3.49Å; V215-Y238 PolarHBondContact O-N 3.28Å; Y217-Y238 HydrophobicContact CD1-CD2 4.45Å; Y217-Y238 HydrophobicContact CD1-CE2 4.19Å; Y217-Y238 AromaticContact CE1-CD2 3.97Å; Y217-Y238 HydrophobicContact CE1-CD2 3.97Å; Y217-Y238 AromaticContact CE1-CE2 3.37Å; Y217-Y238 HydrophobicContact CE1-CE2 3.37Å; Y217-Y238 AromaticContact CE1-CZ 3.71Å; Y238-W241 PolarHBondContact O-NE1 2.95Å; Y238-Y248 HydrophobicContact CD1-CE1 4.29Å
239	G	93.4	Very high	94.7	Very high	22 Å²	22	79.3 Å²	79.3	23%	0.227	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	94.9	-172.8	179.2	0	0	0	0	0	113.4	S214 V215 N237	S214-G239 WeakPolarHBondContact CA-O 3.22Å; V215-G239 PolarHBondContact N-O 3.17Å; N237-G239 WeakPolarHBondContact OD1-CA 3.43Å; N237-G239 PolarHBondContact OD1-N 3.43Å
240	F	93.5	Very high	95.2	Very high	145 Å²	145	73.5 Å²	73.5	64%	0.636	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	132.6	173	-66.5	-89.2	0	0	0	109.3	D212	D212-F240 HydrophobicContact CB-CE1 4.34Å
241	W	94.1	Very high	95.6	Very high	114 Å²	114	65.7 Å²	65.7	43%	0.432	32%	0.323	S	S	.	.			trans	-123.8	163	-176.5	-69.7	95.4	0	0	0	111.3	W209 V215 Y238 K243 Y248	W209-W241 HydrophobicContact CH2-CB 3.74Å; W209-W241 HydrophobicContact CZ3-CB 4.08Å; V215-W241 HydrophobicContact CG2-CB 4.46Å; V215-W241 HydrophobicContact CG2-CG 4.37Å; Y238-W241 PolarHBondContact O-NE1 2.95Å; W241-K243 PolarHBondContact O-N 3.12Å; W241-K243 VanDerWaalsContact O-N 3.16Å; W241-Y248 HydrophobicContact CB-CE2 4.29Å; W241-Y248 HydrophobicContact CD2-CE2 4.5Å; W241-Y248 AromaticContact CG-CE2 4Å; W241-Y248 HydrophobicContact CG-CE2 4Å
242	D	95.9	Very high	96	Very high	63 Å²	63	63.5 Å²	63.5	34%	0.337	31%	0.31	S	S	.	.			trans	-62.3	115.7	177.4	-176.9	-49.5	0	0	0	109.3	D244 K245 S246	D242-D244 PolarHBondContact O-N 2.78Å; D242-D244 PolarHBondContact OD1-N 3.47Å; D242-K245 HydrophobicContact CB-CB 4.28Å; D242-K245 PolarHBondContact O-N 3.1Å; D242-K245 PolarHBondContact OD1-N 3.14Å; D242-K245 WeakPolarHBondContact OD2-CD 3.35Å; D242-K245 IonicContact OD2-NZ 3.91Å; D242-S246 VanDerWaalsContact O-CB 3.26Å; D242-S246 WeakPolarHBondContact O-CB 3.38Å; D242-S246 PolarHBondContact O-N 2.79Å; D242-S246 PolarHBondContact O-OG 2.85Å
243	K	96.4	Very high	96.3	Very high	82 Å²	82	58.5 Å²	58.5	36%	0.357	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.9	-173.2	-71.9	-176.5	177.4	-178.1	0	113.2	N173 F174 W241	N173-K243 WeakPolarHBondContact CB-O 3.19Å; F174-K243 HydrophobicContact CB-CB 3.71Å; F174-K243 HydrophobicContact CB-CD 4.47Å; F174-K243 HydrophobicContact CB-CG 3.85Å; F174-K243 WeakPolarHBondContact CB-O 3.28Å; F174-K243 HydrophobicContact CD1-CB 4.36Å; F174-K243 HydrophobicContact CD1-CD 3.85Å; F174-K243 HydrophobicContact CD1-CG 4.17Å; F174-K243 HydrophobicContact CD2-CG 4.44Å; F174-K243 HydrophobicContact CE1-CD 4.22Å; F174-K243 HydrophobicContact CG-CB 4.19Å; F174-K243 HydrophobicContact CG-CD 4.03Å; F174-K243 HydrophobicContact CG-CG 3.89Å; F174-K243 PolarHBondContact N-O 2.88Å; F174-K243 VanDerWaalsContact N-O 3.07Å; W241-K243 PolarHBondContact O-N 3.12Å; W241-K243 VanDerWaalsContact O-N 3.16Å
244	D	97.2	Very high	96.4	Very high	105 Å²	105	55.3 Å²	55.3	56%	0.561	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-37.4	-176.8	-62.9	-48.5	0	0	0	112.1	N173 H175 D242	N173-D244 PolarHBondContact ND2-O 2.91Å; H175-D244 IonicContact CD2-OD1 3.37Å; H175-D244 IonicContact NE2-OD1 3.5Å; D242-D244 PolarHBondContact O-N 2.78Å; D242-D244 PolarHBondContact OD1-N 3.47Å
245	K	96.6	Very high	96.4	Very high	161 Å²	161	54.8 Å²	54.8	70%	0.7	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-40.6	-170.8	-62.8	176.6	-170	157.6	0	114.3	D242	D242-K245 HydrophobicContact CB-CB 4.28Å; D242-K245 PolarHBondContact O-N 3.1Å; D242-K245 PolarHBondContact OD1-N 3.14Å; D242-K245 WeakPolarHBondContact OD2-CD 3.35Å; D242-K245 IonicContact OD2-NZ 3.91Å
246	S	97.6	Very high	96.2	Very high	24 Å²	24	55.6 Å²	55.6	17%	0.168	26%	0.256	C	S	.	.			trans	-71.3	145.5	-174.6	-66.1	0	0	0	0	110.3	N173 W209 D242	N173-S246 VanDerWaalsContact CA-O 3.3Å; N173-S246 WeakPolarHBondContact CA-O 3.5Å; W209-S246 WeakPolarHBondContact CZ2-O 3.24Å; D242-S246 VanDerWaalsContact O-CB 3.26Å; D242-S246 WeakPolarHBondContact O-CB 3.38Å; D242-S246 PolarHBondContact O-N 2.79Å; D242-S246 PolarHBondContact O-OG 2.85Å
247	R	97.8	Very high	96.1	Very high	107 Å²	107	54.8 Å²	54.8	40%	0.404	25%	0.254	S	S	.	.			trans	-129.3	129.7	-178.9	-57.2	-156.3	-170.9	-87.9	-4.1	112	Y170 L172 E176	Y170-R247 VanDerWaalsContact O-CB 3.25Å; Y170-R247 WeakPolarHBondContact O-CB 3.38Å; L172-R247 VanDerWaalsContact O-CA 3.28Å; L172-R247 WeakPolarHBondContact O-CA 3.19Å; E176-R247 VanDerWaalsContact CD-NH1 3.31Å; E176-R247 IonicContact OE1-NH1 2.64Å; E176-R247 PolarHBondContact OE1-NH1 2.89Å; E176-R247 VanDerWaalsContact OE1-NH1 3.1Å; E176-R247 IonicContact OE2-NH1 3.72Å; E176-R247 PolarHBondContact OE2-NH1 3.36Å
248	Y	98.1	Very high	96.1	Very high	37 Å²	37	55.4 Å²	55.4	15%	0.145	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-145	-177.6	-176.9	-66.9	-74.3	0	0	0	110.3	Y170 L172 A207 W209 V215 Y238 W241	Y170-Y248 HydrophobicContact CD1-CD1 4.39Å; L172-Y248 WeakPolarHBondContact CB-O 3.32Å; L172-Y248 PolarHBondContact N-O 2.84Å; L172-Y248 PolarHBondContact O-N 3.1Å; A207-Y248 HydrophobicContact CB-CD1 3.96Å; A207-Y248 HydrophobicContact CB-CE1 4.33Å; W209-Y248 HydrophobicContact CD2-CD2 4.49Å; W209-Y248 AromaticContact CE2-CD2 3.85Å; W209-Y248 HydrophobicContact CH2-CD2 4.35Å; W209-Y248 AromaticContact CZ2-CD2 3.79Å; W209-Y248 HydrophobicContact CZ2-CD2 3.79Å; W209-Y248 HydrophobicContact CZ2-CE2 4.4Å; V215-Y248 HydrophobicContact CB-CD2 4.32Å; V215-Y248 HydrophobicContact CB-CE2 4.39Å; V215-Y248 HydrophobicContact CG1-CD1 3.77Å; V215-Y248 HydrophobicContact CG1-CD2 3.92Å; V215-Y248 HydrophobicContact CG1-CE1 4.03Å; V215-Y248 HydrophobicContact CG1-CE2 4.15Å; V215-Y248 HydrophobicContact CG1-CG 3.71Å; V215-Y248 HydrophobicContact CG2-CD2 3.51Å; V215-Y248 HydrophobicContact CG2-CE2 3.74Å; V215-Y248 HydrophobicContact CG2-CG 4.11Å; Y238-Y248 HydrophobicContact CD1-CE1 4.29Å; W241-Y248 HydrophobicContact CB-CE2 4.29Å; W241-Y248 HydrophobicContact CD2-CE2 4.5Å; W241-Y248 AromaticContact CG-CE2 4Å; W241-Y248 HydrophobicContact CG-CE2 4Å
249	D	98.1	Very high	96.3	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.011	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-168.2	164.8	-68.3	-9.2	0	0	0	108.5	F164 R169 Y170 N206 A207 G208 W209	F164-D249 HydrophobicContact CB-CB 4.5Å; F164-D249 WeakPolarHBondContact CB-OD1 3.45Å; R169-D249 VanDerWaalsContact CA-OD1 3.23Å; R169-D249 WeakPolarHBondContact CA-OD1 3.3Å; R169-D249 WeakPolarHBondContact CB-OD1 3.13Å; Y170-D249 PolarHBondContact N-OD1 2.89Å; N206-D249 WeakPolarHBondContact CB-OD2 3.29Å; A207-D249 PolarHBondContact O-N 3.39Å; A207-D249 VanDerWaalsContact O-N 3.17Å; G208-D249 CarbonylContact C-O 3.49Å; G208-D249 WeakPolarHBondContact CA-O 3.2Å; W209-D249 VanDerWaalsContact CD1-O 3.26Å; W209-D249 PolarHBondContact N-O 2.55Å
250	V	98.8	Very high	96.5	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	146.4	174.1	62.5	0	0	0	0	111.1	Y163 L172 A177 C181 I188 W209	Y163-V250 HydrophobicContact CD1-CG1 4.05Å; Y163-V250 PolarHBondContact N-O 3.26Å; Y163-V250 PolarHBondContact O-N 3.48Å; L172-V250 HydrophobicContact CD1-CG1 3.97Å; A177-V250 HydrophobicContact CB-CB 3.79Å; A177-V250 HydrophobicContact CB-CG1 4.33Å; A177-V250 HydrophobicContact CB-CG2 3.87Å; C181-V250 VanDerWaalsContact SG-CG2 3.57Å; I188-V250 HydrophobicContact CD1-CG2 3.91Å; I188-V250 HydrophobicContact CG1-CG2 3.83Å; W209-V250 HydrophobicContact CB-CG2 4.23Å
251	F	98.8	Very high	96.7	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.009	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	119.5	164.4	-69.9	-80.8	0	0	0	108.7	V160 P162 A189 L194 L202 W204 W209 L210 Q216 P218	V160-F251 HydrophobicContact CG1-CB 3.97Å; V160-F251 HydrophobicContact CG1-CD1 4.04Å; V160-F251 HydrophobicContact CG1-CG 4.41Å; P162-F251 HydrophobicContact CB-CD1 4.18Å; P162-F251 HydrophobicContact CB-CE1 3.9Å; A189-F251 HydrophobicContact CB-CB 4.1Å; A189-F251 WeakPolarHBondContact CB-O 3.18Å; A189-F251 PolarHBondContact N-O 3.47Å; L194-F251 HydrophobicContact CD1-CB 4.37Å; L194-F251 HydrophobicContact CD1-CD1 3.69Å; L194-F251 HydrophobicContact CD1-CD2 4.14Å; L194-F251 HydrophobicContact CD1-CE1 3.95Å; L194-F251 HydrophobicContact CD1-CE2 4.39Å; L194-F251 HydrophobicContact CD1-CG 3.79Å; L194-F251 HydrophobicContact CD1-CZ 4.3Å; L194-F251 HydrophobicContact CD2-CD2 4.29Å; L194-F251 HydrophobicContact CD2-CE2 4.45Å; L202-F251 HydrophobicContact CD2-CE1 4.36Å; W204-F251 HydrophobicContact CB-CE1 4.14Å; W204-F251 HydrophobicContact CB-CZ 4.18Å; W204-F251 AromaticContact CD1-CE1 3.98Å; W204-F251 AromaticContact CD1-CZ 3.73Å; W204-F251 HydrophobicContact CG-CE1 4.21Å; W204-F251 HydrophobicContact CG-CZ 4.24Å; W209-F251 PolarHBondContact O-N 2.81Å; L210-F251 HydrophobicContact CD2-CB 4.07Å; L210-F251 HydrophobicContact CD2-CD2 4.37Å; Q216-F251 VanDerWaalsContact O-CE2 3.29Å; Q216-F251 WeakPolarHBondContact O-CE2 3.39Å; P218-F251 VanDerWaalsContact CD-CZ 3.46Å; P218-F251 HydrophobicContact CG-CE1 4.35Å; P218-F251 HydrophobicContact CG-CZ 4.31Å
252	C	98.7	Very high	96.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	146.8	176.8	-57.9	0	0	0	0	109.9	V160 F161 C181 A186 V187	V160-C252 CarbonylContact C-O 3.54Å; V160-C252 VanDerWaalsContact CA-O 3.27Å; V160-C252 WeakPolarHBondContact CA-O 3.27Å; F161-C252 HydrophobicContact CD1-CB 4.29Å; F161-C252 HydrophobicContact CD2-CB 4.21Å; F161-C252 HydrophobicContact CE1-CB 3.76Å; F161-C252 HydrophobicContact CE2-CB 3.67Å; F161-C252 HydrophobicContact CZ-CB 3.42Å; F161-C252 VanDerWaalsContact CZ-CB 3.42Å; F161-C252 PolarHBondContact N-O 2.9Å; F161-C252 PolarHBondContact O-N 3.12Å; C181-C252 WeakPolarHBondContact CA-SG 3.37Å; C181-C252 HydrophobicContact CB-CB 3.82Å; C181-C252 WeakPolarHBondContact CB-SG 3.04Å; C181-C252 VanDerWaalsContact SG-CA 3.51Å; C181-C252 WeakPolarHBondContact SG-CB 3.33Å; C181-C252 CovalentContact SG-SG 2.04Å; C181-C252 PolarHBondContact SG-SG 3.06Å; A186-C252 HydrophobicContact CB-CB 3.81Å; V187-C252 CarbonylContact O-C 3.44Å; V187-C252 WeakPolarHBondContact O-CA 3.25Å
253	F	98.5	Very high	97.1	Very high	7 Å²	7	43 Å²	43	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.4	172.9	173.1	-93.3	0	0	0	110.1	L131 L156 V159 V160 A186 V187 A189 Q193	L131-F253 HydrophobicContact CD2-CD1 4.34Å; L131-F253 HydrophobicContact CD2-CE1 4.04Å; L156-F253 HydrophobicContact CB-CE1 4.08Å; L156-F253 HydrophobicContact CB-CZ 3.93Å; L156-F253 WeakPolarHBondContact O-CZ 3.38Å; V159-F253 WeakPolarHBondContact O-CA 3.35Å; V160-F253 HydrophobicContact CG2-CB 4.46Å; V160-F253 HydrophobicContact CG2-CD2 4.03Å; A186-F253 CarbonylContact C-O 3.55Å; A186-F253 VanDerWaalsContact CA-O 3.28Å; A186-F253 WeakPolarHBondContact CA-O 3.27Å; A186-F253 VanDerWaalsContact CB-O 3.27Å; A186-F253 WeakPolarHBondContact CB-O 3.42Å; V187-F253 HydrophobicContact CG2-CB 4.43Å; V187-F253 HydrophobicContact CG2-CD1 4.18Å; V187-F253 PolarHBondContact N-O 3.03Å; V187-F253 PolarHBondContact O-N 3.43Å; A189-F253 HydrophobicContact CB-CB 4.02Å; Q193-F253 HydrophobicContact CB-CD2 4.39Å; Q193-F253 HydrophobicContact CG-CD2 4.07Å; Q193-F253 HydrophobicContact CG-CE2 4.32Å; Q193-F253 VanDerWaalsContact NE2-CD1 3.28Å; Q193-F253 VanDerWaalsContact NE2-CG 3.28Å
254	T	98	Very high	97.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	163	171.9	-168.7	0	0	0	0	110.4	G158 V159 F161 D185 G290 A294	G158-T254 CarbonylContact C-O 3.49Å; G158-T254 WeakPolarHBondContact CA-O 3.42Å; V159-T254 HydrophobicContact CG1-CG2 3.59Å; V159-T254 PolarHBondContact N-O 3.36Å; V159-T254 PolarHBondContact O-N 3.47Å; F161-T254 HydrophobicContact CD1-CG2 4.22Å; F161-T254 HydrophobicContact CE1-CG2 3.81Å; D185-T254 WeakPolarHBondContact O-CB 3.44Å; D185-T254 PolarHBondContact O-OG1 2.78Å; T254-G290 WeakPolarHBondContact CG2-O 3.3Å; T254-A294 HydrophobicContact CG2-CB 4.12Å
255	S	96.5	Very high	97.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	-169.4	-177	-173.6	0	0	0	0	109.7	R53 L131 Q157 A294	R53-S255 PolarHBondContact N-OG 2.86Å; L131-S255 VanDerWaalsContact CD2-CB 3.48Å; Q157-S255 WeakPolarHBondContact O-CB 3.47Å; Q157-S255 PolarHBondContact O-OG 3.12Å; S255-A294 WeakPolarHBondContact O-CB 3.36Å
256	N	92.6	Very high	97	Very high	43 Å²	43	37.4 Å²	37.4	23%	0.23	17%	0.174	C	C	.	.			trans	-53.2	146.7	170.6	-79.5	19.5	0	0	0	110.6	R53 L298	R53-N256 WeakPolarHBondContact CB-O 3.41Å; R53-N256 WeakPolarHBondContact CD-O 3.24Å; N256-L298 WeakPolarHBondContact OD1-CD1 3.3Å
257	F	93.9	Very high	96.8	Very high	28 Å²	28	42.3 Å²	42.3	12%	0.123	21%	0.206	C	C	.	.			trans	-112.3	153.7	172.5	49.1	-110.1	0	0	0	109.7	G259 F261 Q291 A294 A295 L299 F350	F257-G259 WeakPolarHBondContact CE2-O 3.04Å; F257-G259 PolarHBondContact O-N 2.58Å; F257-F261 HydrophobicContact CE1-CB 4.34Å; F257-F261 HydrophobicContact CE2-CB 4.16Å; F257-F261 HydrophobicContact CZ-CB 3.61Å; F257-Q291 HydrophobicContact CD1-CB 4.37Å; F257-Q291 HydrophobicContact CD1-CG 4.33Å; F257-Q291 HydrophobicContact CE1-CB 4.37Å; F257-Q291 WeakPolarHBondContact CE1-O 3.28Å; F257-A294 HydrophobicContact CD1-CB 3.78Å; F257-A294 HydrophobicContact CE1-CB 3.73Å; F257-A295 HydrophobicContact CE1-CB 4.16Å; F257-A295 HydrophobicContact CZ-CB 4.05Å; F257-L299 HydrophobicContact CE2-CD1 3.98Å; F257-L299 HydrophobicContact CZ-CD1 3.67Å; F257-F350 HydrophobicContact CB-CE2 4.15Å; F257-F350 HydrophobicContact CB-CZ 4.14Å; F257-F350 HydrophobicContact CD1-CE2 4.42Å; F257-F350 HydrophobicContact CD2-CD2 4.46Å; F257-F350 AromaticContact CD2-CE2 3.43Å; F257-F350 HydrophobicContact CD2-CE2 3.43Å; F257-F350 VanDerWaalsContact CD2-CE2 3.43Å; F257-F350 HydrophobicContact CD2-CZ 4.1Å; F257-F350 AromaticContact CE2-CE2 3.87Å; F257-F350 HydrophobicContact CE2-CE2 3.87Å; F257-F350 AromaticContact CG-CE2 3.74Å; F257-F350 HydrophobicContact CG-CE2 3.74Å; F257-F350 HydrophobicContact CG-CZ 4.24Å
258	N	92.7	Very high	96.7	Very high	112 Å²	112	41.4 Å²	41.4	60%	0.599	21%	0.212	S	C	*	.	S	Bend	trans	-93.2	86.9	171.4	-172	24.1	0	0	0	110.1	Y353	N258-Y353 PolarHBondContact ND2-O 3.45Å; N258-Y353 PolarHBondContact O-N 3.32Å; N258-Y353 VanDerWaalsContact O-N 3.17Å
259	G	95.4	Very high	96.6	Very high	9 Å²	9	44.3 Å²	44.3	9%	0.093	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.9	-173.2	-178.5	0	0	0	0	0	113.9	F257 R351 Y353	F257-G259 WeakPolarHBondContact CE2-O 3.04Å; F257-G259 PolarHBondContact O-N 2.58Å; G259-R351 CarbonylContact C-O 3.58Å; G259-R351 WeakPolarHBondContact CA-O 3.5Å; G259-Y353 VanDerWaalsContact C-CE2 3.44Å; G259-Y353 VanDerWaalsContact CA-CD2 3.45Å; G259-Y353 WeakPolarHBondContact O-CE2 3.36Å
260	R	97.1	Very high	96.6	Very high	131 Å²	131	44.6 Å²	44.6	49%	0.494	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116.6	178.5	-165.8	180	172.7	-178	-3.1	110.6	Y262 F350 R351 Y353	R260-Y262 HydrophobicContact CB-CD1 4.41Å; R260-Y262 HydrophobicContact CG-CD1 3.94Å; R260-F350 WeakPolarHBondContact O-CA 3.49Å; R260-R351 HydrophobicContact CB-CB 4.47Å; R260-R351 PolarHBondContact N-O 3.3Å; R260-R351 PolarHBondContact O-N 3.43Å; R260-Y353 HydrophobicContact CB-CE1 4.03Å; R260-Y353 WeakPolarHBondContact CB-OH 3.38Å
261	F	98.4	Very high	96.6	Very high	13 Å²	13	45.7 Å²	45.7	6%	0.057	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	132.4	166.1	176.9	-89.6	0	0	0	110	F257 A287 Q291 I292 A295 Y301 Y348 F350	F257-F261 HydrophobicContact CE1-CB 4.34Å; F257-F261 HydrophobicContact CE2-CB 4.16Å; F257-F261 HydrophobicContact CZ-CB 3.61Å; F261-A287 HydrophobicContact CD2-CB 3.76Å; F261-A287 HydrophobicContact CE2-CB 3.51Å; F261-Q291 HydrophobicContact CD2-CB 4.04Å; F261-I292 HydrophobicContact CE1-CB 4.49Å; F261-I292 HydrophobicContact CE1-CG1 4.33Å; F261-I292 HydrophobicContact CE2-CB 3.72Å; F261-I292 HydrophobicContact CE2-CG1 4.36Å; F261-I292 HydrophobicContact CZ-CB 3.54Å; F261-I292 HydrophobicContact CZ-CD1 4.03Å; F261-I292 HydrophobicContact CZ-CG1 3.66Å; F261-A295 HydrophobicContact CB-CB 4Å; F261-A295 HydrophobicContact CD1-CB 3.39Å; F261-A295 HydrophobicContact CD2-CB 4.5Å; F261-A295 HydrophobicContact CE1-CB 3.96Å; F261-A295 HydrophobicContact CG-CB 3.71Å; F261-Y301 HydrophobicContact CD1-CD1 4.17Å; F261-Y301 HydrophobicContact CD1-CD2 4.15Å; F261-Y301 HydrophobicContact CD1-CE1 4.25Å; F261-Y301 HydrophobicContact CD1-CE2 4.21Å; F261-Y301 HydrophobicContact CD1-CG 4.13Å; F261-Y301 AromaticContact CE1-CD1 3.77Å; F261-Y301 HydrophobicContact CE1-CD1 3.77Å; F261-Y301 AromaticContact CE1-CE1 3.72Å; F261-Y301 HydrophobicContact CE1-CE1 3.72Å; F261-Y301 HydrophobicContact CE1-CE2 4.47Å; F261-Y301 HydrophobicContact CE1-CG 4.19Å; F261-Y348 AromaticContact CE1-CD1 3.64Å; F261-Y348 HydrophobicContact CE1-CD1 3.64Å; F261-Y348 HydrophobicContact CE1-CE1 4.13Å; F261-Y348 HydrophobicContact CE1-CG 4.47Å; F261-Y348 HydrophobicContact CE2-CD1 4.26Å; F261-Y348 HydrophobicContact CE2-CG 4.34Å; F261-Y348 AromaticContact CZ-CD1 3.34Å; F261-Y348 HydrophobicContact CZ-CD1 3.34Å; F261-Y348 HydrophobicContact CZ-CE1 4.1Å; F261-Y348 AromaticContact CZ-CG 3.74Å; F261-Y348 HydrophobicContact CZ-CG 3.74Å; F261-F350 HydrophobicContact CB-CD2 4.35Å
262	Y	98.6	Very high	96.6	Very high	21 Å²	21	47 Å²	47	8%	0.082	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	159.8	-179.3	59.7	-76.2	0	0	0	112.5	R260 L264 D282 A284 Y348 C349 R351	R260-Y262 HydrophobicContact CB-CD1 4.41Å; R260-Y262 HydrophobicContact CG-CD1 3.94Å; Y262-L264 HydrophobicContact CE2-CD1 4.23Å; Y262-D282 WeakPolarHBondContact CE2-OD2 3.32Å; Y262-D282 VanDerWaalsContact CZ-OD2 3.29Å; Y262-D282 PolarHBondContact OH-OD2 3.03Å; Y262-A284 HydrophobicContact CE1-CB 4.47Å; Y262-A284 WeakPolarHBondContact OH-CB 3.35Å; Y262-Y348 CarbonylContact O-C 3.57Å; Y262-Y348 WeakPolarHBondContact O-CA 3.47Å; Y262-C349 HydrophobicContact CE1-CB 4.06Å; Y262-C349 HydrophobicContact CE2-CB 4Å; Y262-C349 PolarHBondContact N-O 2.87Å; Y262-C349 PolarHBondContact O-N 3.04Å; Y262-R351 HydrophobicContact CE1-CB 4.29Å; Y262-R351 PolarHBondContact OH-NH2 3.36Å
263	Y	98.6	Very high	96.6	Very high	19 Å²	19	51.7 Å²	51.7	8%	0.075	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.1	168	-173.8	-92.3	0	0	0	109.5	I265 K269 Y301 R303 D305 G346 Y348	Y263-I265 HydrophobicContact CD1-CD1 3.99Å; Y263-I265 HydrophobicContact CE1-CD1 4.41Å; Y263-I265 PolarHBondContact O-N 3.36Å; Y263-K269 PolarHBondContact OH-NZ 3.41Å; Y263-Y301 WeakPolarHBondContact CB-OH 3.47Å; Y263-Y301 PolarHBondContact N-OH 3.24Å; Y263-R303 HydrophobicContact CD2-CG 4.45Å; Y263-R303 HydrophobicContact CG-CG 4.4Å; Y263-D305 HydrophobicContact CD2-CB 4.31Å; Y263-D305 HydrophobicContact CE1-CB 4.35Å; Y263-D305 HydrophobicContact CE2-CB 3.64Å; Y263-G346 VanDerWaalsContact OH-CA 3.24Å; Y263-G346 WeakPolarHBondContact OH-CA 3.29Å; Y263-Y348 HydrophobicContact CD2-CD1 4.06Å; Y263-Y348 HydrophobicContact CD2-CD2 4.29Å; Y263-Y348 AromaticContact CD2-CE1 3.69Å; Y263-Y348 HydrophobicContact CD2-CE1 3.69Å; Y263-Y348 AromaticContact CD2-CE2 3.91Å; Y263-Y348 HydrophobicContact CD2-CE2 3.91Å; Y263-Y348 HydrophobicContact CD2-CG 4.35Å; Y263-Y348 AromaticContact CD2-CZ 3.6Å; Y263-Y348 HydrophobicContact CE2-CE2 4.32Å; Y263-Y348 HydrophobicContact CG-CE1 4.26Å
264	L	98.3	Very high	96.5	Very high	23 Å²	23	55.9 Å²	55.9	12%	0.12	28%	0.284	C	S	.	.			trans	-77	122.4	177.9	-175.1	63.9	0	0	0	110	Y262 H266 A278 D282 V347	Y262-L264 HydrophobicContact CE2-CD1 4.23Å; L264-H266 PolarHBondContact O-N 3.35Å; L264-A278 HydrophobicContact CD2-CB 3.66Å; L264-D282 HydrophobicContact CD1-CB 4.18Å; L264-V347 HydrophobicContact CB-CG1 3.71Å; L264-V347 HydrophobicContact CD2-CG1 3.93Å; L264-V347 HydrophobicContact CG-CG1 4.42Å; L264-V347 PolarHBondContact N-O 3.5Å
265	I	96.9	Very high	96.6	Very high	125 Å²	125	55.9 Å²	55.9	64%	0.641	28%	0.284	S	S	*	.			trans	-79.9	107.3	174.7	-55.5	-63.2	0	0	0	108.1	Y263	Y263-I265 HydrophobicContact CD1-CD1 3.99Å; Y263-I265 HydrophobicContact CE1-CD1 4.41Å; Y263-I265 PolarHBondContact O-N 3.36Å
266	H	94.3	Very high	96.7	Very high	82 Å²	82	57.5 Å²	57.5	38%	0.38	29%	0.293	S	S	.	.			trans	-120.9	143.8	-179.8	-167.5	-92	0	0	0	110.3	L264 T268 L270	L264-H266 PolarHBondContact O-N 3.35Å; H266-T268 VanDerWaalsContact C-N 3.25Å; H266-T268 PolarHBondContact CE1-OG1 2.84Å; H266-T268 PolarHBondContact ND1-N 2.87Å; H266-T268 PolarHBondContact ND1-O 2.8Å; H266-T268 PolarHBondContact ND1-OG1 2.82Å; H266-T268 PolarHBondContact O-N 2.82Å; H266-L270 HydrophobicContact CB-CD1 4.45Å; H266-L270 VanDerWaalsContact CE1-CD2 3.48Å; H266-L270 WeakPolarHBondContact CE1-CD2 3.47Å
267	P	93.9	Very high	96.9	Very high	127 Å²	127	60.2 Å²	60.2	83%	0.825	31%	0.305	S	S	*	.	S	Bend	trans	-58.9	-34	-177.5	-26.4	34.7	0	0	0	114.2
268	T	94.9	Very high	97.2	Very high	89 Å²	89	59.6 Å²	59.6	55%	0.546	31%	0.305	S	S	.	.	S	Bend	trans	-122.9	158.8	178.9	56.3	0	0	0	0	111.2	H266	H266-T268 VanDerWaalsContact C-N 3.25Å; H266-T268 PolarHBondContact CE1-OG1 2.84Å; H266-T268 PolarHBondContact ND1-N 2.87Å; H266-T268 PolarHBondContact ND1-O 2.8Å; H266-T268 PolarHBondContact ND1-OG1 2.82Å; H266-T268 PolarHBondContact O-N 2.82Å
269	K	96.5	Very high	97.4	Very high	97 Å²	97	54.3 Å²	54.3	42%	0.422	28%	0.276	S	S	.	.			trans	-73.7	151	166.3	-59.3	-58.5	-173.8	-173.2	0	109.3	Y263 L344 Y345	Y263-K269 PolarHBondContact OH-NZ 3.41Å; K269-L344 HydrophobicContact CB-CB 3.6Å; K269-Y345 CarbonylContact C-O 3.53Å; K269-Y345 WeakPolarHBondContact CA-O 3.33Å
270	L	97.7	Very high	97.6	Very high	9 Å²	9	57.9 Å²	57.9	5%	0.047	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-121.3	145.6	-165.5	-59.7	177	0	0	0	111.3	H266 E274 A275 A278 W308 L344 Y345 V347	H266-L270 HydrophobicContact CB-CD1 4.45Å; H266-L270 VanDerWaalsContact CE1-CD2 3.48Å; H266-L270 WeakPolarHBondContact CE1-CD2 3.47Å; L270-E274 HydrophobicContact CB-CB 4.01Å; L270-E274 HydrophobicContact CD2-CB 4.05Å; L270-E274 HydrophobicContact CG-CB 4.49Å; L270-A275 HydrophobicContact CB-CB 4.07Å; L270-A275 HydrophobicContact CD1-CB 4.33Å; L270-A278 HydrophobicContact CD1-CB 3.63Å; L270-W308 PolarHBondContact O-NE1 3.45Å; L270-L344 VanDerWaalsContact O-CA 3.31Å; L270-L344 WeakPolarHBondContact O-CA 3.31Å; L270-Y345 PolarHBondContact N-O 2.75Å; L270-Y345 PolarHBondContact O-N 2.85Å; L270-V347 HydrophobicContact CD1-CG1 4.41Å
271	T	98.4	Very high	97.6	Very high	22 Å²	22	58.3 Å²	58.3	14%	0.135	31%	0.305	C	S	.	.			trans	-64.2	169.1	160.6	62.8	0	0	0	0	110	D273 E274 A275 K341 L344	T271-D273 PolarHBondContact O-N 2.58Å; T271-E274 WeakPolarHBondContact CB-OE2 3.28Å; T271-E274 WeakPolarHBondContact CG2-OE2 3.41Å; T271-E274 PolarHBondContact N-OE2 2.94Å; T271-E274 PolarHBondContact O-N 3.04Å; T271-E274 WeakPolarHBondContact OG1-CB 3.06Å; T271-E274 WeakPolarHBondContact OG1-CG 3.48Å; T271-E274 PolarHBondContact OG1-N 3.42Å; T271-E274 PolarHBondContact OG1-OE2 3.49Å; T271-A275 WeakPolarHBondContact O-CB 3.35Å; T271-A275 PolarHBondContact O-N 3.36Å; T271-K341 WeakPolarHBondContact CG2-O 3.21Å; T271-L344 HydrophobicContact CG2-CD2 3.53Å
272	Y	98.4	Very high	97.6	Very high	29 Å²	29	60.6 Å²	60.6	11%	0.114	32%	0.318	C	S	.	.	H	α-helix	trans	-61.5	-45.3	-178.2	176	-94.5	0	0	0	112.1	A275 V276 I286 W308 L309 A310 K340	Y272-A275 WeakPolarHBondContact O-CB 3.31Å; Y272-A275 PolarHBondContact O-N 2.84Å; Y272-V276 HydrophobicContact CD1-CG2 4.31Å; Y272-V276 HydrophobicContact CE1-CG2 3.79Å; Y272-V276 HydrophobicContact CE2-CG2 4.31Å; Y272-V276 WeakPolarHBondContact O-CG2 3.06Å; Y272-V276 PolarHBondContact O-N 2.85Å; Y272-I286 HydrophobicContact CE2-CD1 4.05Å; Y272-W308 HydrophobicContact CD2-CB 4.47Å; Y272-W308 HydrophobicContact CD2-CD2 4.09Å; Y272-W308 AromaticContact CD2-CE3 3.84Å; Y272-W308 HydrophobicContact CD2-CE3 3.84Å; Y272-W308 HydrophobicContact CD2-CG 4.41Å; Y272-W308 HydrophobicContact CD2-CZ3 4.34Å; Y272-L309 WeakPolarHBondContact CE2-O 3.38Å; Y272-A310 PolarHBondContact OH-O 2.79Å; Y272-K340 HydrophobicContact CD1-CD 3.7Å; Y272-K340 HydrophobicContact CD1-CG 4.31Å; Y272-K340 HydrophobicContact CD2-CD 4.38Å; Y272-K340 HydrophobicContact CE1-CD 4.24Å; Y272-K340 HydrophobicContact CG-CB 4.33Å; Y272-K340 HydrophobicContact CG-CD 3.79Å; Y272-K340 HydrophobicContact CG-CG 3.94Å; Y272-K340 PolarHBondContact N-O 3.37Å
273	D	98.3	Very high	97.5	Very high	99 Å²	99	62.3 Å²	62.3	53%	0.529	34%	0.342	S	S	.	.	H	α-helix	trans	-69.2	-38.4	-176.9	-63.9	-32.1	0	0	0	111.3	T271 A275 V276 Q277	T271-D273 PolarHBondContact O-N 2.58Å; D273-A275 VanDerWaalsContact C-N 3.34Å; D273-V276 PolarHBondContact O-N 3.44Å; D273-Q277 PolarHBondContact O-N 3.12Å
274	E	98.3	Very high	97.5	Very high	96 Å²	96	61.7 Å²	61.7	45%	0.449	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-39	172.1	-68.4	167.2	152.4	0	0	111.9	L270 T271 Q277 A278	L270-E274 HydrophobicContact CB-CB 4.01Å; L270-E274 HydrophobicContact CD2-CB 4.05Å; L270-E274 HydrophobicContact CG-CB 4.49Å; T271-E274 WeakPolarHBondContact CB-OE2 3.28Å; T271-E274 WeakPolarHBondContact CG2-OE2 3.41Å; T271-E274 PolarHBondContact N-OE2 2.94Å; T271-E274 PolarHBondContact O-N 3.04Å; T271-E274 WeakPolarHBondContact OG1-CB 3.06Å; T271-E274 WeakPolarHBondContact OG1-CG 3.48Å; T271-E274 PolarHBondContact OG1-N 3.42Å; T271-E274 PolarHBondContact OG1-OE2 3.49Å; E274-Q277 PolarHBondContact O-N 2.87Å; E274-A278 VanDerWaalsContact O-CB 3.3Å; E274-A278 WeakPolarHBondContact O-CB 3.45Å; E274-A278 PolarHBondContact O-N 2.91Å
275	A	98.5	Very high	97.5	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-43	176.7	0	0	0	0	0	112.2	L270 T271 Y272 D273 A278 C279 W308 V347	L270-A275 HydrophobicContact CB-CB 4.07Å; L270-A275 HydrophobicContact CD1-CB 4.33Å; T271-A275 WeakPolarHBondContact O-CB 3.35Å; T271-A275 PolarHBondContact O-N 3.36Å; Y272-A275 WeakPolarHBondContact O-CB 3.31Å; Y272-A275 PolarHBondContact O-N 2.84Å; D273-A275 VanDerWaalsContact C-N 3.34Å; A275-A278 PolarHBondContact O-N 3.07Å; A275-C279 PolarHBondContact O-N 2.83Å; A275-W308 HydrophobicContact CB-CB 4.19Å; A275-W308 HydrophobicContact CB-CG 4.15Å; A275-V347 HydrophobicContact CB-CB 3.74Å; A275-V347 HydrophobicContact CB-CG1 4.42Å; A275-V347 HydrophobicContact CB-CG2 3.76Å
276	V	98.6	Very high	97.6	Very high	33 Å²	33	62 Å²	62	20%	0.2	34%	0.339	C	S	.	.	H	α-helix	trans	-59.5	-49.4	173.5	173.3	0	0	0	0	110.2	Y272 D273 A278 C279 L280 I286	Y272-V276 HydrophobicContact CD1-CG2 4.31Å; Y272-V276 HydrophobicContact CE1-CG2 3.79Å; Y272-V276 HydrophobicContact CE2-CG2 4.31Å; Y272-V276 WeakPolarHBondContact O-CG2 3.06Å; Y272-V276 PolarHBondContact O-N 2.85Å; D273-V276 PolarHBondContact O-N 3.44Å; V276-A278 VanDerWaalsContact C-N 3.33Å; V276-A278 PolarHBondContact O-N 3.26Å; V276-C279 PolarHBondContact O-N 2.77Å; V276-L280 HydrophobicContact CG1-CD1 4.15Å; V276-L280 WeakPolarHBondContact O-CG 3.3Å; V276-L280 PolarHBondContact O-N 2.93Å; V276-L280 VanDerWaalsContact O-N 3.14Å; V276-I286 HydrophobicContact CG2-CB 4.39Å; V276-I286 HydrophobicContact CG2-CD1 3.95Å; V276-I286 HydrophobicContact CG2-CG2 4.1Å
277	Q	98.4	Very high	97.8	Very high	101 Å²	101	58.1 Å²	58.1	47%	0.472	32%	0.321	S	S	.	.	H	α-helix	trans	-65.3	-35.7	179.8	-71.6	-59.4	-11.4	0	0	113.2	D273 E274 C279 L280 N281	D273-Q277 PolarHBondContact O-N 3.12Å; E274-Q277 PolarHBondContact O-N 2.87Å; Q277-C279 VanDerWaalsContact C-N 3.34Å; Q277-C279 PolarHBondContact O-N 3.38Å; Q277-L280 PolarHBondContact O-N 3.1Å; Q277-N281 WeakPolarHBondContact O-CB 3.17Å; Q277-N281 PolarHBondContact O-N 3.22Å; Q277-N281 PolarHBondContact O-ND2 2.67Å
278	A	98.4	Very high	98	Very high	15 Å²	15	55.1 Å²	55.1	12%	0.124	30%	0.296	C	S	.	.	H	α-helix	trans	-62.8	-40.4	176.7	0	0	0	0	0	111.9	L264 L270 E274 A275 V276 D282	L264-A278 HydrophobicContact CD2-CB 3.66Å; L270-A278 HydrophobicContact CD1-CB 3.63Å; E274-A278 VanDerWaalsContact O-CB 3.3Å; E274-A278 WeakPolarHBondContact O-CB 3.45Å; E274-A278 PolarHBondContact O-N 2.91Å; A275-A278 PolarHBondContact O-N 3.07Å; V276-A278 VanDerWaalsContact C-N 3.33Å; V276-A278 PolarHBondContact O-N 3.26Å; A278-D282 PolarHBondContact O-N 2.9Å
279	C	98.5	Very high	98.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-42.9	172.8	-67.2	0	0	0	0	112	A275 V276 Q277 D282 G283 A284 V347 C349	A275-C279 PolarHBondContact O-N 2.83Å; V276-C279 PolarHBondContact O-N 2.77Å; Q277-C279 VanDerWaalsContact C-N 3.34Å; Q277-C279 PolarHBondContact O-N 3.38Å; C279-D282 CarbonylContact O-C 3.56Å; C279-D282 PolarHBondContact O-N 2.94Å; C279-D282 VanDerWaalsContact O-N 3.13Å; C279-G283 PolarHBondContact O-N 3.28Å; C279-A284 CarbonylContact C-O 3.39Å; C279-A284 CarbonylContact O-C 3.54Å; C279-A284 WeakPolarHBondContact O-CA 3.5Å; C279-A284 PolarHBondContact O-N 3.3Å; C279-V347 WeakPolarHBondContact SG-CG2 3.13Å; C279-C349 WeakPolarHBondContact CA-SG 3.49Å; C279-C349 HydrophobicContact CB-CB 3.84Å; C279-C349 WeakPolarHBondContact CB-SG 3.46Å; C279-C349 WeakPolarHBondContact SG-CB 3.45Å; C279-C349 CovalentContact SG-SG 2.04Å; C279-C349 PolarHBondContact SG-SG 3.35Å
280	L	98.4	Very high	98.3	Very high	84 Å²	84	46.3 Å²	46.3	44%	0.44	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-43.9	179.3	-69.4	172.5	0	0	0	111.9	V276 Q277 D282 G283 A284	V276-L280 HydrophobicContact CG1-CD1 4.15Å; V276-L280 WeakPolarHBondContact O-CG 3.3Å; V276-L280 PolarHBondContact O-N 2.93Å; V276-L280 VanDerWaalsContact O-N 3.14Å; Q277-L280 PolarHBondContact O-N 3.1Å; L280-D282 PolarHBondContact O-N 2.81Å; L280-G283 PolarHBondContact O-N 3.17Å; L280-A284 VanDerWaalsContact CA-O 3.28Å; L280-A284 WeakPolarHBondContact CA-O 3.48Å; L280-A284 PolarHBondContact N-O 3.36Å
281	N	97.9	Very high	98.3	Very high	140 Å²	140	46.5 Å²	46.5	75%	0.749	25%	0.25	S	S	*	.	H	α-helix	trans	-63.1	-25.7	176.2	-69.8	-19.5	0	0	0	112.7	Q277 G283	Q277-N281 WeakPolarHBondContact O-CB 3.17Å; Q277-N281 PolarHBondContact O-N 3.22Å; Q277-N281 PolarHBondContact O-ND2 2.67Å; N281-G283 VanDerWaalsContact C-N 3.28Å
282	D	97.6	Very high	98.3	Very high	61 Å²	61	45.4 Å²	45.4	33%	0.326	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	9.2	174	-169	58.3	0	0	0	113.1	Y262 L264 A278 C279 L280 A284 R351	Y262-D282 WeakPolarHBondContact CE2-OD2 3.32Å; Y262-D282 VanDerWaalsContact CZ-OD2 3.29Å; Y262-D282 PolarHBondContact OH-OD2 3.03Å; L264-D282 HydrophobicContact CD1-CB 4.18Å; A278-D282 PolarHBondContact O-N 2.9Å; C279-D282 CarbonylContact O-C 3.56Å; C279-D282 PolarHBondContact O-N 2.94Å; C279-D282 VanDerWaalsContact O-N 3.13Å; L280-D282 PolarHBondContact O-N 2.81Å; D282-A284 VanDerWaalsContact C-N 3.32Å; D282-A284 PolarHBondContact O-N 3.31Å; D282-R351 PolarHBondContact O-NH2 3.29Å; D282-R351 IonicContact OD1-NH2 3.58Å; D282-R351 IonicContact OD2-NH2 3.27Å; D282-R351 PolarHBondContact OD2-NH2 3.29Å
283	G	97.5	Very high	98.3	Very high	57 Å²	57	44.9 Å²	44.9	59%	0.588	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	28.5	-179	0	0	0	0	0	113.4	C279 L280 N281	C279-G283 PolarHBondContact O-N 3.28Å; L280-G283 PolarHBondContact O-N 3.17Å; N281-G283 VanDerWaalsContact C-N 3.28Å
284	A	98.1	Very high	98.3	Very high	6 Å²	6	40.2 Å²	40.2	5%	0.05	22%	0.217	C	C	.	.			trans	-130.7	175.4	-179	0	0	0	0	0	111.1	Y262 C279 L280 D282 C349 F350 R351	Y262-A284 HydrophobicContact CE1-CB 4.47Å; Y262-A284 WeakPolarHBondContact OH-CB 3.35Å; C279-A284 CarbonylContact C-O 3.39Å; C279-A284 CarbonylContact O-C 3.54Å; C279-A284 WeakPolarHBondContact O-CA 3.5Å; C279-A284 PolarHBondContact O-N 3.3Å; L280-A284 VanDerWaalsContact CA-O 3.28Å; L280-A284 WeakPolarHBondContact CA-O 3.48Å; L280-A284 PolarHBondContact N-O 3.36Å; D282-A284 VanDerWaalsContact C-N 3.32Å; D282-A284 PolarHBondContact O-N 3.31Å; A284-C349 HydrophobicContact CB-CB 3.97Å; A284-F350 WeakPolarHBondContact CB-O 3.1Å; A284-R351 HydrophobicContact CB-CB 4.11Å
285	Q	98.2	Very high	98.3	Very high	133 Å²	133	35.7 Å²	35.7	62%	0.621	20%	0.196	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	157.7	171.3	-62.1	178.3	22.4	0	0	109.3	A287 C349 F350	Q285-A287 PolarHBondContact O-N 3.36Å; Q285-C349 CarbonylContact O-C 3.11Å; Q285-C349 VanDerWaalsContact O-CA 3.25Å; Q285-C349 WeakPolarHBondContact O-CA 3.21Å; Q285-F350 PolarHBondContact N-O 3.17Å; Q285-F350 PolarHBondContact O-N 3.11Å
286	I	98.6	Very high	98.3	Very high	22 Å²	22	37.3 Å²	37.3	11%	0.113	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	133.7	169.2	-170.6	166.7	0	0	0	109.3	Y272 V276 W308 A310 V347	Y272-I286 HydrophobicContact CE2-CD1 4.05Å; V276-I286 HydrophobicContact CG2-CB 4.39Å; V276-I286 HydrophobicContact CG2-CD1 3.95Å; V276-I286 HydrophobicContact CG2-CG2 4.1Å; I286-W308 HydrophobicContact CD1-CB 4.01Å; I286-A310 HydrophobicContact CG2-CB 3.85Å; I286-V347 HydrophobicContact CD1-CG2 3.88Å; I286-V347 HydrophobicContact CG1-CG2 3.85Å
287	A	98.8	Very high	98.2	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-71.4	145.2	-173	0	0	0	0	0	111.8	F261 Q285 L309 A310 Y348 F350	F261-A287 HydrophobicContact CD2-CB 3.76Å; F261-A287 HydrophobicContact CE2-CB 3.51Å; Q285-A287 PolarHBondContact O-N 3.36Å; A287-L309 HydrophobicContact CB-CD2 4.06Å; A287-L309 CarbonylContact O-C 3.37Å; A287-L309 WeakPolarHBondContact O-CA 3.41Å; A287-L309 WeakPolarHBondContact O-CB 3.43Å; A287-L309 WeakPolarHBondContact O-CD2 3.02Å; A287-A310 PolarHBondContact O-N 2.86Å; A287-Y348 WeakPolarHBondContact CB-O 3.31Å; A287-Y348 PolarHBondContact N-O 2.68Å; A287-F350 HydrophobicContact CB-CB 4.08Å
288	K	98.7	Very high	98.1	Very high	65 Å²	65	38.2 Å²	38.2	28%	0.283	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-84.2	163.5	175.9	-69.4	177	170.3	-159.4	0	111.8	D183 D185 G290 Q291 I292 A310	D183-K288 WeakPolarHBondContact O-CD 3.39Å; D183-K288 WeakPolarHBondContact O-CE 3.17Å; D183-K288 PolarHBondContact O-NZ 3.1Å; D185-K288 HydrophobicContact CB-CB 4.47Å; D185-K288 HydrophobicContact CB-CD 3.8Å; K288-G290 PolarHBondContact O-N 3.09Å; K288-Q291 HydrophobicContact CB-CG 4.28Å; K288-Q291 PolarHBondContact O-N 3.05Å; K288-I292 PolarHBondContact O-N 2.04Å; K288-A310 HydrophobicContact CG-CB 4.04Å
289	V	98.6	Very high	98	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-42.1	178.7	176.2	0	0	0	0	112.1	F161 Y163 Q184 Q291 I292 F293 L309 D311 R315	F161-V289 HydrophobicContact CD2-CG1 4.02Å; F161-V289 HydrophobicContact CE2-CB 4.46Å; F161-V289 HydrophobicContact CE2-CG1 3.67Å; F161-V289 HydrophobicContact CZ-CG1 4.37Å; Y163-V289 HydrophobicContact CD2-CG1 4.34Å; Y163-V289 HydrophobicContact CE2-CG2 4.23Å; Q184-V289 HydrophobicContact CB-CB 4.15Å; Q184-V289 HydrophobicContact CG-CB 4.06Å; Q184-V289 HydrophobicContact CG-CG2 4.38Å; Q184-V289 VanDerWaalsContact OE1-CG2 3.31Å; V289-Q291 VanDerWaalsContact C-N 3.25Å; V289-Q291 PolarHBondContact O-N 2.89Å; V289-I292 WeakPolarHBondContact O-CG2 3.3Å; V289-I292 PolarHBondContact O-N 2.92Å; V289-F293 HydrophobicContact CG1-CD2 3.75Å; V289-F293 HydrophobicContact CG1-CE2 3.68Å; V289-F293 WeakPolarHBondContact O-CD2 3.45Å; V289-F293 PolarHBondContact O-N 3Å; V289-L309 HydrophobicContact CG2-CD1 3.97Å; V289-D311 HydrophobicContact CG2-CB 4.27Å; V289-D311 VanDerWaalsContact CG2-CG 3.45Å; V289-D311 WeakPolarHBondContact CG2-OD2 3.42Å; V289-R315 VanDerWaalsContact CG1-CZ 3.46Å; V289-R315 VanDerWaalsContact CG1-NH1 3.31Å
290	G	98.3	Very high	98	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58	-40.9	176.2	0	0	0	0	0	112	Q184 T254 K288 I292 F293 A294	Q184-G290 WeakPolarHBondContact O-CA 3.38Å; Q184-G290 PolarHBondContact O-N 2.89Å; T254-G290 WeakPolarHBondContact CG2-O 3.3Å; K288-G290 PolarHBondContact O-N 3.09Å; G290-I292 PolarHBondContact O-N 2.79Å; G290-F293 PolarHBondContact O-N 2.73Å; G290-F293 VanDerWaalsContact O-N 3.16Å; G290-A294 WeakPolarHBondContact O-CB 3.38Å; G290-A294 PolarHBondContact O-N 2.81Å
291	Q	98.5	Very high	97.9	Very high	13 Å²	13	43.4 Å²	43.4	6%	0.061	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-40.6	-178.9	-64.9	168.1	-17.1	0	0	112.9	D185 F257 F261 K288 V289 F293 A294 A295 F350	D185-Q291 HydrophobicContact CB-CG 4.45Å; F257-Q291 HydrophobicContact CD1-CB 4.37Å; F257-Q291 HydrophobicContact CD1-CG 4.33Å; F257-Q291 HydrophobicContact CE1-CB 4.37Å; F257-Q291 WeakPolarHBondContact CE1-O 3.28Å; F261-Q291 HydrophobicContact CD2-CB 4.04Å; K288-Q291 HydrophobicContact CB-CG 4.28Å; K288-Q291 PolarHBondContact O-N 3.05Å; V289-Q291 VanDerWaalsContact C-N 3.25Å; V289-Q291 PolarHBondContact O-N 2.89Å; Q291-F293 VanDerWaalsContact C-N 3.35Å; Q291-F293 PolarHBondContact O-N 2.93Å; Q291-A294 PolarHBondContact O-N 2.8Å; Q291-A295 VanDerWaalsContact O-CB 3.25Å; Q291-A295 WeakPolarHBondContact O-CB 3.46Å; Q291-A295 PolarHBondContact O-N 2.75Å; Q291-F350 VanDerWaalsContact CD-CG 3.47Å; Q291-F350 HydrophobicContact CG-CD2 4.27Å; Q291-F350 HydrophobicContact CG-CG 4.5Å
292	I	98.7	Very high	97.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.4	-36.6	175	-175.9	162.7	0	0	0	111.8	F261 K288 V289 G290 W296 L309 R315 P317 V332 Y348	F261-I292 HydrophobicContact CE1-CB 4.49Å; F261-I292 HydrophobicContact CE1-CG1 4.33Å; F261-I292 HydrophobicContact CE2-CB 3.72Å; F261-I292 HydrophobicContact CE2-CG1 4.36Å; F261-I292 HydrophobicContact CZ-CB 3.54Å; F261-I292 HydrophobicContact CZ-CD1 4.03Å; F261-I292 HydrophobicContact CZ-CG1 3.66Å; K288-I292 PolarHBondContact O-N 2.04Å; V289-I292 WeakPolarHBondContact O-CG2 3.3Å; V289-I292 PolarHBondContact O-N 2.92Å; G290-I292 PolarHBondContact O-N 2.79Å; I292-W296 WeakPolarHBondContact O-CB 3.26Å; I292-W296 PolarHBondContact O-N 2.85Å; I292-L309 HydrophobicContact CB-CD2 4.41Å; I292-L309 HydrophobicContact CD1-CD1 4.44Å; I292-L309 HydrophobicContact CG2-CD1 3.69Å; I292-L309 HydrophobicContact CG2-CD2 4.35Å; I292-R315 HydrophobicContact CD1-CB 4.2Å; I292-P317 HydrophobicContact CD1-CB 4.28Å; I292-P317 HydrophobicContact CD1-CG 4.02Å; I292-P317 HydrophobicContact CG1-CB 4.05Å; I292-P317 HydrophobicContact CG1-CG 4.07Å; I292-V332 HydrophobicContact CD1-CG1 4.02Å; I292-V332 HydrophobicContact CG1-CG1 4.05Å; I292-V332 HydrophobicContact CG1-CG2 4.34Å; I292-V332 HydrophobicContact CG2-CG1 4.24Å; I292-Y348 HydrophobicContact CD1-CD2 4.38Å; I292-Y348 HydrophobicContact CD1-CE2 4.32Å
293	F	98.6	Very high	97.9	Very high	18 Å²	18	39.6 Å²	39.6	8%	0.079	21%	0.21	C	C	.	.	H	α-helix	trans	-68.6	-44	176.4	-85.1	-78.3	0	0	0	111.9	V159 F161 V289 G290 Q291 W296 K297 V332	V159-F293 HydrophobicContact CG1-CB 3.87Å; F161-F293 HydrophobicContact CB-CB 4.39Å; F161-F293 HydrophobicContact CB-CD1 3.55Å; F161-F293 HydrophobicContact CB-CD2 3.55Å; F161-F293 HydrophobicContact CB-CE1 3.53Å; F161-F293 HydrophobicContact CB-CE2 3.54Å; F161-F293 HydrophobicContact CB-CG 3.57Å; F161-F293 HydrophobicContact CB-CZ 3.53Å; F161-F293 HydrophobicContact CD1-CB 4Å; F161-F293 AromaticContact CD1-CD2 3.92Å; F161-F293 HydrophobicContact CD1-CD2 3.92Å; F161-F293 AromaticContact CD1-CG 3.98Å; F161-F293 HydrophobicContact CD1-CG 3.98Å; F161-F293 AromaticContact CD2-CD2 3.66Å; F161-F293 HydrophobicContact CD2-CD2 3.66Å; F161-F293 AromaticContact CD2-CE2 3.64Å; F161-F293 HydrophobicContact CD2-CE2 3.64Å; F161-F293 HydrophobicContact CD2-CG 4.44Å; F161-F293 HydrophobicContact CD2-CZ 4.4Å; F161-F293 HydrophobicContact CE2-CD2 4.31Å; F161-F293 HydrophobicContact CE2-CE2 4.5Å; F161-F293 HydrophobicContact CG-CB 4.3Å; F161-F293 HydrophobicContact CG-CD1 4.27Å; F161-F293 AromaticContact CG-CD2 3.43Å; F161-F293 HydrophobicContact CG-CD2 3.43Å; F161-F293 VanDerWaalsContact CG-CD2 3.43Å; F161-F293 HydrophobicContact CG-CE1 4.47Å; F161-F293 AromaticContact CG-CE2 3.7Å; F161-F293 HydrophobicContact CG-CE2 3.7Å; F161-F293 AromaticContact CG-CG 3.76Å; F161-F293 HydrophobicContact CG-CG 3.76Å; F161-F293 HydrophobicContact CG-CZ 4.23Å; V289-F293 HydrophobicContact CG1-CD2 3.75Å; V289-F293 HydrophobicContact CG1-CE2 3.68Å; V289-F293 WeakPolarHBondContact O-CD2 3.45Å; V289-F293 PolarHBondContact O-N 3Å; G290-F293 PolarHBondContact O-N 2.73Å; G290-F293 VanDerWaalsContact O-N 3.16Å; Q291-F293 VanDerWaalsContact C-N 3.35Å; Q291-F293 PolarHBondContact O-N 2.93Å; F293-W296 HydrophobicContact CD1-CE3 4.11Å; F293-W296 HydrophobicContact CD1-CZ3 4.34Å; F293-W296 PolarHBondContact O-N 3.09Å; F293-K297 WeakPolarHBondContact O-CB 3.29Å; F293-K297 PolarHBondContact O-N 2.52Å; F293-V332 HydrophobicContact CD1-CB 4.04Å; F293-V332 HydrophobicContact CD1-CG2 3.57Å; F293-V332 HydrophobicContact CE1-CB 3.63Å; F293-V332 HydrophobicContact CE1-CG1 4.48Å; F293-V332 HydrophobicContact CE1-CG2 3.71Å; F293-V332 HydrophobicContact CE2-CB 4.34Å; F293-V332 HydrophobicContact CE2-CG1 4.35Å; F293-V332 HydrophobicContact CG-CG2 4Å; F293-V332 HydrophobicContact CZ-CB 3.79Å; F293-V332 HydrophobicContact CZ-CG1 4.2Å; F293-V332 HydrophobicContact CZ-CG2 4.24Å
294	A	98	Very high	97.9	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-61.1	-47.5	174.7	0	0	0	0	0	111.1	T254 S255 F257 G290 Q291 W296 K297 L298	T254-A294 HydrophobicContact CG2-CB 4.12Å; S255-A294 WeakPolarHBondContact O-CB 3.36Å; F257-A294 HydrophobicContact CD1-CB 3.78Å; F257-A294 HydrophobicContact CE1-CB 3.73Å; G290-A294 WeakPolarHBondContact O-CB 3.38Å; G290-A294 PolarHBondContact O-N 2.81Å; Q291-A294 PolarHBondContact O-N 2.8Å; A294-W296 PolarHBondContact O-N 3.03Å; A294-K297 PolarHBondContact O-N 2.84Å; A294-L298 HydrophobicContact CB-CD1 4.27Å; A294-L298 WeakPolarHBondContact O-CA 3.48Å; A294-L298 VanDerWaalsContact O-CB 3.25Å; A294-L298 WeakPolarHBondContact O-CB 3.33Å; A294-L298 PolarHBondContact O-N 2.82Å
295	A	98.3	Very high	97.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.9	-44.6	178	0	0	0	0	0	111.9	F257 F261 Q291 L299 G300 Y301	F257-A295 HydrophobicContact CE1-CB 4.16Å; F257-A295 HydrophobicContact CZ-CB 4.05Å; F261-A295 HydrophobicContact CB-CB 4Å; F261-A295 HydrophobicContact CD1-CB 3.39Å; F261-A295 HydrophobicContact CD2-CB 4.5Å; F261-A295 HydrophobicContact CE1-CB 3.96Å; F261-A295 HydrophobicContact CG-CB 3.71Å; Q291-A295 VanDerWaalsContact O-CB 3.25Å; Q291-A295 WeakPolarHBondContact O-CB 3.46Å; Q291-A295 PolarHBondContact O-N 2.75Å; A295-L299 CarbonylContact O-C 3.55Å; A295-L299 WeakPolarHBondContact O-CA 3.24Å; A295-L299 WeakPolarHBondContact O-CB 3.32Å; A295-L299 PolarHBondContact O-N 2.83Å; A295-G300 PolarHBondContact O-N 2.93Å; A295-G300 VanDerWaalsContact O-N 3.16Å; A295-Y301 HydrophobicContact CB-CG 4.36Å; A295-Y301 VanDerWaalsContact O-CB 3.27Å; A295-Y301 WeakPolarHBondContact O-CB 3.31Å; A295-Y301 PolarHBondContact O-N 3.21Å
296	W	98	Very high	97.8	Very high	35 Å²	35	36.2 Å²	36.2	13%	0.133	19%	0.188	C	C	.	.	H	α-helix	trans	-62.9	-48.8	178.1	164.9	70.4	0	0	0	112.8	V159 I292 F293 A294 G300 P317 I318 S319 A330 V332	V159-W296 HydrophobicContact CG2-CZ3 4.23Å; I292-W296 WeakPolarHBondContact O-CB 3.26Å; I292-W296 PolarHBondContact O-N 2.85Å; F293-W296 HydrophobicContact CD1-CE3 4.11Å; F293-W296 HydrophobicContact CD1-CZ3 4.34Å; F293-W296 PolarHBondContact O-N 3.09Å; A294-W296 PolarHBondContact O-N 3.03Å; W296-G300 WeakPolarHBondContact O-CA 3.38Å; W296-G300 PolarHBondContact O-N 3.12Å; W296-P317 HydrophobicContact CB-CB 3.81Å; W296-P317 HydrophobicContact CG-CB 4.17Å; W296-I318 PolarHBondContact NE1-O 3.49Å; W296-S319 PolarHBondContact O-OG 2.75Å; W296-S319 VanDerWaalsContact O-OG 3.09Å; W296-A330 VanDerWaalsContact CZ2-C 3.46Å; W296-A330 HydrophobicContact CZ2-CB 4.11Å; W296-A330 VanDerWaalsContact CZ2-O 3.28Å; W296-A330 WeakPolarHBondContact CZ2-O 3.34Å; W296-V332 HydrophobicContact CB-CG2 3.75Å; W296-V332 HydrophobicContact CD2-CG2 3.85Å; W296-V332 HydrophobicContact CE3-CG2 3.95Å; W296-V332 HydrophobicContact CG-CG2 3.74Å
297	K	96.9	Very high	97.8	Very high	110 Å²	110	35.1 Å²	35.1	48%	0.478	18%	0.183	S	C	.	.	H	α-helix	trans	-82.2	-43	-171.7	-173	63.1	173.9	-175.7	0	112.9	V159 F293 A294	V159-K297 HydrophobicContact CB-CB 3.94Å; V159-K297 HydrophobicContact CB-CG 3.93Å; V159-K297 HydrophobicContact CG1-CB 4.38Å; V159-K297 HydrophobicContact CG2-CB 3.87Å; V159-K297 HydrophobicContact CG2-CG 3.87Å; F293-K297 WeakPolarHBondContact O-CB 3.29Å; F293-K297 PolarHBondContact O-N 2.52Å; A294-K297 PolarHBondContact O-N 2.84Å
298	L	95.9	Very high	97.8	Very high	42 Å²	42	35.1 Å²	35.1	22%	0.22	18%	0.183	C	C	.	.	H	α-helix	trans	-97.1	-32	-169.2	-51.2	175.4	0	0	0	111.8	Q157 N256 A294	Q157-L298 HydrophobicContact CG-CD2 4.15Å; N256-L298 WeakPolarHBondContact OD1-CD1 3.3Å; A294-L298 HydrophobicContact CB-CD1 4.27Å; A294-L298 WeakPolarHBondContact O-CA 3.48Å; A294-L298 VanDerWaalsContact O-CB 3.25Å; A294-L298 WeakPolarHBondContact O-CB 3.33Å; A294-L298 PolarHBondContact O-N 2.82Å
299	L	96.3	Very high	97.8	Very high	110 Å²	110	32 Å²	32	58%	0.576	17%	0.169	S	C	*	.	S	Bend	trans	-105.9	-1.6	-179.8	-49	-180	0	0	0	113.3	F257 A295 Y301	F257-L299 HydrophobicContact CE2-CD1 3.98Å; F257-L299 HydrophobicContact CZ-CD1 3.67Å; A295-L299 CarbonylContact O-C 3.55Å; A295-L299 WeakPolarHBondContact O-CA 3.24Å; A295-L299 WeakPolarHBondContact O-CB 3.32Å; A295-L299 PolarHBondContact O-N 2.83Å; L299-Y301 PolarHBondContact O-N 3.16Å
300	G	97.3	Very high	97.8	Very high	43 Å²	43	33.4 Å²	33.4	44%	0.443	18%	0.18	S	C	.	.			trans	64	25.6	-179	0	0	0	0	0	113.9	A295 W296 D302 S319	A295-G300 PolarHBondContact O-N 2.93Å; A295-G300 VanDerWaalsContact O-N 3.16Å; W296-G300 WeakPolarHBondContact O-CA 3.38Å; W296-G300 PolarHBondContact O-N 3.12Å; G300-D302 PolarHBondContact O-N 2.95Å; G300-S319 PolarHBondContact O-OG 3.16Å
301	Y	98.2	Very high	97.8	Very high	55 Å²	55	34.5 Å²	34.5	22%	0.216	19%	0.186	C	C	.	.			trans	-65.4	122.9	-176.7	-171.6	-82.3	0	0	0	111.1	F261 Y263 A295 L299 R303 P317 S319 Y348	F261-Y301 HydrophobicContact CD1-CD1 4.17Å; F261-Y301 HydrophobicContact CD1-CD2 4.15Å; F261-Y301 HydrophobicContact CD1-CE1 4.25Å; F261-Y301 HydrophobicContact CD1-CE2 4.21Å; F261-Y301 HydrophobicContact CD1-CG 4.13Å; F261-Y301 AromaticContact CE1-CD1 3.77Å; F261-Y301 HydrophobicContact CE1-CD1 3.77Å; F261-Y301 AromaticContact CE1-CE1 3.72Å; F261-Y301 HydrophobicContact CE1-CE1 3.72Å; F261-Y301 HydrophobicContact CE1-CE2 4.47Å; F261-Y301 HydrophobicContact CE1-CG 4.19Å; Y263-Y301 WeakPolarHBondContact CB-OH 3.47Å; Y263-Y301 PolarHBondContact N-OH 3.24Å; A295-Y301 HydrophobicContact CB-CG 4.36Å; A295-Y301 VanDerWaalsContact O-CB 3.27Å; A295-Y301 WeakPolarHBondContact O-CB 3.31Å; A295-Y301 PolarHBondContact O-N 3.21Å; L299-Y301 PolarHBondContact O-N 3.16Å; Y301-R303 HydrophobicContact CD1-CB 4.47Å; Y301-R303 HydrophobicContact CE1-CB 3.67Å; Y301-P317 HydrophobicContact CD1-CB 4.48Å; Y301-P317 HydrophobicContact CD1-CG 3.52Å; Y301-P317 HydrophobicContact CE1-CG 3.86Å; Y301-S319 PolarHBondContact O-OG 3.3Å; Y301-S319 VanDerWaalsContact O-OG 3.07Å; Y301-Y348 AromaticContact CE1-CE1 3.9Å; Y301-Y348 HydrophobicContact CE1-CE1 3.9Å
302	D	97.8	Very high	97.7	Very high	46 Å²	46	33.9 Å²	33.9	25%	0.246	18%	0.184	C	C	.	.			trans	-128	121.7	-174	-175.2	-70	0	0	0	110.8	G300 S319 R320 R322	G300-D302 PolarHBondContact O-N 2.95Å; D302-S319 PolarHBondContact OD2-N 3.16Å; D302-R320 PolarHBondContact OD2-N 3.31Å; D302-R322 VanDerWaalsContact CG-NH1 3.25Å; D302-R322 IonicContact OD1-CZ 2.72Å; D302-R322 IonicContact OD1-NH1 3.14Å; D302-R322 PolarHBondContact OD1-NH1 2.87Å; D302-R322 IonicContact OD1-NH2 3Å; D302-R322 PolarHBondContact OD1-NH2 2.87Å; D302-R322 IonicContact OD2-NH1 3.9Å; D302-R322 PolarHBondContact OD2-NH1 3.5Å
303	R	97.3	Very high	97.7	Very high	76 Å²	76	33.9 Å²	33.9	29%	0.287	18%	0.184	S	C	.	.			trans	-152.3	122.8	179.5	-170.7	83.8	-168.7	-167.7	3.1	110.5	Y263 Y301 D305 P317 Y348	Y263-R303 HydrophobicContact CD2-CG 4.45Å; Y263-R303 HydrophobicContact CG-CG 4.4Å; Y301-R303 HydrophobicContact CD1-CB 4.47Å; Y301-R303 HydrophobicContact CE1-CB 3.67Å; R303-D305 VanDerWaalsContact C-N 3.26Å; R303-D305 HydrophobicContact CG-CB 4.03Å; R303-D305 IonicContact CZ-OD2 3.16Å; R303-D305 IonicContact NE-OD2 2.89Å; R303-D305 PolarHBondContact NE-OD2 2.82Å; R303-D305 IonicContact NH2-OD2 2.8Å; R303-D305 PolarHBondContact NH2-OD2 3.48Å; R303-D305 PolarHBondContact O-N 2.95Å; R303-P317 CarbonylContact C-O 3.58Å; R303-P317 HydrophobicContact CB-CG 4.36Å; R303-P317 PolarHBondContact N-O 3.01Å; R303-Y348 HydrophobicContact CB-CE1 4.38Å; R303-Y348 HydrophobicContact CG-CE1 4.38Å; R303-Y348 WeakPolarHBondContact CG-OH 3.49Å
304	C	96.3	Very high	97.7	Very high	48 Å²	48	33 Å²	33	32%	0.324	18%	0.18	S	C	.	.			trans	-93.2	42	177.9	-172.4	0	0	0	0	112.5	I318 C325	C304-I318 HydrophobicContact CB-CD1 3.9Å; C304-C325 HydrophobicContact CB-CB 3.79Å; C304-C325 WeakPolarHBondContact CB-SG 3.4Å; C304-C325 VanDerWaalsContact SG-CA 3.54Å; C304-C325 WeakPolarHBondContact SG-CB 3.46Å; C304-C325 CovalentContact SG-SG 2.01Å; C304-C325 PolarHBondContact SG-SG 3.32Å
305	D	97.2	Very high	97.8	Very high	49 Å²	49	33.5 Å²	33.5	26%	0.262	18%	0.182	S	C	.	.			trans	-126.9	120.1	177.5	-74.2	-69.7	0	0	0	109.5	Y263 R303 G307 Y316 Y348	Y263-D305 HydrophobicContact CD2-CB 4.31Å; Y263-D305 HydrophobicContact CE1-CB 4.35Å; Y263-D305 HydrophobicContact CE2-CB 3.64Å; R303-D305 VanDerWaalsContact C-N 3.26Å; R303-D305 HydrophobicContact CG-CB 4.03Å; R303-D305 IonicContact CZ-OD2 3.16Å; R303-D305 IonicContact NE-OD2 2.89Å; R303-D305 PolarHBondContact NE-OD2 2.82Å; R303-D305 IonicContact NH2-OD2 2.8Å; R303-D305 PolarHBondContact NH2-OD2 3.48Å; R303-D305 PolarHBondContact O-N 2.95Å; D305-G307 PolarHBondContact O-N 2.86Å; D305-Y316 VanDerWaalsContact O-CB 3.26Å; D305-Y316 WeakPolarHBondContact O-CB 3.11Å; D305-Y348 PolarHBondContact O-OH 2.92Å
306	A	97.9	Very high	97.8	Very high	27 Å²	27	35.9 Å²	35.9	22%	0.223	19%	0.191	C	C	.	.			trans	-63	130.9	172.2	0	0	0	0	0	110.5	V314 Y316 V335 Y345 G346	A306-V314 HydrophobicContact CB-CG1 3.69Å; A306-Y316 HydrophobicContact CB-CD1 4.3Å; A306-V335 HydrophobicContact CB-CG2 4.21Å; A306-Y345 HydrophobicContact CB-CD1 3.86Å; A306-Y345 HydrophobicContact CB-CE1 4.25Å; A306-G346 PolarHBondContact O-N 2.9Å; A306-G346 VanDerWaalsContact O-N 3.12Å
307	G	98.5	Very high	97.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	152.8	179.1	0	0	0	0	0	113.1	D305 V314 R315 G346	D305-G307 PolarHBondContact O-N 2.86Å; G307-V314 WeakPolarHBondContact O-CA 3.24Å; G307-R315 PolarHBondContact N-O 2.84Å; G307-R315 PolarHBondContact O-N 2.93Å; G307-G346 CarbonylContact C-O 3.21Å; G307-G346 WeakPolarHBondContact CA-O 3.23Å
308	W	98.8	Very high	97.8	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	145.5	174.9	-66	113.3	0	0	0	112	L270 Y272 A275 I286 G312 V314 P338 K343 Y345 G346 V347 Y348	L270-W308 PolarHBondContact O-NE1 3.45Å; Y272-W308 HydrophobicContact CD2-CB 4.47Å; Y272-W308 HydrophobicContact CD2-CD2 4.09Å; Y272-W308 AromaticContact CD2-CE3 3.84Å; Y272-W308 HydrophobicContact CD2-CE3 3.84Å; Y272-W308 HydrophobicContact CD2-CG 4.41Å; Y272-W308 HydrophobicContact CD2-CZ3 4.34Å; A275-W308 HydrophobicContact CB-CB 4.19Å; A275-W308 HydrophobicContact CB-CG 4.15Å; I286-W308 HydrophobicContact CD1-CB 4.01Å; W308-G312 WeakPolarHBondContact CZ3-O 3.48Å; W308-V314 HydrophobicContact CD2-CG2 3.75Å; W308-V314 HydrophobicContact CE3-CG2 3.37Å; W308-V314 HydrophobicContact CG-CG2 4.46Å; W308-V314 HydrophobicContact CH2-CG2 4.19Å; W308-V314 HydrophobicContact CZ2-CG2 4.47Å; W308-V314 HydrophobicContact CZ3-CG2 3.62Å; W308-P338 HydrophobicContact CH2-CB 4.19Å; W308-P338 HydrophobicContact CH2-CG 3.57Å; W308-P338 HydrophobicContact CZ2-CG 4.4Å; W308-P338 HydrophobicContact CZ3-CG 3.71Å; W308-K343 HydrophobicContact CZ2-CB 4.5Å; W308-K343 WeakPolarHBondContact CZ2-O 3.45Å; W308-Y345 HydrophobicContact CD2-CD2 4.48Å; W308-Y345 AromaticContact CE2-CD2 3.79Å; W308-Y345 HydrophobicContact CH2-CD2 4.35Å; W308-Y345 AromaticContact CZ2-CD2 3.73Å; W308-Y345 HydrophobicContact CZ2-CD2 3.73Å; W308-Y345 HydrophobicContact CZ2-CE2 4.32Å; W308-G346 VanDerWaalsContact CD1-O 3.25Å; W308-G346 PolarHBondContact N-O 2.8Å; W308-V347 HydrophobicContact CB-CG2 4.37Å; W308-Y348 PolarHBondContact O-N 2.82Å
309	L	98.8	Very high	97.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.161	C	C	.	.			trans	-123.8	166.5	168.3	-64.7	174.1	0	0	0	110.1	Y272 A287 V289 I292 D311 G312 S313 R315 Y348	Y272-L309 WeakPolarHBondContact CE2-O 3.38Å; A287-L309 HydrophobicContact CB-CD2 4.06Å; A287-L309 CarbonylContact O-C 3.37Å; A287-L309 WeakPolarHBondContact O-CA 3.41Å; A287-L309 WeakPolarHBondContact O-CB 3.43Å; A287-L309 WeakPolarHBondContact O-CD2 3.02Å; V289-L309 HydrophobicContact CG2-CD1 3.97Å; I292-L309 HydrophobicContact CB-CD2 4.41Å; I292-L309 HydrophobicContact CD1-CD1 4.44Å; I292-L309 HydrophobicContact CG2-CD1 3.69Å; I292-L309 HydrophobicContact CG2-CD2 4.35Å; L309-D311 PolarHBondContact O-N 3.19Å; L309-G312 WeakPolarHBondContact O-CA 3.13Å; L309-G312 PolarHBondContact O-N 2.81Å; L309-S313 PolarHBondContact N-O 3.07Å; L309-R315 HydrophobicContact CD1-CB 3.87Å; L309-R315 HydrophobicContact CD1-CG 3.71Å; L309-Y348 HydrophobicContact CD2-CD2 4.31Å; L309-Y348 HydrophobicContact CD2-CG 4.4Å
310	A	98.3	Very high	97.8	Very high	28 Å²	28	32.4 Å²	32.4	23%	0.231	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.8	-174.4	0	0	0	0	0	114.7	Y272 I286 A287 K288 G312	Y272-A310 PolarHBondContact OH-O 2.79Å; I286-A310 HydrophobicContact CG2-CB 3.85Å; A287-A310 PolarHBondContact O-N 2.86Å; K288-A310 HydrophobicContact CG-CB 4.04Å; A310-G312 PolarHBondContact O-N 3.15Å
311	D	97.8	Very high	97.7	Very high	23 Å²	23	33.4 Å²	33.4	12%	0.123	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-3.9	175.6	69.8	-18.6	0	0	0	113	Y163 V289 L309 S313 R315	Y163-D311 HydrophobicContact CE2-CB 4.48Å; V289-D311 HydrophobicContact CG2-CB 4.27Å; V289-D311 VanDerWaalsContact CG2-CG 3.45Å; V289-D311 WeakPolarHBondContact CG2-OD2 3.42Å; L309-D311 PolarHBondContact O-N 3.19Å; D311-S313 WeakPolarHBondContact OD1-CA 3.24Å; D311-S313 WeakPolarHBondContact OD1-CB 3.34Å; D311-S313 PolarHBondContact OD1-N 3.43Å; D311-S313 PolarHBondContact OD1-OG 2.84Å; D311-S313 WeakPolarHBondContact OD2-CB 3.38Å; D311-S313 PolarHBondContact OD2-OG 3.28Å; D311-R315 IonicContact OD2-NH2 2.69Å; D311-R315 PolarHBondContact OD2-NH2 2.97Å; D311-R315 VanDerWaalsContact OD2-NH2 3.07Å
312	G	97.9	Very high	97.6	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.01	17%	0.173	C	C	.	.	S	Bend	trans	75.4	11.8	-172.3	0	0	0	0	0	113.6	W308 L309 A310	W308-G312 WeakPolarHBondContact CZ3-O 3.48Å; L309-G312 WeakPolarHBondContact O-CA 3.13Å; L309-G312 PolarHBondContact O-N 2.81Å; A310-G312 PolarHBondContact O-N 3.15Å
313	S	98.4	Very high	97.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.204	C	C	.	.			trans	-79.6	160.2	166.9	71.1	0	0	0	0	110.8	L309 D311 R315 G336	L309-S313 PolarHBondContact N-O 3.07Å; D311-S313 WeakPolarHBondContact OD1-CA 3.24Å; D311-S313 WeakPolarHBondContact OD1-CB 3.34Å; D311-S313 PolarHBondContact OD1-N 3.43Å; D311-S313 PolarHBondContact OD1-OG 2.84Å; D311-S313 WeakPolarHBondContact OD2-CB 3.38Å; D311-S313 PolarHBondContact OD2-OG 3.28Å; S313-R315 PolarHBondContact OG-NE 3.14Å; S313-G336 WeakPolarHBondContact CA-O 3.5Å
314	V	98.6	Very high	97	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.4	169.1	175.3	0	0	0	0	108.8	A306 G307 W308 V335 G336 P338 Y345	A306-V314 HydrophobicContact CB-CG1 3.69Å; G307-V314 WeakPolarHBondContact O-CA 3.24Å; W308-V314 HydrophobicContact CD2-CG2 3.75Å; W308-V314 HydrophobicContact CE3-CG2 3.37Å; W308-V314 HydrophobicContact CG-CG2 4.46Å; W308-V314 HydrophobicContact CH2-CG2 4.19Å; W308-V314 HydrophobicContact CZ2-CG2 4.47Å; W308-V314 HydrophobicContact CZ3-CG2 3.62Å; V314-V335 HydrophobicContact CB-CB 4.11Å; V314-V335 HydrophobicContact CG1-CB 3.96Å; V314-V335 HydrophobicContact CG1-CG1 4.4Å; V314-V335 HydrophobicContact CG1-CG2 4Å; V314-V335 WeakPolarHBondContact O-CB 3.46Å; V314-V335 PolarHBondContact O-N 3.39Å; V314-G336 PolarHBondContact N-O 2.67Å; V314-P338 HydrophobicContact CB-CG 4.18Å; V314-P338 HydrophobicContact CG2-CG 3.44Å; V314-P338 VanDerWaalsContact CG2-CG 3.44Å; V314-Y345 HydrophobicContact CG1-CD1 3.7Å; V314-Y345 HydrophobicContact CG1-CD2 4.37Å; V314-Y345 HydrophobicContact CG1-CE1 3.93Å; V314-Y345 HydrophobicContact CG1-CG 3.92Å; V314-Y345 HydrophobicContact CG2-CD1 4.45Å; V314-Y345 HydrophobicContact CG2-CD2 3.63Å; V314-Y345 HydrophobicContact CG2-CE2 3.87Å; V314-Y345 HydrophobicContact CG2-CG 3.92Å
315	R	98.6	Very high	96.8	Very high	11 Å²	11	50.6 Å²	50.6	4%	0.042	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	167.2	-178	-52.1	-170.5	-165.3	-149.2	2.3	111.3	V289 I292 G307 L309 D311 S313 V332 R333 F334 Y348	V289-R315 VanDerWaalsContact CG1-CZ 3.46Å; V289-R315 VanDerWaalsContact CG1-NH1 3.31Å; I292-R315 HydrophobicContact CD1-CB 4.2Å; G307-R315 PolarHBondContact N-O 2.84Å; G307-R315 PolarHBondContact O-N 2.93Å; L309-R315 HydrophobicContact CD1-CB 3.87Å; L309-R315 HydrophobicContact CD1-CG 3.71Å; D311-R315 IonicContact OD2-NH2 2.69Å; D311-R315 PolarHBondContact OD2-NH2 2.97Å; D311-R315 VanDerWaalsContact OD2-NH2 3.07Å; S313-R315 PolarHBondContact OG-NE 3.14Å; R315-V332 HydrophobicContact CB-CG1 4.03Å; R315-R333 CarbonylContact C-O 3.5Å; R315-R333 WeakPolarHBondContact CA-O 3.43Å; R315-R333 WeakPolarHBondContact CB-O 3.5Å; R315-F334 HydrophobicContact CG-CD2 4.19Å; R315-Y348 WeakPolarHBondContact O-CE2 3.43Å
316	Y	98.3	Very high	96.6	Very high	50 Å²	50	48.3 Å²	48.3	20%	0.196	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	138.6	167.7	61.3	-86.5	0	0	0	111.3	D305 A306 I318 C325 R333 V335	D305-Y316 VanDerWaalsContact O-CB 3.26Å; D305-Y316 WeakPolarHBondContact O-CB 3.11Å; A306-Y316 HydrophobicContact CB-CD1 4.3Å; Y316-I318 HydrophobicContact CD2-CD1 4.06Å; Y316-I318 HydrophobicContact CD2-CG1 3.88Å; Y316-I318 HydrophobicContact CE2-CD1 4.31Å; Y316-I318 HydrophobicContact CE2-CG1 3.9Å; Y316-C325 PolarHBondContact OH-O 3.07Å; Y316-R333 HydrophobicContact CD1-CB 3.97Å; Y316-R333 HydrophobicContact CD2-CB 4.02Å; Y316-R333 HydrophobicContact CD2-CG 4.28Å; Y316-R333 HydrophobicContact CE1-CB 3.53Å; Y316-R333 HydrophobicContact CE1-CG 4.36Å; Y316-R333 HydrophobicContact CE2-CB 3.58Å; Y316-R333 HydrophobicContact CE2-CG 3.58Å; Y316-R333 HydrophobicContact CG-CB 4.2Å; Y316-R333 PolarHBondContact N-O 3.04Å; Y316-R333 PolarHBondContact O-N 2.81Å; Y316-V335 HydrophobicContact CD1-CG2 3.95Å; Y316-V335 HydrophobicContact CE1-CG2 3.85Å
317	P	98	Very high	96.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.4	-177.3	34.8	-30	0	0	0	112.3	I292 W296 Y301 R303 V332 Y348	I292-P317 HydrophobicContact CD1-CB 4.28Å; I292-P317 HydrophobicContact CD1-CG 4.02Å; I292-P317 HydrophobicContact CG1-CB 4.05Å; I292-P317 HydrophobicContact CG1-CG 4.07Å; W296-P317 HydrophobicContact CB-CB 3.81Å; W296-P317 HydrophobicContact CG-CB 4.17Å; Y301-P317 HydrophobicContact CD1-CB 4.48Å; Y301-P317 HydrophobicContact CD1-CG 3.52Å; Y301-P317 HydrophobicContact CE1-CG 3.86Å; R303-P317 CarbonylContact C-O 3.58Å; R303-P317 HydrophobicContact CB-CG 4.36Å; R303-P317 PolarHBondContact N-O 3.01Å; P317-V332 HydrophobicContact CB-CG2 4.3Å; P317-Y348 VanDerWaalsContact CD-OH 3.24Å; P317-Y348 WeakPolarHBondContact CD-OH 3.37Å; P317-Y348 HydrophobicContact CG-CE1 4.48Å
318	I	98	Very high	95.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	111.3	171.8	-57.7	-63.8	0	0	0	109.1	W296 C304 Y316 R320 C325 A330 A331	W296-I318 PolarHBondContact NE1-O 3.49Å; C304-I318 HydrophobicContact CB-CD1 3.9Å; Y316-I318 HydrophobicContact CD2-CD1 4.06Å; Y316-I318 HydrophobicContact CD2-CG1 3.88Å; Y316-I318 HydrophobicContact CE2-CD1 4.31Å; Y316-I318 HydrophobicContact CE2-CG1 3.9Å; I318-R320 VanDerWaalsContact CG2-O 3.3Å; I318-R320 WeakPolarHBondContact CG2-O 3.41Å; I318-C325 HydrophobicContact CD1-CB 3.61Å; I318-C325 HydrophobicContact CG1-CB 4.1Å; I318-A330 CarbonylContact O-C 3.45Å; I318-A330 WeakPolarHBondContact O-CA 3.46Å; I318-A330 WeakPolarHBondContact O-CB 3.21Å; I318-A331 PolarHBondContact N-O 3.48Å; I318-A331 PolarHBondContact O-N 3.45Å
319	S	96.7	Very high	95.5	Very high	29 Å²	29	60.7 Å²	60.7	20%	0.203	28%	0.28	C	S	.	.	S	Bend	trans	-92.3	-22.9	173.2	-54.8	0	0	0	0	111.6	W296 G300 Y301 D302	W296-S319 PolarHBondContact O-OG 2.75Å; W296-S319 VanDerWaalsContact O-OG 3.09Å; G300-S319 PolarHBondContact O-OG 3.16Å; Y301-S319 PolarHBondContact O-OG 3.3Å; Y301-S319 VanDerWaalsContact O-OG 3.07Å; D302-S319 PolarHBondContact OD2-N 3.16Å
320	R	95.8	Very high	95.3	Very high	195 Å²	195	62.9 Å²	62.9	74%	0.736	30%	0.298	S	S	*	.	S	Bend	trans	-119.2	100.2	177.9	-62.4	-176.4	-171.5	173.6	2.9	110.6	D302 I318 R322	D302-R320 PolarHBondContact OD2-N 3.31Å; I318-R320 VanDerWaalsContact CG2-O 3.3Å; I318-R320 WeakPolarHBondContact CG2-O 3.41Å; R320-R322 PolarHBondContact O-N 3.44Å; R320-R322 PolarHBondContact O-NH1 3.24Å
321	P	95.3	Very high	95.2	Very high	63 Å²	63	62.6 Å²	62.6	41%	0.409	30%	0.295	S	S	.	.			trans	-53.1	136.7	-179.1	-26.7	34.9	0	0	0	112.9	S326 A330	P321-S326 CarbonylContact C-O 3.52Å; P321-S326 WeakPolarHBondContact CA-O 3.28Å; P321-S326 WeakPolarHBondContact CB-O 3.43Å; P321-A330 HydrophobicContact CG-CB 4.45Å
322	R	95.3	Very high	95.2	Very high	91 Å²	91	62.3 Å²	62.3	34%	0.343	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-160.7	149.5	179	59.9	-172.1	177	-90.4	11.2	112.2	D302 R320 R324 C325 S326	D302-R322 VanDerWaalsContact CG-NH1 3.25Å; D302-R322 IonicContact OD1-CZ 2.72Å; D302-R322 IonicContact OD1-NH1 3.14Å; D302-R322 PolarHBondContact OD1-NH1 2.87Å; D302-R322 IonicContact OD1-NH2 3Å; D302-R322 PolarHBondContact OD1-NH2 2.87Å; D302-R322 IonicContact OD2-NH1 3.9Å; D302-R322 PolarHBondContact OD2-NH1 3.5Å; R320-R322 PolarHBondContact O-N 3.44Å; R320-R322 PolarHBondContact O-NH1 3.24Å; R322-R324 PolarHBondContact O-N 2.91Å; R322-R324 VanDerWaalsContact O-N 3.15Å; R322-C325 HydrophobicContact CG-CB 3.9Å; R322-C325 PolarHBondContact NE-SG 3.32Å; R322-C325 VanDerWaalsContact NE-SG 3.4Å; R322-C325 PolarHBondContact O-N 3.17Å; R322-S326 PolarHBondContact N-O 2.69Å; R322-S326 CarbonylContact O-C 3.37Å; R322-S326 PolarHBondContact O-N 3.45Å
323	R	90.5	Very high	95.1	Very high	235 Å²	235	65.4 Å²	65.4	89%	0.887	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-44.5	-167.9	-70.5	-173.3	179.3	-178.9	0.1	115.9	C325	R323-C325 VanDerWaalsContact C-N 3.31Å; R323-C325 PolarHBondContact O-N 3.35Å
324	R	91.3	Very high	95.1	Very high	247 Å²	247	69 Å²	69	93%	0.932	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-3.7	-174.5	-66.8	-173.4	-177.4	178.7	1.2	114.7	R322	R322-R324 PolarHBondContact O-N 2.91Å; R322-R324 VanDerWaalsContact O-N 3.15Å
325	C	92.8	Very high	95	Very high	14 Å²	14	72.4 Å²	72.4	10%	0.095	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	-59.8	-168.2	-54.6	0	0	0	0	111.3	C304 Y316 I318 R322 R323	C304-C325 HydrophobicContact CB-CB 3.79Å; C304-C325 WeakPolarHBondContact CB-SG 3.4Å; C304-C325 VanDerWaalsContact SG-CA 3.54Å; C304-C325 WeakPolarHBondContact SG-CB 3.46Å; C304-C325 CovalentContact SG-SG 2.01Å; C304-C325 PolarHBondContact SG-SG 3.32Å; Y316-C325 PolarHBondContact OH-O 3.07Å; I318-C325 HydrophobicContact CD1-CB 3.61Å; I318-C325 HydrophobicContact CG1-CB 4.1Å; R322-C325 HydrophobicContact CG-CB 3.9Å; R322-C325 PolarHBondContact NE-SG 3.32Å; R322-C325 VanDerWaalsContact NE-SG 3.4Å; R322-C325 PolarHBondContact O-N 3.17Å; R323-C325 VanDerWaalsContact C-N 3.31Å; R323-C325 PolarHBondContact O-N 3.35Å
326	S	92.9	Very high	94.9	Very high	1 Å²	1	72.6 Å²	72.6	1%	0.007	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-155.6	94	178.8	-174.6	0	0	0	0	107.1	P321 R322 T328 E329 R333	P321-S326 CarbonylContact C-O 3.52Å; P321-S326 WeakPolarHBondContact CA-O 3.28Å; P321-S326 WeakPolarHBondContact CB-O 3.43Å; R322-S326 PolarHBondContact N-O 2.69Å; R322-S326 CarbonylContact O-C 3.37Å; R322-S326 PolarHBondContact O-N 3.45Å; S326-T328 VanDerWaalsContact C-N 3.3Å; S326-T328 PolarHBondContact O-N 2.85Å; S326-E329 WeakPolarHBondContact CB-O 3.48Å; S326-E329 PolarHBondContact OG-O 2.92Å; S326-R333 VanDerWaalsContact OG-CZ 3.3Å; S326-R333 PolarHBondContact OG-NE 2.88Å; S326-R333 VanDerWaalsContact OG-NE 3.08Å; S326-R333 PolarHBondContact OG-NH2 3.08Å
327	P	91.2	Very high	94.8	Very high	86 Å²	86	72.3 Å²	72.3	56%	0.558	35%	0.347	S	S	*	.	S	Bend	trans	-61.6	-35.1	-167.8	-25.5	33.2	0	0	0	114.4
328	T	89.8	Confident	94.8	Very high	112 Å²	112	73.4 Å²	73.4	69%	0.687	35%	0.354	S	S	*	.	S	Bend	trans	-119.4	-21.1	-165.2	49.3	0	0	0	0	114.7	S326	S326-T328 VanDerWaalsContact C-N 3.3Å; S326-T328 PolarHBondContact O-N 2.85Å
329	E	91.9	Very high	94.7	Very high	89 Å²	89	77.2 Å²	77.2	42%	0.416	38%	0.375	S	S	.	.			trans	-137.4	140.8	-165.7	-68.8	166.2	173.9	0	0	112.2	S326 R333	S326-E329 WeakPolarHBondContact CB-O 3.48Å; S326-E329 PolarHBondContact OG-O 2.92Å; E329-R333 IonicContact OE2-CZ 2.66Å; E329-R333 IonicContact OE2-NH1 3.89Å; E329-R333 IonicContact OE2-NH2 2.74Å; E329-R333 PolarHBondContact OE2-NH2 3.02Å
330	A	95	Very high	94.7	Very high	46 Å²	46	78.6 Å²	78.6	38%	0.38	38%	0.377	S	S	.	.			trans	-80	122.3	164.5	0	0	0	0	0	107.4	W296 I318 P321	W296-A330 VanDerWaalsContact CZ2-C 3.46Å; W296-A330 HydrophobicContact CZ2-CB 4.11Å; W296-A330 VanDerWaalsContact CZ2-O 3.28Å; W296-A330 WeakPolarHBondContact CZ2-O 3.34Å; I318-A330 CarbonylContact O-C 3.45Å; I318-A330 WeakPolarHBondContact O-CA 3.46Å; I318-A330 WeakPolarHBondContact O-CB 3.21Å; P321-A330 HydrophobicContact CG-CB 4.45Å
331	A	95.3	Very high	94.6	Very high	21 Å²	21	76.7 Å²	76.7	17%	0.174	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	156.5	-178	0	0	0	0	0	111.5	I318 R333	I318-A331 PolarHBondContact N-O 3.48Å; I318-A331 PolarHBondContact O-N 3.45Å; A331-R333 PolarHBondContact O-N 3.2Å
332	V	97.6	Very high	94.3	Very high	17 Å²	17	80.4 Å²	80.4	10%	0.103	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	109	158	-177.2	0	0	0	0	107.8	I292 F293 W296 R315 P317	I292-V332 HydrophobicContact CD1-CG1 4.02Å; I292-V332 HydrophobicContact CG1-CG1 4.05Å; I292-V332 HydrophobicContact CG1-CG2 4.34Å; I292-V332 HydrophobicContact CG2-CG1 4.24Å; F293-V332 HydrophobicContact CD1-CB 4.04Å; F293-V332 HydrophobicContact CD1-CG2 3.57Å; F293-V332 HydrophobicContact CE1-CB 3.63Å; F293-V332 HydrophobicContact CE1-CG1 4.48Å; F293-V332 HydrophobicContact CE1-CG2 3.71Å; F293-V332 HydrophobicContact CE2-CB 4.34Å; F293-V332 HydrophobicContact CE2-CG1 4.35Å; F293-V332 HydrophobicContact CG-CG2 4Å; F293-V332 HydrophobicContact CZ-CB 3.79Å; F293-V332 HydrophobicContact CZ-CG1 4.2Å; F293-V332 HydrophobicContact CZ-CG2 4.24Å; W296-V332 HydrophobicContact CB-CG2 3.75Å; W296-V332 HydrophobicContact CD2-CG2 3.85Å; W296-V332 HydrophobicContact CE3-CG2 3.95Å; W296-V332 HydrophobicContact CG-CG2 3.74Å; R315-V332 HydrophobicContact CB-CG1 4.03Å; P317-V332 HydrophobicContact CB-CG2 4.3Å
333	R	96.9	Very high	94.1	Very high	66 Å²	66	81.4 Å²	81.4	25%	0.249	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	129.4	-179	-65.9	-64.3	-173.9	-169.5	-1.8	110	R315 Y316 S326 E329 A331	R315-R333 CarbonylContact C-O 3.5Å; R315-R333 WeakPolarHBondContact CA-O 3.43Å; R315-R333 WeakPolarHBondContact CB-O 3.5Å; Y316-R333 HydrophobicContact CD1-CB 3.97Å; Y316-R333 HydrophobicContact CD2-CB 4.02Å; Y316-R333 HydrophobicContact CD2-CG 4.28Å; Y316-R333 HydrophobicContact CE1-CB 3.53Å; Y316-R333 HydrophobicContact CE1-CG 4.36Å; Y316-R333 HydrophobicContact CE2-CB 3.58Å; Y316-R333 HydrophobicContact CE2-CG 3.58Å; Y316-R333 HydrophobicContact CG-CB 4.2Å; Y316-R333 PolarHBondContact N-O 3.04Å; Y316-R333 PolarHBondContact O-N 2.81Å; S326-R333 VanDerWaalsContact OG-CZ 3.3Å; S326-R333 PolarHBondContact OG-NE 2.88Å; S326-R333 VanDerWaalsContact OG-NE 3.08Å; S326-R333 PolarHBondContact OG-NH2 3.08Å; E329-R333 IonicContact OE2-CZ 2.66Å; E329-R333 IonicContact OE2-NH1 3.89Å; E329-R333 IonicContact OE2-NH2 2.74Å; E329-R333 PolarHBondContact OE2-NH2 3.02Å; A331-R333 PolarHBondContact O-N 3.2Å
334	F	96.6	Very high	94.4	Very high	77 Å²	77	74.8 Å²	74.8	34%	0.338	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.5	176	176	-106.9	0	0	0	109.9	F164 R315 F337	F164-F334 HydrophobicContact CE1-CE1 4.43Å; F164-F334 HydrophobicContact CE2-CE1 4.18Å; F164-F334 HydrophobicContact CE2-CZ 4.01Å; F164-F334 HydrophobicContact CZ-CD1 4.18Å; F164-F334 AromaticContact CZ-CE1 3.5Å; F164-F334 HydrophobicContact CZ-CE1 3.5Å; F164-F334 VanDerWaalsContact CZ-CE1 3.5Å; F164-F334 HydrophobicContact CZ-CE2 4.5Å; F164-F334 AromaticContact CZ-CZ 3.67Å; F164-F334 HydrophobicContact CZ-CZ 3.67Å; R315-F334 HydrophobicContact CG-CD2 4.19Å; F334-F337 HydrophobicContact CE2-CD2 4.16Å; F334-F337 AromaticContact CE2-CE2 3.9Å; F334-F337 HydrophobicContact CE2-CE2 3.9Å; F334-F337 HydrophobicContact CE2-CZ 4.32Å; F334-F337 AromaticContact CZ-CD2 3.67Å; F334-F337 HydrophobicContact CZ-CD2 3.67Å; F334-F337 AromaticContact CZ-CE2 3.65Å; F334-F337 HydrophobicContact CZ-CE2 3.65Å; F334-F337 HydrophobicContact CZ-CZ 4.5Å
335	V	96.7	Very high	94.7	Very high	70 Å²	70	65.5 Å²	65.5	42%	0.424	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-38.2	177.6	-179.4	0	0	0	0	110.7	A306 V314 Y316	A306-V335 HydrophobicContact CB-CG2 4.21Å; V314-V335 HydrophobicContact CB-CB 4.11Å; V314-V335 HydrophobicContact CG1-CB 3.96Å; V314-V335 HydrophobicContact CG1-CG1 4.4Å; V314-V335 HydrophobicContact CG1-CG2 4Å; V314-V335 WeakPolarHBondContact O-CB 3.46Å; V314-V335 PolarHBondContact O-N 3.39Å; Y316-V335 HydrophobicContact CD1-CG2 3.95Å; Y316-V335 HydrophobicContact CE1-CG2 3.85Å
336	G	97	Very high	95	Very high	15 Å²	15	65.1 Å²	65.1	16%	0.155	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.6	-170.7	-178	0	0	0	0	0	113.2	S313 V314 P338	S313-G336 WeakPolarHBondContact CA-O 3.5Å; V314-G336 PolarHBondContact N-O 2.67Å; G336-P338 WeakPolarHBondContact O-CD 3.26Å
337	F	97.3	Very high	95.2	Very high	44 Å²	44	65.1 Å²	65.1	19%	0.193	34%	0.338	C	S	.	.			trans	-108.6	79.9	165	-69.2	-81.1	0	0	0	109.5	F164 R166 F334	F164-F337 HydrophobicContact CD2-CE2 4.14Å; F164-F337 HydrophobicContact CE2-CD2 4.4Å; F164-F337 AromaticContact CE2-CE2 3.82Å; F164-F337 HydrophobicContact CE2-CE2 3.82Å; R166-F337 HydrophobicContact CB-CB 4.36Å; R166-F337 HydrophobicContact CB-CD1 3.67Å; R166-F337 HydrophobicContact CB-CD2 4.29Å; R166-F337 HydrophobicContact CB-CE1 3.93Å; R166-F337 HydrophobicContact CB-CG 3.86Å; R166-F337 HydrophobicContact CB-CZ 4.36Å; R166-F337 HydrophobicContact CG-CB 3.9Å; R166-F337 HydrophobicContact CG-CD1 4.08Å; R166-F337 HydrophobicContact CG-CG 3.98Å; F334-F337 HydrophobicContact CE2-CD2 4.16Å; F334-F337 AromaticContact CE2-CE2 3.9Å; F334-F337 HydrophobicContact CE2-CE2 3.9Å; F334-F337 HydrophobicContact CE2-CZ 4.32Å; F334-F337 AromaticContact CZ-CD2 3.67Å; F334-F337 HydrophobicContact CZ-CD2 3.67Å; F334-F337 AromaticContact CZ-CE2 3.65Å; F334-F337 HydrophobicContact CZ-CE2 3.65Å; F334-F337 HydrophobicContact CZ-CZ 4.5Å
338	P	96.9	Very high	95.6	Very high	24 Å²	24	61 Å²	61	16%	0.156	31%	0.311	C	S	.	.			trans	-70.6	166.5	-178.2	21.4	-22.5	0	0	0	112.7	W308 V314 G336 K340 K343 Y345	W308-P338 HydrophobicContact CH2-CB 4.19Å; W308-P338 HydrophobicContact CH2-CG 3.57Å; W308-P338 HydrophobicContact CZ2-CG 4.4Å; W308-P338 HydrophobicContact CZ3-CG 3.71Å; V314-P338 HydrophobicContact CB-CG 4.18Å; V314-P338 HydrophobicContact CG2-CG 3.44Å; V314-P338 VanDerWaalsContact CG2-CG 3.44Å; G336-P338 WeakPolarHBondContact O-CD 3.26Å; P338-K340 PolarHBondContact O-N 3.05Å; P338-K343 HydrophobicContact CB-CB 4.05Å; P338-K343 HydrophobicContact CB-CG 3.95Å; P338-Y345 HydrophobicContact CB-CE2 3.88Å; P338-Y345 HydrophobicContact CG-CD2 4.21Å; P338-Y345 HydrophobicContact CG-CE2 3.46Å; P338-Y345 VanDerWaalsContact CG-CE2 3.46Å
339	D	95.9	Very high	96	Very high	80 Å²	80	55.7 Å²	55.7	43%	0.428	28%	0.279	S	S	.	.			trans	-59.8	120.8	174.7	-175.8	-68.6	0	0	0	110.9	K341 H342 K343	D339-K341 VanDerWaalsContact C-N 3.28Å; D339-K341 PolarHBondContact O-N 2.75Å; D339-K341 WeakPolarHBondContact OD1-CA 3.45Å; D339-K341 WeakPolarHBondContact OD1-CB 3.27Å; D339-K341 PolarHBondContact OD1-N 2.98Å; D339-H342 IonicContact OD1-CE1 3.54Å; D339-H342 IonicContact OD1-CG 2.94Å; D339-H342 PolarHBondContact OD1-N 2.86Å; D339-H342 IonicContact OD1-ND1 3.19Å; D339-H342 PolarHBondContact OD1-ND1 2.84Å; D339-H342 IonicContact OD2-ND1 3.64Å; D339-H342 PolarHBondContact OD2-ND1 2.89Å; D339-K343 HydrophobicContact CB-CG 4.35Å; D339-K343 WeakPolarHBondContact O-CB 3.21Å; D339-K343 PolarHBondContact O-N 2.81Å
340	K	96.1	Very high	96.3	Very high	57 Å²	57	52.6 Å²	52.6	25%	0.248	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.6	-174.4	-74.2	-170	169.6	-162	0	114.1	Y272 P338	Y272-K340 HydrophobicContact CD1-CD 3.7Å; Y272-K340 HydrophobicContact CD1-CG 4.31Å; Y272-K340 HydrophobicContact CD2-CD 4.38Å; Y272-K340 HydrophobicContact CE1-CD 4.24Å; Y272-K340 HydrophobicContact CG-CB 4.33Å; Y272-K340 HydrophobicContact CG-CD 3.79Å; Y272-K340 HydrophobicContact CG-CG 3.94Å; Y272-K340 PolarHBondContact N-O 3.37Å; P338-K340 PolarHBondContact O-N 3.05Å
341	K	94.1	Very high	96.5	Very high	156 Å²	156	54.5 Å²	54.5	68%	0.678	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-31.9	-173.4	-65	-175.5	177.1	-175	0	112.8	T271 D339	T271-K341 WeakPolarHBondContact CG2-O 3.21Å; D339-K341 VanDerWaalsContact C-N 3.28Å; D339-K341 PolarHBondContact O-N 2.75Å; D339-K341 WeakPolarHBondContact OD1-CA 3.45Å; D339-K341 WeakPolarHBondContact OD1-CB 3.27Å; D339-K341 PolarHBondContact OD1-N 2.98Å
342	H	90.3	Very high	96.5	Very high	140 Å²	140	56.2 Å²	56.2	65%	0.648	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-22.3	-168.8	-55	97.1	0	0	0	114.1	D339	D339-H342 IonicContact OD1-CE1 3.54Å; D339-H342 IonicContact OD1-CG 2.94Å; D339-H342 PolarHBondContact OD1-N 2.86Å; D339-H342 IonicContact OD1-ND1 3.19Å; D339-H342 PolarHBondContact OD1-ND1 2.84Å; D339-H342 IonicContact OD2-ND1 3.64Å; D339-H342 PolarHBondContact OD2-ND1 2.89Å
343	K	91.1	Very high	96.2	Very high	113 Å²	113	61.4 Å²	61.4	49%	0.491	29%	0.294	S	S	.	.			trans	-91.4	136.7	-178.7	-64.2	-65.5	-174.3	-178.5	0	110.8	W308 P338 D339 Y345	W308-K343 HydrophobicContact CZ2-CB 4.5Å; W308-K343 WeakPolarHBondContact CZ2-O 3.45Å; P338-K343 HydrophobicContact CB-CB 4.05Å; P338-K343 HydrophobicContact CB-CG 3.95Å; D339-K343 HydrophobicContact CB-CG 4.35Å; D339-K343 WeakPolarHBondContact O-CB 3.21Å; D339-K343 PolarHBondContact O-N 2.81Å; K343-Y345 HydrophobicContact CB-CD2 4.27Å; K343-Y345 HydrophobicContact CB-CE2 3.7Å
344	L	95.4	Very high	94.6	Very high	95 Å²	95	69.1 Å²	69.1	50%	0.497	34%	0.34	S	S	.	.			trans	-109.5	124.8	-177.3	-55.3	177.8	0	0	0	110.3	K269 L270 T271	K269-L344 HydrophobicContact CB-CB 3.6Å; L270-L344 VanDerWaalsContact O-CA 3.31Å; L270-L344 WeakPolarHBondContact O-CA 3.31Å; T271-L344 HydrophobicContact CG2-CD2 3.53Å
345	Y	97.9	Very high	94.5	Very high	52 Å²	52	68.7 Å²	68.7	20%	0.204	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-136.5	177.1	175.3	-66.7	-82.6	0	0	0	110.9	K269 L270 A306 W308 V314 P338 K343	K269-Y345 CarbonylContact C-O 3.53Å; K269-Y345 WeakPolarHBondContact CA-O 3.33Å; L270-Y345 PolarHBondContact N-O 2.75Å; L270-Y345 PolarHBondContact O-N 2.85Å; A306-Y345 HydrophobicContact CB-CD1 3.86Å; A306-Y345 HydrophobicContact CB-CE1 4.25Å; W308-Y345 HydrophobicContact CD2-CD2 4.48Å; W308-Y345 AromaticContact CE2-CD2 3.79Å; W308-Y345 HydrophobicContact CH2-CD2 4.35Å; W308-Y345 AromaticContact CZ2-CD2 3.73Å; W308-Y345 HydrophobicContact CZ2-CD2 3.73Å; W308-Y345 HydrophobicContact CZ2-CE2 4.32Å; V314-Y345 HydrophobicContact CG1-CD1 3.7Å; V314-Y345 HydrophobicContact CG1-CD2 4.37Å; V314-Y345 HydrophobicContact CG1-CE1 3.93Å; V314-Y345 HydrophobicContact CG1-CG 3.92Å; V314-Y345 HydrophobicContact CG2-CD1 4.45Å; V314-Y345 HydrophobicContact CG2-CD2 3.63Å; V314-Y345 HydrophobicContact CG2-CE2 3.87Å; V314-Y345 HydrophobicContact CG2-CG 3.92Å; P338-Y345 HydrophobicContact CB-CE2 3.88Å; P338-Y345 HydrophobicContact CG-CD2 4.21Å; P338-Y345 HydrophobicContact CG-CE2 3.46Å; P338-Y345 VanDerWaalsContact CG-CE2 3.46Å; K343-Y345 HydrophobicContact CB-CD2 4.27Å; K343-Y345 HydrophobicContact CB-CE2 3.7Å
346	G	98.4	Very high	94.4	Very high	6 Å²	6	68.6 Å²	68.6	6%	0.062	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	-169.6	164.7	0	0	0	0	0	112	Y263 A306 G307 W308	Y263-G346 VanDerWaalsContact OH-CA 3.24Å; Y263-G346 WeakPolarHBondContact OH-CA 3.29Å; A306-G346 PolarHBondContact O-N 2.9Å; A306-G346 VanDerWaalsContact O-N 3.12Å; G307-G346 CarbonylContact C-O 3.21Å; G307-G346 WeakPolarHBondContact CA-O 3.23Å; W308-G346 VanDerWaalsContact CD1-O 3.25Å; W308-G346 PolarHBondContact N-O 2.8Å
347	V	98.7	Very high	94.3	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.006	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	140.4	173.1	65.5	0	0	0	0	110.7	L264 L270 A275 C279 I286 W308	L264-V347 HydrophobicContact CB-CG1 3.71Å; L264-V347 HydrophobicContact CD2-CG1 3.93Å; L264-V347 HydrophobicContact CG-CG1 4.42Å; L264-V347 PolarHBondContact N-O 3.5Å; L270-V347 HydrophobicContact CD1-CG1 4.41Å; A275-V347 HydrophobicContact CB-CB 3.74Å; A275-V347 HydrophobicContact CB-CG1 4.42Å; A275-V347 HydrophobicContact CB-CG2 3.76Å; C279-V347 WeakPolarHBondContact SG-CG2 3.13Å; I286-V347 HydrophobicContact CD1-CG2 3.88Å; I286-V347 HydrophobicContact CG1-CG2 3.85Å; W308-V347 HydrophobicContact CB-CG2 4.37Å
348	Y	98.8	Very high	94.1	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	130	166.1	-68.4	-85.4	0	0	0	108.6	F261 Y262 Y263 A287 I292 Y301 R303 D305 W308 L309 R315 P317	F261-Y348 AromaticContact CE1-CD1 3.64Å; F261-Y348 HydrophobicContact CE1-CD1 3.64Å; F261-Y348 HydrophobicContact CE1-CE1 4.13Å; F261-Y348 HydrophobicContact CE1-CG 4.47Å; F261-Y348 HydrophobicContact CE2-CD1 4.26Å; F261-Y348 HydrophobicContact CE2-CG 4.34Å; F261-Y348 AromaticContact CZ-CD1 3.34Å; F261-Y348 HydrophobicContact CZ-CD1 3.34Å; F261-Y348 HydrophobicContact CZ-CE1 4.1Å; F261-Y348 AromaticContact CZ-CG 3.74Å; F261-Y348 HydrophobicContact CZ-CG 3.74Å; Y262-Y348 CarbonylContact O-C 3.57Å; Y262-Y348 WeakPolarHBondContact O-CA 3.47Å; Y263-Y348 HydrophobicContact CD2-CD1 4.06Å; Y263-Y348 HydrophobicContact CD2-CD2 4.29Å; Y263-Y348 AromaticContact CD2-CE1 3.69Å; Y263-Y348 HydrophobicContact CD2-CE1 3.69Å; Y263-Y348 AromaticContact CD2-CE2 3.91Å; Y263-Y348 HydrophobicContact CD2-CE2 3.91Å; Y263-Y348 HydrophobicContact CD2-CG 4.35Å; Y263-Y348 AromaticContact CD2-CZ 3.6Å; Y263-Y348 HydrophobicContact CE2-CE2 4.32Å; Y263-Y348 HydrophobicContact CG-CE1 4.26Å; A287-Y348 WeakPolarHBondContact CB-O 3.31Å; A287-Y348 PolarHBondContact N-O 2.68Å; I292-Y348 HydrophobicContact CD1-CD2 4.38Å; I292-Y348 HydrophobicContact CD1-CE2 4.32Å; Y301-Y348 AromaticContact CE1-CE1 3.9Å; Y301-Y348 HydrophobicContact CE1-CE1 3.9Å; R303-Y348 HydrophobicContact CB-CE1 4.38Å; R303-Y348 HydrophobicContact CG-CE1 4.38Å; R303-Y348 WeakPolarHBondContact CG-OH 3.49Å; D305-Y348 PolarHBondContact O-OH 2.92Å; W308-Y348 PolarHBondContact O-N 2.82Å; L309-Y348 HydrophobicContact CD2-CD2 4.31Å; L309-Y348 HydrophobicContact CD2-CG 4.4Å; R315-Y348 WeakPolarHBondContact O-CE2 3.43Å; P317-Y348 VanDerWaalsContact CD-OH 3.24Å; P317-Y348 WeakPolarHBondContact CD-OH 3.37Å; P317-Y348 HydrophobicContact CG-CE1 4.48Å
349	C	98.8	Very high	93.9	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	156.8	178	-52.2	0	0	0	0	110.4	Y262 C279 A284 Q285	Y262-C349 HydrophobicContact CE1-CB 4.06Å; Y262-C349 HydrophobicContact CE2-CB 4Å; Y262-C349 PolarHBondContact N-O 2.87Å; Y262-C349 PolarHBondContact O-N 3.04Å; C279-C349 WeakPolarHBondContact CA-SG 3.49Å; C279-C349 HydrophobicContact CB-CB 3.84Å; C279-C349 WeakPolarHBondContact CB-SG 3.46Å; C279-C349 WeakPolarHBondContact SG-CB 3.45Å; C279-C349 CovalentContact SG-SG 2.04Å; C279-C349 PolarHBondContact SG-SG 3.35Å; A284-C349 HydrophobicContact CB-CB 3.97Å; Q285-C349 CarbonylContact O-C 3.11Å; Q285-C349 VanDerWaalsContact O-CA 3.25Å; Q285-C349 WeakPolarHBondContact O-CA 3.21Å
350	F	98.6	Very high	93.8	Very high	24 Å²	24	76.1 Å²	76.1	11%	0.105	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.1	176.3	-180	-98.4	0	0	0	110.4	F257 R260 F261 A284 Q285 A287 Q291 A352	F257-F350 HydrophobicContact CB-CE2 4.15Å; F257-F350 HydrophobicContact CB-CZ 4.14Å; F257-F350 HydrophobicContact CD1-CE2 4.42Å; F257-F350 HydrophobicContact CD2-CD2 4.46Å; F257-F350 AromaticContact CD2-CE2 3.43Å; F257-F350 HydrophobicContact CD2-CE2 3.43Å; F257-F350 VanDerWaalsContact CD2-CE2 3.43Å; F257-F350 HydrophobicContact CD2-CZ 4.1Å; F257-F350 AromaticContact CE2-CE2 3.87Å; F257-F350 HydrophobicContact CE2-CE2 3.87Å; F257-F350 AromaticContact CG-CE2 3.74Å; F257-F350 HydrophobicContact CG-CE2 3.74Å; F257-F350 HydrophobicContact CG-CZ 4.24Å; R260-F350 WeakPolarHBondContact O-CA 3.49Å; F261-F350 HydrophobicContact CB-CD2 4.35Å; A284-F350 WeakPolarHBondContact CB-O 3.1Å; Q285-F350 PolarHBondContact N-O 3.17Å; Q285-F350 PolarHBondContact O-N 3.11Å; A287-F350 HydrophobicContact CB-CB 4.08Å; Q291-F350 VanDerWaalsContact CD-CG 3.47Å; Q291-F350 HydrophobicContact CG-CD2 4.27Å; Q291-F350 HydrophobicContact CG-CG 4.5Å; F350-A352 HydrophobicContact CE1-CB 4.16Å
351	R	97.9	Very high	93.6	Very high	86 Å²	86	77.4 Å²	77.4	33%	0.325	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	113.3	177.9	-167.6	-177	-42.6	-171.3	0.5	109.1	G259 R260 Y262 D282 A284	G259-R351 CarbonylContact C-O 3.58Å; G259-R351 WeakPolarHBondContact CA-O 3.5Å; R260-R351 HydrophobicContact CB-CB 4.47Å; R260-R351 PolarHBondContact N-O 3.3Å; R260-R351 PolarHBondContact O-N 3.43Å; Y262-R351 HydrophobicContact CE1-CB 4.29Å; Y262-R351 PolarHBondContact OH-NH2 3.36Å; D282-R351 PolarHBondContact O-NH2 3.29Å; D282-R351 IonicContact OD1-NH2 3.58Å; D282-R351 IonicContact OD2-NH2 3.27Å; D282-R351 PolarHBondContact OD2-NH2 3.29Å; A284-R351 HydrophobicContact CB-CB 4.11Å
352	A	95	Very high	93.6	Very high	58 Å²	58	71.4 Å²	71.4	48%	0.479	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	145.6	175.6	0	0	0	0	0	110.4	F350	F350-A352 HydrophobicContact CE1-CB 4.16Å
353	Y	91.1	Very high	93.9	Very high	126 Å²	126	65.7 Å²	65.7	49%	0.494	32%	0.323	S	S	.	.			trans	-88	122.5	164.7	-58.5	-41.5	0	0	0	107.2	N258 G259 R260	N258-Y353 PolarHBondContact ND2-O 3.45Å; N258-Y353 PolarHBondContact O-N 3.32Å; N258-Y353 VanDerWaalsContact O-N 3.17Å; G259-Y353 VanDerWaalsContact C-CE2 3.44Å; G259-Y353 VanDerWaalsContact CA-CD2 3.45Å; G259-Y353 WeakPolarHBondContact O-CE2 3.36Å; R260-Y353 HydrophobicContact CB-CE1 4.03Å; R260-Y353 WeakPolarHBondContact CB-OH 3.38Å
354	N	64.6	Low	94.1	Very high	227 Å²	227	61.4 Å²	61.4	100%	1.214	31%	0.308	S	S	*	.			trans	-70	0	176.8	-75.8	-7.2	0	0	0	111.6

Retrieved 354 of 354 residues in 2541.2 ms (Link to these results)

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