A0A096N1T6_PAPAN Loading...

Cell adhesion molecule 2

Adhesion molecule that engages in homo- and heterophilic interactions with the other nectin-like family members, leading to cell aggregation. Important for synapse organization, providing regulated trans-synaptic adhesion. Preferentially binds to oligodendrocytes.

AlphaFold DB , UniProt , Accession A0A096N1T6, Species PAPAN (Papio anubis, Olive baboon), Gene CADM2, Length 437 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	38.5	Very low	34.5	Very low	235 Å²	235	157.1 Å²	157.1	100%	1.158	83%	0.829	S	S	*	*				0	79	0	-157.6	163.4	178.2	0	0	105.5
2	F	29.7	Very low	34.6	Very low	186 Å²	186	150.3 Å²	150.3	82%	0.816	81%	0.813	S	S	*	*				41.4	115.5	91.9	-86.6	-84	0	0	0	109.9
3	V	34.5	Very low	34.7	Very low	126 Å²	126	148.1 Å²	148.1	76%	0.764	81%	0.811	S	S	*	*				-157.9	139.4	59.6	163.9	0	0	0	0	111.5
4	L	37.7	Very low	34.5	Very low	146 Å²	146	144.9 Å²	144.9	76%	0.764	81%	0.813	S	S	*	*			trans	-62.9	155.4	165.3	-73	119.2	0	0	0	112.8
5	F	35.2	Very low	34.3	Very low	188 Å²	188	141.5 Å²	141.5	83%	0.825	81%	0.812	S	S	*	*			trans	170.9	136.7	141.1	-108.9	-92.5	0	0	0	106.9
6	L	34.7	Very low	34.4	Very low	144 Å²	144	138.7 Å²	138.7	75%	0.754	81%	0.81	S	S	*	*			cis	-159.4	143.7	-18.1	-111.3	-176.7	0	0	0	104.7
7	C	32.8	Very low	34.1	Very low	109 Å²	109	135.5 Å²	135.5	74%	0.736	80%	0.797	S	S	*	*			trans	-84.4	137.8	166.2	-160.6	0	0	0	0	109.1
8	N	31.4	Very low	34.5	Very low	146 Å²	146	138.9 Å²	138.9	78%	0.781	80%	0.801	S	S	*	*			trans	139.7	115.9	149.1	-79.6	-33	0	0	0	111.5
9	L	33.6	Very low	34.3	Very low	169 Å²	169	138.4 Å²	138.4	89%	0.885	80%	0.795	S	S	*	*				-151.7	120.4	125.5	-127.5	86.2	0	0	0	109
10	S	33.2	Very low	34.5	Very low	103 Å²	103	140.2 Å²	140.2	72%	0.72	79%	0.793	S	S	*	*			trans	-54.2	127.5	171.6	52.1	0	0	0	0	111.7	A12	S10-A12 PolarHBondContact O-N 3.43Å; S10-A12 VanDerWaalsContact O-N 3.08Å
11	L	38.3	Very low	34.6	Very low	176 Å²	176	139.4 Å²	139.4	92%	0.921	79%	0.791	S	S	*	*			trans	-69.6	98	160.2	-87.9	134.3	0	0	0	108.4
12	A	36.1	Very low	34.7	Very low	76 Å²	76	137 Å²	137	63%	0.628	77%	0.774	S	S	*	*			trans	-63.4	142.7	161.3	0	0	0	0	0	108.9	S10 A14	S10-A12 PolarHBondContact O-N 3.43Å; S10-A12 VanDerWaalsContact O-N 3.08Å; A12-A14 PolarHBondContact O-N 3.24Å
13	P	34.8	Very low	35	Very low	121 Å²	121	130.3 Å²	130.3	79%	0.786	76%	0.758	S	S	*	*			trans	-63.9	128.4	176.4	27.2	-31.4	0	0	0	108.2	A15	P13-A15 PolarHBondContact O-N 3.26Å
14	A	32.3	Very low	35.5	Very low	103 Å²	103	129.9 Å²	129.9	85%	0.851	76%	0.76	S	S	*	*			trans	-56.6	107.2	169.1	0	0	0	0	0	107.5	A12 A16	A12-A14 PolarHBondContact O-N 3.24Å; A14-A16 PolarHBondContact O-N 3.24Å
15	A	31.5	Very low	36.2	Very low	95 Å²	95	128.8 Å²	128.8	79%	0.785	75%	0.751	S	S	*	*			trans	-53.5	117.2	170.7	0	0	0	0	0	107.2	P13 S17	P13-A15 PolarHBondContact O-N 3.26Å; A15-S17 PolarHBondContact O-N 2.91Å
16	A	36.8	Very low	37.4	Very low	96 Å²	96	121.3 Å²	121.3	79%	0.793	73%	0.728	S	S	*	*			trans	-60.3	91.6	165.9	0	0	0	0	0	107.3	A14 K18	A14-A16 PolarHBondContact O-N 3.24Å; A16-K18 PolarHBondContact O-N 2.92Å
17	S	29	Very low	39.5	Very low	84 Å²	84	116 Å²	116	59%	0.587	70%	0.699	S	S	*	*			trans	-65.7	93.6	162.1	-178.9	0	0	0	0	106.1	A15 N19	A15-S17 PolarHBondContact O-N 2.91Å; S17-N19 PolarHBondContact O-N 3.03Å; S17-N19 VanDerWaalsContact OG-CG 3.29Å; S17-N19 PolarHBondContact OG-OD1 2.86Å
18	K	41	Very low	42.2	Very low	197 Å²	197	116.3 Å²	116.3	86%	0.857	69%	0.688	S	S	*	*			trans	-64.8	73.6	154.3	-77.5	-176.6	177.7	177	0	106.8	A16 K20	A16-K18 PolarHBondContact O-N 2.92Å; K18-K20 PolarHBondContact O-N 2.84Å
19	N	31.3	Very low	45.2	Very low	130 Å²	130	109.6 Å²	109.6	70%	0.695	65%	0.652	S	S	*	*			trans	-68.9	83.8	157.4	-89.4	-17.6	0	0	0	106	S17 V21	S17-N19 PolarHBondContact O-N 3.03Å; S17-N19 VanDerWaalsContact OG-CG 3.29Å; S17-N19 PolarHBondContact OG-OD1 2.86Å; N19-V21 HydrophobicContact CB-CG2 4.38Å; N19-V21 PolarHBondContact O-N 3Å
20	K	37.3	Very low	48.2	Very low	173 Å²	173	105.7 Å²	105.7	75%	0.752	63%	0.632	S	S	*	*			trans	-64.3	84.2	158.1	-167.5	173.7	-171.8	172.1	0	105.3	K18 K22	K18-K20 PolarHBondContact O-N 2.84Å; K20-K22 PolarHBondContact O-N 2.91Å
21	V	36.4	Very low	51.3	Low	124 Å²	124	102 Å²	102	75%	0.752	61%	0.605	S	S	*	*			trans	-65.9	84.7	164.8	-178.4	0	0	0	0	105.1	N19 G23	N19-V21 HydrophobicContact CB-CG2 4.38Å; N19-V21 PolarHBondContact O-N 3Å; V21-G23 PolarHBondContact O-N 2.66Å
22	K	42.3	Very low	54.1	Low	184 Å²	184	101.3 Å²	101.3	80%	0.8	60%	0.597	S	S	*	*			trans	-70.5	68.9	152.9	-96.4	-173.1	170.1	-173.1	0	106.2	K20	K20-K22 PolarHBondContact O-N 2.91Å
23	G	35	Very low	57.1	Low	46 Å²	46	103 Å²	103	47%	0.474	60%	0.596	S	S	.	*			trans	-80.7	121.3	157	0	0	0	0	0	105.3	V21 Q25	V21-G23 PolarHBondContact O-N 2.66Å; G23-Q25 VanDerWaalsContact C-N 3.3Å; G23-Q25 PolarHBondContact O-N 3.4Å
24	S	45.5	Very low	60.1	Low	117 Å²	117	98.6 Å²	98.6	82%	0.818	57%	0.566	S	S	*	*			trans	-51.5	104.3	155.7	49.7	0	0	0	0	106.4	G26	S24-G26 PolarHBondContact O-N 2.95Å
25	Q	52.9	Low	63.2	Low	123 Å²	123	97.6 Å²	97.6	58%	0.575	55%	0.55	S	S	*	.			trans	-63.6	98.2	169.5	-95.9	-158.3	-34.5	0	0	105.8	G23 D49	G23-Q25 VanDerWaalsContact C-N 3.3Å; G23-Q25 PolarHBondContact O-N 3.4Å; Q25-D49 PolarHBondContact OE1-OD2 3.06Å
26	G	58.4	Low	66.4	Low	32 Å²	32	93.9 Å²	93.9	33%	0.33	52%	0.517	S	S	.	.			trans	-60.4	151.8	176	0	0	0	0	0	109.2	S24 F28	S24-G26 PolarHBondContact O-N 2.95Å; G26-F28 WeakPolarHBondContact O-CD2 3.4Å; G26-F28 PolarHBondContact O-N 3.27Å
27	Q	79.6	Confident	69.3	Low	32 Å²	32	91.2 Å²	91.2	15%	0.15	49%	0.491	C	S	.	.	S	Bend	trans	-49.2	94.6	167.8	176.2	-179	38.5	0	0	110.2	V48 Q50 N51 T54 L108 T110 K114	Q27-V48 HydrophobicContact CG-CG1 4.11Å; Q27-Q50 WeakPolarHBondContact CA-O 3.37Å; Q27-Q50 WeakPolarHBondContact CB-O 3.15Å; Q27-Q50 VanDerWaalsContact CG-O 3.26Å; Q27-Q50 WeakPolarHBondContact CG-O 3.38Å; Q27-N51 PolarHBondContact NE2-OD1 2.81Å; Q27-T54 PolarHBondContact NE2-OG1 2.7Å; Q27-L108 HydrophobicContact CG-CD2 3.35Å; Q27-T110 HydrophobicContact CG-CG2 4.15Å; Q27-K114 WeakPolarHBondContact O-CD 3.31Å; Q27-K114 WeakPolarHBondContact O-CE 3.17Å; Q27-K114 PolarHBondContact O-NZ 3.44Å
28	F	89.8	Confident	72.5	Confident	116 Å²	116	91.2 Å²	91.2	51%	0.509	48%	0.482	S	S	.	.			trans	-131.8	132.5	-179.5	-81	-79.4	0	0	0	109.3	G26 K114	G26-F28 WeakPolarHBondContact O-CD2 3.4Å; G26-F28 PolarHBondContact O-N 3.27Å; F28-K114 HydrophobicContact CD1-CB 4.32Å; F28-K114 HydrophobicContact CD1-CD 3.66Å; F28-K114 HydrophobicContact CD1-CG 4.13Å; F28-K114 HydrophobicContact CE1-CD 3.65Å; F28-K114 HydrophobicContact CE1-CG 3.99Å; F28-K114 HydrophobicContact CG-CD 4.19Å; F28-K114 HydrophobicContact CZ-CD 4.18Å
29	P	94.7	Very high	75.1	Confident	5 Å²	5	84 Å²	84	3%	0.032	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	139.6	174.8	27.3	-30.9	0	0	0	111.7	C46 R47 V48 L108 K114 S116	P29-C46 VanDerWaalsContact CB-SG 3.58Å; P29-R47 CarbonylContact C-O 3.57Å; P29-R47 WeakPolarHBondContact CA-O 3.49Å; P29-V48 HydrophobicContact CB-CG2 4.29Å; P29-L108 HydrophobicContact CB-CB 4.48Å; P29-L108 HydrophobicContact CG-CB 4.05Å; P29-K114 HydrophobicContact CG-CB 4.48Å; P29-S116 WeakPolarHBondContact O-CB 2.93Å; P29-S116 PolarHBondContact O-OG 3.13Å
30	L	96.5	Very high	78.2	Confident	87 Å²	87	78.9 Å²	78.9	46%	0.455	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132	178.2	-63.5	172.1	0	0	0	109.1	C46 R47	L30-C46 WeakPolarHBondContact O-CA 3.45Å; L30-R47 PolarHBondContact N-O 2.99Å; L30-R47 PolarHBondContact O-N 3.08Å
31	T	97.6	Very high	81.1	Confident	26 Å²	26	74.5 Å²	74.5	16%	0.16	43%	0.429	C	S	.	.			trans	-143.5	165.3	174.4	-169.9	0	0	0	0	109.9	T45 W58 S116 K117 A118	T31-T45 PolarHBondContact OG1-O 3.33Å; T31-T45 VanDerWaalsContact OG1-O 3.07Å; T31-W58 HydrophobicContact CG2-CH2 4.37Å; T31-W58 WeakPolarHBondContact OG1-CH2 3.33Å; T31-S116 PolarHBondContact N-OG 2.83Å; T31-K117 VanDerWaalsContact CG2-O 3.27Å; T31-K117 WeakPolarHBondContact CG2-O 3.36Å; T31-A118 HydrophobicContact CG2-CB 3.77Å; T31-A118 WeakPolarHBondContact OG1-CB 3.3Å
32	Q	97.8	Very high	84.1	Confident	161 Å²	161	68.6 Å²	68.6	75%	0.752	39%	0.394	S	S	*	.			trans	-126.3	155.9	178.1	-60.9	-179.5	22.7	0	0	110.7	A118	Q32-A118 WeakPolarHBondContact O-CB 3.3Å
33	N	98.4	Very high	86.8	Confident	112 Å²	112	64.1 Å²	64.1	60%	0.599	38%	0.377	S	S	*	.			trans	-67.6	148.9	171.1	-66.5	-12.8	0	0	0	110	Y119	N33-Y119 WeakPolarHBondContact CA-O 3.32Å; N33-Y119 WeakPolarHBondContact CB-O 3.44Å; N33-Y119 PolarHBondContact OD1-N 3.32Å
34	V	98.3	Very high	89.8	Confident	28 Å²	28	61.9 Å²	61.9	17%	0.17	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.1	-178.3	179.5	0	0	0	0	108	A42 I43 L44 Y119 L120 T121	V34-A42 HydrophobicContact CG1-CB 4.1Å; V34-I43 WeakPolarHBondContact CG2-O 3.32Å; V34-L44 HydrophobicContact CG2-CD2 4.07Å; V34-Y119 PolarHBondContact N-O 3.4Å; V34-L120 HydrophobicContact CB-CD1 4.12Å; V34-L120 HydrophobicContact CG1-CD1 4.06Å; V34-L120 CarbonylContact O-C 3.58Å; V34-L120 WeakPolarHBondContact O-CA 3.41Å; V34-T121 PolarHBondContact O-N 3.13Å
35	T	97.9	Very high	92.3	Very high	82 Å²	82	58.3 Å²	58.3	50%	0.503	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.2	171.2	-58.1	0	0	0	0	108.3	T121 L123	T35-T121 WeakPolarHBondContact CA-O 3.38Å; T35-T121 HydrophobicContact CG2-CG2 4.29Å; T35-L123 HydrophobicContact CG2-CD1 3.64Å; T35-L123 HydrophobicContact CG2-CD2 3.65Å; T35-L123 HydrophobicContact CG2-CG 3.53Å
36	V	97.7	Very high	94.4	Very high	17 Å²	17	52.4 Å²	52.4	10%	0.103	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	147	-178.9	71	0	0	0	0	110.1	A42 V96 L120 T121 V122 L123	V36-A42 HydrophobicContact CB-CB 4.42Å; V36-A42 HydrophobicContact CG1-CB 4.2Å; V36-V96 HydrophobicContact CG1-CB 4Å; V36-V96 HydrophobicContact CG1-CG1 3.66Å; V36-V96 HydrophobicContact CG1-CG2 4.13Å; V36-L120 HydrophobicContact CG1-CD1 3.86Å; V36-T121 PolarHBondContact N-O 2.9Å; V36-V122 HydrophobicContact CG1-CG2 4.37Å; V36-V122 CarbonylContact O-C 3.58Å; V36-V122 WeakPolarHBondContact O-CA 3.47Å; V36-L123 PolarHBondContact O-N 2.8Å
37	V	97.7	Very high	96.2	Very high	40 Å²	40	56.9 Å²	56.9	24%	0.242	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	141.4	171	-177.3	0	0	0	0	109.6	G40 L123 V125	V37-G40 WeakPolarHBondContact O-CA 3.36Å; V37-G40 PolarHBondContact O-N 2.84Å; V37-L123 HydrophobicContact CG2-CB 4.46Å; V37-L123 HydrophobicContact CG2-CD1 4.23Å; V37-V125 HydrophobicContact CG1-CG2 3.29Å
38	E	96.3	Very high	97	Very high	83 Å²	83	55.5 Å²	55.5	39%	0.388	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	139.3	174.4	-175.6	169.6	-140.6	0	0	111.9	G40 V96 V122 L123	E38-G40 PolarHBondContact O-N 2.85Å; E38-V96 CarbonylContact C-O 3.57Å; E38-V96 WeakPolarHBondContact CA-O 3.44Å; E38-V122 HydrophobicContact CB-CG1 4.14Å; E38-L123 WeakPolarHBondContact CB-O 3.41Å; E38-L123 PolarHBondContact N-O 2.87Å
39	G	96.1	Very high	96.8	Very high	45 Å²	45	54.3 Å²	54.3	46%	0.464	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-8.9	-170.2	0	0	0	0	0	114.4	V96	G39-V96 PolarHBondContact N-O 3.42Å
40	G	96.9	Very high	96.4	Very high	23 Å²	23	59.9 Å²	59.9	24%	0.237	33%	0.326	C	S	.	.	S	Bend	trans	-75.4	-171.9	178	0	0	0	0	0	114	V37 E38 D95 V96	V37-G40 WeakPolarHBondContact O-CA 3.36Å; V37-G40 PolarHBondContact O-N 2.84Å; E38-G40 PolarHBondContact O-N 2.85Å; G40-D95 PolarHBondContact O-N 3.35Å; G40-V96 WeakPolarHBondContact O-CG2 3.46Å; G40-V96 PolarHBondContact O-N 2.91Å
41	T	98.2	Very high	95.9	Very high	81 Å²	81	56.2 Å²	56.2	50%	0.497	31%	0.306	S	S	.	.			trans	-119.3	122.4	175.5	-59.7	0	0	0	0	110.4	V93	T41-V93 CarbonylContact C-O 3.6Å; T41-V93 VanDerWaalsContact CA-O 3.29Å; T41-V93 WeakPolarHBondContact CA-O 3.27Å
42	A	98.3	Very high	95.3	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.008	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	140	174.3	0	0	0	0	0	110.7	V34 V36 S92 V93 V96 L120	V34-A42 HydrophobicContact CG1-CB 4.1Å; V36-A42 HydrophobicContact CB-CB 4.42Å; V36-A42 HydrophobicContact CG1-CB 4.2Å; A42-S92 CarbonylContact O-C 3.57Å; A42-S92 VanDerWaalsContact O-CA 3.25Å; A42-S92 WeakPolarHBondContact O-CA 3.31Å; A42-V93 PolarHBondContact N-O 3.07Å; A42-V93 PolarHBondContact O-N 3.26Å; A42-V96 HydrophobicContact CB-CG2 4.02Å; A42-L120 HydrophobicContact CB-CD1 3.61Å; A42-L120 HydrophobicContact CB-CD2 4.24Å
43	I	98.4	Very high	94.6	Very high	89 Å²	89	58.1 Å²	58.1	46%	0.456	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	111.2	174.9	-58.2	175.5	0	0	0	108.7	V34 I91	V34-I43 WeakPolarHBondContact CG2-O 3.32Å; I43-I91 CarbonylContact C-O 3.59Å; I43-I91 WeakPolarHBondContact CA-O 3.46Å
44	L	98.5	Very high	94.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117.4	176.4	-61.9	171.1	0	0	0	108.7	V34 W58 S90 I91 Y104 A118	V34-L44 HydrophobicContact CG2-CD2 4.07Å; L44-W58 HydrophobicContact CB-CH2 4.18Å; L44-W58 HydrophobicContact CB-CZ2 3.91Å; L44-S90 CarbonylContact O-C 3.52Å; L44-S90 VanDerWaalsContact O-CA 3.26Å; L44-S90 WeakPolarHBondContact O-CA 3.44Å; L44-I91 HydrophobicContact CB-CG1 3.93Å; L44-I91 HydrophobicContact CD1-CD1 4.23Å; L44-I91 HydrophobicContact CD1-CG1 4.37Å; L44-I91 PolarHBondContact N-O 2.94Å; L44-I91 PolarHBondContact O-N 3.46Å; L44-Y104 HydrophobicContact CD1-CD1 3.42Å; L44-Y104 VanDerWaalsContact CD1-CD1 3.42Å; L44-Y104 HydrophobicContact CD1-CD2 4.14Å; L44-Y104 HydrophobicContact CD1-CE1 3.88Å; L44-Y104 HydrophobicContact CD1-CG 3.57Å; L44-A118 HydrophobicContact CD2-CB 4.33Å
45	T	98.4	Very high	94.2	Very high	41 Å²	41	54.4 Å²	54.4	25%	0.252	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.6	-174.4	-64.1	0	0	0	0	110.4	T31 R47 E88 S90	T31-T45 PolarHBondContact OG1-O 3.33Å; T31-T45 VanDerWaalsContact OG1-O 3.07Å; T45-R47 HydrophobicContact CG2-CG 3.88Å; T45-E88 HydrophobicContact CG2-CG 4.45Å; T45-E88 WeakPolarHBondContact CG2-OE1 3.47Å; T45-S90 WeakPolarHBondContact CG2-OG 3.32Å; T45-S90 PolarHBondContact OG1-OG 2.99Å
46	C	97.6	Very high	94.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.5	172.2	-173.5	0	0	0	0	110.2	P29 L30 W58 E88 L89 C106	P29-C46 VanDerWaalsContact CB-SG 3.58Å; L30-C46 WeakPolarHBondContact O-CA 3.45Å; C46-W58 HydrophobicContact CB-CZ2 3.63Å; C46-E88 CarbonylContact O-C 3.51Å; C46-E88 VanDerWaalsContact O-CA 3.26Å; C46-E88 WeakPolarHBondContact O-CA 3.45Å; C46-L89 PolarHBondContact N-O 3.04Å; C46-L89 PolarHBondContact O-N 3.49Å; C46-C106 HydrophobicContact CB-CB 3.58Å; C46-C106 WeakPolarHBondContact CB-SG 3.19Å; C46-C106 WeakPolarHBondContact SG-CB 3.23Å; C46-C106 CovalentContact SG-SG 2.01Å; C46-C106 PolarHBondContact SG-SG 2.91Å
47	R	96.3	Very high	94.1	Very high	125 Å²	125	51.1 Å²	51.1	47%	0.472	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.3	-179.8	-67.9	-178.9	-179.4	-144.8	-2.5	111.7	P29 L30 T45 H87 E88	P29-R47 CarbonylContact C-O 3.57Å; P29-R47 WeakPolarHBondContact CA-O 3.49Å; L30-R47 PolarHBondContact N-O 2.99Å; L30-R47 PolarHBondContact O-N 3.08Å; T45-R47 HydrophobicContact CG2-CG 3.88Å; R47-H87 CarbonylContact C-O 3.53Å; R47-H87 VanDerWaalsContact CA-O 3.32Å; R47-H87 WeakPolarHBondContact CA-O 3.21Å; R47-E88 HydrophobicContact CG-CB 4.3Å; R47-E88 HydrophobicContact CG-CG 4Å; R47-E88 IonicContact CZ-OE1 3.38Å; R47-E88 VanDerWaalsContact CZ-OE1 3.26Å; R47-E88 IonicContact CZ-OE2 3.77Å; R47-E88 IonicContact NE-OE1 3.38Å; R47-E88 PolarHBondContact NE-OE1 3.42Å; R47-E88 VanDerWaalsContact NE-OE1 3.11Å; R47-E88 IonicContact NE-OE2 2.81Å; R47-E88 IonicContact NH2-OE1 3.18Å; R47-E88 PolarHBondContact NH2-OE1 2.91Å; R47-E88 IonicContact NH2-OE2 3.99Å; R47-E88 PolarHBondContact NH2-OE2 3.47Å
48	V	94.9	Very high	94.2	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	120.5	175.9	-173	0	0	0	0	108.1	Q27 P29 Q50 N51 L56 H87 L108	Q27-V48 HydrophobicContact CG-CG1 4.11Å; P29-V48 HydrophobicContact CB-CG2 4.29Å; V48-Q50 WeakPolarHBondContact CG1-O 3.31Å; V48-N51 HydrophobicContact CB-CB 4.17Å; V48-N51 HydrophobicContact CG1-CB 3.91Å; V48-L56 HydrophobicContact CG2-CD1 4.22Å; V48-L56 HydrophobicContact CG2-CD2 3.79Å; V48-L56 HydrophobicContact CG2-CG 4.45Å; V48-H87 PolarHBondContact N-O 2.94Å; V48-H87 PolarHBondContact O-CD2 2.95Å; V48-L108 HydrophobicContact CG1-CD2 4.07Å; V48-L108 HydrophobicContact CG2-CD1 4.26Å; V48-L108 HydrophobicContact CG2-CD2 4.21Å
49	D	87.4	Confident	94.3	Very high	90 Å²	90	45.4 Å²	45.4	48%	0.481	25%	0.253	S	S	.	.	S	Bend	trans	-67.6	-38.3	-174.3	-66.5	-36.3	0	0	0	113.1	Q25	Q25-D49 PolarHBondContact OE1-OD2 3.06Å
50	Q	85.8	Confident	94.3	Very high	123 Å²	123	44.3 Å²	44.3	58%	0.575	24%	0.236	S	C	*	.	S	Bend	trans	-130.8	107.8	174.6	-64.8	-176.7	15.9	0	0	108.3	Q27 V48	Q27-Q50 WeakPolarHBondContact CA-O 3.37Å; Q27-Q50 WeakPolarHBondContact CB-O 3.15Å; Q27-Q50 VanDerWaalsContact CG-O 3.26Å; Q27-Q50 WeakPolarHBondContact CG-O 3.38Å; V48-Q50 WeakPolarHBondContact CG1-O 3.31Å
51	N	85.3	Confident	94.3	Very high	10 Å²	10	45.9 Å²	45.9	5%	0.053	24%	0.242	C	C	.	.			trans	-121.3	118.8	177.8	-169.4	34.5	0	0	0	112.2	Q27 V48 N53 T54 W86	Q27-N51 PolarHBondContact NE2-OD1 2.81Å; V48-N51 HydrophobicContact CB-CB 4.17Å; V48-N51 HydrophobicContact CG1-CB 3.91Å; N51-N53 PolarHBondContact O-N 2.99Å; N51-T54 PolarHBondContact ND2-N 3.07Å; N51-T54 PolarHBondContact ND2-O 2.9Å; N51-T54 VanDerWaalsContact OD1-CB 3.32Å; N51-T54 WeakPolarHBondContact OD1-CB 3.25Å; N51-T54 PolarHBondContact OD1-N 2.84Å; N51-W86 WeakPolarHBondContact CB-O 3.49Å; N51-W86 PolarHBondContact ND2-O 3.46Å
52	D	84.5	Confident	94.2	Very high	141 Å²	141	45.4 Å²	45.4	75%	0.754	25%	0.247	S	C	*	.	S	Bend	trans	-82.4	53.5	175.5	-64.5	-27.8	0	0	0	111	T54	D52-T54 PolarHBondContact O-N 2.68Å; D52-T54 VanDerWaalsContact O-N 3.12Å
53	N	84.8	Confident	94.1	Very high	86 Å²	86	51.1 Å²	51.1	46%	0.46	27%	0.273	S	S	.	.	S	Bend	trans	54.2	32.7	-179.3	-161.7	17.1	0	0	0	114	N51 W86	N51-N53 PolarHBondContact O-N 2.99Å; N53-W86 HydrophobicContact CB-CD2 3.97Å; N53-W86 HydrophobicContact CB-CE3 3.54Å; N53-W86 HydrophobicContact CB-CH2 4.18Å; N53-W86 HydrophobicContact CB-CZ3 3.66Å; N53-W86 VanDerWaalsContact CG-CD2 3.43Å; N53-W86 VanDerWaalsContact CG-CE2 3.44Å; N53-W86 VanDerWaalsContact CG-CE3 3.44Å; N53-W86 VanDerWaalsContact CG-CZ3 3.48Å; N53-W86 VanDerWaalsContact ND2-CH2 3.33Å; N53-W86 WeakPolarHBondContact ND2-CH2 3.39Å; N53-W86 WeakPolarHBondContact ND2-CZ2 3.02Å; N53-W86 VanDerWaalsContact OD1-CG 3.28Å; N53-W86 WeakPolarHBondContact OD1-CZ2 3.49Å; N53-W86 PolarHBondContact OD1-NE1 2.82Å; N53-W86 VanDerWaalsContact OD1-NE1 3.13Å
54	T	91.4	Very high	94.1	Very high	29 Å²	29	51.6 Å²	51.6	18%	0.178	27%	0.273	C	S	.	.			trans	-85	136.1	176.6	-57	0	0	0	0	109.9	Q27 N51 D52 L108 F109 T110	Q27-T54 PolarHBondContact NE2-OG1 2.7Å; N51-T54 PolarHBondContact ND2-N 3.07Å; N51-T54 PolarHBondContact ND2-O 2.9Å; N51-T54 VanDerWaalsContact OD1-CB 3.32Å; N51-T54 WeakPolarHBondContact OD1-CB 3.25Å; N51-T54 PolarHBondContact OD1-N 2.84Å; D52-T54 PolarHBondContact O-N 2.68Å; D52-T54 VanDerWaalsContact O-N 3.12Å; T54-L108 HydrophobicContact CG2-CD1 3.86Å; T54-L108 HydrophobicContact CG2-CG 4.06Å; T54-F109 HydrophobicContact CG2-CB 4.28Å; T54-F109 WeakPolarHBondContact CG2-O 3.44Å; T54-T110 HydrophobicContact CG2-CG2 4.1Å
55	S	95.1	Very high	94	Very high	32 Å²	32	53.7 Å²	53.7	22%	0.224	29%	0.286	C	S	.	.			trans	-64.3	143.7	-175.8	-66.2	0	0	0	0	113.4	F68 D69 F109	S55-F68 VanDerWaalsContact CB-CZ 3.45Å; S55-D69 WeakPolarHBondContact CA-OD1 3.29Å; S55-D69 VanDerWaalsContact CB-OD1 3.31Å; S55-D69 WeakPolarHBondContact CB-OD1 3.4Å; S55-D69 VanDerWaalsContact CB-OD2 3.24Å; S55-D69 WeakPolarHBondContact CB-OD2 3.34Å; S55-D69 PolarHBondContact OG-OD2 3.34Å; S55-F109 PolarHBondContact O-N 2.81Å; S55-F109 VanDerWaalsContact O-N 3.16Å
56	L	96.9	Very high	94	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	147.3	175.3	-77.3	170.4	0	0	0	110.7	V48 D69 L89 S107 L108	V48-L56 HydrophobicContact CG2-CD1 4.22Å; V48-L56 HydrophobicContact CG2-CD2 3.79Å; V48-L56 HydrophobicContact CG2-CG 4.45Å; L56-D69 PolarHBondContact N-OD1 3.43Å; L56-D69 PolarHBondContact O-N 2.98Å; L56-L89 HydrophobicContact CB-CB 3.84Å; L56-L89 HydrophobicContact CB-CD2 3.88Å; L56-L89 HydrophobicContact CB-CG 4.5Å; L56-L89 HydrophobicContact CD1-CB 3.9Å; L56-L89 HydrophobicContact CG-CB 4.5Å; L56-S107 CarbonylContact C-O 3.59Å; L56-S107 WeakPolarHBondContact CA-O 3.25Å; L56-L108 HydrophobicContact CD2-CB 4.15Å; L56-L108 HydrophobicContact CD2-CD1 3.6Å; L56-L108 HydrophobicContact CD2-CG 4.45Å; L56-L108 HydrophobicContact CG-CD1 4.01Å
57	Q	98.1	Very high	94	Very high	29 Å²	29	52.3 Å²	52.3	14%	0.136	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	138.5	176.4	-178.9	-167.8	-91.6	0	0	111.8	T65 Y67 F68 C106 S107 F109	Q57-T65 HydrophobicContact CG-CG2 3.51Å; Q57-T65 PolarHBondContact OE1-OG1 3.42Å; Q57-T65 VanDerWaalsContact OE1-OG1 3.14Å; Q57-Y67 VanDerWaalsContact CA-O 3.27Å; Q57-Y67 WeakPolarHBondContact CA-O 3.16Å; Q57-Y67 WeakPolarHBondContact CG-O 3.45Å; Q57-F68 HydrophobicContact CB-CD2 4.13Å; Q57-F68 HydrophobicContact CG-CD2 4.27Å; Q57-C106 CarbonylContact O-C 3.47Å; Q57-C106 VanDerWaalsContact O-CA 3.3Å; Q57-C106 WeakPolarHBondContact O-CA 3.49Å; Q57-S107 PolarHBondContact N-O 3.07Å; Q57-S107 PolarHBondContact O-N 3.31Å; Q57-F109 HydrophobicContact CB-CE2 3.55Å; Q57-F109 HydrophobicContact CB-CZ 4.29Å; Q57-F109 HydrophobicContact CG-CE2 4.35Å
58	W	98.4	Very high	94.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.3	163.9	-84.8	111	0	0	0	110.9	T31 L44 C46 L66 Y67 L89 I91 T105 C106 A118	T31-W58 HydrophobicContact CG2-CH2 4.37Å; T31-W58 WeakPolarHBondContact OG1-CH2 3.33Å; L44-W58 HydrophobicContact CB-CH2 4.18Å; L44-W58 HydrophobicContact CB-CZ2 3.91Å; C46-W58 HydrophobicContact CB-CZ2 3.63Å; W58-L66 HydrophobicContact CB-CB 4.28Å; W58-L66 HydrophobicContact CB-CD1 4.5Å; W58-L66 PolarHBondContact O-N 3.46Å; W58-Y67 PolarHBondContact N-O 3.5Å; W58-L89 PolarHBondContact NE1-O 3.22Å; W58-I91 HydrophobicContact CB-CD1 3.82Å; W58-I91 HydrophobicContact CD2-CD1 4.48Å; W58-I91 HydrophobicContact CG-CD1 3.84Å; W58-I91 HydrophobicContact CG-CG1 4.29Å; W58-T105 WeakPolarHBondContact CA-O 3.09Å; W58-T105 VanDerWaalsContact CE3-C 3.47Å; W58-C106 HydrophobicContact CD2-CB 4.26Å; W58-C106 HydrophobicContact CE3-CB 4.17Å; W58-C106 HydrophobicContact CH2-CB 3.96Å; W58-C106 HydrophobicContact CZ2-CB 4.04Å; W58-C106 HydrophobicContact CZ3-CB 4.02Å; W58-A118 HydrophobicContact CH2-CB 4.07Å; W58-A118 HydrophobicContact CZ3-CB 4.43Å
59	S	98.4	Very high	94.1	Very high	4 Å²	4	52 Å²	52	3%	0.028	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	148.5	164.8	61.1	0	0	0	0	111.6	Q64 Y104 T105	S59-Q64 CarbonylContact C-O 3.54Å; S59-Q64 WeakPolarHBondContact CA-O 3.42Å; S59-Q64 WeakPolarHBondContact CB-O 3.42Å; S59-Y104 WeakPolarHBondContact O-CA 3.47Å; S59-T105 PolarHBondContact N-O 2.78Å; S59-T105 PolarHBondContact O-N 3.38Å; S59-T105 PolarHBondContact OG-O 2.85Å
60	N	97.4	Very high	94.5	Very high	21 Å²	21	52.7 Å²	52.7	11%	0.112	28%	0.284	C	S	.	.			trans	-79	176.5	176.9	75.5	0.6	0	0	0	111.6	A62 Q63 Q64 L66 Y104	N60-A62 PolarHBondContact O-N 3.08Å; N60-A62 WeakPolarHBondContact OD1-CA 3.46Å; N60-A62 WeakPolarHBondContact OD1-CB 3.45Å; N60-A62 PolarHBondContact OD1-N 3.09Å; N60-Q63 WeakPolarHBondContact O-CA 3.33Å; N60-Q63 PolarHBondContact O-N 2.82Å; N60-Q63 PolarHBondContact OD1-N 3.15Å; N60-Q63 VanDerWaalsContact OD1-N 3.16Å; N60-Q64 PolarHBondContact N-O 3.35Å; N60-Q64 PolarHBondContact ND2-OE1 2.73Å; N60-Q64 WeakPolarHBondContact OD1-CB 3.49Å; N60-Q64 PolarHBondContact OD1-N 2.59Å; N60-L66 HydrophobicContact CB-CD1 4.13Å; N60-L66 HydrophobicContact CB-CD2 3.94Å; N60-L66 HydrophobicContact CB-CG 4.15Å; N60-Y104 HydrophobicContact CB-CD1 4.31Å; N60-Y104 HydrophobicContact CB-CE1 3.98Å
61	P	97	Very high	95	Very high	56 Å²	56	54 Å²	54	36%	0.364	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-31	178.1	-27.4	36.5	0	0	0	114.1	Q63 Q103 Y104	P61-Q63 PolarHBondContact O-N 2.79Å; P61-Q103 WeakPolarHBondContact CA-O 3.44Å; P61-Y104 HydrophobicContact CG-CD2 4.25Å; P61-Y104 HydrophobicContact CG-CE2 3.97Å
62	A	96.3	Very high	95.6	Very high	72 Å²	72	57.6 Å²	57.6	60%	0.595	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	9.6	174.4	0	0	0	0	0	113.8	N60 Q64	N60-A62 PolarHBondContact O-N 3.08Å; N60-A62 WeakPolarHBondContact OD1-CA 3.46Å; N60-A62 WeakPolarHBondContact OD1-CB 3.45Å; N60-A62 PolarHBondContact OD1-N 3.09Å; A62-Q64 HydrophobicContact CB-CG 4.34Å; A62-Q64 PolarHBondContact O-N 3.41Å
63	Q	95.9	Very high	96.1	Very high	121 Å²	121	53.7 Å²	53.7	57%	0.565	29%	0.291	S	S	*	.			trans	61.9	19.3	-178.7	-55.1	-57.9	-49.8	0	0	114.7	N60 P61	N60-Q63 WeakPolarHBondContact O-CA 3.33Å; N60-Q63 PolarHBondContact O-N 2.82Å; N60-Q63 PolarHBondContact OD1-N 3.15Å; N60-Q63 VanDerWaalsContact OD1-N 3.16Å; P61-Q63 PolarHBondContact O-N 2.79Å
64	Q	97.1	Very high	96.6	Very high	98 Å²	98	51.8 Å²	51.8	46%	0.458	28%	0.28	S	S	.	.			trans	-81.5	133.6	173.1	-59.3	171.4	-45.6	0	0	109.6	S59 N60 A62 L66	S59-Q64 CarbonylContact C-O 3.54Å; S59-Q64 WeakPolarHBondContact CA-O 3.42Å; S59-Q64 WeakPolarHBondContact CB-O 3.42Å; N60-Q64 PolarHBondContact N-O 3.35Å; N60-Q64 PolarHBondContact ND2-OE1 2.73Å; N60-Q64 WeakPolarHBondContact OD1-CB 3.49Å; N60-Q64 PolarHBondContact OD1-N 2.59Å; A62-Q64 HydrophobicContact CB-CG 4.34Å; A62-Q64 PolarHBondContact O-N 3.41Å; Q64-L66 PolarHBondContact O-N 2.84Å
65	T	97.9	Very high	96.6	Very high	44 Å²	44	62.1 Å²	62.1	27%	0.27	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	124.9	175	-58.5	0	0	0	0	110.4	Q57 F68 A73 L74	Q57-T65 HydrophobicContact CG-CG2 3.51Å; Q57-T65 PolarHBondContact OE1-OG1 3.42Å; Q57-T65 VanDerWaalsContact OE1-OG1 3.14Å; T65-F68 HydrophobicContact CG2-CB 4.36Å; T65-A73 HydrophobicContact CG2-CB 3.72Å; T65-A73 WeakPolarHBondContact O-CB 3.43Å; T65-L74 PolarHBondContact O-N 3.5Å
66	L	97.8	Very high	96.6	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-55.6	175.1	-60.1	-178.4	0	0	0	110.1	W58 N60 Q64 A73 L74 I79 I91 Y104	W58-L66 HydrophobicContact CB-CB 4.28Å; W58-L66 HydrophobicContact CB-CD1 4.5Å; W58-L66 PolarHBondContact O-N 3.46Å; N60-L66 HydrophobicContact CB-CD1 4.13Å; N60-L66 HydrophobicContact CB-CD2 3.94Å; N60-L66 HydrophobicContact CB-CG 4.15Å; Q64-L66 PolarHBondContact O-N 2.84Å; L66-A73 PolarHBondContact O-N 3.16Å; L66-L74 HydrophobicContact CD2-CB 4.02Å; L66-L74 HydrophobicContact CD2-CD2 3.43Å; L66-L74 VanDerWaalsContact CD2-CD2 3.43Å; L66-L74 HydrophobicContact CD2-CG 4.37Å; L66-L74 PolarHBondContact O-N 3.33Å; L66-I79 HydrophobicContact CD1-CD1 4.31Å; L66-I79 HydrophobicContact CD2-CD1 3.61Å; L66-I79 HydrophobicContact CG-CD1 4.47Å; L66-I91 HydrophobicContact CB-CD1 4.26Å; L66-I91 HydrophobicContact CD1-CD1 3.7Å; L66-Y104 HydrophobicContact CD1-CD1 3.87Å; L66-Y104 HydrophobicContact CD1-CE1 3.84Å
67	Y	98.3	Very high	96.5	Very high	12 Å²	12	69.1 Å²	69.1	5%	0.047	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.4	178	-82.5	-97.2	0	0	0	109.7	Q57 W58 K71 K72 I79 L81 I91	Q57-Y67 VanDerWaalsContact CA-O 3.27Å; Q57-Y67 WeakPolarHBondContact CA-O 3.16Å; Q57-Y67 WeakPolarHBondContact CG-O 3.45Å; W58-Y67 PolarHBondContact N-O 3.5Å; Y67-K71 WeakPolarHBondContact CA-O 3.26Å; Y67-K72 HydrophobicContact CD1-CB 4.16Å; Y67-K72 HydrophobicContact CE1-CB 3.56Å; Y67-K72 HydrophobicContact CE1-CG 4.03Å; Y67-K72 HydrophobicContact CE2-CB 4.4Å; Y67-K72 HydrophobicContact CE2-CD 4.41Å; Y67-K72 HydrophobicContact CE2-CG 3.96Å; Y67-K72 WeakPolarHBondContact OH-CD 3.34Å; Y67-I79 HydrophobicContact CD2-CG2 4.28Å; Y67-I79 HydrophobicContact CE2-CG2 3.82Å; Y67-I79 PolarHBondContact OH-O 3.49Å; Y67-I79 VanDerWaalsContact OH-O 3.13Å; Y67-L81 HydrophobicContact CD1-CB 4.41Å; Y67-L81 HydrophobicContact CD1-CD1 4.09Å; Y67-L81 HydrophobicContact CE1-CB 3.7Å; Y67-L81 HydrophobicContact CE1-CD1 4.24Å; Y67-L81 HydrophobicContact CE1-CG 4.41Å; Y67-L81 PolarHBondContact OH-N 2.82Å; Y67-I91 HydrophobicContact CD2-CB 4.5Å; Y67-I91 HydrophobicContact CD2-CG2 3.6Å; Y67-I91 HydrophobicContact CE2-CG2 4.09Å; Y67-I91 HydrophobicContact CG-CG2 3.95Å
68	F	97.3	Very high	96.5	Very high	72 Å²	72	70.3 Å²	70.3	32%	0.316	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	112.8	167.9	-175.6	-77.9	0	0	0	107.1	S55 Q57 T65 D70 K71 F109	S55-F68 VanDerWaalsContact CB-CZ 3.45Å; Q57-F68 HydrophobicContact CB-CD2 4.13Å; Q57-F68 HydrophobicContact CG-CD2 4.27Å; T65-F68 HydrophobicContact CG2-CB 4.36Å; F68-D70 PolarHBondContact O-N 3.03Å; F68-K71 PolarHBondContact N-O 3.48Å; F68-K71 WeakPolarHBondContact O-CB 3.33Å; F68-K71 PolarHBondContact O-N 3.41Å; F68-F109 AromaticContact CD2-CE2 3.88Å; F68-F109 HydrophobicContact CD2-CE2 3.88Å; F68-F109 HydrophobicContact CD2-CZ 4.29Å; F68-F109 AromaticContact CE2-CD2 3.78Å; F68-F109 HydrophobicContact CE2-CD2 3.78Å; F68-F109 AromaticContact CE2-CE2 3.42Å; F68-F109 HydrophobicContact CE2-CE2 3.42Å; F68-F109 VanDerWaalsContact CE2-CE2 3.42Å; F68-F109 HydrophobicContact CE2-CG 4.46Å; F68-F109 AromaticContact CE2-CZ 3.84Å; F68-F109 HydrophobicContact CE2-CZ 3.84Å; F68-F109 HydrophobicContact CZ-CD2 4.41Å; F68-F109 HydrophobicContact CZ-CE2 4.44Å
69	D	95.3	Very high	96.4	Very high	49 Å²	49	70.8 Å²	70.8	26%	0.262	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	-124.3	-164.8	-59.9	-37.8	0	0	0	110.8	S55 L56 K71 L89	S55-D69 WeakPolarHBondContact CA-OD1 3.29Å; S55-D69 VanDerWaalsContact CB-OD1 3.31Å; S55-D69 WeakPolarHBondContact CB-OD1 3.4Å; S55-D69 VanDerWaalsContact CB-OD2 3.24Å; S55-D69 WeakPolarHBondContact CB-OD2 3.34Å; S55-D69 PolarHBondContact OG-OD2 3.34Å; L56-D69 PolarHBondContact N-OD1 3.43Å; L56-D69 PolarHBondContact O-N 2.98Å; D69-K71 VanDerWaalsContact C-N 3.33Å; D69-L89 WeakPolarHBondContact O-CD1 3.48Å
70	D	95.7	Very high	96.4	Very high	106 Å²	106	76.1 Å²	76.1	57%	0.567	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-1	177.3	64.5	-23.4	0	0	0	113.7	F68 L81 A84	F68-D70 PolarHBondContact O-N 3.03Å; D70-L81 HydrophobicContact CB-CD2 4.23Å; D70-A84 HydrophobicContact CB-CB 3.94Å
71	K	96.9	Very high	96.4	Very high	150 Å²	150	78.1 Å²	78.1	65%	0.652	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	118.6	-174.4	-60.8	177.7	-174.7	170.6	0	111.2	Y67 F68 D69 A73	Y67-K71 WeakPolarHBondContact CA-O 3.26Å; F68-K71 PolarHBondContact N-O 3.48Å; F68-K71 WeakPolarHBondContact O-CB 3.33Å; F68-K71 PolarHBondContact O-N 3.41Å; D69-K71 VanDerWaalsContact C-N 3.33Å; K71-A73 PolarHBondContact O-N 3.15Å
72	K	97	Very high	96.4	Very high	85 Å²	85	79.1 Å²	79.1	37%	0.37	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	125.4	171.8	-168.3	173.1	-172.7	163.5	0	110.4	Y67 L74 D76 I79	Y67-K72 HydrophobicContact CD1-CB 4.16Å; Y67-K72 HydrophobicContact CE1-CB 3.56Å; Y67-K72 HydrophobicContact CE1-CG 4.03Å; Y67-K72 HydrophobicContact CE2-CB 4.4Å; Y67-K72 HydrophobicContact CE2-CD 4.41Å; Y67-K72 HydrophobicContact CE2-CG 3.96Å; Y67-K72 WeakPolarHBondContact OH-CD 3.34Å; K72-L74 WeakPolarHBondContact CE-O 3.27Å; K72-L74 WeakPolarHBondContact CG-O 3.33Å; K72-D76 WeakPolarHBondContact CE-O 3.43Å; K72-D76 PolarHBondContact NZ-O 3.01Å; K72-I79 VanDerWaalsContact CE-O 3.23Å; K72-I79 WeakPolarHBondContact CE-O 3.44Å; K72-I79 PolarHBondContact NZ-O 3.3Å
73	A	95.9	Very high	96.5	Very high	59 Å²	59	82.2 Å²	82.2	49%	0.488	39%	0.392	S	S	.	.			trans	-103.1	-41.2	178.6	0	0	0	0	0	112.3	T65 L66 K71	T65-A73 HydrophobicContact CG2-CB 3.72Å; T65-A73 WeakPolarHBondContact O-CB 3.43Å; L66-A73 PolarHBondContact O-N 3.16Å; K71-A73 PolarHBondContact O-N 3.15Å
74	L	94.8	Very high	96.5	Very high	47 Å²	47	78.4 Å²	78.4	25%	0.246	38%	0.382	C	S	.	.	S	Bend	trans	-88.9	129	177.5	-170.4	67.2	0	0	0	111	T65 L66 K72 D76 I79	T65-L74 PolarHBondContact O-N 3.5Å; L66-L74 HydrophobicContact CD2-CB 4.02Å; L66-L74 HydrophobicContact CD2-CD2 3.43Å; L66-L74 VanDerWaalsContact CD2-CD2 3.43Å; L66-L74 HydrophobicContact CD2-CG 4.37Å; L66-L74 PolarHBondContact O-N 3.33Å; K72-L74 WeakPolarHBondContact CE-O 3.27Å; K72-L74 WeakPolarHBondContact CG-O 3.33Å; L74-D76 HydrophobicContact CD2-CB 4.24Å; L74-D76 HydrophobicContact CG-CB 4.37Å; L74-D76 PolarHBondContact O-N 3.21Å; L74-I79 HydrophobicContact CD2-CD1 4.23Å
75	R	91.9	Very high	96.4	Very high	246 Å²	246	76.2 Å²	76.2	93%	0.928	38%	0.378	S	S	*	.			trans	-81.3	62.6	174.6	-65.2	-175	-178.3	-177.6	0.4	111.6
76	D	94.3	Very high	96	Very high	39 Å²	39	81.4 Å²	81.4	21%	0.209	39%	0.392	C	S	.	.			trans	-112.1	119	167.1	-172.8	-21.7	0	0	0	108.6	K72 L74 R78 I79	K72-D76 WeakPolarHBondContact CE-O 3.43Å; K72-D76 PolarHBondContact NZ-O 3.01Å; L74-D76 HydrophobicContact CD2-CB 4.24Å; L74-D76 HydrophobicContact CG-CB 4.37Å; L74-D76 PolarHBondContact O-N 3.21Å; D76-R78 PolarHBondContact O-N 3.25Å; D76-R78 VanDerWaalsContact OD1-CB 3.31Å; D76-R78 WeakPolarHBondContact OD1-CB 3.31Å; D76-R78 WeakPolarHBondContact OD1-CG 3.37Å; D76-R78 PolarHBondContact OD1-N 2.89Å; D76-R78 IonicContact OD1-NE 3.42Å; D76-R78 PolarHBondContact OD1-NE 2.85Å; D76-R78 IonicContact OD2-CZ 2.68Å; D76-R78 IonicContact OD2-NE 2.8Å; D76-R78 PolarHBondContact OD2-NE 2.81Å; D76-R78 IonicContact OD2-NH2 3.38Å; D76-R78 PolarHBondContact OD2-NH2 3.44Å; D76-I79 HydrophobicContact CB-CD1 3.97Å; D76-I79 HydrophobicContact CB-CG1 4.01Å; D76-I79 PolarHBondContact O-N 3.47Å
77	N	94.9	Very high	95.8	Very high	140 Å²	140	85.6 Å²	85.6	75%	0.749	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-20	-177.1	-70.4	-16.4	0	0	0	113	I79	N77-I79 PolarHBondContact O-N 2.67Å
78	R	97.4	Very high	95.6	Very high	55 Å²	55	85.8 Å²	85.8	21%	0.208	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-18.4	176.8	-60	-180	-54.5	132.7	5.4	113	D76 V93 S94 D95 D100	D76-R78 PolarHBondContact O-N 3.25Å; D76-R78 VanDerWaalsContact OD1-CB 3.31Å; D76-R78 WeakPolarHBondContact OD1-CB 3.31Å; D76-R78 WeakPolarHBondContact OD1-CG 3.37Å; D76-R78 PolarHBondContact OD1-N 2.89Å; D76-R78 IonicContact OD1-NE 3.42Å; D76-R78 PolarHBondContact OD1-NE 2.85Å; D76-R78 IonicContact OD2-CZ 2.68Å; D76-R78 IonicContact OD2-NE 2.8Å; D76-R78 PolarHBondContact OD2-NE 2.81Å; D76-R78 IonicContact OD2-NH2 3.38Å; D76-R78 PolarHBondContact OD2-NH2 3.44Å; R78-V93 CarbonylContact O-C 3.59Å; R78-V93 WeakPolarHBondContact O-CA 3.13Å; R78-S94 WeakPolarHBondContact CA-OG 3.19Å; R78-S94 WeakPolarHBondContact CB-O 3.44Å; R78-S94 PolarHBondContact O-N 3.38Å; R78-S94 PolarHBondContact O-OG 3.28Å; R78-D95 PolarHBondContact NH1-O 3.49Å; R78-D100 IonicContact CZ-OD1 2.91Å; R78-D100 IonicContact CZ-OD2 3.11Å; R78-D100 VanDerWaalsContact NH1-CG 3.34Å; R78-D100 IonicContact NH1-OD1 2.79Å; R78-D100 PolarHBondContact NH1-OD1 3.12Å; R78-D100 IonicContact NH1-OD2 2.76Å; R78-D100 PolarHBondContact NH1-OD2 3.34Å; R78-D100 IonicContact NH2-OD1 3.56Å; R78-D100 PolarHBondContact NH2-OD1 3.31Å; R78-D100 IonicContact NH2-OD2 2.81Å
79	I	97.3	Very high	95.7	Very high	9 Å²	9	82.4 Å²	82.4	5%	0.046	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	108.4	-175.8	-47.5	-179.5	0	0	0	110	L66 Y67 K72 L74 D76 N77 I91 S92 V93	L66-I79 HydrophobicContact CD1-CD1 4.31Å; L66-I79 HydrophobicContact CD2-CD1 3.61Å; L66-I79 HydrophobicContact CG-CD1 4.47Å; Y67-I79 HydrophobicContact CD2-CG2 4.28Å; Y67-I79 HydrophobicContact CE2-CG2 3.82Å; Y67-I79 PolarHBondContact OH-O 3.49Å; Y67-I79 VanDerWaalsContact OH-O 3.13Å; K72-I79 VanDerWaalsContact CE-O 3.23Å; K72-I79 WeakPolarHBondContact CE-O 3.44Å; K72-I79 PolarHBondContact NZ-O 3.3Å; L74-I79 HydrophobicContact CD2-CD1 4.23Å; D76-I79 HydrophobicContact CB-CD1 3.97Å; D76-I79 HydrophobicContact CB-CG1 4.01Å; D76-I79 PolarHBondContact O-N 3.47Å; N77-I79 PolarHBondContact O-N 2.67Å; I79-I91 HydrophobicContact CG2-CB 4.5Å; I79-I91 HydrophobicContact CG2-CD1 4.12Å; I79-S92 CarbonylContact C-O 3.57Å; I79-S92 VanDerWaalsContact CA-O 3.25Å; I79-S92 WeakPolarHBondContact CA-O 3.29Å; I79-V93 HydrophobicContact CG1-CG1 4.4Å; I79-V93 HydrophobicContact CG1-CG2 4.29Å; I79-V93 HydrophobicContact CG2-CG2 4.46Å
80	E	97.6	Very high	95.8	Very high	117 Å²	117	80.2 Å²	80.2	55%	0.547	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	151.5	-176.8	-62.7	-165.6	157.1	0	0	111.8	V82 I91 S92	E80-V82 PolarHBondContact O-N 3.3Å; E80-I91 CarbonylContact O-C 3.52Å; E80-I91 VanDerWaalsContact O-CA 3.29Å; E80-I91 WeakPolarHBondContact O-CA 3.38Å; E80-S92 PolarHBondContact N-O 3.47Å; E80-S92 PolarHBondContact O-N 2.87Å; E80-S92 PolarHBondContact O-OG 2.91Å
81	L	97.8	Very high	95.9	Very high	63 Å²	63	75.1 Å²	75.1	33%	0.33	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	120.7	175.7	-175.7	66.7	0	0	0	108.9	Y67 D70 A84 L89 I91	Y67-L81 HydrophobicContact CD1-CB 4.41Å; Y67-L81 HydrophobicContact CD1-CD1 4.09Å; Y67-L81 HydrophobicContact CE1-CB 3.7Å; Y67-L81 HydrophobicContact CE1-CD1 4.24Å; Y67-L81 HydrophobicContact CE1-CG 4.41Å; Y67-L81 PolarHBondContact OH-N 2.82Å; D70-L81 HydrophobicContact CB-CD2 4.23Å; L81-A84 HydrophobicContact CD1-CB 4.02Å; L81-A84 HydrophobicContact CD2-CB 3.86Å; L81-A84 HydrophobicContact CG-CB 4.39Å; L81-L89 HydrophobicContact CD1-CD1 3.78Å; L81-I91 HydrophobicContact CD1-CG2 4.32Å
82	V	98	Very high	96	Very high	77 Å²	77	68.9 Å²	68.9	47%	0.467	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-47.2	173.9	177.7	0	0	0	0	109.7	E80 S90	E80-V82 PolarHBondContact O-N 3.3Å; V82-S90 WeakPolarHBondContact CA-O 3.4Å; V82-S90 WeakPolarHBondContact CB-O 3.4Å; V82-S90 PolarHBondContact N-O 2.81Å
83	R	97.2	Very high	96.1	Very high	136 Å²	136	64.9 Å²	64.9	51%	0.513	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	133.4	-179.8	-161.4	-177.9	-166.3	172	8.9	110.9	E88 L89 S90	R83-E88 VanDerWaalsContact CD-OE2 3.23Å; R83-E88 WeakPolarHBondContact CD-OE2 3.39Å; R83-E88 IonicContact CZ-OE2 3.97Å; R83-E88 IonicContact NE-OE2 3.95Å; R83-E88 IonicContact NH1-OE2 3.06Å; R83-E88 PolarHBondContact NH1-OE2 2.86Å; R83-L89 WeakPolarHBondContact O-CA 3.47Å; R83-S90 PolarHBondContact N-O 3.21Å; R83-S90 PolarHBondContact O-N 2.9Å
84	A	96.7	Very high	96.2	Very high	42 Å²	42	64.1 Å²	64.1	35%	0.347	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129	166.7	0	0	0	0	0	110	D70 L81 E88 L89	D70-A84 HydrophobicContact CB-CB 3.94Å; L81-A84 HydrophobicContact CD1-CB 4.02Å; L81-A84 HydrophobicContact CD2-CB 3.86Å; L81-A84 HydrophobicContact CG-CB 4.39Å; A84-E88 CarbonylContact C-O 3.58Å; A84-L89 HydrophobicContact CB-CD1 4.24Å
85	S	94.6	Very high	96.3	Very high	52 Å²	52	66.9 Å²	66.9	36%	0.364	32%	0.323	S	S	.	.			trans	-154.1	175.7	167.8	70.5	0	0	0	0	108	H87 E88	S85-H87 PolarHBondContact O-N 3.42Å; S85-H87 PolarHBondContact OG-N 2.87Å; S85-E88 PolarHBondContact N-O 2.82Å; S85-E88 PolarHBondContact O-N 3.43Å; S85-E88 VanDerWaalsContact O-O 3.06Å; S85-E88 PolarHBondContact OG-N 3.47Å; S85-E88 VanDerWaalsContact OG-N 3.09Å; S85-E88 PolarHBondContact OG-O 2.8Å
86	W	89.4	Confident	96.6	Very high	153 Å²	153	55.2 Å²	55.2	58%	0.58	28%	0.28	S	S	*	.	S	Bend	trans	-65.8	-27.9	176.5	-50.3	-11.9	0	0	0	111.2	N51 N53	N51-W86 WeakPolarHBondContact CB-O 3.49Å; N51-W86 PolarHBondContact ND2-O 3.46Å; N53-W86 HydrophobicContact CB-CD2 3.97Å; N53-W86 HydrophobicContact CB-CE3 3.54Å; N53-W86 HydrophobicContact CB-CH2 4.18Å; N53-W86 HydrophobicContact CB-CZ3 3.66Å; N53-W86 VanDerWaalsContact CG-CD2 3.43Å; N53-W86 VanDerWaalsContact CG-CE2 3.44Å; N53-W86 VanDerWaalsContact CG-CE3 3.44Å; N53-W86 VanDerWaalsContact CG-CZ3 3.48Å; N53-W86 VanDerWaalsContact ND2-CH2 3.33Å; N53-W86 WeakPolarHBondContact ND2-CH2 3.39Å; N53-W86 WeakPolarHBondContact ND2-CZ2 3.02Å; N53-W86 VanDerWaalsContact OD1-CG 3.28Å; N53-W86 WeakPolarHBondContact OD1-CZ2 3.49Å; N53-W86 PolarHBondContact OD1-NE1 2.82Å; N53-W86 VanDerWaalsContact OD1-NE1 3.13Å
87	H	92.8	Very high	96.6	Very high	88 Å²	88	54.9 Å²	54.9	41%	0.407	28%	0.28	S	S	.	.	S	Bend	trans	-97.4	-10.2	-176.9	-63.8	80.3	0	0	0	113.6	R47 V48 S85	R47-H87 CarbonylContact C-O 3.53Å; R47-H87 VanDerWaalsContact CA-O 3.32Å; R47-H87 WeakPolarHBondContact CA-O 3.21Å; V48-H87 PolarHBondContact N-O 2.94Å; V48-H87 PolarHBondContact O-CD2 2.95Å; S85-H87 PolarHBondContact O-N 3.42Å; S85-H87 PolarHBondContact OG-N 2.87Å
88	E	95.8	Very high	96.6	Very high	16 Å²	16	49 Å²	49	8%	0.075	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	129.2	-173.4	-177.5	170.8	-164.3	0	0	111.3	T45 C46 R47 R83 A84 S85 S90	T45-E88 HydrophobicContact CG2-CG 4.45Å; T45-E88 WeakPolarHBondContact CG2-OE1 3.47Å; C46-E88 CarbonylContact O-C 3.51Å; C46-E88 VanDerWaalsContact O-CA 3.26Å; C46-E88 WeakPolarHBondContact O-CA 3.45Å; R47-E88 HydrophobicContact CG-CB 4.3Å; R47-E88 HydrophobicContact CG-CG 4Å; R47-E88 IonicContact CZ-OE1 3.38Å; R47-E88 VanDerWaalsContact CZ-OE1 3.26Å; R47-E88 IonicContact CZ-OE2 3.77Å; R47-E88 IonicContact NE-OE1 3.38Å; R47-E88 PolarHBondContact NE-OE1 3.42Å; R47-E88 VanDerWaalsContact NE-OE1 3.11Å; R47-E88 IonicContact NE-OE2 2.81Å; R47-E88 IonicContact NH2-OE1 3.18Å; R47-E88 PolarHBondContact NH2-OE1 2.91Å; R47-E88 IonicContact NH2-OE2 3.99Å; R47-E88 PolarHBondContact NH2-OE2 3.47Å; R83-E88 VanDerWaalsContact CD-OE2 3.23Å; R83-E88 WeakPolarHBondContact CD-OE2 3.39Å; R83-E88 IonicContact CZ-OE2 3.97Å; R83-E88 IonicContact NE-OE2 3.95Å; R83-E88 IonicContact NH1-OE2 3.06Å; R83-E88 PolarHBondContact NH1-OE2 2.86Å; A84-E88 CarbonylContact C-O 3.58Å; S85-E88 PolarHBondContact N-O 2.82Å; S85-E88 PolarHBondContact O-N 3.43Å; S85-E88 VanDerWaalsContact O-O 3.06Å; S85-E88 PolarHBondContact OG-N 3.47Å; S85-E88 VanDerWaalsContact OG-N 3.09Å; S85-E88 PolarHBondContact OG-O 2.8Å; E88-S90 WeakPolarHBondContact CG-OG 3.29Å; E88-S90 PolarHBondContact OE1-OG 2.98Å
89	L	97.8	Very high	96.5	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	109.5	167.6	-179.2	63.3	0	0	0	109.1	C46 L56 W58 D69 L81 R83 A84	C46-L89 PolarHBondContact N-O 3.04Å; C46-L89 PolarHBondContact O-N 3.49Å; L56-L89 HydrophobicContact CB-CB 3.84Å; L56-L89 HydrophobicContact CB-CD2 3.88Å; L56-L89 HydrophobicContact CB-CG 4.5Å; L56-L89 HydrophobicContact CD1-CB 3.9Å; L56-L89 HydrophobicContact CG-CB 4.5Å; W58-L89 PolarHBondContact NE1-O 3.22Å; D69-L89 WeakPolarHBondContact O-CD1 3.48Å; L81-L89 HydrophobicContact CD1-CD1 3.78Å; R83-L89 WeakPolarHBondContact O-CA 3.47Å; A84-L89 HydrophobicContact CB-CD1 4.24Å
90	S	98.4	Very high	96.4	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.9	-177.2	-57.6	0	0	0	0	110.5	L44 T45 V82 R83 E88	L44-S90 CarbonylContact O-C 3.52Å; L44-S90 VanDerWaalsContact O-CA 3.26Å; L44-S90 WeakPolarHBondContact O-CA 3.44Å; T45-S90 WeakPolarHBondContact CG2-OG 3.32Å; T45-S90 PolarHBondContact OG1-OG 2.99Å; V82-S90 WeakPolarHBondContact CA-O 3.4Å; V82-S90 WeakPolarHBondContact CB-O 3.4Å; V82-S90 PolarHBondContact N-O 2.81Å; R83-S90 PolarHBondContact N-O 3.21Å; R83-S90 PolarHBondContact O-N 2.9Å; E88-S90 WeakPolarHBondContact CG-OG 3.29Å; E88-S90 PolarHBondContact OE1-OG 2.98Å
91	I	98.3	Very high	96.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	148.8	-179.9	62.4	173.1	0	0	0	110	I43 L44 W58 L66 Y67 I79 E80 L81	I43-I91 CarbonylContact C-O 3.59Å; I43-I91 WeakPolarHBondContact CA-O 3.46Å; L44-I91 HydrophobicContact CB-CG1 3.93Å; L44-I91 HydrophobicContact CD1-CD1 4.23Å; L44-I91 HydrophobicContact CD1-CG1 4.37Å; L44-I91 PolarHBondContact N-O 2.94Å; L44-I91 PolarHBondContact O-N 3.46Å; W58-I91 HydrophobicContact CB-CD1 3.82Å; W58-I91 HydrophobicContact CD2-CD1 4.48Å; W58-I91 HydrophobicContact CG-CD1 3.84Å; W58-I91 HydrophobicContact CG-CG1 4.29Å; L66-I91 HydrophobicContact CB-CD1 4.26Å; L66-I91 HydrophobicContact CD1-CD1 3.7Å; Y67-I91 HydrophobicContact CD2-CB 4.5Å; Y67-I91 HydrophobicContact CD2-CG2 3.6Å; Y67-I91 HydrophobicContact CE2-CG2 4.09Å; Y67-I91 HydrophobicContact CG-CG2 3.95Å; I79-I91 HydrophobicContact CG2-CB 4.5Å; I79-I91 HydrophobicContact CG2-CD1 4.12Å; E80-I91 CarbonylContact O-C 3.52Å; E80-I91 VanDerWaalsContact O-CA 3.29Å; E80-I91 WeakPolarHBondContact O-CA 3.38Å; L81-I91 HydrophobicContact CD1-CG2 4.32Å
92	S	98.3	Very high	96.4	Very high	18 Å²	18	45.6 Å²	45.6	13%	0.126	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	141.3	171.7	53	0	0	0	0	110.2	A42 I79 E80	A42-S92 CarbonylContact O-C 3.57Å; A42-S92 VanDerWaalsContact O-CA 3.25Å; A42-S92 WeakPolarHBondContact O-CA 3.31Å; I79-S92 CarbonylContact C-O 3.57Å; I79-S92 VanDerWaalsContact CA-O 3.25Å; I79-S92 WeakPolarHBondContact CA-O 3.29Å; E80-S92 PolarHBondContact N-O 3.47Å; E80-S92 PolarHBondContact O-N 2.87Å; E80-S92 PolarHBondContact O-OG 2.91Å
93	V	98.1	Very high	96.4	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	107.1	169	-173.1	0	0	0	0	106.6	T41 A42 R78 I79 V96	T41-V93 CarbonylContact C-O 3.6Å; T41-V93 VanDerWaalsContact CA-O 3.29Å; T41-V93 WeakPolarHBondContact CA-O 3.27Å; A42-V93 PolarHBondContact N-O 3.07Å; A42-V93 PolarHBondContact O-N 3.26Å; R78-V93 CarbonylContact O-C 3.59Å; R78-V93 WeakPolarHBondContact O-CA 3.13Å; I79-V93 HydrophobicContact CG1-CG1 4.4Å; I79-V93 HydrophobicContact CG1-CG2 4.29Å; I79-V93 HydrophobicContact CG2-CG2 4.46Å; V93-V96 HydrophobicContact CB-CG2 4.28Å; V93-V96 HydrophobicContact CG1-CG2 4.13Å; V93-V96 WeakPolarHBondContact O-CG2 3.48Å
94	S	98.1	Very high	96.5	Very high	43 Å²	43	39.3 Å²	39.3	30%	0.301	22%	0.217	S	C	.	.			trans	-85.1	161.9	176.4	63.7	0	0	0	0	111.6	R78 V96	R78-S94 WeakPolarHBondContact CA-OG 3.19Å; R78-S94 WeakPolarHBondContact CB-O 3.44Å; R78-S94 PolarHBondContact O-N 3.38Å; R78-S94 PolarHBondContact O-OG 3.28Å; S94-V96 VanDerWaalsContact C-N 3.32Å; S94-V96 PolarHBondContact O-N 2.97Å
95	D	97.3	Very high	96.6	Very high	106 Å²	106	37.7 Å²	37.7	57%	0.567	20%	0.202	S	C	*	.	S	Bend	trans	49.9	55.1	177.7	-168.4	31.7	0	0	0	111.3	G40 R78 S97	G40-D95 PolarHBondContact O-N 3.35Å; R78-D95 PolarHBondContact NH1-O 3.49Å; D95-S97 PolarHBondContact O-N 3.03Å
96	V	97.8	Very high	96.7	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	19%	0.185	C	C	.	.			trans	-69.8	127.4	-175.4	176	0	0	0	0	109.9	V36 E38 G39 G40 A42 V93 S94 D100 L120 V122	V36-V96 HydrophobicContact CG1-CB 4Å; V36-V96 HydrophobicContact CG1-CG1 3.66Å; V36-V96 HydrophobicContact CG1-CG2 4.13Å; E38-V96 CarbonylContact C-O 3.57Å; E38-V96 WeakPolarHBondContact CA-O 3.44Å; G39-V96 PolarHBondContact N-O 3.42Å; G40-V96 WeakPolarHBondContact O-CG2 3.46Å; G40-V96 PolarHBondContact O-N 2.91Å; A42-V96 HydrophobicContact CB-CG2 4.02Å; V93-V96 HydrophobicContact CB-CG2 4.28Å; V93-V96 HydrophobicContact CG1-CG2 4.13Å; V93-V96 WeakPolarHBondContact O-CG2 3.48Å; S94-V96 VanDerWaalsContact C-N 3.32Å; S94-V96 PolarHBondContact O-N 2.97Å; V96-D100 HydrophobicContact CG1-CB 4.14Å; V96-L120 HydrophobicContact CG1-CD2 4.41Å; V96-V122 HydrophobicContact CG1-CB 4.38Å; V96-V122 HydrophobicContact CG1-CG1 3.99Å; V96-V122 HydrophobicContact CG1-CG2 3.45Å; V96-V122 VanDerWaalsContact CG1-CG2 3.45Å
97	S	95.8	Very high	97.1	Very high	32 Å²	32	28.6 Å²	28.6	22%	0.224	16%	0.162	C	C	.	.			trans	-106.2	163.5	176.8	70.3	0	0	0	0	111.5	D95 S99 D100	D95-S97 PolarHBondContact O-N 3.03Å; S97-S99 PolarHBondContact O-N 2.84Å; S97-S99 PolarHBondContact OG-N 2.87Å; S97-S99 PolarHBondContact OG-OG 3.27Å; S97-D100 WeakPolarHBondContact CB-OD2 3.43Å; S97-D100 PolarHBondContact N-OD2 3.29Å; S97-D100 PolarHBondContact O-N 2.88Å; S97-D100 PolarHBondContact OG-OD2 2.85Å
98	L	95.2	Very high	97.3	Very high	17 Å²	17	24.4 Å²	24.4	9%	0.089	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-12.2	171.7	-65.8	170.3	0	0	0	114.3	V122 K154 K182 T183	L98-V122 HydrophobicContact CD2-CB 4.3Å; L98-V122 HydrophobicContact CD2-CG1 4.06Å; L98-K154 HydrophobicContact CD2-CD 3.66Å; L98-K182 HydrophobicContact CB-CD 3.69Å; L98-K182 HydrophobicContact CD1-CB 4.1Å; L98-K182 PolarHBondContact O-NZ 2.91Å; L98-T183 HydrophobicContact CD1-CG2 3.55Å
99	S	94.3	Very high	97.3	Very high	88 Å²	88	27.7 Å²	27.7	62%	0.615	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-21.2	172.5	16.9	0	0	0	0	114.2	S97 E101	S97-S99 PolarHBondContact O-N 2.84Å; S97-S99 PolarHBondContact OG-N 2.87Å; S97-S99 PolarHBondContact OG-OG 3.27Å; S99-E101 VanDerWaalsContact C-N 3.26Å
100	D	95.8	Very high	97.1	Very high	20 Å²	20	28.5 Å²	28.5	11%	0.107	16%	0.162	C	C	.	.	S	Bend	trans	-80.9	-12.3	-178.9	-59.5	-61.2	0	0	0	112.3	R78 V96 S97 Y104 L120	R78-D100 IonicContact CZ-OD1 2.91Å; R78-D100 IonicContact CZ-OD2 3.11Å; R78-D100 VanDerWaalsContact NH1-CG 3.34Å; R78-D100 IonicContact NH1-OD1 2.79Å; R78-D100 PolarHBondContact NH1-OD1 3.12Å; R78-D100 IonicContact NH1-OD2 2.76Å; R78-D100 PolarHBondContact NH1-OD2 3.34Å; R78-D100 IonicContact NH2-OD1 3.56Å; R78-D100 PolarHBondContact NH2-OD1 3.31Å; R78-D100 IonicContact NH2-OD2 2.81Å; V96-D100 HydrophobicContact CG1-CB 4.14Å; S97-D100 WeakPolarHBondContact CB-OD2 3.43Å; S97-D100 PolarHBondContact N-OD2 3.29Å; S97-D100 PolarHBondContact O-N 2.88Å; S97-D100 PolarHBondContact OG-OD2 2.85Å; D100-Y104 VanDerWaalsContact O-CE2 3.27Å; D100-Y104 WeakPolarHBondContact O-CE2 3.46Å; D100-Y104 PolarHBondContact O-OH 3.05Å; D100-L120 HydrophobicContact CB-CD2 4.37Å
101	E	97.2	Very high	96.7	Very high	56 Å²	56	37.6 Å²	37.6	26%	0.262	21%	0.206	S	C	.	.			trans	-57.1	137.4	175.7	174.5	161.3	110.7	0	0	112.1	S99 Y119 L120 V122 K154	S99-E101 VanDerWaalsContact C-N 3.26Å; E101-Y119 HydrophobicContact CG-CE1 4.08Å; E101-L120 WeakPolarHBondContact CA-O 3.29Å; E101-L120 WeakPolarHBondContact CG-O 3.07Å; E101-V122 HydrophobicContact CB-CB 4.44Å; E101-V122 HydrophobicContact CB-CG2 3.96Å; E101-V122 PolarHBondContact OE2-N 3.48Å; E101-K154 IonicContact OE1-NZ 3.29Å; E101-K154 PolarHBondContact OE1-NZ 2.97Å; E101-K154 IonicContact OE2-NZ 2.75Å; E101-K154 PolarHBondContact OE2-NZ 2.86Å
102	G	97.4	Very high	96.4	Very high	7 Å²	7	42.8 Å²	42.8	7%	0.072	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.2	-167.5	172.3	0	0	0	0	0	113.1	Y104 Y119 L120	G102-Y104 WeakPolarHBondContact O-CD2 3.47Å; G102-Y119 WeakPolarHBondContact O-CA 3.41Å; G102-L120 PolarHBondContact N-O 3.37Å; G102-L120 VanDerWaalsContact N-O 3.14Å; G102-L120 PolarHBondContact O-N 2.85Å
103	Q	98.5	Very high	96.3	Very high	72 Å²	72	45.5 Å²	45.5	34%	0.336	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	107	-174.7	-166.7	-166.1	-86.9	0	0	111.6	P61 K117 A118 Y119	P61-Q103 WeakPolarHBondContact CA-O 3.44Å; Q103-K117 HydrophobicContact CG-CB 3.96Å; Q103-K117 HydrophobicContact CG-CD 4.33Å; Q103-K117 HydrophobicContact CG-CG 4.2Å; Q103-K117 VanDerWaalsContact NE2-CD 3.25Å; Q103-A118 CarbonylContact C-O 3.51Å; Q103-A118 WeakPolarHBondContact CA-O 3.47Å; Q103-Y119 HydrophobicContact CB-CD2 3.93Å; Q103-Y119 HydrophobicContact CB-CE2 4.16Å; Q103-Y119 HydrophobicContact CG-CD2 4.4Å
104	Y	98.5	Very high	96.1	Very high	10 Å²	10	47.8 Å²	47.8	4%	0.039	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	144.9	171.5	-68.7	-104.9	0	0	0	109.7	L44 S59 N60 P61 L66 D100 G102 K117 A118 L120	L44-Y104 HydrophobicContact CD1-CD1 3.42Å; L44-Y104 VanDerWaalsContact CD1-CD1 3.42Å; L44-Y104 HydrophobicContact CD1-CD2 4.14Å; L44-Y104 HydrophobicContact CD1-CE1 3.88Å; L44-Y104 HydrophobicContact CD1-CG 3.57Å; S59-Y104 WeakPolarHBondContact O-CA 3.47Å; N60-Y104 HydrophobicContact CB-CD1 4.31Å; N60-Y104 HydrophobicContact CB-CE1 3.98Å; P61-Y104 HydrophobicContact CG-CD2 4.25Å; P61-Y104 HydrophobicContact CG-CE2 3.97Å; L66-Y104 HydrophobicContact CD1-CD1 3.87Å; L66-Y104 HydrophobicContact CD1-CE1 3.84Å; D100-Y104 VanDerWaalsContact O-CE2 3.27Å; D100-Y104 WeakPolarHBondContact O-CE2 3.46Å; D100-Y104 PolarHBondContact O-OH 3.05Å; G102-Y104 WeakPolarHBondContact O-CD2 3.47Å; Y104-K117 WeakPolarHBondContact O-CA 3.32Å; Y104-A118 PolarHBondContact N-O 3.4Å; Y104-A118 PolarHBondContact O-N 3.21Å; Y104-L120 HydrophobicContact CD2-CB 3.91Å; Y104-L120 HydrophobicContact CE2-CB 3.7Å; Y104-L120 HydrophobicContact CE2-CD2 3.82Å; Y104-L120 HydrophobicContact CE2-CG 4.39Å
105	T	98.6	Very high	96.1	Very high	8 Å²	8	49.3 Å²	49.3	5%	0.049	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121.8	-176.3	-52.5	0	0	0	0	110.3	W58 S59 T115 K117	W58-T105 WeakPolarHBondContact CA-O 3.09Å; W58-T105 VanDerWaalsContact CE3-C 3.47Å; S59-T105 PolarHBondContact N-O 2.78Å; S59-T105 PolarHBondContact O-N 3.38Å; S59-T105 PolarHBondContact OG-O 2.85Å; T105-T115 HydrophobicContact CG2-CG2 4.21Å; T105-K117 HydrophobicContact CG2-CG 4.32Å
106	C	98.2	Very high	96.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	127.5	164.7	-179.4	0	0	0	0	109.2	C46 Q57 W58 T115 S116	C46-C106 HydrophobicContact CB-CB 3.58Å; C46-C106 WeakPolarHBondContact CB-SG 3.19Å; C46-C106 WeakPolarHBondContact SG-CB 3.23Å; C46-C106 CovalentContact SG-SG 2.01Å; C46-C106 PolarHBondContact SG-SG 2.91Å; Q57-C106 CarbonylContact O-C 3.47Å; Q57-C106 VanDerWaalsContact O-CA 3.3Å; Q57-C106 WeakPolarHBondContact O-CA 3.49Å; W58-C106 HydrophobicContact CD2-CB 4.26Å; W58-C106 HydrophobicContact CE3-CB 4.17Å; W58-C106 HydrophobicContact CH2-CB 3.96Å; W58-C106 HydrophobicContact CZ2-CB 4.04Å; W58-C106 HydrophobicContact CZ3-CB 4.02Å; C106-T115 CarbonylContact O-C 3.5Å; C106-T115 WeakPolarHBondContact O-CA 3.42Å; C106-S116 PolarHBondContact N-O 2.82Å; C106-S116 PolarHBondContact O-N 2.81Å
107	S	97.6	Very high	96.1	Very high	13 Å²	13	51 Å²	51	9%	0.091	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.9	178.1	-56.4	0	0	0	0	110.2	L56 Q57	L56-S107 CarbonylContact C-O 3.59Å; L56-S107 WeakPolarHBondContact CA-O 3.25Å; Q57-S107 PolarHBondContact N-O 3.07Å; Q57-S107 PolarHBondContact O-N 3.31Å
108	L	96.9	Very high	96.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120	171.3	-176.9	69.7	0	0	0	108.5	Q27 P29 V48 T54 L56 T110 V113 K114	Q27-L108 HydrophobicContact CG-CD2 3.35Å; P29-L108 HydrophobicContact CB-CB 4.48Å; P29-L108 HydrophobicContact CG-CB 4.05Å; V48-L108 HydrophobicContact CG1-CD2 4.07Å; V48-L108 HydrophobicContact CG2-CD1 4.26Å; V48-L108 HydrophobicContact CG2-CD2 4.21Å; T54-L108 HydrophobicContact CG2-CD1 3.86Å; T54-L108 HydrophobicContact CG2-CG 4.06Å; L56-L108 HydrophobicContact CD2-CB 4.15Å; L56-L108 HydrophobicContact CD2-CD1 3.6Å; L56-L108 HydrophobicContact CD2-CG 4.45Å; L56-L108 HydrophobicContact CG-CD1 4.01Å; L108-T110 HydrophobicContact CD2-CG2 4.08Å; L108-T110 HydrophobicContact CG-CG2 4.15Å; L108-T110 PolarHBondContact O-N 3.27Å; L108-V113 WeakPolarHBondContact O-CG1 3.38Å; L108-K114 PolarHBondContact N-O 2.93Å; L108-K114 PolarHBondContact O-N 2.89Å
109	F	94.9	Very high	96.4	Very high	86 Å²	86	53.4 Å²	53.4	38%	0.377	28%	0.282	S	S	.	.			trans	-79.1	51.1	-170.2	-74.5	-90.2	0	0	0	114.3	T54 S55 Q57 F68 V113	T54-F109 HydrophobicContact CG2-CB 4.28Å; T54-F109 WeakPolarHBondContact CG2-O 3.44Å; S55-F109 PolarHBondContact O-N 2.81Å; S55-F109 VanDerWaalsContact O-N 3.16Å; Q57-F109 HydrophobicContact CB-CE2 3.55Å; Q57-F109 HydrophobicContact CB-CZ 4.29Å; Q57-F109 HydrophobicContact CG-CE2 4.35Å; F68-F109 AromaticContact CD2-CE2 3.88Å; F68-F109 HydrophobicContact CD2-CE2 3.88Å; F68-F109 HydrophobicContact CD2-CZ 4.29Å; F68-F109 AromaticContact CE2-CD2 3.78Å; F68-F109 HydrophobicContact CE2-CD2 3.78Å; F68-F109 AromaticContact CE2-CE2 3.42Å; F68-F109 HydrophobicContact CE2-CE2 3.42Å; F68-F109 VanDerWaalsContact CE2-CE2 3.42Å; F68-F109 HydrophobicContact CE2-CG 4.46Å; F68-F109 AromaticContact CE2-CZ 3.84Å; F68-F109 HydrophobicContact CE2-CZ 3.84Å; F68-F109 HydrophobicContact CZ-CD2 4.41Å; F68-F109 HydrophobicContact CZ-CE2 4.44Å; F109-V113 HydrophobicContact CD1-CG2 4.28Å
110	T	93.3	Very high	96.6	Very high	19 Å²	19	49.2 Å²	49.2	12%	0.117	25%	0.253	C	S	.	.			trans	-74.3	171.4	165.8	52.3	0	0	0	0	110.9	Q27 T54 L108 P112 V113 K114	Q27-T110 HydrophobicContact CG-CG2 4.15Å; T54-T110 HydrophobicContact CG2-CG2 4.1Å; L108-T110 HydrophobicContact CD2-CG2 4.08Å; L108-T110 HydrophobicContact CG-CG2 4.15Å; L108-T110 PolarHBondContact O-N 3.27Å; T110-P112 VanDerWaalsContact C-C 3.42Å; T110-P112 CarbonylContact C-O 2.95Å; T110-P112 VanDerWaalsContact C-O 3.22Å; T110-P112 WeakPolarHBondContact CB-O 3.09Å; T110-P112 CarbonylContact O-C 3.59Å; T110-P112 VanDerWaalsContact O-O 3.13Å; T110-P112 PolarHBondContact OG1-O 2.88Å; T110-V113 VanDerWaalsContact O-CA 3.3Å; T110-V113 WeakPolarHBondContact O-CA 3.25Å; T110-V113 PolarHBondContact O-N 3.39Å; T110-K114 WeakPolarHBondContact OG1-CG 3.11Å; T110-K114 PolarHBondContact OG1-N 3.46Å
111	M	90.7	Very high	96.7	Very high	193 Å²	193	50.5 Å²	50.5	95%	0.951	26%	0.261	S	S	*	.	S	Bend	trans	-111.3	105.1	168.5	-71.7	-173.7	-82.1	0	0	109.3
112	P	92.7	Very high	96.7	Very high	108 Å²	108	47.8 Å²	47.8	70%	0.701	25%	0.249	S	C	*	.	S	Bend	cis	-74.7	160.8	-1.1	32.8	-36.4	0	0	0	113.3	T110 K114	T110-P112 VanDerWaalsContact C-C 3.42Å; T110-P112 CarbonylContact C-O 2.95Å; T110-P112 VanDerWaalsContact C-O 3.22Å; T110-P112 WeakPolarHBondContact CB-O 3.09Å; T110-P112 CarbonylContact O-C 3.59Å; T110-P112 VanDerWaalsContact O-O 3.13Å; T110-P112 PolarHBondContact OG1-O 2.88Å; P112-K114 PolarHBondContact O-N 3.31Å
113	V	94.9	Very high	96.7	Very high	76 Å²	76	48 Å²	48	46%	0.461	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-62.4	130.1	178.5	177	0	0	0	0	109.3	L108 F109 T110 T115	L108-V113 WeakPolarHBondContact O-CG1 3.38Å; F109-V113 HydrophobicContact CD1-CG2 4.28Å; T110-V113 VanDerWaalsContact O-CA 3.3Å; T110-V113 WeakPolarHBondContact O-CA 3.25Å; T110-V113 PolarHBondContact O-N 3.39Å; V113-T115 HydrophobicContact CG1-CG2 4.12Å
114	K	95.4	Very high	96.7	Very high	48 Å²	48	44.6 Å²	44.6	21%	0.209	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	140.3	175.8	-69.6	173	-179.7	-170.5	0	109.4	Q27 F28 P29 L108 T110 P112	Q27-K114 WeakPolarHBondContact O-CD 3.31Å; Q27-K114 WeakPolarHBondContact O-CE 3.17Å; Q27-K114 PolarHBondContact O-NZ 3.44Å; F28-K114 HydrophobicContact CD1-CB 4.32Å; F28-K114 HydrophobicContact CD1-CD 3.66Å; F28-K114 HydrophobicContact CD1-CG 4.13Å; F28-K114 HydrophobicContact CE1-CD 3.65Å; F28-K114 HydrophobicContact CE1-CG 3.99Å; F28-K114 HydrophobicContact CG-CD 4.19Å; F28-K114 HydrophobicContact CZ-CD 4.18Å; P29-K114 HydrophobicContact CG-CB 4.48Å; L108-K114 PolarHBondContact N-O 2.93Å; L108-K114 PolarHBondContact O-N 2.89Å; T110-K114 WeakPolarHBondContact OG1-CG 3.11Å; T110-K114 PolarHBondContact OG1-N 3.46Å; P112-K114 PolarHBondContact O-N 3.31Å
115	T	96.9	Very high	96.6	Very high	75 Å²	75	47 Å²	47	46%	0.46	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	152.9	-175.9	60.6	0	0	0	0	111.9	T105 C106 V113	T105-T115 HydrophobicContact CG2-CG2 4.21Å; C106-T115 CarbonylContact O-C 3.5Å; C106-T115 WeakPolarHBondContact O-CA 3.42Å; V113-T115 HydrophobicContact CG1-CG2 4.12Å
116	S	97.7	Very high	96.5	Very high	24 Å²	24	46.7 Å²	46.7	17%	0.168	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	145.3	171.6	-144.7	0	0	0	0	108.5	P29 T31 C106	P29-S116 WeakPolarHBondContact O-CB 2.93Å; P29-S116 PolarHBondContact O-OG 3.13Å; T31-S116 PolarHBondContact N-OG 2.83Å; C106-S116 PolarHBondContact N-O 2.82Å; C106-S116 PolarHBondContact O-N 2.81Å
117	K	98	Very high	96.5	Very high	119 Å²	119	52.4 Å²	52.4	52%	0.517	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.1	-173.5	-72.2	166.7	167.1	-167.4	0	110.4	T31 Q103 Y104 T105	T31-K117 VanDerWaalsContact CG2-O 3.27Å; T31-K117 WeakPolarHBondContact CG2-O 3.36Å; Q103-K117 HydrophobicContact CG-CB 3.96Å; Q103-K117 HydrophobicContact CG-CD 4.33Å; Q103-K117 HydrophobicContact CG-CG 4.2Å; Q103-K117 VanDerWaalsContact NE2-CD 3.25Å; Y104-K117 WeakPolarHBondContact O-CA 3.32Å; T105-K117 HydrophobicContact CG2-CG 4.32Å
118	A	98.3	Very high	96.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.9	172.3	0	0	0	0	0	109.4	T31 Q32 L44 W58 Q103 Y104	T31-A118 HydrophobicContact CG2-CB 3.77Å; T31-A118 WeakPolarHBondContact OG1-CB 3.3Å; Q32-A118 WeakPolarHBondContact O-CB 3.3Å; L44-A118 HydrophobicContact CD2-CB 4.33Å; W58-A118 HydrophobicContact CH2-CB 4.07Å; W58-A118 HydrophobicContact CZ3-CB 4.43Å; Q103-A118 CarbonylContact C-O 3.51Å; Q103-A118 WeakPolarHBondContact CA-O 3.47Å; Y104-A118 PolarHBondContact N-O 3.4Å; Y104-A118 PolarHBondContact O-N 3.21Å
119	Y	98.4	Very high	96.5	Very high	99 Å²	99	60 Å²	60	39%	0.388	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.4	168.9	-146	-86	0	0	0	109.3	N33 V34 E101 G102 Q103	N33-Y119 WeakPolarHBondContact CA-O 3.32Å; N33-Y119 WeakPolarHBondContact CB-O 3.44Å; N33-Y119 PolarHBondContact OD1-N 3.32Å; V34-Y119 PolarHBondContact N-O 3.4Å; E101-Y119 HydrophobicContact CG-CE1 4.08Å; G102-Y119 WeakPolarHBondContact O-CA 3.41Å; Q103-Y119 HydrophobicContact CB-CD2 3.93Å; Q103-Y119 HydrophobicContact CB-CE2 4.16Å; Q103-Y119 HydrophobicContact CG-CD2 4.4Å
120	L	98.4	Very high	96.7	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.3	168.3	174.4	58.3	0	0	0	107.9	V34 V36 A42 V96 D100 E101 G102 Y104 V122	V34-L120 HydrophobicContact CB-CD1 4.12Å; V34-L120 HydrophobicContact CG1-CD1 4.06Å; V34-L120 CarbonylContact O-C 3.58Å; V34-L120 WeakPolarHBondContact O-CA 3.41Å; V36-L120 HydrophobicContact CG1-CD1 3.86Å; A42-L120 HydrophobicContact CB-CD1 3.61Å; A42-L120 HydrophobicContact CB-CD2 4.24Å; V96-L120 HydrophobicContact CG1-CD2 4.41Å; D100-L120 HydrophobicContact CB-CD2 4.37Å; E101-L120 WeakPolarHBondContact CA-O 3.29Å; E101-L120 WeakPolarHBondContact CG-O 3.07Å; G102-L120 PolarHBondContact N-O 3.37Å; G102-L120 VanDerWaalsContact N-O 3.14Å; G102-L120 PolarHBondContact O-N 2.85Å; Y104-L120 HydrophobicContact CD2-CB 3.91Å; Y104-L120 HydrophobicContact CE2-CB 3.7Å; Y104-L120 HydrophobicContact CE2-CD2 3.82Å; Y104-L120 HydrophobicContact CE2-CG 4.39Å; L120-V122 HydrophobicContact CG-CG2 4.27Å
121	T	97.8	Very high	96.9	Very high	47 Å²	47	62 Å²	62	29%	0.288	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128.6	173.1	-58.2	0	0	0	0	109.3	V34 T35 V36 L123	V34-T121 PolarHBondContact O-N 3.13Å; T35-T121 WeakPolarHBondContact CA-O 3.38Å; T35-T121 HydrophobicContact CG2-CG2 4.29Å; V36-T121 PolarHBondContact N-O 2.9Å; T121-L123 HydrophobicContact CG2-CD2 4.3Å
122	V	97.9	Very high	97.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.4	179	-174.8	0	0	0	0	109.4	V36 E38 V96 L98 E101 L120 K154	V36-V122 HydrophobicContact CG1-CG2 4.37Å; V36-V122 CarbonylContact O-C 3.58Å; V36-V122 WeakPolarHBondContact O-CA 3.47Å; E38-V122 HydrophobicContact CB-CG1 4.14Å; V96-V122 HydrophobicContact CG1-CB 4.38Å; V96-V122 HydrophobicContact CG1-CG1 3.99Å; V96-V122 HydrophobicContact CG1-CG2 3.45Å; V96-V122 VanDerWaalsContact CG1-CG2 3.45Å; L98-V122 HydrophobicContact CD2-CB 4.3Å; L98-V122 HydrophobicContact CD2-CG1 4.06Å; E101-V122 HydrophobicContact CB-CB 4.44Å; E101-V122 HydrophobicContact CB-CG2 3.96Å; E101-V122 PolarHBondContact OE2-N 3.48Å; L120-V122 HydrophobicContact CG-CG2 4.27Å; V122-K154 WeakPolarHBondContact O-CD 3.22Å
123	L	98.1	Very high	97.2	Very high	12 Å²	12	52.7 Å²	52.7	6%	0.063	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	126.9	179.6	-52.9	179.7	0	0	0	110.9	T35 V36 V37 E38 T121 K154 E210	T35-L123 HydrophobicContact CG2-CD1 3.64Å; T35-L123 HydrophobicContact CG2-CD2 3.65Å; T35-L123 HydrophobicContact CG2-CG 3.53Å; V36-L123 PolarHBondContact O-N 2.8Å; V37-L123 HydrophobicContact CG2-CB 4.46Å; V37-L123 HydrophobicContact CG2-CD1 4.23Å; E38-L123 WeakPolarHBondContact CB-O 3.41Å; E38-L123 PolarHBondContact N-O 2.87Å; T121-L123 HydrophobicContact CG2-CD2 4.3Å; L123-K154 CarbonylContact C-O 3.58Å; L123-K154 VanDerWaalsContact CA-O 3.3Å; L123-K154 WeakPolarHBondContact CA-O 3.35Å; L123-E210 HydrophobicContact CD1-CB 4.45Å; L123-E210 HydrophobicContact CD1-CG 3.88Å; L123-E210 HydrophobicContact CD2-CG 4.14Å; L123-E210 WeakPolarHBondContact CD2-OE1 3.31Å
124	G	96.9	Very high	96.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-83.3	132.2	173.5	0	0	0	0	0	109.9	G152 K154 H209 S211	G124-G152 CarbonylContact C-O 3.57Å; G124-G152 WeakPolarHBondContact CA-O 3.47Å; G124-K154 PolarHBondContact N-O 3.34Å; G124-K154 PolarHBondContact O-N 3.32Å; G124-H209 PolarHBondContact O-CE1 2.88Å; G124-S211 PolarHBondContact O-OG 3.48Å
125	V	96.3	Very high	96.5	Very high	59 Å²	59	54.4 Å²	54.4	36%	0.358	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-86.6	124	-179.6	-174.5	0	0	0	0	109.3	V37 E127 L212	V37-V125 HydrophobicContact CG1-CG2 3.29Å; V125-E127 PolarHBondContact O-N 2.98Å; V125-L212 HydrophobicContact CG1-CD2 4.14Å
126	P	97.5	Very high	96	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.013	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-61.4	138.4	173.4	23.9	-31.3	0	0	0	111	T150 S151 V207 H209 L212 Q217	P126-T150 WeakPolarHBondContact CB-OG1 3.48Å; P126-S151 WeakPolarHBondContact CA-O 3.07Å; P126-V207 HydrophobicContact CB-CG1 4.3Å; P126-V207 HydrophobicContact CG-CG1 4.27Å; P126-H209 HydrophobicContact CG-CB 3.91Å; P126-L212 HydrophobicContact CG-CD1 4.06Å; P126-L212 HydrophobicContact CG-CD2 4.27Å; P126-L212 HydrophobicContact CG-CG 4.28Å; P126-Q217 PolarHBondContact O-NE2 2.83Å; P126-Q217 PolarHBondContact O-OE1 3.21Å
127	E	97.1	Very high	95.7	Very high	121 Å²	121	56 Å²	56	57%	0.565	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-63.2	163	166.8	-71.7	179.7	-135.2	0	0	111.4	V125 T150 S151 Q217	V125-E127 PolarHBondContact O-N 2.98Å; E127-T150 PolarHBondContact O-OG1 2.81Å; E127-S151 PolarHBondContact N-O 3.33Å; E127-S151 PolarHBondContact OE1-OG 3.49Å; E127-S151 PolarHBondContact OE2-OG 2.92Å; E127-Q217 VanDerWaalsContact C-OE1 3.31Å; E127-Q217 PolarHBondContact O-OE1 2.84Å
128	K	97.9	Very high	95.5	Very high	166 Å²	166	50.6 Å²	50.6	72%	0.722	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-59.4	124.7	177.9	-69.4	-176.8	-179.1	178.7	0	110.3	Q130 Q217	K128-Q130 PolarHBondContact O-NE2 3.47Å; K128-Q217 VanDerWaalsContact CA-OE1 3.31Å
129	P	98.4	Very high	95.3	Very high	5 Å²	5	54.4 Å²	54.4	3%	0.032	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-58.6	148.1	179.9	21.3	-31.2	0	0	0	111.2	K149 V207 Q217 A219	P129-K149 WeakPolarHBondContact CA-O 3.3Å; P129-V207 HydrophobicContact CB-CG2 3.63Å; P129-V207 HydrophobicContact CG-CB 4.42Å; P129-V207 HydrophobicContact CG-CG2 3.74Å; P129-Q217 VanDerWaalsContact CD-OE1 3.31Å; P129-Q217 HydrophobicContact CG-CB 4.22Å; P129-A219 HydrophobicContact CB-CB 3.98Å; P129-A219 HydrophobicContact CG-CB 3.96Å; P129-A219 WeakPolarHBondContact O-CB 3.4Å
130	Q	98.1	Very high	95.2	Very high	126 Å²	126	52.5 Å²	52.5	59%	0.589	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	132	175.6	-59.9	-58.2	-44.3	0	0	109.4	K128 C148 K149	K128-Q130 PolarHBondContact O-NE2 3.47Å; Q130-C148 CarbonylContact O-C 3.45Å; Q130-C148 VanDerWaalsContact O-CA 3.29Å; Q130-C148 WeakPolarHBondContact O-CA 3.43Å; Q130-K149 PolarHBondContact N-O 3.26Å; Q130-K149 PolarHBondContact O-N 3.36Å
131	I	98	Very high	95	Very high	21 Å²	21	53.4 Å²	53.4	11%	0.108	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	136.2	171.9	-64.2	170	0	0	0	108.3	F134 L146 T147 C148 W161 C205 A219 Q221	I131-F134 HydrophobicContact CG2-CD1 4.39Å; I131-L146 HydrophobicContact CG2-CB 4.49Å; I131-L146 HydrophobicContact CG2-CD2 4.45Å; I131-T147 CarbonylContact C-O 3.53Å; I131-T147 WeakPolarHBondContact CA-O 3.42Å; I131-C148 HydrophobicContact CG1-CB 4.36Å; I131-W161 HydrophobicContact CD1-CH2 4.43Å; I131-W161 HydrophobicContact CD1-CZ3 3.98Å; I131-W161 HydrophobicContact CG1-CH2 4.11Å; I131-W161 HydrophobicContact CG1-CZ3 4.18Å; I131-W161 HydrophobicContact CG2-CH2 4.14Å; I131-W161 HydrophobicContact CG2-CZ3 4.43Å; I131-C205 HydrophobicContact CD1-CB 3.86Å; I131-C205 HydrophobicContact CG1-CB 3.9Å; I131-A219 HydrophobicContact CD1-CB 3.92Å; I131-A219 WeakPolarHBondContact CD1-O 3.29Å; I131-A219 HydrophobicContact CG1-CB 3.82Å; I131-Q221 HydrophobicContact CD1-CB 4.2Å; I131-Q221 HydrophobicContact CG2-CB 4.09Å
132	S	96.9	Very high	94.8	Very high	58 Å²	58	54.8 Å²	54.8	41%	0.406	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	174.7	179.6	61.6	0	0	0	0	110.4	L146 T147	S132-L146 CarbonylContact O-C 3.44Å; S132-L146 WeakPolarHBondContact O-CA 3.32Å; S132-T147 PolarHBondContact N-O 2.93Å; S132-T147 PolarHBondContact O-N 3.37Å; S132-T147 PolarHBondContact OG-O 3.02Å; S132-T147 VanDerWaalsContact OG-O 3.1Å
133	G	92.6	Very high	94.6	Very high	49 Å²	49	61 Å²	61	51%	0.505	34%	0.34	S	S	.	.	S	Bend	trans	86	15	179.1	0	0	0	0	0	115.3	Q145	G133-Q145 CarbonylContact C-O 3.5Å; G133-Q145 WeakPolarHBondContact CA-O 3.38Å
134	F	88.4	Confident	94.3	Very high	85 Å²	85	61 Å²	61	37%	0.373	34%	0.34	S	S	.	.			trans	-106.3	151.2	172.8	63.7	-85.8	0	0	0	111.6	I131 M144 L146 Q221	I131-F134 HydrophobicContact CG2-CD1 4.39Å; F134-M144 HydrophobicContact CB-SD 4.35Å; F134-L146 HydrophobicContact CB-CD2 3.7Å; F134-Q221 HydrophobicContact CD1-CG 4.08Å; F134-Q221 HydrophobicContact CD2-CG 4.41Å; F134-Q221 HydrophobicContact CE1-CG 4.31Å; F134-Q221 VanDerWaalsContact CE1-OE1 3.28Å; F134-Q221 HydrophobicContact CG-CG 4.15Å
135	S	86.6	Confident	94.3	Very high	75 Å²	75	65.9 Å²	65.9	52%	0.524	36%	0.362	S	S	.	.			trans	-122.5	142.6	167	53.8	0	0	0	0	108.7	P137 V138	S135-P137 CarbonylContact O-C 3.54Å; S135-V138 WeakPolarHBondContact O-CG2 3.32Å
136	S	87.6	Confident	94.3	Very high	73 Å²	73	63 Å²	63	51%	0.51	35%	0.345	S	S	.	.	S	Bend	trans	-119.6	127.3	177.4	-152.9	0	0	0	0	109.6	E224	S136-E224 WeakPolarHBondContact OG-CB 3.42Å; S136-E224 PolarHBondContact OG-OE2 2.84Å
137	P	90.8	Very high	94.3	Very high	60 Å²	60	64.5 Å²	64.5	39%	0.39	35%	0.354	S	S	.	.	S	Bend	cis	-77.8	162.1	-4.6	34	-36.4	0	0	0	113.1	S135 E224 H226	S135-P137 CarbonylContact O-C 3.54Å; P137-E224 HydrophobicContact CB-CG 4.41Å; P137-H226 HydrophobicContact CB-CB 4.26Å; P137-H226 WeakPolarHBondContact CB-CD2 3.46Å; P137-H226 VanDerWaalsContact CB-NE2 3.34Å; P137-H226 WeakPolarHBondContact CB-NE2 3.38Å
138	V	93.9	Very high	94.4	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.024	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	144.2	173.7	-170.3	0	0	0	0	109.4	S135 D142 M144 V194 E224 I225 H226	S135-V138 WeakPolarHBondContact O-CG2 3.32Å; V138-D142 HydrophobicContact CG1-CB 4.18Å; V138-M144 HydrophobicContact CB-CE 3.99Å; V138-M144 HydrophobicContact CG1-CE 3.35Å; V138-M144 HydrophobicContact CG2-CE 3.29Å; V138-V194 HydrophobicContact CG1-CB 4.32Å; V138-V194 HydrophobicContact CG1-CG1 4.06Å; V138-V194 HydrophobicContact CG1-CG2 3.67Å; V138-E224 PolarHBondContact N-O 2.82Å; V138-I225 HydrophobicContact CB-CD1 3.77Å; V138-I225 HydrophobicContact CG1-CD1 4.38Å; V138-I225 HydrophobicContact CG2-CD1 4.15Å; V138-I225 CarbonylContact O-C 3.57Å; V138-I225 WeakPolarHBondContact O-CA 2.93Å; V138-H226 PolarHBondContact O-N 3.47Å
139	M	94.7	Very high	94.4	Very high	80 Å²	80	55.8 Å²	55.8	39%	0.394	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	145	178.3	-57.3	-83.5	-79.3	0	0	111.3	G141 D142 H226 I304	M139-G141 PolarHBondContact O-N 3.15Å; M139-D142 WeakPolarHBondContact CB-OD2 3.35Å; M139-D142 PolarHBondContact N-OD2 2.76Å; M139-D142 WeakPolarHBondContact O-CB 3.35Å; M139-D142 PolarHBondContact O-N 3.17Å; M139-H226 WeakPolarHBondContact CA-O 3.39Å; M139-H226 HydrophobicContact SD-CB 4.36Å; M139-I304 HydrophobicContact CE-CD1 4.2Å; M139-I304 HydrophobicContact CE-CG2 3.71Å; M139-I304 HydrophobicContact SD-CD1 3.71Å; M139-I304 HydrophobicContact SD-CG2 4.24Å
140	E	95.6	Very high	94.4	Very high	60 Å²	60	55.7 Å²	55.7	28%	0.28	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	134.3	170.7	177.1	-179.9	-131.8	0	0	111.3	D142 R196 H226	E140-D142 VanDerWaalsContact C-N 3.32Å; E140-R196 WeakPolarHBondContact OE1-CB 3.41Å; E140-R196 IonicContact OE1-CZ 3.99Å; E140-R196 PolarHBondContact OE1-N 2.89Å; E140-R196 IonicContact OE1-NE 3.15Å; E140-R196 PolarHBondContact OE1-NE 2.97Å; E140-R196 IonicContact OE1-NH2 3.44Å; E140-R196 PolarHBondContact OE1-NH2 2.9Å; E140-R196 IonicContact OE2-CZ 2.81Å; E140-R196 IonicContact OE2-NE 2.89Å; E140-R196 IonicContact OE2-NH2 3.57Å; E140-R196 PolarHBondContact OE2-NH2 3.18Å; E140-H226 PolarHBondContact N-O 3.32Å
141	G	94.3	Very high	94.4	Very high	19 Å²	19	51 Å²	51	20%	0.196	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	88	-8.9	-178.8	0	0	0	0	0	114.8	M139 R193 V194	M139-G141 PolarHBondContact O-N 3.15Å; G141-R193 PolarHBondContact O-NE 3.48Å; G141-R193 PolarHBondContact O-NH1 2.85Å; G141-R193 PolarHBondContact O-NH2 2.74Å; G141-R193 VanDerWaalsContact O-NH2 3.15Å; G141-V194 PolarHBondContact N-O 3.05Å
142	D	94.1	Very high	94.3	Very high	75 Å²	75	50.8 Å²	50.8	40%	0.401	30%	0.298	S	S	.	.			trans	-62.6	149.2	172.9	-74.3	-13.3	0	0	0	111	V138 M139 E140 R193 V194	V138-D142 HydrophobicContact CG1-CB 4.18Å; M139-D142 WeakPolarHBondContact CB-OD2 3.35Å; M139-D142 PolarHBondContact N-OD2 2.76Å; M139-D142 WeakPolarHBondContact O-CB 3.35Å; M139-D142 PolarHBondContact O-N 3.17Å; E140-D142 VanDerWaalsContact C-N 3.32Å; D142-R193 WeakPolarHBondContact O-CA 3.33Å; D142-V194 HydrophobicContact CB-CG2 4.43Å; D142-V194 WeakPolarHBondContact O-CG2 3.34Å; D142-V194 PolarHBondContact O-N 3.26Å
143	L	93.4	Very high	94.3	Very high	132 Å²	132	48 Å²	48	69%	0.691	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	108.8	169.4	-174.1	68.1	0	0	0	108.3
144	M	92.2	Very high	94.5	Very high	11 Å²	11	47 Å²	47	5%	0.054	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136.9	179.4	-178	59.3	65.2	0	0	110.4	F134 V138 L146 D191 F192 V194	F134-M144 HydrophobicContact CB-SD 4.35Å; V138-M144 HydrophobicContact CB-CE 3.99Å; V138-M144 HydrophobicContact CG1-CE 3.35Å; V138-M144 HydrophobicContact CG2-CE 3.29Å; M144-L146 HydrophobicContact CG-CD2 3.93Å; M144-L146 HydrophobicContact CG-CG 3.96Å; M144-L146 HydrophobicContact SD-CD2 3.93Å; M144-D191 WeakPolarHBondContact O-CA 3.46Å; M144-F192 HydrophobicContact CB-CE1 4.24Å; M144-F192 HydrophobicContact CB-CZ 4.26Å; M144-F192 HydrophobicContact CG-CE1 4.12Å; M144-F192 HydrophobicContact CG-CZ 4.2Å; M144-F192 PolarHBondContact N-O 3.14Å; M144-F192 PolarHBondContact O-N 2.79Å; M144-V194 HydrophobicContact CB-CG2 3.68Å
145	Q	95.2	Very high	94.9	Very high	102 Å²	102	45.7 Å²	45.7	48%	0.477	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	99.4	175.6	176.9	165.7	95.7	0	0	109.8	G133 T189 L190 D191	G133-Q145 CarbonylContact C-O 3.5Å; G133-Q145 WeakPolarHBondContact CA-O 3.38Å; Q145-T189 HydrophobicContact CG-CG2 3.36Å; Q145-L190 WeakPolarHBondContact CA-O 3.21Å; Q145-D191 WeakPolarHBondContact CB-OD1 3.35Å; Q145-D191 WeakPolarHBondContact CG-OD1 3.48Å; Q145-D191 PolarHBondContact NE2-OD1 2.93Å
146	L	96.8	Very high	95.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.8	176.3	-60.1	179.8	0	0	0	110.2	I131 S132 F134 M144 W161 T189 L190 F192 V203	I131-L146 HydrophobicContact CG2-CB 4.49Å; I131-L146 HydrophobicContact CG2-CD2 4.45Å; S132-L146 CarbonylContact O-C 3.44Å; S132-L146 WeakPolarHBondContact O-CA 3.32Å; F134-L146 HydrophobicContact CB-CD2 3.7Å; M144-L146 HydrophobicContact CG-CD2 3.93Å; M144-L146 HydrophobicContact CG-CG 3.96Å; M144-L146 HydrophobicContact SD-CD2 3.93Å; L146-W161 HydrophobicContact CB-CH2 3.64Å; L146-W161 HydrophobicContact CB-CZ2 4.3Å; L146-W161 HydrophobicContact CB-CZ3 4.14Å; L146-W161 HydrophobicContact CD1-CZ3 4.3Å; L146-T189 CarbonylContact O-C 3.55Å; L146-T189 VanDerWaalsContact O-CA 3.28Å; L146-T189 WeakPolarHBondContact O-CA 3.34Å; L146-L190 PolarHBondContact N-O 2.95Å; L146-L190 PolarHBondContact O-N 2Å; L146-F192 HydrophobicContact CD1-CE1 3.96Å; L146-F192 HydrophobicContact CD1-CZ 4.47Å; L146-F192 HydrophobicContact CG-CE1 4.3Å; L146-V203 HydrophobicContact CD1-CB 4.1Å; L146-V203 HydrophobicContact CD1-CG1 3.87Å; L146-V203 HydrophobicContact CD1-CG2 4.15Å
147	T	98.2	Very high	96	Very high	32 Å²	32	40.3 Å²	40.3	20%	0.196	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.1	174.2	-63.2	0	0	0	0	110.3	I131 S132 S188 T189	I131-T147 CarbonylContact C-O 3.53Å; I131-T147 WeakPolarHBondContact CA-O 3.42Å; S132-T147 PolarHBondContact N-O 2.93Å; S132-T147 PolarHBondContact O-N 3.37Å; S132-T147 PolarHBondContact OG-O 3.02Å; S132-T147 VanDerWaalsContact OG-O 3.1Å; T147-S188 CarbonylContact C-O 3.51Å; T147-S188 WeakPolarHBondContact CA-O 3.42Å; T147-T189 PolarHBondContact OG1-OG1 2.95Å
148	C	98.4	Very high	96.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130.2	171.5	-176.5	0	0	0	0	109.3	Q130 I131 I159 W161 S187 S188 C205	Q130-C148 CarbonylContact O-C 3.45Å; Q130-C148 VanDerWaalsContact O-CA 3.29Å; Q130-C148 WeakPolarHBondContact O-CA 3.43Å; I131-C148 HydrophobicContact CG1-CB 4.36Å; C148-I159 HydrophobicContact CB-CG2 4.32Å; C148-W161 HydrophobicContact CB-CH2 3.69Å; C148-W161 HydrophobicContact CB-CZ2 3.37Å; C148-S187 CarbonylContact O-C 3.24Å; C148-S187 WeakPolarHBondContact O-CA 3.18Å; C148-S188 PolarHBondContact N-O 3.01Å; C148-S188 PolarHBondContact O-N 2.84Å; C148-C205 HydrophobicContact CB-CB 3.57Å; C148-C205 WeakPolarHBondContact CB-SG 3Å; C148-C205 WeakPolarHBondContact SG-CB 2.97Å; C148-C205 CovalentContact SG-SG 2.01Å; C148-C205 PolarHBondContact SG-SG 3.22Å
149	K	98.4	Very high	96.5	Very high	105 Å²	105	41.4 Å²	41.4	46%	0.457	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	139.9	-176.4	-174.7	176.1	-178.9	174.3	0	111.2	P129 Q130 T185	P129-K149 WeakPolarHBondContact CA-O 3.3Å; Q130-K149 PolarHBondContact N-O 3.26Å; Q130-K149 PolarHBondContact O-N 3.36Å; K149-T185 HydrophobicContact CD-CG2 4.36Å; K149-T185 HydrophobicContact CG-CG2 4.16Å
150	T	98.4	Very high	96.6	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	143.4	170.1	177	0	0	0	0	110.4	P126 E127 I159 T185 V186 V207	P126-T150 WeakPolarHBondContact CB-OG1 3.48Å; E127-T150 PolarHBondContact O-OG1 2.81Å; T150-I159 HydrophobicContact CG2-CD1 4.41Å; T150-T185 WeakPolarHBondContact O-CA 3.04Å; T150-V186 HydrophobicContact CG2-CG2 3.39Å; T150-V186 PolarHBondContact N-O 2.93Å; T150-V186 PolarHBondContact O-N 3.11Å; T150-V207 HydrophobicContact CG2-CG1 4.05Å; T150-V207 HydrophobicContact CG2-CG2 4.01Å
151	S	97.4	Very high	96.7	Very high	27 Å²	27	38.2 Å²	38.2	19%	0.189	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	168.7	179.6	43	0	0	0	0	111.9	P126 E127 S153 T185	P126-S151 WeakPolarHBondContact CA-O 3.07Å; E127-S151 PolarHBondContact N-O 3.33Å; E127-S151 PolarHBondContact OE1-OG 3.49Å; E127-S151 PolarHBondContact OE2-OG 2.92Å; S151-S153 VanDerWaalsContact C-N 3.31Å; S151-S153 PolarHBondContact O-N 3.5Å; S151-T185 VanDerWaalsContact CB-OG1 3.28Å; S151-T185 WeakPolarHBondContact CB-OG1 3.5Å
152	G	96.1	Very high	96.9	Very high	16 Å²	16	38.8 Å²	38.8	17%	0.165	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80.8	1.6	171	0	0	0	0	0	115.8	G124 T183 F184	G124-G152 CarbonylContact C-O 3.57Å; G124-G152 WeakPolarHBondContact CA-O 3.47Å; G152-T183 WeakPolarHBondContact O-CG2 3.47Å; G152-F184 PolarHBondContact N-O 3.21Å
153	S	97.1	Very high	96.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	134.3	-178.6	63.7	0	0	0	0	112	S151 P155 A157 T183 F184	S151-S153 VanDerWaalsContact C-N 3.31Å; S151-S153 PolarHBondContact O-N 3.5Å; S153-P155 CarbonylContact C-O 3.59Å; S153-P155 WeakPolarHBondContact CB-O 3.47Å; S153-A157 PolarHBondContact OG-N 3.14Å; S153-T183 CarbonylContact O-C 3.58Å; S153-T183 WeakPolarHBondContact O-CA 3.47Å; S153-F184 PolarHBondContact N-O 3.47Å; S153-F184 VanDerWaalsContact N-O 3.1Å; S153-F184 PolarHBondContact O-N 3.37Å; S153-F184 PolarHBondContact OG-O 2.9Å
154	K	97.3	Very high	96.8	Very high	27 Å²	27	35.5 Å²	35.5	12%	0.117	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-145.3	114.9	166.5	-177.1	-167.3	-174.6	-169.7	0	109.4	L98 E101 V122 L123 G124 K182 T183 H209	L98-K154 HydrophobicContact CD2-CD 3.66Å; E101-K154 IonicContact OE1-NZ 3.29Å; E101-K154 PolarHBondContact OE1-NZ 2.97Å; E101-K154 IonicContact OE2-NZ 2.75Å; E101-K154 PolarHBondContact OE2-NZ 2.86Å; V122-K154 WeakPolarHBondContact O-CD 3.22Å; L123-K154 CarbonylContact C-O 3.58Å; L123-K154 VanDerWaalsContact CA-O 3.3Å; L123-K154 WeakPolarHBondContact CA-O 3.35Å; G124-K154 PolarHBondContact N-O 3.34Å; G124-K154 PolarHBondContact O-N 3.32Å; K154-K182 WeakPolarHBondContact CD-O 3.21Å; K154-K182 WeakPolarHBondContact CG-O 3.5Å; K154-T183 HydrophobicContact CB-CG2 4.25Å; K154-H209 PolarHBondContact O-CE1 3.44Å; K154-H209 VanDerWaalsContact O-CE1 3.28Å; K154-H209 PolarHBondContact O-NE2 2.87Å
155	P	97.2	Very high	96.7	Very high	59 Å²	59	42.4 Å²	42.4	38%	0.383	22%	0.224	S	C	.	.	S	Bend	cis	-64.4	179.8	-2.9	30.4	-37.4	0	0	0	113.6	S153 A157 H209 E210	S153-P155 CarbonylContact C-O 3.59Å; S153-P155 WeakPolarHBondContact CB-O 3.47Å; P155-A157 PolarHBondContact O-N 2.92Å; P155-H209 WeakPolarHBondContact CD-NE2 3.38Å; P155-H209 PolarHBondContact O-CD2 3.15Å; P155-H209 VanDerWaalsContact O-CD2 3.29Å; P155-H209 PolarHBondContact O-NE2 2.81Å; P155-E210 WeakPolarHBondContact CD-OE1 3.33Å; P155-E210 HydrophobicContact CG-CG 4.39Å; P155-E210 WeakPolarHBondContact CG-OE1 3.36Å
156	A	97.5	Very high	96.7	Very high	33 Å²	33	45 Å²	45	27%	0.273	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-57.2	126.6	176.3	0	0	0	0	0	110.9	F184 V186	A156-F184 HydrophobicContact CB-CB 3.99Å; A156-F184 HydrophobicContact CB-CD2 4.09Å; A156-F184 HydrophobicContact CB-CG 3.97Å; A156-V186 HydrophobicContact CB-CG1 3.86Å
157	A	98	Very high	96.6	Very high	2 Å²	2	48.4 Å²	48.4	2%	0.017	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-72.8	155.6	-177.8	0	0	0	0	0	113.4	S153 P155 Y173 V186 V207 H209	S153-A157 PolarHBondContact OG-N 3.14Å; P155-A157 PolarHBondContact O-N 2.92Å; A157-Y173 PolarHBondContact O-OH 2.82Å; A157-Y173 VanDerWaalsContact O-OH 3.06Å; A157-V186 HydrophobicContact CB-CG2 4.1Å; A157-V207 HydrophobicContact CB-CG1 3.81Å; A157-H209 HydrophobicContact CB-CB 4.15Å
158	D	97.4	Very high	96.5	Very high	77 Å²	77	49 Å²	49	41%	0.412	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	132.8	175	-176.9	42.9	0	0	0	110.3	R160 V207 D208	D158-R160 WeakPolarHBondContact OD2-CD 3.19Å; D158-R160 WeakPolarHBondContact OD2-CG 3.35Å; D158-R160 IonicContact OD2-CZ 2.66Å; D158-R160 IonicContact OD2-NE 3.89Å; D158-R160 PolarHBondContact OD2-NE 3.5Å; D158-V207 WeakPolarHBondContact O-CA 2.92Å; D158-D208 HydrophobicContact CB-CB 4.36Å; D158-D208 PolarHBondContact N-O 3.31Å; D158-D208 PolarHBondContact O-N 2.9Å
159	I	98.3	Very high	96.3	Very high	10 Å²	10	56.7 Å²	56.7	5%	0.051	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127	177	-62.8	171.8	0	0	0	109.4	C148 T150 V186 S188 C205 R206 V207	C148-I159 HydrophobicContact CB-CG2 4.32Å; T150-I159 HydrophobicContact CG2-CD1 4.41Å; I159-V186 HydrophobicContact CD1-CB 4.17Å; I159-V186 HydrophobicContact CD1-CG2 3.78Å; I159-V186 HydrophobicContact CG1-CG2 4.1Å; I159-S188 VanDerWaalsContact CG2-CB 3.5Å; I159-C205 VanDerWaalsContact CG2-SG 3.53Å; I159-R206 WeakPolarHBondContact CA-O 3.47Å; I159-V207 HydrophobicContact CG1-CG2 4.25Å
160	R	97.8	Very high	96	Very high	73 Å²	73	58.4 Å²	58.4	28%	0.275	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	135.4	179.4	-61.5	-171.5	-80.2	-173.7	-9.1	111.4	D158 F162 E167 R206 D208	D158-R160 WeakPolarHBondContact OD2-CD 3.19Å; D158-R160 WeakPolarHBondContact OD2-CG 3.35Å; D158-R160 IonicContact OD2-CZ 2.66Å; D158-R160 IonicContact OD2-NE 3.89Å; D158-R160 PolarHBondContact OD2-NE 3.5Å; R160-F162 HydrophobicContact CB-CE2 3.71Å; R160-F162 HydrophobicContact CB-CZ 4.36Å; R160-E167 WeakPolarHBondContact CD-OE1 3.31Å; R160-R206 PolarHBondContact N-O 3.42Å; R160-R206 VanDerWaalsContact NH1-NH2 3.16Å; R160-R206 VanDerWaalsContact NH2-NH2 3.11Å; R160-R206 PolarHBondContact O-N 2.87Å; R160-D208 IonicContact CZ-OD2 2.64Å; R160-D208 IonicContact NE-OD2 2.9Å; R160-D208 PolarHBondContact NE-OD2 2.89Å; R160-D208 IonicContact NH2-OD1 3.26Å; R160-D208 PolarHBondContact NH2-OD1 3.08Å; R160-D208 VanDerWaalsContact NH2-OD1 3.11Å; R160-D208 IonicContact NH2-OD2 2.74Å; R160-D208 PolarHBondContact NH2-OD2 2.73Å
161	W	98.2	Very high	95.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	139.6	179.8	-72.3	91.8	0	0	0	111.8	I131 L146 C148 E167 I168 V171 S188 L190 V203 I204 C205	I131-W161 HydrophobicContact CD1-CH2 4.43Å; I131-W161 HydrophobicContact CD1-CZ3 3.98Å; I131-W161 HydrophobicContact CG1-CH2 4.11Å; I131-W161 HydrophobicContact CG1-CZ3 4.18Å; I131-W161 HydrophobicContact CG2-CH2 4.14Å; I131-W161 HydrophobicContact CG2-CZ3 4.43Å; L146-W161 HydrophobicContact CB-CH2 3.64Å; L146-W161 HydrophobicContact CB-CZ2 4.3Å; L146-W161 HydrophobicContact CB-CZ3 4.14Å; L146-W161 HydrophobicContact CD1-CZ3 4.3Å; C148-W161 HydrophobicContact CB-CH2 3.69Å; C148-W161 HydrophobicContact CB-CZ2 3.37Å; W161-E167 CarbonylContact O-C 3.5Å; W161-E167 WeakPolarHBondContact O-CA 3.4Å; W161-I168 HydrophobicContact CB-CB 4.28Å; W161-I168 PolarHBondContact O-N 2.88Å; W161-V171 HydrophobicContact CG-CG1 4.3Å; W161-S188 WeakPolarHBondContact CZ2-O 3.38Å; W161-S188 PolarHBondContact NE1-OG 2.98Å; W161-L190 HydrophobicContact CB-CD2 4.28Å; W161-L190 HydrophobicContact CD2-CB 4.01Å; W161-L190 HydrophobicContact CD2-CD2 3.99Å; W161-L190 HydrophobicContact CE3-CD2 3.95Å; W161-L190 HydrophobicContact CG-CB 4.25Å; W161-L190 HydrophobicContact CG-CD2 4.2Å; W161-L190 HydrophobicContact CZ2-CB 4.19Å; W161-V203 HydrophobicContact CE3-CG1 3.52Å; W161-V203 HydrophobicContact CZ3-CG1 3.61Å; W161-I204 CarbonylContact C-O 3.55Å; W161-I204 WeakPolarHBondContact CA-O 3.33Å; W161-C205 HydrophobicContact CE3-CB 4.23Å; W161-C205 HydrophobicContact CH2-CB 4.45Å; W161-C205 HydrophobicContact CZ3-CB 4.15Å
162	F	97.1	Very high	95.8	Very high	30 Å²	30	64.7 Å²	64.7	13%	0.132	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	137.6	177	-66.3	-94.6	0	0	0	110.9	R160 K166 E167 I204 R206	R160-F162 HydrophobicContact CB-CE2 3.71Å; R160-F162 HydrophobicContact CB-CZ 4.36Å; F162-K166 WeakPolarHBondContact CA-O 3.46Å; F162-E167 HydrophobicContact CD1-CB 4.2Å; F162-E167 HydrophobicContact CE1-CB 3.66Å; F162-E167 HydrophobicContact CE1-CG 4.22Å; F162-E167 HydrophobicContact CZ-CB 4.02Å; F162-E167 HydrophobicContact CZ-CG 4.05Å; F162-I204 HydrophobicContact CB-CB 4.15Å; F162-I204 PolarHBondContact N-O 2.81Å; F162-I204 PolarHBondContact O-N 2.87Å; F162-R206 HydrophobicContact CD2-CB 4.19Å; F162-R206 HydrophobicContact CE2-CB 4Å; F162-R206 VanDerWaalsContact CZ-CZ 3.43Å
163	K	94.6	Very high	95.9	Very high	33 Å²	33	68.4 Å²	68.4	14%	0.143	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	127.3	173	-176.4	-179.2	177.5	-176.9	0	107.6	D165 K166 I168 D198 V201 V203	K163-D165 VanDerWaalsContact C-N 3.28Å; K163-D165 PolarHBondContact O-N 2.6Å; K163-K166 PolarHBondContact N-O 2.77Å; K163-K166 PolarHBondContact O-N 2.95Å; K163-I168 HydrophobicContact CB-CD1 3.68Å; K163-I168 HydrophobicContact CB-CG1 4.41Å; K163-I168 HydrophobicContact CD-CD1 4.28Å; K163-D198 WeakPolarHBondContact CE-OD1 3.29Å; K163-D198 IonicContact NZ-OD1 2.67Å; K163-D198 PolarHBondContact NZ-OD1 2.91Å; K163-D198 IonicContact NZ-OD2 3.78Å; K163-D198 PolarHBondContact NZ-OD2 2.71Å; K163-V201 HydrophobicContact CG-CG1 3.86Å; K163-V203 HydrophobicContact CG-CG2 4.48Å
164	N	90.9	Very high	95.9	Very high	106 Å²	106	73 Å²	73	57%	0.567	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	47	-174	-59.3	-33	0	0	0	112.4	K166 V201	N164-K166 PolarHBondContact O-N 2.89Å; N164-V201 WeakPolarHBondContact OD1-CG1 3.38Å
165	D	90.1	Very high	96	Very high	155 Å²	155	78.5 Å²	78.5	83%	0.829	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	6	-176.9	-57	-47.3	0	0	0	116.2	K163	K163-D165 VanDerWaalsContact C-N 3.28Å; K163-D165 PolarHBondContact O-N 2.6Å
166	K	94.9	Very high	96	Very high	158 Å²	158	81 Å²	81	69%	0.687	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	131	178.8	-172.6	178.1	177.1	-177.2	0	110.7	F162 K163 N164	F162-K166 WeakPolarHBondContact CA-O 3.46Å; K163-K166 PolarHBondContact N-O 2.77Å; K163-K166 PolarHBondContact O-N 2.95Å; N164-K166 PolarHBondContact O-N 2.89Å
167	E	96.4	Very high	95.9	Very high	71 Å²	71	84.8 Å²	84.8	33%	0.332	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	131.5	173.2	-172.4	179.1	-151.4	0	0	110.9	R160 W161 F162 K169	R160-E167 WeakPolarHBondContact CD-OE1 3.31Å; W161-E167 CarbonylContact O-C 3.5Å; W161-E167 WeakPolarHBondContact O-CA 3.4Å; F162-E167 HydrophobicContact CD1-CB 4.2Å; F162-E167 HydrophobicContact CE1-CB 3.66Å; F162-E167 HydrophobicContact CE1-CG 4.22Å; F162-E167 HydrophobicContact CZ-CB 4.02Å; F162-E167 HydrophobicContact CZ-CG 4.05Å; E167-K169 HydrophobicContact CG-CG 4.37Å; E167-K169 WeakPolarHBondContact OE2-CE 3.33Å
168	I	96.2	Very high	95.7	Very high	43 Å²	43	86.3 Å²	86.3	22%	0.221	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.6	172.5	-54.4	168.6	0	0	0	108.4	W161 K163 V171 L190	W161-I168 HydrophobicContact CB-CB 4.28Å; W161-I168 PolarHBondContact O-N 2.88Å; K163-I168 HydrophobicContact CB-CD1 3.68Å; K163-I168 HydrophobicContact CB-CG1 4.41Å; K163-I168 HydrophobicContact CD-CD1 4.28Å; I168-V171 HydrophobicContact CG2-CG1 4.44Å; I168-L190 HydrophobicContact CB-CD1 4.32Å; I168-L190 HydrophobicContact CD1-CD1 4.1Å; I168-L190 HydrophobicContact CD1-CD2 3.71Å; I168-L190 HydrophobicContact CG2-CD1 3.59Å
169	K	93.3	Very high	95.4	Very high	163 Å²	163	88 Å²	88	71%	0.709	44%	0.435	S	S	*	.			trans	-101.1	-21.3	-174.7	-62	-172.3	177.7	-173.3	0	114.3	E167 V171	E167-K169 HydrophobicContact CG-CG 4.37Å; E167-K169 WeakPolarHBondContact OE2-CE 3.33Å; K169-V171 VanDerWaalsContact C-N 3.3Å; K169-V171 PolarHBondContact O-N 2.92Å
170	D	92.3	Very high	94.8	Very high	141 Å²	141	91.4 Å²	91.4	75%	0.754	45%	0.453	S	S	*	.			trans	-80.2	83.2	178	-171.6	23.7	0	0	0	109.5
171	V	95.8	Very high	94.4	Very high	44 Å²	44	97.3 Å²	97.3	27%	0.267	48%	0.475	S	S	.	.			trans	-140.6	150.8	-174.7	-59.6	0	0	0	0	109.7	W161 I168 K169 T189 L190	W161-V171 HydrophobicContact CG-CG1 4.3Å; I168-V171 HydrophobicContact CG2-CG1 4.44Å; K169-V171 VanDerWaalsContact C-N 3.3Å; K169-V171 PolarHBondContact O-N 2.92Å; V171-T189 WeakPolarHBondContact CA-O 3.46Å; V171-L190 HydrophobicContact CG1-CB 4.29Å; V171-L190 HydrophobicContact CG1-CD1 4.09Å
172	K	96.5	Very high	94.1	Very high	118 Å²	118	101 Å²	101	51%	0.513	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	135.5	170.2	-65.5	162.4	-174.1	150.9	0	107.7	S188 T189 D191	K172-S188 CarbonylContact O-C 3.54Å; K172-S188 WeakPolarHBondContact O-CA 3.29Å; K172-S188 PolarHBondContact O-OG 3.06Å; K172-S188 VanDerWaalsContact O-OG 3.05Å; K172-T189 PolarHBondContact N-O 2.66Å; K172-T189 PolarHBondContact O-N 3.36Å; K172-D191 IonicContact NZ-OD2 2.91Å; K172-D191 PolarHBondContact NZ-OD2 2.57Å
173	Y	97.7	Very high	94.1	Very high	94 Å²	94	100 Å²	100	37%	0.369	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129.7	175.4	173.7	-92.4	0	0	0	109.2	A157 K175 V186	A157-Y173 PolarHBondContact O-OH 2.82Å; A157-Y173 VanDerWaalsContact O-OH 3.06Å; Y173-K175 HydrophobicContact CE1-CB 4.15Å; Y173-V186 HydrophobicContact CE2-CB 4.02Å; Y173-V186 HydrophobicContact CE2-CG1 4.3Å; Y173-V186 WeakPolarHBondContact OH-CG1 3.32Å
174	L	97.6	Very high	94.3	Very high	97 Å²	97	101 Å²	101	51%	0.508	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	142.8	177.8	-61.3	175	0	0	0	109.3	V186 S187	L174-V186 WeakPolarHBondContact O-CA 3.34Å; L174-S187 PolarHBondContact N-O 3.2Å; L174-S187 PolarHBondContact O-N 3.02Å
175	K	97.4	Very high	94.6	Very high	141 Å²	141	96.7 Å²	96.7	61%	0.613	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.4	172.5	67.8	-179.3	-176.2	178.7	0	109	Y173 V186	Y173-K175 HydrophobicContact CE1-CB 4.15Å; K175-V186 HydrophobicContact CB-CG1 3.99Å
176	E	97.6	Very high	95	Very high	113 Å²	113	89.3 Å²	89.3	53%	0.528	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	136.7	179.9	-65.1	178.4	178.4	0	0	107.9	F184 T185	E176-F184 CarbonylContact O-C 3.22Å; E176-F184 VanDerWaalsContact O-CA 3.29Å; E176-F184 WeakPolarHBondContact O-CA 3.44Å; E176-T185 PolarHBondContact N-O 2.97Å; E176-T185 PolarHBondContact O-N 2.88Å
177	E	96.8	Very high	95.2	Very high	112 Å²	112	82.6 Å²	82.6	52%	0.523	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.6	174.9	-169.6	178	-161.2	0	0	109.1	R181 F184	E177-R181 HydrophobicContact CG-CB 4.46Å; E177-R181 VanDerWaalsContact OE1-C 3.29Å; E177-R181 WeakPolarHBondContact OE1-CA 3.35Å; E177-R181 WeakPolarHBondContact OE1-CB 2.87Å; E177-F184 HydrophobicContact CB-CD1 4.36Å; E177-F184 HydrophobicContact CB-CE1 4.31Å; E177-F184 HydrophobicContact CG-CE1 4.32Å
178	D	93.1	Very high	95.3	Very high	33 Å²	33	79.2 Å²	79.2	18%	0.176	39%	0.387	C	S	.	.			trans	-69.3	163	-178.7	-67.3	-35.3	0	0	0	111.1	N180 R181 T183 F184 T185	D178-N180 PolarHBondContact O-N 3.31Å; D178-R181 PolarHBondContact O-N 2.84Å; D178-T183 WeakPolarHBondContact CB-OG1 3.48Å; D178-T183 PolarHBondContact N-O 2.87Å; D178-T183 VanDerWaalsContact OD2-CB 3.25Å; D178-T183 WeakPolarHBondContact OD2-CB 3.39Å; D178-T183 PolarHBondContact OD2-OG1 3.25Å; D178-F184 PolarHBondContact OD2-N 2.86Å; D178-T185 WeakPolarHBondContact OD1-CB 3.41Å; D178-T185 PolarHBondContact OD1-N 2.96Å; D178-T185 PolarHBondContact OD1-OG1 3.08Å
179	A	90.5	Very high	95.4	Very high	113 Å²	113	78.1 Å²	78.1	93%	0.934	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-24.5	-179.7	0	0	0	0	0	113.7	R181	A179-R181 VanDerWaalsContact C-N 3.3Å; A179-R181 PolarHBondContact O-N 2.79Å
180	N	86.1	Confident	95.5	Very high	82 Å²	82	70.5 Å²	70.5	44%	0.439	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-11.3	176.4	66.9	15.3	0	0	0	113.9	D178 K182 T183	D178-N180 PolarHBondContact O-N 3.31Å; N180-K182 WeakPolarHBondContact O-CG 3.23Å; N180-K182 PolarHBondContact O-N 3.43Å; N180-K182 PolarHBondContact OD1-N 2.78Å; N180-T183 PolarHBondContact ND2-OG1 3.05Å; N180-T183 PolarHBondContact OD1-N 2.64Å; N180-T183 VanDerWaalsContact OD1-N 3.08Å; N180-T183 PolarHBondContact OD1-OG1 3.34Å
181	R	89.9	Confident	95.6	Very high	196 Å²	196	66.2 Å²	66.2	74%	0.74	33%	0.327	S	S	*	.	S	Bend	trans	53.5	28.5	-173.9	-61.4	-174.6	-173.8	163.5	0.9	115.2	E177 D178 A179	E177-R181 HydrophobicContact CG-CB 4.46Å; E177-R181 VanDerWaalsContact OE1-C 3.29Å; E177-R181 WeakPolarHBondContact OE1-CA 3.35Å; E177-R181 WeakPolarHBondContact OE1-CB 2.87Å; D178-R181 PolarHBondContact O-N 2.84Å; A179-R181 VanDerWaalsContact C-N 3.3Å; A179-R181 PolarHBondContact O-N 2.79Å
182	K	92.1	Very high	95.5	Very high	79 Å²	79	65.5 Å²	65.5	34%	0.343	32%	0.32	S	S	.	.	S	Bend	trans	-125.9	-34	-179.3	-65.8	-169.6	-173.2	-172.7	0	111.9	L98 K154 N180	L98-K182 HydrophobicContact CB-CD 3.69Å; L98-K182 HydrophobicContact CD1-CB 4.1Å; L98-K182 PolarHBondContact O-NZ 2.91Å; K154-K182 WeakPolarHBondContact CD-O 3.21Å; K154-K182 WeakPolarHBondContact CG-O 3.5Å; N180-K182 WeakPolarHBondContact O-CG 3.23Å; N180-K182 PolarHBondContact O-N 3.43Å; N180-K182 PolarHBondContact OD1-N 2.78Å
183	T	97	Very high	95.5	Very high	7 Å²	7	68.6 Å²	68.6	4%	0.043	33%	0.328	C	S	.	.	S	Bend	trans	-113	166.4	179.1	53.5	0	0	0	0	111	L98 G152 S153 K154 D178 N180	L98-T183 HydrophobicContact CD1-CG2 3.55Å; G152-T183 WeakPolarHBondContact O-CG2 3.47Å; S153-T183 CarbonylContact O-C 3.58Å; S153-T183 WeakPolarHBondContact O-CA 3.47Å; K154-T183 HydrophobicContact CB-CG2 4.25Å; D178-T183 WeakPolarHBondContact CB-OG1 3.48Å; D178-T183 PolarHBondContact N-O 2.87Å; D178-T183 VanDerWaalsContact OD2-CB 3.25Å; D178-T183 WeakPolarHBondContact OD2-CB 3.39Å; D178-T183 PolarHBondContact OD2-OG1 3.25Å; N180-T183 PolarHBondContact ND2-OG1 3.05Å; N180-T183 PolarHBondContact OD1-N 2.64Å; N180-T183 VanDerWaalsContact OD1-N 3.08Å; N180-T183 PolarHBondContact OD1-OG1 3.34Å
184	F	98	Very high	95.3	Very high	56 Å²	56	64.3 Å²	64.3	25%	0.246	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	137.3	178.8	-59.2	-82.8	0	0	0	110.4	G152 S153 A156 E176 E177 D178 V186	G152-F184 PolarHBondContact N-O 3.21Å; S153-F184 PolarHBondContact N-O 3.47Å; S153-F184 VanDerWaalsContact N-O 3.1Å; S153-F184 PolarHBondContact O-N 3.37Å; S153-F184 PolarHBondContact OG-O 2.9Å; A156-F184 HydrophobicContact CB-CB 3.99Å; A156-F184 HydrophobicContact CB-CD2 4.09Å; A156-F184 HydrophobicContact CB-CG 3.97Å; E176-F184 CarbonylContact O-C 3.22Å; E176-F184 VanDerWaalsContact O-CA 3.29Å; E176-F184 WeakPolarHBondContact O-CA 3.44Å; E177-F184 HydrophobicContact CB-CD1 4.36Å; E177-F184 HydrophobicContact CB-CE1 4.31Å; E177-F184 HydrophobicContact CG-CE1 4.32Å; D178-F184 PolarHBondContact OD2-N 2.86Å; F184-V186 HydrophobicContact CB-CG1 4.47Å
185	T	98.3	Very high	95.2	Very high	14 Å²	14	63 Å²	63	9%	0.086	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.7	159.3	-71.3	0	0	0	0	108.7	K149 T150 S151 E176 D178	K149-T185 HydrophobicContact CD-CG2 4.36Å; K149-T185 HydrophobicContact CG-CG2 4.16Å; T150-T185 WeakPolarHBondContact O-CA 3.04Å; S151-T185 VanDerWaalsContact CB-OG1 3.28Å; S151-T185 WeakPolarHBondContact CB-OG1 3.5Å; E176-T185 PolarHBondContact N-O 2.97Å; E176-T185 PolarHBondContact O-N 2.88Å; D178-T185 WeakPolarHBondContact OD1-CB 3.41Å; D178-T185 PolarHBondContact OD1-N 2.96Å; D178-T185 PolarHBondContact OD1-OG1 3.08Å
186	V	98.4	Very high	95.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.1	177.9	-62.5	0	0	0	0	109.8	T150 A156 A157 I159 Y173 L174 K175 F184	T150-V186 HydrophobicContact CG2-CG2 3.39Å; T150-V186 PolarHBondContact N-O 2.93Å; T150-V186 PolarHBondContact O-N 3.11Å; A156-V186 HydrophobicContact CB-CG1 3.86Å; A157-V186 HydrophobicContact CB-CG2 4.1Å; I159-V186 HydrophobicContact CD1-CB 4.17Å; I159-V186 HydrophobicContact CD1-CG2 3.78Å; I159-V186 HydrophobicContact CG1-CG2 4.1Å; Y173-V186 HydrophobicContact CE2-CB 4.02Å; Y173-V186 HydrophobicContact CE2-CG1 4.3Å; Y173-V186 WeakPolarHBondContact OH-CG1 3.32Å; L174-V186 WeakPolarHBondContact O-CA 3.34Å; K175-V186 HydrophobicContact CB-CG1 3.99Å; F184-V186 HydrophobicContact CB-CG1 4.47Å
187	S	98.2	Very high	94.9	Very high	18 Å²	18	58.6 Å²	58.6	13%	0.126	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	143.6	176.6	62.7	0	0	0	0	111.2	C148 L174	C148-S187 CarbonylContact O-C 3.24Å; C148-S187 WeakPolarHBondContact O-CA 3.18Å; L174-S187 PolarHBondContact N-O 3.2Å; L174-S187 PolarHBondContact O-N 3.02Å
188	S	98.4	Very high	94.8	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.5	172	-178.6	0	0	0	0	111.3	T147 C148 I159 W161 K172	T147-S188 CarbonylContact C-O 3.51Å; T147-S188 WeakPolarHBondContact CA-O 3.42Å; C148-S188 PolarHBondContact N-O 3.01Å; C148-S188 PolarHBondContact O-N 2.84Å; I159-S188 VanDerWaalsContact CG2-CB 3.5Å; W161-S188 WeakPolarHBondContact CZ2-O 3.38Å; W161-S188 PolarHBondContact NE1-OG 2.98Å; K172-S188 CarbonylContact O-C 3.54Å; K172-S188 WeakPolarHBondContact O-CA 3.29Å; K172-S188 PolarHBondContact O-OG 3.06Å; K172-S188 VanDerWaalsContact O-OG 3.05Å
189	T	98.1	Very high	94.9	Very high	20 Å²	20	54.1 Å²	54.1	12%	0.123	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.3	-179.7	-56	0	0	0	0	110.3	Q145 L146 T147 V171 K172	Q145-T189 HydrophobicContact CG-CG2 3.36Å; L146-T189 CarbonylContact O-C 3.55Å; L146-T189 VanDerWaalsContact O-CA 3.28Å; L146-T189 WeakPolarHBondContact O-CA 3.34Å; T147-T189 PolarHBondContact OG1-OG1 2.95Å; V171-T189 WeakPolarHBondContact CA-O 3.46Å; K172-T189 PolarHBondContact N-O 2.66Å; K172-T189 PolarHBondContact O-N 3.36Å
190	L	96.6	Very high	95.1	Very high	2 Å²	2	51 Å²	51	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	119	178.6	168.3	62.4	0	0	0	109.2	Q145 L146 W161 I168 V171 F192 V203	Q145-L190 WeakPolarHBondContact CA-O 3.21Å; L146-L190 PolarHBondContact N-O 2.95Å; L146-L190 PolarHBondContact O-N 2Å; W161-L190 HydrophobicContact CB-CD2 4.28Å; W161-L190 HydrophobicContact CD2-CB 4.01Å; W161-L190 HydrophobicContact CD2-CD2 3.99Å; W161-L190 HydrophobicContact CE3-CD2 3.95Å; W161-L190 HydrophobicContact CG-CB 4.25Å; W161-L190 HydrophobicContact CG-CD2 4.2Å; W161-L190 HydrophobicContact CZ2-CB 4.19Å; I168-L190 HydrophobicContact CB-CD1 4.32Å; I168-L190 HydrophobicContact CD1-CD1 4.1Å; I168-L190 HydrophobicContact CD1-CD2 3.71Å; I168-L190 HydrophobicContact CG2-CD1 3.59Å; V171-L190 HydrophobicContact CG1-CB 4.29Å; V171-L190 HydrophobicContact CG1-CD1 4.09Å; L190-F192 HydrophobicContact CD1-CD1 4.47Å; L190-F192 HydrophobicContact CD2-CD1 4.17Å; L190-F192 HydrophobicContact CD2-CE1 4.25Å; L190-F192 HydrophobicContact CG-CD1 3.95Å; L190-F192 HydrophobicContact CG-CE1 4.41Å; L190-V203 HydrophobicContact CD2-CG1 4.19Å
191	D	94.8	Very high	95.5	Very high	51 Å²	51	48 Å²	48	27%	0.273	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.9	176.8	-63.7	-38.4	0	0	0	109.3	M144 Q145 K172	M144-D191 WeakPolarHBondContact O-CA 3.46Å; Q145-D191 WeakPolarHBondContact CB-OD1 3.35Å; Q145-D191 WeakPolarHBondContact CG-OD1 3.48Å; Q145-D191 PolarHBondContact NE2-OD1 2.93Å; K172-D191 IonicContact NZ-OD2 2.91Å; K172-D191 PolarHBondContact NZ-OD2 2.57Å
192	F	93.6	Very high	95.8	Very high	29 Å²	29	40 Å²	40	13%	0.127	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	155.6	172.2	67.6	-78.8	0	0	0	112.4	M144 L146 L190 V194 L223	M144-F192 HydrophobicContact CB-CE1 4.24Å; M144-F192 HydrophobicContact CB-CZ 4.26Å; M144-F192 HydrophobicContact CG-CE1 4.12Å; M144-F192 HydrophobicContact CG-CZ 4.2Å; M144-F192 PolarHBondContact N-O 3.14Å; M144-F192 PolarHBondContact O-N 2.79Å; L146-F192 HydrophobicContact CD1-CE1 3.96Å; L146-F192 HydrophobicContact CD1-CZ 4.47Å; L146-F192 HydrophobicContact CG-CE1 4.3Å; L190-F192 HydrophobicContact CD1-CD1 4.47Å; L190-F192 HydrophobicContact CD2-CD1 4.17Å; L190-F192 HydrophobicContact CD2-CE1 4.25Å; L190-F192 HydrophobicContact CG-CD1 3.95Å; L190-F192 HydrophobicContact CG-CE1 4.41Å; F192-V194 HydrophobicContact CE2-CG2 4.39Å; F192-L223 HydrophobicContact CE2-CD1 4.36Å; F192-L223 HydrophobicContact CZ-CD1 3.93Å
193	R	95.1	Very high	96	Very high	183 Å²	183	36.3 Å²	36.3	69%	0.691	20%	0.196	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	128.5	173.3	-165	175.1	-176.6	91.2	2.4	109.4	G141 D142	G141-R193 PolarHBondContact O-NE 3.48Å; G141-R193 PolarHBondContact O-NH1 2.85Å; G141-R193 PolarHBondContact O-NH2 2.74Å; G141-R193 VanDerWaalsContact O-NH2 3.15Å; D142-R193 WeakPolarHBondContact O-CA 3.33Å
194	V	95.1	Very high	96	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.03	21%	0.206	C	C	.	.			trans	-73.4	133.1	-175.1	175.6	0	0	0	0	110.3	V138 G141 D142 M144 F192 I225	V138-V194 HydrophobicContact CG1-CB 4.32Å; V138-V194 HydrophobicContact CG1-CG1 4.06Å; V138-V194 HydrophobicContact CG1-CG2 3.67Å; G141-V194 PolarHBondContact N-O 3.05Å; D142-V194 HydrophobicContact CB-CG2 4.43Å; D142-V194 WeakPolarHBondContact O-CG2 3.34Å; D142-V194 PolarHBondContact O-N 3.26Å; M144-V194 HydrophobicContact CB-CG2 3.68Å; F192-V194 HydrophobicContact CE2-CG2 4.39Å; V194-I225 HydrophobicContact CG1-CB 4.39Å; V194-I225 HydrophobicContact CG1-CD1 3.49Å; V194-I225 VanDerWaalsContact CG1-CD1 3.49Å; V194-I225 HydrophobicContact CG1-CG1 3.98Å; V194-I225 HydrophobicContact CG1-CG2 3.54Å
195	D	95.1	Very high	96	Very high	69 Å²	69	35.6 Å²	35.6	37%	0.369	19%	0.194	S	C	.	.			trans	-119.6	153.5	175.4	-175.8	-95.3	0	0	0	110.9	S197 D198	D195-S197 PolarHBondContact O-N 3.1Å; D195-S197 VanDerWaalsContact O-N 3.14Å; D195-S197 WeakPolarHBondContact OD1-CB 3.43Å; D195-S197 PolarHBondContact OD1-N 2.8Å; D195-S197 PolarHBondContact OD1-OG 2.84Å; D195-D198 PolarHBondContact N-OD2 2.77Å; D195-D198 VanDerWaalsContact O-CB 3.23Å; D195-D198 WeakPolarHBondContact O-CB 3.32Å; D195-D198 PolarHBondContact O-N 2.82Å
196	R	94.6	Very high	96	Very high	80 Å²	80	37.9 Å²	37.9	30%	0.302	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-57.3	-26.2	175.5	65.5	-177.5	66.8	-154.7	-7	114.1	E140 D198 D199 Y227	E140-R196 WeakPolarHBondContact OE1-CB 3.41Å; E140-R196 IonicContact OE1-CZ 3.99Å; E140-R196 PolarHBondContact OE1-N 2.89Å; E140-R196 IonicContact OE1-NE 3.15Å; E140-R196 PolarHBondContact OE1-NE 2.97Å; E140-R196 IonicContact OE1-NH2 3.44Å; E140-R196 PolarHBondContact OE1-NH2 2.9Å; E140-R196 IonicContact OE2-CZ 2.81Å; E140-R196 IonicContact OE2-NE 2.89Å; E140-R196 IonicContact OE2-NH2 3.57Å; E140-R196 PolarHBondContact OE2-NH2 3.18Å; R196-D198 PolarHBondContact O-N 3.28Å; R196-D199 PolarHBondContact O-N 3.01Å; R196-Y227 HydrophobicContact CB-CD1 3.74Å; R196-Y227 HydrophobicContact CB-CD2 4.04Å; R196-Y227 HydrophobicContact CB-CE1 3.96Å; R196-Y227 HydrophobicContact CB-CE2 4.25Å; R196-Y227 HydrophobicContact CB-CG 3.79Å
197	S	94.4	Very high	96	Very high	81 Å²	81	37.9 Å²	37.9	57%	0.566	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-71.9	-10.9	175.4	63.1	0	0	0	0	113.6	D195 D199 V201	D195-S197 PolarHBondContact O-N 3.1Å; D195-S197 VanDerWaalsContact O-N 3.14Å; D195-S197 WeakPolarHBondContact OD1-CB 3.43Å; D195-S197 PolarHBondContact OD1-N 2.8Å; D195-S197 PolarHBondContact OD1-OG 2.84Å; S197-D199 VanDerWaalsContact C-N 3.3Å; S197-V201 WeakPolarHBondContact O-CG2 3.39Å
198	D	94.4	Very high	96	Very high	7 Å²	7	38.9 Å²	38.9	4%	0.037	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-83	-7.3	174.9	-61.3	-30.5	0	0	0	112.7	K163 D195 R196 G200 V201 L223 I225	K163-D198 WeakPolarHBondContact CE-OD1 3.29Å; K163-D198 IonicContact NZ-OD1 2.67Å; K163-D198 PolarHBondContact NZ-OD1 2.91Å; K163-D198 IonicContact NZ-OD2 3.78Å; K163-D198 PolarHBondContact NZ-OD2 2.71Å; D195-D198 PolarHBondContact N-OD2 2.77Å; D195-D198 VanDerWaalsContact O-CB 3.23Å; D195-D198 WeakPolarHBondContact O-CB 3.32Å; D195-D198 PolarHBondContact O-N 2.82Å; R196-D198 PolarHBondContact O-N 3.28Å; D198-G200 PolarHBondContact O-N 2.68Å; D198-V201 VanDerWaalsContact O-CB 3.31Å; D198-V201 WeakPolarHBondContact O-CB 3.36Å; D198-V201 PolarHBondContact O-N 2.91Å; D198-L223 HydrophobicContact CB-CD1 4.14Å; D198-I225 HydrophobicContact CB-CG1 4.08Å
199	D	94.8	Very high	96	Very high	45 Å²	45	39.9 Å²	39.9	24%	0.241	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	126	178	-169.3	51.2	0	0	0	112.1	R196 S197 V201 I225 Y227 K255	R196-D199 PolarHBondContact O-N 3.01Å; S197-D199 VanDerWaalsContact C-N 3.3Å; D199-V201 PolarHBondContact O-N 3.38Å; D199-I225 HydrophobicContact CB-CB 4.03Å; D199-I225 HydrophobicContact CB-CG1 4.28Å; D199-I225 PolarHBondContact OD1-N 3.06Å; D199-Y227 HydrophobicContact CB-CE1 4.29Å; D199-K255 VanDerWaalsContact CG-CD 3.5Å; D199-K255 WeakPolarHBondContact OD1-CD 3.34Å; D199-K255 WeakPolarHBondContact OD1-CE 3.43Å; D199-K255 IonicContact OD1-NZ 2.89Å; D199-K255 PolarHBondContact OD1-NZ 2.93Å; D199-K255 WeakPolarHBondContact OD2-CD 3.18Å; D199-K255 IonicContact OD2-NZ 2.71Å; D199-K255 PolarHBondContact OD2-NZ 2.88Å
200	G	94	Very high	95.9	Very high	48 Å²	48	44.3 Å²	44.3	50%	0.495	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	-0.1	-176	0	0	0	0	0	114.3	D198 L223	D198-G200 PolarHBondContact O-N 2.68Å; G200-L223 WeakPolarHBondContact CA-O 3.44Å; G200-L223 PolarHBondContact N-O 3.11Å
201	V	94.8	Very high	95.9	Very high	18 Å²	18	44.6 Å²	44.6	11%	0.109	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-74.9	134.6	176.1	174.6	0	0	0	0	109.8	K163 N164 S197 D198 D199 L223	K163-V201 HydrophobicContact CG-CG1 3.86Å; N164-V201 WeakPolarHBondContact OD1-CG1 3.38Å; S197-V201 WeakPolarHBondContact O-CG2 3.39Å; D198-V201 VanDerWaalsContact O-CB 3.31Å; D198-V201 WeakPolarHBondContact O-CB 3.36Å; D198-V201 PolarHBondContact O-N 2.91Å; D199-V201 PolarHBondContact O-N 3.38Å; V201-L223 PolarHBondContact O-N 3Å
202	A	95.6	Very high	96	Very high	29 Å²	29	43 Å²	43	24%	0.24	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.5	171.6	0	0	0	0	0	110.8	M220 Q221 V222	A202-M220 HydrophobicContact CB-CG 3.77Å; A202-M220 HydrophobicContact CB-SD 3.69Å; A202-Q221 WeakPolarHBondContact CA-O 3.42Å; A202-V222 HydrophobicContact CB-CG2 4.34Å
203	V	96.4	Very high	95.8	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	125.4	165	-175.8	0	0	0	0	108.1	L146 W161 K163 L190 M220 Q221 L223	L146-V203 HydrophobicContact CD1-CB 4.1Å; L146-V203 HydrophobicContact CD1-CG1 3.87Å; L146-V203 HydrophobicContact CD1-CG2 4.15Å; W161-V203 HydrophobicContact CE3-CG1 3.52Å; W161-V203 HydrophobicContact CZ3-CG1 3.61Å; K163-V203 HydrophobicContact CG-CG2 4.48Å; L190-V203 HydrophobicContact CD2-CG1 4.19Å; V203-M220 WeakPolarHBondContact O-CA 3.41Å; V203-Q221 PolarHBondContact N-O 3.25Å; V203-Q221 PolarHBondContact O-N 3.01Å; V203-L223 HydrophobicContact CG2-CD1 3.74Å; V203-L223 HydrophobicContact CG2-CD2 4.39Å; V203-L223 HydrophobicContact CG2-CG 4.07Å
204	I	98.1	Very high	95.6	Very high	48 Å²	48	44 Å²	44	25%	0.246	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	127	-173.9	-59.2	164.1	0	0	0	108.8	W161 F162 V218 A219 M220	W161-I204 CarbonylContact C-O 3.55Å; W161-I204 WeakPolarHBondContact CA-O 3.33Å; F162-I204 HydrophobicContact CB-CB 4.15Å; F162-I204 PolarHBondContact N-O 2.81Å; F162-I204 PolarHBondContact O-N 2.87Å; I204-V218 HydrophobicContact CG2-CB 4.4Å; I204-V218 HydrophobicContact CG2-CG1 4.41Å; I204-A219 CarbonylContact C-O 3.55Å; I204-A219 WeakPolarHBondContact CA-O 3.45Å; I204-M220 HydrophobicContact CG1-CB 4.45Å; I204-M220 HydrophobicContact CG1-CG 3.99Å; I204-M220 HydrophobicContact CG1-SD 4.25Å
205	C	98.2	Very high	95.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	119.7	165.2	173	0	0	0	0	108.7	I131 C148 I159 W161 V218 A219	I131-C205 HydrophobicContact CD1-CB 3.86Å; I131-C205 HydrophobicContact CG1-CB 3.9Å; C148-C205 HydrophobicContact CB-CB 3.57Å; C148-C205 WeakPolarHBondContact CB-SG 3Å; C148-C205 WeakPolarHBondContact SG-CB 2.97Å; C148-C205 CovalentContact SG-SG 2.01Å; C148-C205 PolarHBondContact SG-SG 3.22Å; I159-C205 VanDerWaalsContact CG2-SG 3.53Å; W161-C205 HydrophobicContact CE3-CB 4.23Å; W161-C205 HydrophobicContact CH2-CB 4.45Å; W161-C205 HydrophobicContact CZ3-CB 4.15Å; C205-V218 CarbonylContact O-C 3.54Å; C205-V218 VanDerWaalsContact O-CA 3.29Å; C205-V218 WeakPolarHBondContact O-CA 3.4Å; C205-A219 HydrophobicContact CB-CB 4.35Å; C205-A219 PolarHBondContact N-O 2.88Å; C205-A219 PolarHBondContact O-N 3.05Å
206	R	98.1	Very high	95.7	Very high	63 Å²	63	47.8 Å²	47.8	24%	0.238	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.6	175.9	-172.7	174	72	-158.7	-6.1	109.9	I159 R160 F162 D208 P216 V218	I159-R206 WeakPolarHBondContact CA-O 3.47Å; R160-R206 PolarHBondContact N-O 3.42Å; R160-R206 VanDerWaalsContact NH1-NH2 3.16Å; R160-R206 VanDerWaalsContact NH2-NH2 3.11Å; R160-R206 PolarHBondContact O-N 2.87Å; F162-R206 HydrophobicContact CD2-CB 4.19Å; F162-R206 HydrophobicContact CE2-CB 4Å; F162-R206 VanDerWaalsContact CZ-CZ 3.43Å; R206-D208 IonicContact CZ-OD2 3.65Å; R206-D208 IonicContact NE-OD1 2.78Å; R206-D208 IonicContact NE-OD2 2.77Å; R206-D208 PolarHBondContact NE-OD2 3.21Å; R206-P216 HydrophobicContact CG-CB 3.66Å; R206-P216 HydrophobicContact CG-CG 4.26Å; R206-V218 HydrophobicContact CB-CG1 4.42Å; R206-V218 HydrophobicContact CG-CG1 4.21Å
207	V	98.5	Very high	95.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.7	174.4	178.7	0	0	0	0	109.3	P126 P129 T150 A157 D158 I159 P216 Q217	P126-V207 HydrophobicContact CB-CG1 4.3Å; P126-V207 HydrophobicContact CG-CG1 4.27Å; P129-V207 HydrophobicContact CB-CG2 3.63Å; P129-V207 HydrophobicContact CG-CB 4.42Å; P129-V207 HydrophobicContact CG-CG2 3.74Å; T150-V207 HydrophobicContact CG2-CG1 4.05Å; T150-V207 HydrophobicContact CG2-CG2 4.01Å; A157-V207 HydrophobicContact CB-CG1 3.81Å; D158-V207 WeakPolarHBondContact O-CA 2.92Å; I159-V207 HydrophobicContact CG1-CG2 4.25Å; V207-P216 WeakPolarHBondContact O-CA 3.36Å; V207-P216 WeakPolarHBondContact O-CB 3.42Å; V207-Q217 HydrophobicContact CB-CB 4.35Å; V207-Q217 PolarHBondContact N-O 2.01Å; V207-Q217 PolarHBondContact O-N 2.78Å
208	D	97.4	Very high	96.1	Very high	38 Å²	38	46.4 Å²	46.4	20%	0.203	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.3	177	-67.5	-91	0	0	0	109.7	D158 R160 R206	D158-D208 HydrophobicContact CB-CB 4.36Å; D158-D208 PolarHBondContact N-O 3.31Å; D158-D208 PolarHBondContact O-N 2.9Å; R160-D208 IonicContact CZ-OD2 2.64Å; R160-D208 IonicContact NE-OD2 2.9Å; R160-D208 PolarHBondContact NE-OD2 2.89Å; R160-D208 IonicContact NH2-OD1 3.26Å; R160-D208 PolarHBondContact NH2-OD1 3.08Å; R160-D208 VanDerWaalsContact NH2-OD1 3.11Å; R160-D208 IonicContact NH2-OD2 2.74Å; R160-D208 PolarHBondContact NH2-OD2 2.73Å; R206-D208 IonicContact CZ-OD2 3.65Å; R206-D208 IonicContact NE-OD1 2.78Å; R206-D208 IonicContact NE-OD2 2.77Å; R206-D208 PolarHBondContact NE-OD2 3.21Å
209	H	98.1	Very high	96.2	Very high	22 Å²	22	46.7 Å²	46.7	10%	0.102	28%	0.281	C	S	.	.			trans	-157.3	147.4	-179.6	-172.1	-95.6	0	0	0	110.9	G124 P126 K154 P155 A157 S211 L212	G124-H209 PolarHBondContact O-CE1 2.88Å; P126-H209 HydrophobicContact CG-CB 3.91Å; K154-H209 PolarHBondContact O-CE1 3.44Å; K154-H209 VanDerWaalsContact O-CE1 3.28Å; K154-H209 PolarHBondContact O-NE2 2.87Å; P155-H209 WeakPolarHBondContact CD-NE2 3.38Å; P155-H209 PolarHBondContact O-CD2 3.15Å; P155-H209 VanDerWaalsContact O-CD2 3.29Å; P155-H209 PolarHBondContact O-NE2 2.81Å; A157-H209 HydrophobicContact CB-CB 4.15Å; H209-S211 VanDerWaalsContact C-N 3.29Å; H209-S211 PolarHBondContact CE1-OG 2.69Å; H209-S211 VanDerWaalsContact CE1-OG 3.31Å; H209-S211 WeakPolarHBondContact ND1-CB 3.44Å; H209-S211 PolarHBondContact ND1-N 3.22Å; H209-S211 VanDerWaalsContact ND1-N 3.12Å; H209-S211 PolarHBondContact ND1-OG 3.19Å; H209-S211 PolarHBondContact O-N 2.77Å; H209-L212 HydrophobicContact CB-CD1 3.96Å; H209-L212 HydrophobicContact CB-CG 4.1Å; H209-L212 WeakPolarHBondContact O-CB 3.48Å; H209-L212 PolarHBondContact O-N 2.9Å; H209-L212 VanDerWaalsContact O-N 3.08Å
210	E	96.8	Very high	96.3	Very high	112 Å²	112	50.4 Å²	50.4	52%	0.523	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-65.6	-28.9	-175.4	50.4	179.7	-168.6	0	0	113.7	L123 P155 L212 N213	L123-E210 HydrophobicContact CD1-CB 4.45Å; L123-E210 HydrophobicContact CD1-CG 3.88Å; L123-E210 HydrophobicContact CD2-CG 4.14Å; L123-E210 WeakPolarHBondContact CD2-OE1 3.31Å; P155-E210 WeakPolarHBondContact CD-OE1 3.33Å; P155-E210 HydrophobicContact CG-CG 4.39Å; P155-E210 WeakPolarHBondContact CG-OE1 3.36Å; E210-L212 PolarHBondContact O-N 2.99Å; E210-N213 PolarHBondContact O-N 2.79Å
211	S	96.6	Very high	96.4	Very high	8 Å²	8	50.1 Å²	50.1	6%	0.056	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-69.8	-11	174.7	70.8	0	0	0	0	114.3	G124 H209	G124-S211 PolarHBondContact O-OG 3.48Å; H209-S211 VanDerWaalsContact C-N 3.29Å; H209-S211 PolarHBondContact CE1-OG 2.69Å; H209-S211 VanDerWaalsContact CE1-OG 3.31Å; H209-S211 WeakPolarHBondContact ND1-CB 3.44Å; H209-S211 PolarHBondContact ND1-N 3.22Å; H209-S211 VanDerWaalsContact ND1-N 3.12Å; H209-S211 PolarHBondContact ND1-OG 3.19Å; H209-S211 PolarHBondContact O-N 2.77Å
212	L	96.1	Very high	96.5	Very high	17 Å²	17	52.9 Å²	52.9	9%	0.089	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-91.3	4.6	-178.2	-58.6	175.1	0	0	0	113.5	V125 P126 H209 E210 A214 T215 Q217	V125-L212 HydrophobicContact CG1-CD2 4.14Å; P126-L212 HydrophobicContact CG-CD1 4.06Å; P126-L212 HydrophobicContact CG-CD2 4.27Å; P126-L212 HydrophobicContact CG-CG 4.28Å; H209-L212 HydrophobicContact CB-CD1 3.96Å; H209-L212 HydrophobicContact CB-CG 4.1Å; H209-L212 WeakPolarHBondContact O-CB 3.48Å; H209-L212 PolarHBondContact O-N 2.9Å; H209-L212 VanDerWaalsContact O-N 3.08Å; E210-L212 PolarHBondContact O-N 2.99Å; L212-A214 VanDerWaalsContact C-N 3.3Å; L212-A214 PolarHBondContact O-N 2.88Å; L212-T215 WeakPolarHBondContact CB-O 3.42Å; L212-T215 PolarHBondContact O-N 2.88Å; L212-T215 PolarHBondContact O-OG1 2.96Å; L212-Q217 HydrophobicContact CD1-CB 4.42Å; L212-Q217 HydrophobicContact CD1-CG 3.88Å; L212-Q217 HydrophobicContact CD2-CG 4Å
213	N	90.8	Very high	96.4	Very high	134 Å²	134	51.9 Å²	51.9	72%	0.717	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	46	176.1	-61.6	-39.3	0	0	0	113.7	E210 T215	E210-N213 PolarHBondContact O-N 2.79Å; N213-T215 PolarHBondContact O-N 2.96Å
214	A	90.5	Very high	96.4	Very high	101 Å²	101	55.3 Å²	55.3	84%	0.835	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	13.6	-176.9	0	0	0	0	0	116	L212 P216	L212-A214 VanDerWaalsContact C-N 3.3Å; L212-A214 PolarHBondContact O-N 2.88Å; A214-P216 VanDerWaalsContact O-CD 3.29Å; A214-P216 WeakPolarHBondContact O-CD 3.39Å
215	T	96.1	Very high	96.2	Very high	98 Å²	98	53.1 Å²	53.1	60%	0.601	30%	0.296	S	S	*	.			trans	-101.8	93.2	169.9	58.7	0	0	0	0	110.3	L212 N213	L212-T215 WeakPolarHBondContact CB-O 3.42Å; L212-T215 PolarHBondContact O-N 2.88Å; L212-T215 PolarHBondContact O-OG1 2.96Å; N213-T215 PolarHBondContact O-N 2.96Å
216	P	96.4	Very high	96.2	Very high	55 Å²	55	54.2 Å²	54.2	36%	0.357	30%	0.301	S	S	.	.			trans	-65.7	145.7	-175.5	27.6	-34.7	0	0	0	111.4	R206 V207 A214	R206-P216 HydrophobicContact CG-CB 3.66Å; R206-P216 HydrophobicContact CG-CG 4.26Å; V207-P216 WeakPolarHBondContact O-CA 3.36Å; V207-P216 WeakPolarHBondContact O-CB 3.42Å; A214-P216 VanDerWaalsContact O-CD 3.29Å; A214-P216 WeakPolarHBondContact O-CD 3.39Å
217	Q	97.9	Very high	96.1	Very high	39 Å²	39	53 Å²	53	18%	0.182	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	146.1	169.6	-67.9	-175.4	8.7	0	0	109.7	P126 E127 K128 P129 V207 L212	P126-Q217 PolarHBondContact O-NE2 2.83Å; P126-Q217 PolarHBondContact O-OE1 3.21Å; E127-Q217 VanDerWaalsContact C-OE1 3.31Å; E127-Q217 PolarHBondContact O-OE1 2.84Å; K128-Q217 VanDerWaalsContact CA-OE1 3.31Å; P129-Q217 VanDerWaalsContact CD-OE1 3.31Å; P129-Q217 HydrophobicContact CG-CB 4.22Å; V207-Q217 HydrophobicContact CB-CB 4.35Å; V207-Q217 PolarHBondContact N-O 2.01Å; V207-Q217 PolarHBondContact O-N 2.78Å; L212-Q217 HydrophobicContact CD1-CB 4.42Å; L212-Q217 HydrophobicContact CD1-CG 3.88Å; L212-Q217 HydrophobicContact CD2-CG 4Å
218	V	98	Very high	95.9	Very high	92 Å²	92	55.1 Å²	55.1	56%	0.558	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	141.3	-176.9	-64.7	0	0	0	0	111.7	I204 C205 R206	I204-V218 HydrophobicContact CG2-CB 4.4Å; I204-V218 HydrophobicContact CG2-CG1 4.41Å; C205-V218 CarbonylContact O-C 3.54Å; C205-V218 VanDerWaalsContact O-CA 3.29Å; C205-V218 WeakPolarHBondContact O-CA 3.4Å; R206-V218 HydrophobicContact CB-CG1 4.42Å; R206-V218 HydrophobicContact CG-CG1 4.21Å
219	A	98.3	Very high	95.8	Very high	13 Å²	13	53.3 Å²	53.3	11%	0.107	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	144.5	164	0	0	0	0	0	108.4	P129 I131 I204 C205	P129-A219 HydrophobicContact CB-CB 3.98Å; P129-A219 HydrophobicContact CG-CB 3.96Å; P129-A219 WeakPolarHBondContact O-CB 3.4Å; I131-A219 HydrophobicContact CD1-CB 3.92Å; I131-A219 WeakPolarHBondContact CD1-O 3.29Å; I131-A219 HydrophobicContact CG1-CB 3.82Å; I204-A219 CarbonylContact C-O 3.55Å; I204-A219 WeakPolarHBondContact CA-O 3.45Å; C205-A219 HydrophobicContact CB-CB 4.35Å; C205-A219 PolarHBondContact N-O 2.88Å; C205-A219 PolarHBondContact O-N 3.05Å
220	M	96.9	Very high	95.5	Very high	124 Å²	124	54.6 Å²	54.6	61%	0.611	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	134	-175.7	-174.8	171.1	69.3	0	0	110.1	A202 V203 I204	A202-M220 HydrophobicContact CB-CG 3.77Å; A202-M220 HydrophobicContact CB-SD 3.69Å; V203-M220 WeakPolarHBondContact O-CA 3.41Å; I204-M220 HydrophobicContact CG1-CB 4.45Å; I204-M220 HydrophobicContact CG1-CG 3.99Å; I204-M220 HydrophobicContact CG1-SD 4.25Å
221	Q	95.8	Very high	95.4	Very high	42 Å²	42	50.3 Å²	50.3	20%	0.196	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	118.3	174	-179.2	56.5	53.8	0	0	109.4	I131 F134 A202 V203 L223	I131-Q221 HydrophobicContact CD1-CB 4.2Å; I131-Q221 HydrophobicContact CG2-CB 4.09Å; F134-Q221 HydrophobicContact CD1-CG 4.08Å; F134-Q221 HydrophobicContact CD2-CG 4.41Å; F134-Q221 HydrophobicContact CE1-CG 4.31Å; F134-Q221 VanDerWaalsContact CE1-OE1 3.28Å; F134-Q221 HydrophobicContact CG-CG 4.15Å; A202-Q221 WeakPolarHBondContact CA-O 3.42Å; V203-Q221 PolarHBondContact N-O 3.25Å; V203-Q221 PolarHBondContact O-N 3.01Å; Q221-L223 HydrophobicContact CG-CD2 4.34Å
222	V	95.5	Very high	95.3	Very high	75 Å²	75	57 Å²	57	46%	0.455	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	127.9	171.7	-178.9	0	0	0	0	108.4	A202	A202-V222 HydrophobicContact CB-CG2 4.34Å
223	L	94.4	Very high	95.3	Very high	8 Å²	8	57.2 Å²	57.2	4%	0.042	32%	0.322	C	S	.	.			trans	-86	138.2	-177.9	-57.8	178.1	0	0	0	111.1	F192 D198 G200 V201 V203 Q221 I225	F192-L223 HydrophobicContact CE2-CD1 4.36Å; F192-L223 HydrophobicContact CZ-CD1 3.93Å; D198-L223 HydrophobicContact CB-CD1 4.14Å; G200-L223 WeakPolarHBondContact CA-O 3.44Å; G200-L223 PolarHBondContact N-O 3.11Å; V201-L223 PolarHBondContact O-N 3Å; V203-L223 HydrophobicContact CG2-CD1 3.74Å; V203-L223 HydrophobicContact CG2-CD2 4.39Å; V203-L223 HydrophobicContact CG2-CG 4.07Å; Q221-L223 HydrophobicContact CG-CD2 4.34Å; L223-I225 HydrophobicContact CB-CD1 3.85Å; L223-I225 HydrophobicContact CB-CG1 4.3Å
224	E	95.2	Very high	95.5	Very high	73 Å²	73	54.3 Å²	54.3	34%	0.341	31%	0.306	S	S	.	.			trans	-112.4	107.6	169.5	-170.3	-170.3	168.8	0	0	108.7	S136 P137 V138 H226	S136-E224 WeakPolarHBondContact OG-CB 3.42Å; S136-E224 PolarHBondContact OG-OE2 2.84Å; P137-E224 HydrophobicContact CB-CG 4.41Å; V138-E224 PolarHBondContact N-O 2.82Å; E224-H226 IonicContact OE1-CD2 3.5Å; E224-H226 IonicContact OE1-CE1 3.7Å; E224-H226 IonicContact OE1-NE2 3.57Å; E224-H226 PolarHBondContact OE1-NE2 2.79Å
225	I	95.7	Very high	95.8	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.5	-174.5	-47.5	-52.7	0	0	0	109.7	V138 V194 D198 D199 L223 Y227 K255	V138-I225 HydrophobicContact CB-CD1 3.77Å; V138-I225 HydrophobicContact CG1-CD1 4.38Å; V138-I225 HydrophobicContact CG2-CD1 4.15Å; V138-I225 CarbonylContact O-C 3.57Å; V138-I225 WeakPolarHBondContact O-CA 2.93Å; V194-I225 HydrophobicContact CG1-CB 4.39Å; V194-I225 HydrophobicContact CG1-CD1 3.49Å; V194-I225 VanDerWaalsContact CG1-CD1 3.49Å; V194-I225 HydrophobicContact CG1-CG1 3.98Å; V194-I225 HydrophobicContact CG1-CG2 3.54Å; D198-I225 HydrophobicContact CB-CG1 4.08Å; D199-I225 HydrophobicContact CB-CB 4.03Å; D199-I225 HydrophobicContact CB-CG1 4.28Å; D199-I225 PolarHBondContact OD1-N 3.06Å; L223-I225 HydrophobicContact CB-CD1 3.85Å; L223-I225 HydrophobicContact CB-CG1 4.3Å; I225-Y227 HydrophobicContact CG2-CD1 4.34Å; I225-Y227 WeakPolarHBondContact O-CD1 3.1Å; I225-K255 WeakPolarHBondContact O-CD 3.49Å
226	H	96.4	Very high	95.9	Very high	24 Å²	24	49.9 Å²	49.9	11%	0.111	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	136.4	173.2	-76.3	-157.8	0	0	0	110	P137 V138 M139 E140 E224 K255 P256 I304	P137-H226 HydrophobicContact CB-CB 4.26Å; P137-H226 WeakPolarHBondContact CB-CD2 3.46Å; P137-H226 VanDerWaalsContact CB-NE2 3.34Å; P137-H226 WeakPolarHBondContact CB-NE2 3.38Å; V138-H226 PolarHBondContact O-N 3.47Å; M139-H226 WeakPolarHBondContact CA-O 3.39Å; M139-H226 HydrophobicContact SD-CB 4.36Å; E140-H226 PolarHBondContact N-O 3.32Å; E224-H226 IonicContact OE1-CD2 3.5Å; E224-H226 IonicContact OE1-CE1 3.7Å; E224-H226 IonicContact OE1-NE2 3.57Å; E224-H226 PolarHBondContact OE1-NE2 2.79Å; H226-K255 CarbonylContact C-O 3.49Å; H226-K255 WeakPolarHBondContact CA-O 3.4Å; H226-K255 WeakPolarHBondContact CB-O 3.45Å; H226-P256 WeakPolarHBondContact ND1-CD 3.36Å; H226-I304 HydrophobicContact CB-CD1 3.81Å; H226-I304 HydrophobicContact CB-CG1 3.96Å
227	Y	96.5	Very high	95.8	Very high	37 Å²	37	49.2 Å²	49.2	15%	0.145	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	156.8	-174.5	53.6	-90.4	0	0	0	111.5	R196 D199 I225 K255 N302	R196-Y227 HydrophobicContact CB-CD1 3.74Å; R196-Y227 HydrophobicContact CB-CD2 4.04Å; R196-Y227 HydrophobicContact CB-CE1 3.96Å; R196-Y227 HydrophobicContact CB-CE2 4.25Å; R196-Y227 HydrophobicContact CB-CG 3.79Å; D199-Y227 HydrophobicContact CB-CE1 4.29Å; I225-Y227 HydrophobicContact CG2-CD1 4.34Å; I225-Y227 WeakPolarHBondContact O-CD1 3.1Å; Y227-K255 HydrophobicContact CD1-CB 4.01Å; Y227-K255 HydrophobicContact CE1-CB 3.56Å; Y227-K255 PolarHBondContact N-O 2.89Å; Y227-K255 PolarHBondContact O-N 2.82Å; Y227-N302 PolarHBondContact O-ND2 2.8Å
228	T	95.2	Very high	95.6	Very high	44 Å²	44	52.1 Å²	52.1	27%	0.27	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	156.5	179.3	56.2	0	0	0	0	112.1	I304	T228-I304 HydrophobicContact CG2-CB 4.3Å; T228-I304 HydrophobicContact CG2-CG2 3.79Å
229	P	94.6	Very high	95.5	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	145.6	178.4	-22.1	36.6	0	0	0	111.5	V231 K253 P258 A300 N302 G305 S307	P229-V231 HydrophobicContact CB-CG2 4.36Å; P229-K253 CarbonylContact C-O 3.56Å; P229-K253 WeakPolarHBondContact CA-O 3.39Å; P229-P258 HydrophobicContact CB-CB 4.15Å; P229-P258 HydrophobicContact CB-CG 4.2Å; P229-P258 HydrophobicContact CG-CB 3.8Å; P229-P258 HydrophobicContact CG-CG 4.3Å; P229-A300 HydrophobicContact CB-CB 4.14Å; P229-N302 WeakPolarHBondContact CD-OD1 3.29Å; P229-N302 HydrophobicContact CG-CB 4.11Å; P229-G305 WeakPolarHBondContact CD-O 3.28Å; P229-S307 WeakPolarHBondContact O-CB 3.17Å; P229-S307 PolarHBondContact O-OG 3.42Å
230	S	93.1	Very high	95.3	Very high	49 Å²	49	54.1 Å²	54.1	34%	0.343	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.7	164.8	52.2	0	0	0	0	107.7	S252 K253	S230-S252 CarbonylContact O-C 3.58Å; S230-S252 WeakPolarHBondContact O-CA 3.35Å; S230-K253 PolarHBondContact N-O 2.86Å; S230-K253 PolarHBondContact O-N 2.76Å; S230-K253 PolarHBondContact OG-O 2.85Å; S230-K253 VanDerWaalsContact OG-O 3.08Å
231	V	93.8	Very high	95.2	Very high	22 Å²	22	51.4 Å²	51.4	13%	0.133	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.8	-167.4	-171.9	0	0	0	0	110.4	P229 C250 E251 C298 A300 S307 A309	P229-V231 HydrophobicContact CB-CG2 4.36Å; V231-C250 WeakPolarHBondContact CG1-SG 3.48Å; V231-E251 CarbonylContact C-O 3.58Å; V231-E251 WeakPolarHBondContact CA-O 2.97Å; V231-C298 HydrophobicContact CG1-CB 4.34Å; V231-A300 HydrophobicContact CG2-CB 3.64Å; V231-S307 WeakPolarHBondContact CG2-O 2.9Å; V231-A309 HydrophobicContact CB-CB 4.15Å; V231-A309 HydrophobicContact CG1-CB 3.83Å
232	K	94.5	Very high	95.2	Very high	147 Å²	147	52.7 Å²	52.7	64%	0.639	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.7	145.9	172.5	-63.7	-175.8	-178.7	-178.8	0	109.8	C250 E251	K232-C250 CarbonylContact O-C 3.55Å; K232-C250 WeakPolarHBondContact O-CA 3.4Å; K232-E251 PolarHBondContact N-O 3.06Å; K232-E251 PolarHBondContact O-N 3.01Å
233	I	95.1	Very high	95.1	Very high	23 Å²	23	51 Å²	51	12%	0.118	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128	173	-63.8	165.7	0	0	0	108.4	L248 T249 W263 Y296 C298 A309 Y311	I233-L248 HydrophobicContact CG2-CB 4.06Å; I233-L248 HydrophobicContact CG2-CD2 4.3Å; I233-T249 WeakPolarHBondContact CA-O 3.36Å; I233-W263 HydrophobicContact CB-CH2 4.46Å; I233-W263 HydrophobicContact CD1-CH2 4.09Å; I233-W263 HydrophobicContact CD1-CZ3 3.76Å; I233-W263 HydrophobicContact CG1-CH2 3.83Å; I233-W263 HydrophobicContact CG1-CZ3 4.05Å; I233-W263 HydrophobicContact CG2-CH2 3.88Å; I233-W263 HydrophobicContact CG2-CZ3 4.32Å; I233-Y296 WeakPolarHBondContact CD1-O 3.46Å; I233-C298 HydrophobicContact CD1-CB 3.9Å; I233-C298 HydrophobicContact CG1-CB 3.84Å; I233-A309 HydrophobicContact CD1-CB 4.29Å; I233-A309 VanDerWaalsContact CD1-O 3.29Å; I233-A309 WeakPolarHBondContact CD1-O 3.13Å; I233-A309 HydrophobicContact CG1-CB 4.16Å; I233-Y311 HydrophobicContact CG2-CD2 4.43Å; I233-Y311 HydrophobicContact CG2-CG 4.02Å
234	I	95.7	Very high	95.1	Very high	72 Å²	72	55.6 Å²	55.6	37%	0.369	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	117.2	178.4	-55.8	-178.4	0	0	0	108.4	T249 E251	I234-T249 PolarHBondContact N-O 2.9Å; I234-T249 PolarHBondContact O-N 3.29Å; I234-E251 HydrophobicContact CD1-CG 3.81Å; I234-E251 WeakPolarHBondContact CD1-OE1 3.36Å; I234-E251 HydrophobicContact CG1-CG 4.45Å
235	P	97	Very high	95.1	Very high	34 Å²	34	55.7 Å²	55.7	22%	0.221	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	147.2	174.3	33.6	-35.7	0	0	0	111.3	T237 L246 I247 L248 Y311	P235-T237 WeakPolarHBondContact CB-O 3.34Å; P235-T237 PolarHBondContact O-N 3.42Å; P235-L246 HydrophobicContact CB-CD1 4.18Å; P235-I247 CarbonylContact C-O 3.5Å; P235-I247 WeakPolarHBondContact CA-O 3.47Å; P235-L248 HydrophobicContact CB-CD2 3.76Å; P235-Y311 HydrophobicContact CB-CE1 4.47Å; P235-Y311 HydrophobicContact CB-CE2 4.24Å; P235-Y311 HydrophobicContact CG-CE2 3.8Å
236	S	97.1	Very high	95.2	Very high	72 Å²	72	55.6 Å²	55.6	50%	0.503	31%	0.306	S	S	.	.	S	Bend	trans	-66.6	-21.7	175.6	60.1	0	0	0	0	113.8	I247	S236-I247 PolarHBondContact N-O 3.1Å; S236-I247 PolarHBondContact OG-N 2.93Å; S236-I247 VanDerWaalsContact OG-N 3.07Å
237	T	94.9	Very high	95.2	Very high	42 Å²	42	57.1 Å²	57.1	26%	0.258	31%	0.314	S	S	.	.			trans	-137.8	139.1	174.2	174.7	0	0	0	0	110.5	P235 F239 P240 L246	P235-T237 WeakPolarHBondContact CB-O 3.34Å; P235-T237 PolarHBondContact O-N 3.42Å; T237-F239 PolarHBondContact O-N 2.95Å; T237-F239 PolarHBondContact OG1-N 3.23Å; T237-F239 VanDerWaalsContact OG1-N 3.13Å; T237-F239 PolarHBondContact OG1-O 2.96Å; T237-P240 HydrophobicContact CG2-CG 4.47Å; T237-L246 HydrophobicContact CG2-CD1 3.81Å
238	P	94.4	Very high	95.2	Very high	99 Å²	99	55.3 Å²	55.3	64%	0.643	31%	0.308	S	S	*	.	S	Bend	trans	-72.3	-15	172	29.3	-33.4	0	0	0	113.1
239	F	94.5	Very high	95.1	Very high	144 Å²	144	55.1 Å²	55.1	63%	0.632	31%	0.306	S	S	*	.	S	Bend	trans	-126.6	83.5	-179.5	-60.7	-74.7	0	0	0	110.6	T237 Q241	T237-F239 PolarHBondContact O-N 2.95Å; T237-F239 PolarHBondContact OG1-N 3.23Å; T237-F239 VanDerWaalsContact OG1-N 3.13Å; T237-F239 PolarHBondContact OG1-O 2.96Å; F239-Q241 PolarHBondContact O-N 3.23Å
240	P	95.7	Very high	95	Very high	4 Å²	4	55 Å²	55	3%	0.026	31%	0.306	C	S	.	.			trans	-66.2	124.3	177	-20.2	34.5	0	0	0	110.9	T237 L246 L288 L313 H316	T237-P240 HydrophobicContact CG2-CG 4.47Å; P240-L246 HydrophobicContact CB-CD2 4.29Å; P240-L246 HydrophobicContact CG-CD1 4.38Å; P240-L246 HydrophobicContact CG-CD2 4.33Å; P240-L288 HydrophobicContact CB-CD1 3.56Å; P240-L313 HydrophobicContact CB-CD1 3.66Å; P240-L313 HydrophobicContact CG-CD1 3.59Å; P240-H316 WeakPolarHBondContact O-CB 3.24Å; P240-H316 PolarHBondContact O-CD2 2.8Å; P240-H316 PolarHBondContact O-N 2.86Å
241	Q	95.3	Very high	95	Very high	66 Å²	66	57.4 Å²	57.4	31%	0.308	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-115.6	146	-178.2	-71.9	-177.6	-33.2	0	0	111.6	F239 Q244 L288 H316	F239-Q241 PolarHBondContact O-N 3.23Å; Q241-Q244 HydrophobicContact CB-CG 4.05Å; Q241-Q244 WeakPolarHBondContact O-CB 3.29Å; Q241-Q244 PolarHBondContact O-N 3.45Å; Q241-Q244 VanDerWaalsContact O-N 3.13Å; Q241-L288 WeakPolarHBondContact O-CB 3.42Å; Q241-L288 WeakPolarHBondContact O-CD1 3.36Å; Q241-H316 CarbonylContact C-O 3.57Å; Q241-H316 WeakPolarHBondContact CA-O 3.23Å; Q241-H316 HydrophobicContact CG-CB 4.4Å
242	E	95.3	Very high	94.9	Very high	70 Å²	70	57 Å²	57	33%	0.327	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	137.9	176.1	-174.7	159.5	-148	0	0	111.7	Q244 K290 V315 H316 V318	E242-Q244 PolarHBondContact O-N 2.73Å; E242-K290 WeakPolarHBondContact OE2-CE 3.48Å; E242-V315 HydrophobicContact CB-CG1 3.96Å; E242-H316 PolarHBondContact N-O 3.08Å; E242-V318 HydrophobicContact CB-CG2 4.47Å; E242-V318 WeakPolarHBondContact O-CG2 3.16Å
243	G	92.7	Very high	94.8	Very high	40 Å²	40	57.2 Å²	57.2	41%	0.412	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	-7	-176.4	0	0	0	0	0	115.5	L288	G243-L288 PolarHBondContact N-O 3.31Å
244	Q	94.7	Very high	94.7	Very high	104 Å²	104	56.7 Å²	56.7	49%	0.486	31%	0.311	S	S	.	.	S	Bend	trans	-92.3	152.9	174.8	-62.9	-62.3	-42.3	0	0	111.5	Q241 E242 L288	Q241-Q244 HydrophobicContact CB-CG 4.05Å; Q241-Q244 WeakPolarHBondContact O-CB 3.29Å; Q241-Q244 PolarHBondContact O-N 3.45Å; Q241-Q244 VanDerWaalsContact O-N 3.13Å; E242-Q244 PolarHBondContact O-N 2.73Å; Q244-L288 WeakPolarHBondContact O-CB 3.36Å; Q244-L288 VanDerWaalsContact O-CG 3.32Å; Q244-L288 WeakPolarHBondContact O-CG 3.42Å; Q244-L288 PolarHBondContact O-N 3.12Å
245	P	95.7	Very high	94.7	Very high	74 Å²	74	55.8 Å²	55.8	48%	0.481	30%	0.304	S	S	.	.			trans	-73	150.6	170.1	30.1	-34.1	0	0	0	111.5	I285 L286	P245-I285 CarbonylContact C-O 3.6Å; P245-I285 VanDerWaalsContact CA-O 3.3Å; P245-I285 WeakPolarHBondContact CA-O 3.35Å; P245-L286 VanDerWaalsContact CA-O 3.3Å; P245-L286 WeakPolarHBondContact CA-O 3.45Å; P245-L286 WeakPolarHBondContact CB-O 3.26Å
246	L	96.8	Very high	94.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135.5	172.2	177.9	67	0	0	0	110.1	P235 T237 P240 L248 I285 L288 L313	P235-L246 HydrophobicContact CB-CD1 4.18Å; T237-L246 HydrophobicContact CG2-CD1 3.81Å; P240-L246 HydrophobicContact CB-CD2 4.29Å; P240-L246 HydrophobicContact CG-CD1 4.38Å; P240-L246 HydrophobicContact CG-CD2 4.33Å; L246-L248 HydrophobicContact CD1-CD2 4.33Å; L246-L248 HydrophobicContact CD2-CD2 3.94Å; L246-L248 HydrophobicContact CD2-CG 4.3Å; L246-L248 HydrophobicContact CG-CD2 4.09Å; L246-L248 HydrophobicContact CG-CG 4.4Å; L246-I285 HydrophobicContact CB-CB 4.47Å; L246-I285 HydrophobicContact CD2-CD1 4.46Å; L246-I285 PolarHBondContact N-O 3.29Å; L246-I285 PolarHBondContact O-N 3.33Å; L246-L288 HydrophobicContact CB-CD1 3.91Å; L246-L288 HydrophobicContact CB-CD2 4.04Å; L246-L288 HydrophobicContact CB-CG 4.06Å; L246-L288 HydrophobicContact CD2-CD1 4.41Å; L246-L288 HydrophobicContact CD2-CD2 4.08Å; L246-L313 HydrophobicContact CD2-CD1 3.47Å; L246-L313 VanDerWaalsContact CD2-CD1 3.47Å; L246-L313 HydrophobicContact CD2-CD2 3.91Å; L246-L313 HydrophobicContact CD2-CG 4.35Å
247	I	96.4	Very high	94.3	Very high	55 Å²	55	59.1 Å²	59.1	28%	0.282	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.4	172.1	-48.9	-178.9	0	0	0	107	P235 S236 E282 L283 N284	P235-I247 CarbonylContact C-O 3.5Å; P235-I247 WeakPolarHBondContact CA-O 3.47Å; S236-I247 PolarHBondContact N-O 3.1Å; S236-I247 PolarHBondContact OG-N 2.93Å; S236-I247 VanDerWaalsContact OG-N 3.07Å; I247-E282 HydrophobicContact CG2-CB 4.01Å; I247-E282 HydrophobicContact CG2-CG 4.24Å; I247-L283 WeakPolarHBondContact CA-O 3.36Å; I247-N284 WeakPolarHBondContact CD1-OD1 3.32Å; I247-N284 VanDerWaalsContact CG1-OD1 3.32Å; I247-N284 WeakPolarHBondContact CG1-OD1 3.45Å
248	L	96.1	Very high	94.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	112.5	168	-59.6	-177.4	0	0	0	107.8	I233 P235 L246 W263 E282 L283 Y296 Y311	I233-L248 HydrophobicContact CG2-CB 4.06Å; I233-L248 HydrophobicContact CG2-CD2 4.3Å; P235-L248 HydrophobicContact CB-CD2 3.76Å; L246-L248 HydrophobicContact CD1-CD2 4.33Å; L246-L248 HydrophobicContact CD2-CD2 3.94Å; L246-L248 HydrophobicContact CD2-CG 4.3Å; L246-L248 HydrophobicContact CG-CD2 4.09Å; L246-L248 HydrophobicContact CG-CG 4.4Å; L248-W263 HydrophobicContact CB-CH2 3.61Å; L248-W263 HydrophobicContact CB-CZ2 4.21Å; L248-W263 HydrophobicContact CB-CZ3 4.11Å; L248-W263 HydrophobicContact CD1-CZ3 4.29Å; L248-W263 WeakPolarHBondContact O-CZ2 3.33Å; L248-E282 WeakPolarHBondContact O-CA 3.41Å; L248-L283 HydrophobicContact CB-CB 4.33Å; L248-L283 HydrophobicContact CD1-CD2 4.41Å; L248-L283 PolarHBondContact N-O 2.79Å; L248-L283 PolarHBondContact O-N 2.84Å; L248-Y296 HydrophobicContact CD1-CD1 4.02Å; L248-Y296 HydrophobicContact CD1-CD2 4.22Å; L248-Y296 HydrophobicContact CD1-CG 3.74Å; L248-Y311 HydrophobicContact CD1-CD1 4.02Å; L248-Y311 HydrophobicContact CD2-CD1 3.82Å; L248-Y311 HydrophobicContact CD2-CE1 3.76Å
249	T	94.5	Very high	93.5	Very high	39 Å²	39	59.7 Å²	59.7	24%	0.239	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	123.3	178.3	-55.8	0	0	0	0	109.3	I233 I234 E282	I233-T249 WeakPolarHBondContact CA-O 3.36Å; I234-T249 PolarHBondContact N-O 2.9Å; I234-T249 PolarHBondContact O-N 3.29Å; T249-E282 HydrophobicContact CG2-CG 4.16Å
250	C	92.9	Very high	92.1	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	102.8	173.4	-170.7	0	0	0	0	111.5	V231 K232 V261 W263 R281 C298	V231-C250 WeakPolarHBondContact CG1-SG 3.48Å; K232-C250 CarbonylContact O-C 3.55Å; K232-C250 WeakPolarHBondContact O-CA 3.4Å; C250-V261 HydrophobicContact CB-CG1 4.11Å; C250-V261 HydrophobicContact CB-CG2 4.01Å; C250-W263 HydrophobicContact CB-CH2 4.07Å; C250-W263 HydrophobicContact CB-CZ2 3.52Å; C250-R281 WeakPolarHBondContact CB-O 3.02Å; C250-R281 PolarHBondContact N-O 2.87Å; C250-C298 HydrophobicContact CB-CB 3.73Å; C250-C298 WeakPolarHBondContact CB-SG 3.3Å; C250-C298 WeakPolarHBondContact SG-CB 3.34Å; C250-C298 CovalentContact SG-SG 2Å; C250-C298 PolarHBondContact SG-SG 3.2Å
251	E	92.3	Very high	91.3	Very high	99 Å²	99	58.5 Å²	58.5	46%	0.463	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	121.2	171.3	-69.4	-163.9	165.8	0	0	109.9	V231 K232 I234	V231-E251 CarbonylContact C-O 3.58Å; V231-E251 WeakPolarHBondContact CA-O 2.97Å; K232-E251 PolarHBondContact N-O 3.06Å; K232-E251 PolarHBondContact O-N 3.01Å; I234-E251 HydrophobicContact CD1-CG 3.81Å; I234-E251 WeakPolarHBondContact CD1-OE1 3.36Å; I234-E251 HydrophobicContact CG1-CG 4.45Å
252	S	91.9	Very high	90.7	Very high	13 Å²	13	60.1 Å²	60.1	9%	0.091	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.9	171.3	69.8	0	0	0	0	112.4	S230 P258 R281	S230-S252 CarbonylContact O-C 3.58Å; S230-S252 WeakPolarHBondContact O-CA 3.35Å; S252-P258 WeakPolarHBondContact OG-CG 3.41Å; S252-R281 PolarHBondContact OG-NH1 2.88Å
253	K	91.4	Very high	90.6	Very high	151 Å²	151	57.3 Å²	57.3	66%	0.657	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	128	174.4	-62.9	-177	-179.4	-177.1	0	109.3	P229 S230	P229-K253 CarbonylContact C-O 3.56Å; P229-K253 WeakPolarHBondContact CA-O 3.39Å; S230-K253 PolarHBondContact N-O 2.86Å; S230-K253 PolarHBondContact O-N 2.76Å; S230-K253 PolarHBondContact OG-O 2.85Å; S230-K253 VanDerWaalsContact OG-O 3.08Å
254	G	93.4	Very high	90.6	Very high	12 Å²	12	56.3 Å²	56.3	12%	0.124	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	159.2	179.2	0	0	0	0	0	110.4	P256	G254-P256 CarbonylContact C-O 3.55Å; G254-P256 VanDerWaalsContact C-O 3.24Å; G254-P256 CarbonylContact O-C 3.56Å
255	K	95.4	Very high	90.6	Very high	54 Å²	54	52.5 Å²	52.5	24%	0.235	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	118.3	172	-170.6	164	177.9	-177.7	0	109.8	D199 I225 H226 Y227	D199-K255 VanDerWaalsContact CG-CD 3.5Å; D199-K255 WeakPolarHBondContact OD1-CD 3.34Å; D199-K255 WeakPolarHBondContact OD1-CE 3.43Å; D199-K255 IonicContact OD1-NZ 2.89Å; D199-K255 PolarHBondContact OD1-NZ 2.93Å; D199-K255 WeakPolarHBondContact OD2-CD 3.18Å; D199-K255 IonicContact OD2-NZ 2.71Å; D199-K255 PolarHBondContact OD2-NZ 2.88Å; I225-K255 WeakPolarHBondContact O-CD 3.49Å; H226-K255 CarbonylContact C-O 3.49Å; H226-K255 WeakPolarHBondContact CA-O 3.4Å; H226-K255 WeakPolarHBondContact CB-O 3.45Å; Y227-K255 HydrophobicContact CD1-CB 4.01Å; Y227-K255 HydrophobicContact CE1-CB 3.56Å; Y227-K255 PolarHBondContact N-O 2.89Å; Y227-K255 PolarHBondContact O-N 2.82Å
256	P	94.9	Very high	90.5	Very high	41 Å²	41	53.6 Å²	53.6	27%	0.266	28%	0.28	S	S	.	.	S	Bend	cis	-61.8	162.2	-0.9	-23.8	37.7	0	0	0	113.2	H226 G254 N302 T303	H226-P256 WeakPolarHBondContact ND1-CD 3.36Å; G254-P256 CarbonylContact C-O 3.55Å; G254-P256 VanDerWaalsContact C-O 3.24Å; G254-P256 CarbonylContact O-C 3.56Å; P256-N302 WeakPolarHBondContact O-CB 3.49Å; P256-N302 PolarHBondContact O-ND2 3.05Å; P256-T303 WeakPolarHBondContact CD-OG1 3.29Å; P256-T303 WeakPolarHBondContact CG-OG1 3.19Å
257	L	91.4	Very high	90.1	Very high	134 Å²	134	57.1 Å²	57.1	70%	0.702	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-56.8	126.5	-178.2	-173.6	74.2	0	0	0	109.8
258	P	90.9	Very high	89.8	Confident	5 Å²	5	56 Å²	56	3%	0.032	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-67.7	143.5	-178.9	22.6	-30.9	0	0	0	113.1	P229 S252 R281 A300 T301 N302	P229-P258 HydrophobicContact CB-CB 4.15Å; P229-P258 HydrophobicContact CB-CG 4.2Å; P229-P258 HydrophobicContact CG-CB 3.8Å; P229-P258 HydrophobicContact CG-CG 4.3Å; S252-P258 WeakPolarHBondContact OG-CG 3.41Å; P258-R281 PolarHBondContact O-NH2 3.07Å; P258-A300 HydrophobicContact CB-CB 4.23Å; P258-T301 CarbonylContact C-O 3.34Å; P258-T301 WeakPolarHBondContact CA-O 3.25Å; P258-T301 WeakPolarHBondContact CB-O 3.25Å; P258-N302 HydrophobicContact CB-CB 4.32Å
259	E	81.8	Confident	89.6	Confident	149 Å²	149	64.6 Å²	64.6	70%	0.696	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-69.8	167.8	175	-77.9	-167.4	-179.8	0	0	112.3	T301	E259-T301 PolarHBondContact N-O 2.79Å
260	P	64.3	Low	89.5	Confident	109 Å²	109	64.1 Å²	64.1	71%	0.708	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-55.9	152.2	-170.3	-23.1	32.9	0	0	0	114.5
261	V	79.5	Confident	89.3	Confident	13 Å²	13	68.2 Å²	68.2	8%	0.079	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-80.7	132.2	-168.5	164.4	0	0	0	0	112.3	C250 W263 R281 C298 E299	C250-V261 HydrophobicContact CB-CG1 4.11Å; C250-V261 HydrophobicContact CB-CG2 4.01Å; V261-W263 HydrophobicContact CG1-CD2 4.28Å; V261-W263 HydrophobicContact CG1-CG 4.13Å; V261-R281 HydrophobicContact CG2-CG 4.32Å; V261-C298 HydrophobicContact CG1-CB 3.96Å; V261-C298 WeakPolarHBondContact CG1-SG 3.18Å; V261-E299 WeakPolarHBondContact CA-O 3.39Å
262	L	81.8	Confident	89.1	Confident	101 Å²	101	66 Å²	66	53%	0.529	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	119.1	164.2	-177.6	66.1	0	0	0	109.5	T264 E299	L262-T264 HydrophobicContact CD2-CG2 4.44Å; L262-T264 HydrophobicContact CG-CG2 4.27Å; L262-E299 HydrophobicContact CB-CB 4.45Å; L262-E299 PolarHBondContact N-O 2.75Å; L262-E299 VanDerWaalsContact N-O 3.17Å; L262-E299 PolarHBondContact O-N 3.49Å
263	W	93.3	Very high	88.7	Confident	10 Å²	10	70 Å²	70	4%	0.038	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.7	172.6	-76.8	101.4	0	0	0	110.6	I233 L248 C250 V261 L270 V278 L283 R297 C298	I233-W263 HydrophobicContact CB-CH2 4.46Å; I233-W263 HydrophobicContact CD1-CH2 4.09Å; I233-W263 HydrophobicContact CD1-CZ3 3.76Å; I233-W263 HydrophobicContact CG1-CH2 3.83Å; I233-W263 HydrophobicContact CG1-CZ3 4.05Å; I233-W263 HydrophobicContact CG2-CH2 3.88Å; I233-W263 HydrophobicContact CG2-CZ3 4.32Å; L248-W263 HydrophobicContact CB-CH2 3.61Å; L248-W263 HydrophobicContact CB-CZ2 4.21Å; L248-W263 HydrophobicContact CB-CZ3 4.11Å; L248-W263 HydrophobicContact CD1-CZ3 4.29Å; L248-W263 WeakPolarHBondContact O-CZ2 3.33Å; C250-W263 HydrophobicContact CB-CH2 4.07Å; C250-W263 HydrophobicContact CB-CZ2 3.52Å; V261-W263 HydrophobicContact CG1-CD2 4.28Å; V261-W263 HydrophobicContact CG1-CG 4.13Å; W263-L270 HydrophobicContact CB-CD1 4.04Å; W263-L270 HydrophobicContact CB-CD2 4.47Å; W263-L270 HydrophobicContact CB-CG 4.48Å; W263-V278 HydrophobicContact CB-CG2 4.22Å; W263-V278 HydrophobicContact CG-CG2 4.39Å; W263-L283 HydrophobicContact CB-CD2 4.46Å; W263-L283 HydrophobicContact CD2-CB 3.74Å; W263-L283 HydrophobicContact CD2-CD2 4.07Å; W263-L283 HydrophobicContact CE3-CB 4.22Å; W263-L283 HydrophobicContact CE3-CD2 3.92Å; W263-L283 HydrophobicContact CG-CB 4.02Å; W263-L283 HydrophobicContact CG-CD2 4.33Å; W263-L283 HydrophobicContact CH2-CB 4.48Å; W263-L283 HydrophobicContact CZ2-CB 4.03Å; W263-L283 HydrophobicContact CZ3-CD2 4.47Å; W263-R297 WeakPolarHBondContact CA-O 3.37Å; W263-C298 HydrophobicContact CD2-CB 4.35Å; W263-C298 HydrophobicContact CE3-CB 4.1Å; W263-C298 HydrophobicContact CH2-CB 4Å; W263-C298 HydrophobicContact CZ2-CB 4.24Å; W263-C298 HydrophobicContact CZ3-CB 3.92Å
264	T	93.9	Very high	88.5	Confident	19 Å²	19	69.6 Å²	69.6	12%	0.117	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	153.1	176.5	49.3	0	0	0	0	110	L262 G268 Y296 R297	L262-T264 HydrophobicContact CD2-CG2 4.44Å; L262-T264 HydrophobicContact CG-CG2 4.27Å; T264-G268 CarbonylContact C-O 3.54Å; T264-G268 VanDerWaalsContact CA-O 3.22Å; T264-G268 WeakPolarHBondContact CA-O 3.47Å; T264-G268 WeakPolarHBondContact CB-O 3.38Å; T264-G268 WeakPolarHBondContact CG2-O 3.33Å; T264-Y296 WeakPolarHBondContact O-CA 3.32Å; T264-R297 PolarHBondContact N-O 2.81Å; T264-R297 PolarHBondContact O-N 2.92Å; T264-R297 WeakPolarHBondContact OG1-CB 3.49Å; T264-R297 PolarHBondContact OG1-O 2.89Å
265	K	95.1	Very high	88.5	Confident	24 Å²	24	70.5 Å²	70.5	10%	0.104	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.7	174.2	-168.3	-162.8	178.2	-144.3	0	108.7	G267 G268 L270 P271 T291 D292 N293 T295 Y296	K265-G267 PolarHBondContact O-N 2.89Å; K265-G267 VanDerWaalsContact O-N 3.07Å; K265-G268 PolarHBondContact N-O 3.01Å; K265-G268 PolarHBondContact O-N 3.33Å; K265-L270 HydrophobicContact CB-CD2 4.27Å; K265-P271 HydrophobicContact CD-CG 4.09Å; K265-T291 PolarHBondContact NZ-O 3.02Å; K265-D292 WeakPolarHBondContact CE-O 3.43Å; K265-N293 WeakPolarHBondContact CE-O 3.4Å; K265-N293 PolarHBondContact NZ-O 2.91Å; K265-T295 WeakPolarHBondContact CA-O 3.26Å; K265-Y296 HydrophobicContact CB-CD1 4.5Å; K265-Y296 HydrophobicContact CB-CE1 4.37Å; K265-Y296 HydrophobicContact CD-CE1 4.32Å; K265-Y296 HydrophobicContact CG-CD1 4.4Å; K265-Y296 HydrophobicContact CG-CE1 4.08Å; K265-Y296 HydrophobicContact CG-CE2 4.3Å
266	D	92.4	Very high	88.4	Confident	98 Å²	98	68.1 Å²	68.1	52%	0.524	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	33	177.2	-55.6	-45.9	0	0	0	113.3	G268 G294 T295	D266-G268 VanDerWaalsContact C-N 3.33Å; D266-G268 PolarHBondContact O-N 3.09Å; D266-G294 WeakPolarHBondContact OD1-CA 3.42Å; D266-T295 PolarHBondContact N-O 2.89Å; D266-T295 PolarHBondContact OD1-N 2.84Å
267	G	88.6	Confident	88.3	Confident	73 Å²	73	69.3 Å²	69.3	75%	0.753	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-0.1	-178.6	0	0	0	0	0	115.7	K265	K265-G267 PolarHBondContact O-N 2.89Å; K265-G267 VanDerWaalsContact O-N 3.07Å
268	G	90.8	Very high	88.4	Confident	33 Å²	33	66.1 Å²	66.1	34%	0.34	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-116.5	-177.2	177.5	0	0	0	0	0	114	T264 K265 D266	T264-G268 CarbonylContact C-O 3.54Å; T264-G268 VanDerWaalsContact CA-O 3.22Å; T264-G268 WeakPolarHBondContact CA-O 3.47Å; T264-G268 WeakPolarHBondContact CB-O 3.38Å; T264-G268 WeakPolarHBondContact CG2-O 3.33Å; K265-G268 PolarHBondContact N-O 3.01Å; K265-G268 PolarHBondContact O-N 3.33Å; D266-G268 VanDerWaalsContact C-N 3.33Å; D266-G268 PolarHBondContact O-N 3.09Å
269	E	91.5	Very high	88.2	Confident	180 Å²	180	69.3 Å²	69.3	84%	0.841	41%	0.407	S	S	*	.			trans	-64.5	158.1	173.2	-64.5	-175.1	167.8	0	0	111.6
270	L	92.4	Very high	88.5	Confident	28 Å²	28	64.6 Å²	64.6	15%	0.147	40%	0.399	C	S	.	.			trans	-63.3	127.4	176.2	-64.7	172.1	0	0	0	109.7	W263 K265 D272 M276 V278 L283 Y296	W263-L270 HydrophobicContact CB-CD1 4.04Å; W263-L270 HydrophobicContact CB-CD2 4.47Å; W263-L270 HydrophobicContact CB-CG 4.48Å; K265-L270 HydrophobicContact CB-CD2 4.27Å; L270-D272 VanDerWaalsContact C-N 3.31Å; L270-D272 PolarHBondContact O-N 3.45Å; L270-M276 HydrophobicContact CB-SD 4.33Å; L270-M276 HydrophobicContact CD1-CB 4.45Å; L270-M276 HydrophobicContact CD2-SD 4.11Å; L270-V278 HydrophobicContact CD1-CG2 3.62Å; L270-L283 HydrophobicContact CD1-CD1 3.57Å; L270-L283 HydrophobicContact CD2-CD1 4.36Å; L270-L283 HydrophobicContact CD2-CD2 3.95Å; L270-Y296 HydrophobicContact CD2-CE1 4.44Å
271	P	88.2	Confident	89.6	Confident	87 Å²	87	63.3 Å²	63.3	57%	0.565	38%	0.38	S	S	*	.	S	Bend	trans	-73.2	-18.2	-168.4	26.9	-35.3	0	0	0	114.7	K265 M276	K265-P271 HydrophobicContact CD-CG 4.09Å; P271-M276 HydrophobicContact CG-CE 4.17Å; P271-M276 HydrophobicContact CG-SD 4.27Å
272	D	88.2	Confident	90.3	Very high	51 Å²	51	66.2 Å²	66.2	27%	0.273	39%	0.393	S	S	.	.			trans	-139.4	86.4	-173.7	-174.9	-13.3	0	0	0	110.6	L270 D274 R275 M276	L270-D272 VanDerWaalsContact C-N 3.31Å; L270-D272 PolarHBondContact O-N 3.45Å; D272-D274 VanDerWaalsContact C-N 3.26Å; D272-D274 PolarHBondContact O-N 3.3Å; D272-D274 PolarHBondContact OD1-N 3.4Å; D272-R275 HydrophobicContact CB-CB 4.34Å; D272-R275 VanDerWaalsContact CG-CB 3.42Å; D272-R275 PolarHBondContact O-N 3.11Å; D272-R275 WeakPolarHBondContact OD1-CB 3.42Å; D272-R275 PolarHBondContact OD1-N 3.03Å; D272-R275 VanDerWaalsContact OD1-N 3.12Å; D272-R275 VanDerWaalsContact OD2-CB 3.23Å; D272-R275 WeakPolarHBondContact OD2-CB 3.49Å; D272-R275 IonicContact OD2-CZ 3.54Å; D272-R275 IonicContact OD2-NE 2.99Å; D272-R275 PolarHBondContact OD2-NE 3.38Å; D272-R275 IonicContact OD2-NH2 3.26Å; D272-M276 HydrophobicContact CB-CG 4.49Å; D272-M276 WeakPolarHBondContact O-CA 3.32Å; D272-M276 WeakPolarHBondContact O-CB 3.44Å; D272-M276 WeakPolarHBondContact O-CG 2.95Å; D272-M276 PolarHBondContact O-N 2.9Å
273	P	84.3	Confident	90.9	Very high	97 Å²	97	61.4 Å²	61.4	63%	0.63	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-25.8	-175.4	-20.8	32.3	0	0	0	114.3
274	D	86.4	Confident	91	Very high	144 Å²	144	62.6 Å²	62.6	77%	0.77	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-32	-179	-69.7	-29.6	0	0	0	111.5	D272	D272-D274 VanDerWaalsContact C-N 3.26Å; D272-D274 PolarHBondContact O-N 3.3Å; D272-D274 PolarHBondContact OD1-N 3.4Å
275	R	92.8	Very high	91.2	Very high	31 Å²	31	61.8 Å²	61.8	12%	0.117	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-27.3	178.6	-169.2	174.2	55.6	88.7	7.2	113.9	D272 N284 L286 F287 D292	D272-R275 HydrophobicContact CB-CB 4.34Å; D272-R275 VanDerWaalsContact CG-CB 3.42Å; D272-R275 PolarHBondContact O-N 3.11Å; D272-R275 WeakPolarHBondContact OD1-CB 3.42Å; D272-R275 PolarHBondContact OD1-N 3.03Å; D272-R275 VanDerWaalsContact OD1-N 3.12Å; D272-R275 VanDerWaalsContact OD2-CB 3.23Å; D272-R275 WeakPolarHBondContact OD2-CB 3.49Å; D272-R275 IonicContact OD2-CZ 3.54Å; D272-R275 IonicContact OD2-NE 2.99Å; D272-R275 PolarHBondContact OD2-NE 3.38Å; D272-R275 IonicContact OD2-NH2 3.26Å; R275-N284 VanDerWaalsContact O-O 3.13Å; R275-L286 HydrophobicContact CG-CB 4.2Å; R275-L286 PolarHBondContact O-N 3.02Å; R275-F287 PolarHBondContact NH1-O 3.2Å; R275-D292 IonicContact CZ-OD1 2.66Å; R275-D292 VanDerWaalsContact CZ-OD1 3.26Å; R275-D292 IonicContact CZ-OD2 3.62Å; R275-D292 IonicContact NH1-OD1 2.68Å; R275-D292 PolarHBondContact NH1-OD1 2.93Å; R275-D292 IonicContact NH1-OD2 3.84Å; R275-D292 PolarHBondContact NH1-OD2 3.48Å; R275-D292 IonicContact NH2-OD1 3.67Å; R275-D292 PolarHBondContact NH2-OD1 2.83Å; R275-D292 IonicContact NH2-OD2 3.56Å
276	M	94.4	Very high	91.1	Very high	4 Å²	4	64.4 Å²	64.4	2%	0.02	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	83.4	-179.4	-61.1	-167.6	177.9	0	0	110.2	L270 P271 D272 L283 N284 I285 D292 Y296	L270-M276 HydrophobicContact CB-SD 4.33Å; L270-M276 HydrophobicContact CD1-CB 4.45Å; L270-M276 HydrophobicContact CD2-SD 4.11Å; P271-M276 HydrophobicContact CG-CE 4.17Å; P271-M276 HydrophobicContact CG-SD 4.27Å; D272-M276 HydrophobicContact CB-CG 4.49Å; D272-M276 WeakPolarHBondContact O-CA 3.32Å; D272-M276 WeakPolarHBondContact O-CB 3.44Å; D272-M276 WeakPolarHBondContact O-CG 2.95Å; D272-M276 PolarHBondContact O-N 2.9Å; M276-L283 HydrophobicContact CB-CD1 4.04Å; M276-N284 CarbonylContact C-O 3.58Å; M276-N284 WeakPolarHBondContact CA-O 3.46Å; M276-I285 HydrophobicContact CG-CG1 4.29Å; M276-D292 WeakPolarHBondContact CE-OD1 3.12Å; M276-Y296 HydrophobicContact CE-CE1 4.49Å; M276-Y296 WeakPolarHBondContact CE-OH 3.47Å; M276-Y296 HydrophobicContact SD-CE1 4.39Å
277	V	92.8	Very high	91.1	Very high	66 Å²	66	66.2 Å²	66.2	40%	0.4	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	117.7	-173.1	-176.8	0	0	0	0	110.4	N284	V277-N284 PolarHBondContact N-O 2.95Å; V277-N284 WeakPolarHBondContact O-CB 3.37Å; V277-N284 PolarHBondContact O-N 2.8Å
278	V	92.3	Very high	91.4	Very high	66 Å²	66	62.9 Å²	62.9	40%	0.4	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	119.6	172.5	179.8	0	0	0	0	109.6	W263 L270 E282 L283	W263-V278 HydrophobicContact CB-CG2 4.22Å; W263-V278 HydrophobicContact CG-CG2 4.39Å; L270-V278 HydrophobicContact CD1-CG2 3.62Å; V278-E282 CarbonylContact C-O 3.54Å; V278-E282 WeakPolarHBondContact CA-O 3.36Å; V278-L283 HydrophobicContact CG2-CD1 3.94Å
279	S	88.5	Confident	91.6	Very high	72 Å²	72	63.5 Å²	63.5	50%	0.503	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	93.9	175.4	-172.4	0	0	0	0	109.6	R281 E282	S279-R281 PolarHBondContact O-N 3.37Å; S279-E282 PolarHBondContact N-O 2.99Å; S279-E282 PolarHBondContact O-N 2.81Å
280	G	86.3	Confident	91.6	Very high	50 Å²	50	58.6 Å²	58.6	52%	0.515	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	-97.8	-178.1	0	0	0	0	0	112.8
281	R	89.3	Confident	91.6	Very high	83 Å²	83	62.3 Å²	62.3	31%	0.313	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-5.6	-179.2	-65.6	171.6	-177	-98.3	-6.3	112.9	C250 S252 P258 V261 S279	C250-R281 WeakPolarHBondContact CB-O 3.02Å; C250-R281 PolarHBondContact N-O 2.87Å; S252-R281 PolarHBondContact OG-NH1 2.88Å; P258-R281 PolarHBondContact O-NH2 3.07Å; V261-R281 HydrophobicContact CG2-CG 4.32Å; S279-R281 PolarHBondContact O-N 3.37Å
282	E	93.3	Very high	91.9	Very high	74 Å²	74	58.2 Å²	58.2	35%	0.346	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	137	-173.9	-62.3	-176.6	156.5	0	0	111	I247 L248 T249 V278 S279	I247-E282 HydrophobicContact CG2-CB 4.01Å; I247-E282 HydrophobicContact CG2-CG 4.24Å; L248-E282 WeakPolarHBondContact O-CA 3.41Å; T249-E282 HydrophobicContact CG2-CG 4.16Å; V278-E282 CarbonylContact C-O 3.54Å; V278-E282 WeakPolarHBondContact CA-O 3.36Å; S279-E282 PolarHBondContact N-O 2.99Å; S279-E282 PolarHBondContact O-N 2.81Å
283	L	94.9	Very high	92.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	112.1	166.2	173.5	61	0	0	0	108.4	I247 L248 W263 L270 M276 V278 I285 Y296	I247-L283 WeakPolarHBondContact CA-O 3.36Å; L248-L283 HydrophobicContact CB-CB 4.33Å; L248-L283 HydrophobicContact CD1-CD2 4.41Å; L248-L283 PolarHBondContact N-O 2.79Å; L248-L283 PolarHBondContact O-N 2.84Å; W263-L283 HydrophobicContact CB-CD2 4.46Å; W263-L283 HydrophobicContact CD2-CB 3.74Å; W263-L283 HydrophobicContact CD2-CD2 4.07Å; W263-L283 HydrophobicContact CE3-CB 4.22Å; W263-L283 HydrophobicContact CE3-CD2 3.92Å; W263-L283 HydrophobicContact CG-CB 4.02Å; W263-L283 HydrophobicContact CG-CD2 4.33Å; W263-L283 HydrophobicContact CH2-CB 4.48Å; W263-L283 HydrophobicContact CZ2-CB 4.03Å; W263-L283 HydrophobicContact CZ3-CD2 4.47Å; L270-L283 HydrophobicContact CD1-CD1 3.57Å; L270-L283 HydrophobicContact CD2-CD1 4.36Å; L270-L283 HydrophobicContact CD2-CD2 3.95Å; M276-L283 HydrophobicContact CB-CD1 4.04Å; V278-L283 HydrophobicContact CG2-CD1 3.94Å; L283-I285 HydrophobicContact CG-CG1 4.3Å; L283-Y296 HydrophobicContact CD2-CD1 3.51Å; L283-Y296 HydrophobicContact CD2-CE1 3.83Å
284	N	95.7	Very high	92.8	Very high	35 Å²	35	54.6 Å²	54.6	19%	0.187	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	114.2	178.5	-66.1	-76.9	0	0	0	109.8	I247 R275 M276 V277	I247-N284 WeakPolarHBondContact CD1-OD1 3.32Å; I247-N284 VanDerWaalsContact CG1-OD1 3.32Å; I247-N284 WeakPolarHBondContact CG1-OD1 3.45Å; R275-N284 VanDerWaalsContact O-O 3.13Å; M276-N284 CarbonylContact C-O 3.58Å; M276-N284 WeakPolarHBondContact CA-O 3.46Å; V277-N284 PolarHBondContact N-O 2.95Å; V277-N284 WeakPolarHBondContact O-CB 3.37Å; V277-N284 PolarHBondContact O-N 2.8Å
285	I	96.3	Very high	93.3	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	106.9	172.6	-52	176.4	0	0	0	107.2	P245 L246 M276 L283 F287 L288 Y296 L313	P245-I285 CarbonylContact C-O 3.6Å; P245-I285 VanDerWaalsContact CA-O 3.3Å; P245-I285 WeakPolarHBondContact CA-O 3.35Å; L246-I285 HydrophobicContact CB-CB 4.47Å; L246-I285 HydrophobicContact CD2-CD1 4.46Å; L246-I285 PolarHBondContact N-O 3.29Å; L246-I285 PolarHBondContact O-N 3.33Å; M276-I285 HydrophobicContact CG-CG1 4.29Å; L283-I285 HydrophobicContact CG-CG1 4.3Å; I285-F287 PolarHBondContact O-N 3.28Å; I285-L288 HydrophobicContact CB-CD2 4.49Å; I285-L288 HydrophobicContact CD1-CD2 4.43Å; I285-L288 HydrophobicContact CG2-CD2 4Å; I285-Y296 HydrophobicContact CD1-CE1 3.91Å; I285-L313 HydrophobicContact CD1-CD2 4.17Å
286	L	94.3	Very high	93.4	Very high	80 Å²	80	48.2 Å²	48.2	42%	0.419	27%	0.27	S	S	.	.	S	Bend	trans	-65.4	-40.7	-168.9	-63.8	175	0	0	0	113.8	P245 R275	P245-L286 VanDerWaalsContact CA-O 3.3Å; P245-L286 WeakPolarHBondContact CA-O 3.45Å; P245-L286 WeakPolarHBondContact CB-O 3.26Å; R275-L286 HydrophobicContact CG-CB 4.2Å; R275-L286 PolarHBondContact O-N 3.02Å
287	F	92.9	Very high	93.5	Very high	135 Å²	135	51.4 Å²	51.4	59%	0.592	28%	0.282	S	S	*	.	S	Bend	trans	-142.3	115	178.9	-57.6	-77.2	0	0	0	109.3	R275 I285	R275-F287 PolarHBondContact NH1-O 3.2Å; I285-F287 PolarHBondContact O-N 3.28Å
288	L	95.1	Very high	93.5	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.021	26%	0.263	C	S	.	.			trans	-70.5	141.3	178.1	-73.8	172.1	0	0	0	112.1	P240 Q241 G243 Q244 L246 I285 D292 L313 V315	P240-L288 HydrophobicContact CB-CD1 3.56Å; Q241-L288 WeakPolarHBondContact O-CB 3.42Å; Q241-L288 WeakPolarHBondContact O-CD1 3.36Å; G243-L288 PolarHBondContact N-O 3.31Å; Q244-L288 WeakPolarHBondContact O-CB 3.36Å; Q244-L288 VanDerWaalsContact O-CG 3.32Å; Q244-L288 WeakPolarHBondContact O-CG 3.42Å; Q244-L288 PolarHBondContact O-N 3.12Å; L246-L288 HydrophobicContact CB-CD1 3.91Å; L246-L288 HydrophobicContact CB-CD2 4.04Å; L246-L288 HydrophobicContact CB-CG 4.06Å; L246-L288 HydrophobicContact CD2-CD1 4.41Å; L246-L288 HydrophobicContact CD2-CD2 4.08Å; I285-L288 HydrophobicContact CB-CD2 4.49Å; I285-L288 HydrophobicContact CD1-CD2 4.43Å; I285-L288 HydrophobicContact CG2-CD2 4Å; L288-D292 WeakPolarHBondContact CA-OD2 3.25Å; L288-D292 HydrophobicContact CD2-CB 4.3Å; L288-L313 HydrophobicContact CD2-CD2 3.85Å; L288-V315 HydrophobicContact CB-CG1 4.01Å; L288-V315 HydrophobicContact CB-CG2 4.33Å; L288-V315 HydrophobicContact CD2-CG2 4.03Å
289	N	93.6	Very high	93.5	Very high	45 Å²	45	46.6 Å²	46.6	24%	0.241	25%	0.25	C	S	.	.			trans	-137.5	170.4	170.8	67.5	44.1	0	0	0	110.7	T291 D292 V315	N289-T291 PolarHBondContact O-N 3.33Å; N289-T291 VanDerWaalsContact O-N 3.15Å; N289-T291 VanDerWaalsContact OD1-CA 3.31Å; N289-T291 WeakPolarHBondContact OD1-CA 3.26Å; N289-T291 WeakPolarHBondContact OD1-CB 3.21Å; N289-T291 PolarHBondContact OD1-N 2.88Å; N289-T291 PolarHBondContact OD1-OG1 3.31Å; N289-D292 PolarHBondContact N-OD2 3.1Å; N289-D292 WeakPolarHBondContact O-CB 3.36Å; N289-D292 PolarHBondContact O-N 2.76Å; N289-D292 VanDerWaalsContact O-N 3.09Å; N289-D292 PolarHBondContact OD1-N 3.48Å; N289-D292 VanDerWaalsContact OD1-N 3.08Å; N289-D292 PolarHBondContact OD1-OD2 2.89Å; N289-V315 WeakPolarHBondContact O-CG2 3.28Å
290	K	92.6	Very high	93.8	Very high	77 Å²	77	43.1 Å²	43.1	34%	0.335	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-64.4	-17.1	179.8	-61.8	-64.9	179.5	173.1	0	115	E242 D292 N293 V315 D317	E242-K290 WeakPolarHBondContact OE2-CE 3.48Å; K290-D292 VanDerWaalsContact C-N 3.32Å; K290-N293 PolarHBondContact O-ND2 3.25Å; K290-V315 PolarHBondContact NZ-O 2.95Å; K290-D317 WeakPolarHBondContact CE-OD1 3.31Å; K290-D317 VanDerWaalsContact NZ-CG 3.28Å; K290-D317 IonicContact NZ-OD1 3.67Å; K290-D317 PolarHBondContact NZ-OD1 3.33Å; K290-D317 IonicContact NZ-OD2 3.67Å
291	T	92.1	Very high	94.1	Very high	107 Å²	107	43.5 Å²	43.5	66%	0.656	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-81.9	-12.9	175.9	71	0	0	0	0	112.9	K265 N289 N293	K265-T291 PolarHBondContact NZ-O 3.02Å; N289-T291 PolarHBondContact O-N 3.33Å; N289-T291 VanDerWaalsContact O-N 3.15Å; N289-T291 VanDerWaalsContact OD1-CA 3.31Å; N289-T291 WeakPolarHBondContact OD1-CA 3.26Å; N289-T291 WeakPolarHBondContact OD1-CB 3.21Å; N289-T291 PolarHBondContact OD1-N 2.88Å; N289-T291 PolarHBondContact OD1-OG1 3.31Å; T291-N293 VanDerWaalsContact C-N 3.26Å; T291-N293 PolarHBondContact O-N 2.96Å
292	D	94.4	Very high	94.3	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-76.6	-14.6	176.1	-62.6	-36.8	0	0	0	113.4	K265 R275 M276 L288 N289 K290 G294 Y296 L313 V315	K265-D292 WeakPolarHBondContact CE-O 3.43Å; R275-D292 IonicContact CZ-OD1 2.66Å; R275-D292 VanDerWaalsContact CZ-OD1 3.26Å; R275-D292 IonicContact CZ-OD2 3.62Å; R275-D292 IonicContact NH1-OD1 2.68Å; R275-D292 PolarHBondContact NH1-OD1 2.93Å; R275-D292 IonicContact NH1-OD2 3.84Å; R275-D292 PolarHBondContact NH1-OD2 3.48Å; R275-D292 IonicContact NH2-OD1 3.67Å; R275-D292 PolarHBondContact NH2-OD1 2.83Å; R275-D292 IonicContact NH2-OD2 3.56Å; M276-D292 WeakPolarHBondContact CE-OD1 3.12Å; L288-D292 WeakPolarHBondContact CA-OD2 3.25Å; L288-D292 HydrophobicContact CD2-CB 4.3Å; N289-D292 PolarHBondContact N-OD2 3.1Å; N289-D292 WeakPolarHBondContact O-CB 3.36Å; N289-D292 PolarHBondContact O-N 2.76Å; N289-D292 VanDerWaalsContact O-N 3.09Å; N289-D292 PolarHBondContact OD1-N 3.48Å; N289-D292 VanDerWaalsContact OD1-N 3.08Å; N289-D292 PolarHBondContact OD1-OD2 2.89Å; K290-D292 VanDerWaalsContact C-N 3.32Å; D292-G294 PolarHBondContact O-N 3.2Å; D292-Y296 VanDerWaalsContact O-CE2 3.29Å; D292-Y296 WeakPolarHBondContact O-CE2 3.27Å; D292-Y296 PolarHBondContact O-OH 3.23Å; D292-L313 HydrophobicContact CB-CD2 4.11Å; D292-V315 HydrophobicContact CB-CG2 4.31Å
293	N	95.5	Very high	94.4	Very high	57 Å²	57	42.4 Å²	42.4	31%	0.305	23%	0.226	S	C	.	.			trans	-51.4	136.7	170.9	-69.6	-52.9	0	0	0	110	K265 K290 T291 L313 I314 V315	K265-N293 WeakPolarHBondContact CE-O 3.4Å; K265-N293 PolarHBondContact NZ-O 2.91Å; K290-N293 PolarHBondContact O-ND2 3.25Å; T291-N293 VanDerWaalsContact C-N 3.26Å; T291-N293 PolarHBondContact O-N 2.96Å; N293-L313 WeakPolarHBondContact CA-O 3.48Å; N293-L313 PolarHBondContact OD1-O 2.93Å; N293-I314 VanDerWaalsContact OD1-CA 3.25Å; N293-I314 WeakPolarHBondContact OD1-CA 3.31Å; N293-V315 PolarHBondContact OD1-N 2.9Å
294	G	95.4	Very high	94.4	Very high	15 Å²	15	44.6 Å²	44.6	16%	0.155	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.9	-175.6	-177.1	0	0	0	0	0	112.3	D266 D292 L313	D266-G294 WeakPolarHBondContact OD1-CA 3.42Å; D292-G294 PolarHBondContact O-N 3.2Å; G294-L313 PolarHBondContact N-O 2.95Å; G294-L313 PolarHBondContact O-N 2.82Å
295	T	97.1	Very high	94.2	Very high	41 Å²	41	44.1 Å²	44.1	25%	0.252	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	116.4	-179.5	-58.3	0	0	0	0	109.8	K265 D266 E310	K265-T295 WeakPolarHBondContact CA-O 3.26Å; D266-T295 PolarHBondContact N-O 2.89Å; D266-T295 PolarHBondContact OD1-N 2.84Å; T295-E310 HydrophobicContact CG2-CB 3.83Å; T295-E310 HydrophobicContact CG2-CG 4.11Å
296	Y	95.6	Very high	94.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.6	174.6	-68.5	-98.8	0	0	0	109.2	I233 L248 T264 K265 L270 M276 L283 I285 D292 E310 Y311 L313	I233-Y296 WeakPolarHBondContact CD1-O 3.46Å; L248-Y296 HydrophobicContact CD1-CD1 4.02Å; L248-Y296 HydrophobicContact CD1-CD2 4.22Å; L248-Y296 HydrophobicContact CD1-CG 3.74Å; T264-Y296 WeakPolarHBondContact O-CA 3.32Å; K265-Y296 HydrophobicContact CB-CD1 4.5Å; K265-Y296 HydrophobicContact CB-CE1 4.37Å; K265-Y296 HydrophobicContact CD-CE1 4.32Å; K265-Y296 HydrophobicContact CG-CD1 4.4Å; K265-Y296 HydrophobicContact CG-CE1 4.08Å; K265-Y296 HydrophobicContact CG-CE2 4.3Å; L270-Y296 HydrophobicContact CD2-CE1 4.44Å; M276-Y296 HydrophobicContact CE-CE1 4.49Å; M276-Y296 WeakPolarHBondContact CE-OH 3.47Å; M276-Y296 HydrophobicContact SD-CE1 4.39Å; L283-Y296 HydrophobicContact CD2-CD1 3.51Å; L283-Y296 HydrophobicContact CD2-CE1 3.83Å; I285-Y296 HydrophobicContact CD1-CE1 3.91Å; D292-Y296 VanDerWaalsContact O-CE2 3.29Å; D292-Y296 WeakPolarHBondContact O-CE2 3.27Å; D292-Y296 PolarHBondContact O-OH 3.23Å; Y296-E310 CarbonylContact O-C 3.56Å; Y296-E310 VanDerWaalsContact O-CA 3.32Å; Y296-E310 WeakPolarHBondContact O-CA 3.23Å; Y296-Y311 PolarHBondContact N-O 2.82Å; Y296-Y311 PolarHBondContact O-N 3.29Å; Y296-L313 HydrophobicContact CD2-CB 3.78Å; Y296-L313 HydrophobicContact CD2-CD2 4.34Å; Y296-L313 HydrophobicContact CE2-CB 3.55Å; Y296-L313 HydrophobicContact CE2-CD2 3.5Å; Y296-L313 HydrophobicContact CE2-CG 4.15Å
297	R	94.8	Very high	94.1	Very high	70 Å²	70	46.6 Å²	46.6	26%	0.264	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.1	-179.8	-179.5	174.8	178.1	-102.7	-7.5	109.9	W263 T264 E299 S308 A309 E310	W263-R297 WeakPolarHBondContact CA-O 3.37Å; T264-R297 PolarHBondContact N-O 2.81Å; T264-R297 PolarHBondContact O-N 2.92Å; T264-R297 WeakPolarHBondContact OG1-CB 3.49Å; T264-R297 PolarHBondContact OG1-O 2.89Å; R297-E299 IonicContact CZ-OE2 3.26Å; R297-E299 IonicContact NH1-OE2 2.66Å; R297-E299 PolarHBondContact NH1-OE2 2.83Å; R297-E299 IonicContact NH2-OE2 3.11Å; R297-E299 PolarHBondContact NH2-OE2 2.9Å; R297-S308 PolarHBondContact NE-OG 2.83Å; R297-S308 VanDerWaalsContact NH2-CB 3.34Å; R297-S308 PolarHBondContact NH2-OG 3.13Å; R297-A309 VanDerWaalsContact CA-O 3.31Å; R297-A309 WeakPolarHBondContact CA-O 3.12Å; R297-E310 HydrophobicContact CB-CG 4.07Å; R297-E310 HydrophobicContact CG-CG 4.01Å
298	C	93.3	Very high	94.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.3	170.1	163.6	0	0	0	0	108.7	V231 I233 C250 V261 W263 S308 A309	V231-C298 HydrophobicContact CG1-CB 4.34Å; I233-C298 HydrophobicContact CD1-CB 3.9Å; I233-C298 HydrophobicContact CG1-CB 3.84Å; C250-C298 HydrophobicContact CB-CB 3.73Å; C250-C298 WeakPolarHBondContact CB-SG 3.3Å; C250-C298 WeakPolarHBondContact SG-CB 3.34Å; C250-C298 CovalentContact SG-SG 2Å; C250-C298 PolarHBondContact SG-SG 3.2Å; V261-C298 HydrophobicContact CG1-CB 3.96Å; V261-C298 WeakPolarHBondContact CG1-SG 3.18Å; W263-C298 HydrophobicContact CD2-CB 4.35Å; W263-C298 HydrophobicContact CE3-CB 4.1Å; W263-C298 HydrophobicContact CH2-CB 4Å; W263-C298 HydrophobicContact CZ2-CB 4.24Å; W263-C298 HydrophobicContact CZ3-CB 3.92Å; C298-S308 CarbonylContact O-C 3.59Å; C298-S308 WeakPolarHBondContact O-CA 3.49Å; C298-S308 VanDerWaalsContact O-CB 3.25Å; C298-S308 WeakPolarHBondContact O-CB 3.15Å; C298-A309 PolarHBondContact N-O 2.88Å; C298-A309 PolarHBondContact O-N 3.49Å
299	E	92.9	Very high	94.1	Very high	31 Å²	31	43.3 Å²	43.3	15%	0.145	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.7	175.6	-169.9	172.7	100.1	0	0	110.8	V261 L262 R297 Q306	V261-E299 WeakPolarHBondContact CA-O 3.39Å; L262-E299 HydrophobicContact CB-CB 4.45Å; L262-E299 PolarHBondContact N-O 2.75Å; L262-E299 VanDerWaalsContact N-O 3.17Å; L262-E299 PolarHBondContact O-N 3.49Å; R297-E299 IonicContact CZ-OE2 3.26Å; R297-E299 IonicContact NH1-OE2 2.66Å; R297-E299 PolarHBondContact NH1-OE2 2.83Å; R297-E299 IonicContact NH2-OE2 3.11Å; R297-E299 PolarHBondContact NH2-OE2 2.9Å; E299-Q306 VanDerWaalsContact CG-CD 3.45Å; E299-Q306 HydrophobicContact CG-CG 3.61Å; E299-Q306 VanDerWaalsContact OE1-CD 3.23Å; E299-Q306 PolarHBondContact OE1-NE2 2.85Å
300	A	93.8	Very high	94.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	138.8	177.4	0	0	0	0	0	110.6	P229 V231 P258 Q306 S307	P229-A300 HydrophobicContact CB-CB 4.14Å; V231-A300 HydrophobicContact CG2-CB 3.64Å; P258-A300 HydrophobicContact CB-CB 4.23Å; A300-Q306 WeakPolarHBondContact O-CA 3.37Å; A300-S307 PolarHBondContact N-O 2.79Å; A300-S307 PolarHBondContact O-N 3.05Å
301	T	92.7	Very high	94.4	Very high	57 Å²	57	46 Å²	46	35%	0.35	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	138.8	-173	-50.5	0	0	0	0	110.6	P258 E259 Q306	P258-T301 CarbonylContact C-O 3.34Å; P258-T301 WeakPolarHBondContact CA-O 3.25Å; P258-T301 WeakPolarHBondContact CB-O 3.25Å; E259-T301 PolarHBondContact N-O 2.79Å; T301-Q306 HydrophobicContact CG2-CB 4.31Å; T301-Q306 PolarHBondContact OG1-NE2 3.45Å
302	N	94.6	Very high	94.6	Very high	15 Å²	15	45.2 Å²	45.2	8%	0.08	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	-178.7	163.8	73.1	1.7	0	0	0	109.9	Y227 P229 P256 P258 I304 G305	Y227-N302 PolarHBondContact O-ND2 2.8Å; P229-N302 WeakPolarHBondContact CD-OD1 3.29Å; P229-N302 HydrophobicContact CG-CB 4.11Å; P256-N302 WeakPolarHBondContact O-CB 3.49Å; P256-N302 PolarHBondContact O-ND2 3.05Å; P258-N302 HydrophobicContact CB-CB 4.32Å; N302-I304 PolarHBondContact O-N 3.38Å; N302-I304 VanDerWaalsContact O-N 3.1Å; N302-I304 WeakPolarHBondContact OD1-CA 3.2Å; N302-I304 WeakPolarHBondContact OD1-CB 3.4Å; N302-I304 PolarHBondContact OD1-N 2.88Å; N302-G305 PolarHBondContact N-O 3.26Å; N302-G305 PolarHBondContact O-N 2.89Å; N302-G305 VanDerWaalsContact O-O 3.1Å; N302-G305 PolarHBondContact OD1-N 3.07Å; N302-G305 PolarHBondContact OD1-O 3.05Å
303	T	94.8	Very high	94.8	Very high	120 Å²	120	45.2 Å²	45.2	74%	0.736	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.1	-179.9	54.3	0	0	0	0	114.2	P256	P256-T303 WeakPolarHBondContact CD-OG1 3.29Å; P256-T303 WeakPolarHBondContact CG-OG1 3.19Å
304	I	94.7	Very high	94.8	Very high	46 Å²	46	47.3 Å²	47.3	24%	0.236	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-32.5	180	-51.1	-48.2	0	0	0	110.8	M139 H226 T228 N302	M139-I304 HydrophobicContact CE-CD1 4.2Å; M139-I304 HydrophobicContact CE-CG2 3.71Å; M139-I304 HydrophobicContact SD-CD1 3.71Å; M139-I304 HydrophobicContact SD-CG2 4.24Å; H226-I304 HydrophobicContact CB-CD1 3.81Å; H226-I304 HydrophobicContact CB-CG1 3.96Å; T228-I304 HydrophobicContact CG2-CB 4.3Å; T228-I304 HydrophobicContact CG2-CG2 3.79Å; N302-I304 PolarHBondContact O-N 3.38Å; N302-I304 VanDerWaalsContact O-N 3.1Å; N302-I304 WeakPolarHBondContact OD1-CA 3.2Å; N302-I304 WeakPolarHBondContact OD1-CB 3.4Å; N302-I304 PolarHBondContact OD1-N 2.88Å
305	G	92.9	Very high	94.8	Very high	24 Å²	24	46.8 Å²	46.8	25%	0.247	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.5	-157	176.8	0	0	0	0	0	112.5	P229 N302	P229-G305 WeakPolarHBondContact CD-O 3.28Å; N302-G305 PolarHBondContact N-O 3.26Å; N302-G305 PolarHBondContact O-N 2.89Å; N302-G305 VanDerWaalsContact O-O 3.1Å; N302-G305 PolarHBondContact OD1-N 3.07Å; N302-G305 PolarHBondContact OD1-O 3.05Å
306	Q	93.5	Very high	94.7	Very high	95 Å²	95	48.9 Å²	48.9	44%	0.444	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	152	-169.3	-179	171.2	65.1	0	0	111	E299 A300 T301	E299-Q306 VanDerWaalsContact CG-CD 3.45Å; E299-Q306 HydrophobicContact CG-CG 3.61Å; E299-Q306 VanDerWaalsContact OE1-CD 3.23Å; E299-Q306 PolarHBondContact OE1-NE2 2.85Å; A300-Q306 WeakPolarHBondContact O-CA 3.37Å; T301-Q306 HydrophobicContact CG2-CB 4.31Å; T301-Q306 PolarHBondContact OG1-NE2 3.45Å
307	S	93.8	Very high	94.4	Very high	38 Å²	38	54 Å²	54	27%	0.266	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	155.5	169.9	-74.7	0	0	0	0	110.5	P229 V231 A300	P229-S307 WeakPolarHBondContact O-CB 3.17Å; P229-S307 PolarHBondContact O-OG 3.42Å; V231-S307 WeakPolarHBondContact CG2-O 2.9Å; A300-S307 PolarHBondContact N-O 2.79Å; A300-S307 PolarHBondContact O-N 3.05Å
308	S	93.9	Very high	93.8	Very high	53 Å²	53	54.2 Å²	54.2	37%	0.371	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	151.9	179.7	59.4	0	0	0	0	111.7	R297 C298	R297-S308 PolarHBondContact NE-OG 2.83Å; R297-S308 VanDerWaalsContact NH2-CB 3.34Å; R297-S308 PolarHBondContact NH2-OG 3.13Å; C298-S308 CarbonylContact O-C 3.59Å; C298-S308 WeakPolarHBondContact O-CA 3.49Å; C298-S308 VanDerWaalsContact O-CB 3.25Å; C298-S308 WeakPolarHBondContact O-CB 3.15Å
309	A	94.8	Very high	92.9	Very high	17 Å²	17	58.4 Å²	58.4	14%	0.14	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	151.7	170.2	0	0	0	0	0	109.9	V231 I233 R297 C298	V231-A309 HydrophobicContact CB-CB 4.15Å; V231-A309 HydrophobicContact CG1-CB 3.83Å; I233-A309 HydrophobicContact CD1-CB 4.29Å; I233-A309 VanDerWaalsContact CD1-O 3.29Å; I233-A309 WeakPolarHBondContact CD1-O 3.13Å; I233-A309 HydrophobicContact CG1-CB 4.16Å; R297-A309 VanDerWaalsContact CA-O 3.31Å; R297-A309 WeakPolarHBondContact CA-O 3.12Å; C298-A309 PolarHBondContact N-O 2.88Å; C298-A309 PolarHBondContact O-N 3.49Å
310	E	95.8	Very high	91.5	Very high	134 Å²	134	63.8 Å²	63.8	63%	0.626	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	143.6	178.1	-67.2	-176.4	172.6	0	0	110.3	T295 Y296 R297	T295-E310 HydrophobicContact CG2-CB 3.83Å; T295-E310 HydrophobicContact CG2-CG 4.11Å; Y296-E310 CarbonylContact O-C 3.56Å; Y296-E310 VanDerWaalsContact O-CA 3.32Å; Y296-E310 WeakPolarHBondContact O-CA 3.23Å; R297-E310 HydrophobicContact CB-CG 4.07Å; R297-E310 HydrophobicContact CG-CG 4.01Å
311	Y	96.2	Very high	89.7	Confident	45 Å²	45	69.8 Å²	69.8	18%	0.176	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	122.5	176.8	177.7	-97.6	0	0	0	109.6	I233 P235 L248 Y296 L313	I233-Y311 HydrophobicContact CG2-CD2 4.43Å; I233-Y311 HydrophobicContact CG2-CG 4.02Å; P235-Y311 HydrophobicContact CB-CE1 4.47Å; P235-Y311 HydrophobicContact CB-CE2 4.24Å; P235-Y311 HydrophobicContact CG-CE2 3.8Å; L248-Y311 HydrophobicContact CD1-CD1 4.02Å; L248-Y311 HydrophobicContact CD2-CD1 3.82Å; L248-Y311 HydrophobicContact CD2-CE1 3.76Å; Y296-Y311 PolarHBondContact N-O 2.82Å; Y296-Y311 PolarHBondContact O-N 3.29Å; Y311-L313 HydrophobicContact CD1-CB 4.42Å; Y311-L313 HydrophobicContact CE1-CB 4.13Å; Y311-L313 HydrophobicContact CE1-CD1 4.25Å
312	V	97.3	Very high	87.9	Confident	91 Å²	91	74.4 Å²	74.4	55%	0.552	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	112.7	177.7	-177.5	0	0	0	0	108.8	I314	V312-I314 HydrophobicContact CG1-CG1 4.4Å
313	L	97	Very high	86	Confident	1 Å²	1	80.9 Å²	80.9	1%	0.005	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	126.1	176.7	177.9	56.5	0	0	0	110.3	P240 L246 I285 L288 D292 N293 G294 Y296 Y311 V315	P240-L313 HydrophobicContact CB-CD1 3.66Å; P240-L313 HydrophobicContact CG-CD1 3.59Å; L246-L313 HydrophobicContact CD2-CD1 3.47Å; L246-L313 VanDerWaalsContact CD2-CD1 3.47Å; L246-L313 HydrophobicContact CD2-CD2 3.91Å; L246-L313 HydrophobicContact CD2-CG 4.35Å; I285-L313 HydrophobicContact CD1-CD2 4.17Å; L288-L313 HydrophobicContact CD2-CD2 3.85Å; D292-L313 HydrophobicContact CB-CD2 4.11Å; N293-L313 WeakPolarHBondContact CA-O 3.48Å; N293-L313 PolarHBondContact OD1-O 2.93Å; G294-L313 PolarHBondContact N-O 2.95Å; G294-L313 PolarHBondContact O-N 2.82Å; Y296-L313 HydrophobicContact CD2-CB 3.78Å; Y296-L313 HydrophobicContact CD2-CD2 4.34Å; Y296-L313 HydrophobicContact CE2-CB 3.55Å; Y296-L313 HydrophobicContact CE2-CD2 3.5Å; Y296-L313 HydrophobicContact CE2-CG 4.15Å; Y311-L313 HydrophobicContact CD1-CB 4.42Å; Y311-L313 HydrophobicContact CE1-CB 4.13Å; Y311-L313 HydrophobicContact CE1-CD1 4.25Å; L313-V315 HydrophobicContact CD1-CG2 4.38Å; L313-V315 HydrophobicContact CD2-CG2 4.33Å; L313-V315 HydrophobicContact CG-CG2 4.13Å
314	I	96.3	Very high	83.8	Confident	101 Å²	101	80.8 Å²	80.8	52%	0.518	45%	0.452	S	S	.	.			trans	-121.4	118.1	169.6	-56.8	177.3	0	0	0	108.5	N293 V312	N293-I314 VanDerWaalsContact OD1-CA 3.25Å; N293-I314 WeakPolarHBondContact OD1-CA 3.31Å; V312-I314 HydrophobicContact CG1-CG1 4.4Å
315	V	96.3	Very high	81.5	Confident	4 Å²	4	84.7 Å²	84.7	2%	0.024	48%	0.478	C	S	.	.			trans	-91.2	114.8	-179.3	-176.9	0	0	0	0	110.1	E242 L288 N289 K290 D292 N293 L313	E242-V315 HydrophobicContact CB-CG1 3.96Å; L288-V315 HydrophobicContact CB-CG1 4.01Å; L288-V315 HydrophobicContact CB-CG2 4.33Å; L288-V315 HydrophobicContact CD2-CG2 4.03Å; N289-V315 WeakPolarHBondContact O-CG2 3.28Å; K290-V315 PolarHBondContact NZ-O 2.95Å; D292-V315 HydrophobicContact CB-CG2 4.31Å; N293-V315 PolarHBondContact OD1-N 2.9Å; L313-V315 HydrophobicContact CD1-CG2 4.38Å; L313-V315 HydrophobicContact CD2-CG2 4.33Å; L313-V315 HydrophobicContact CG-CG2 4.13Å
316	H	93.9	Very high	79.4	Confident	85 Å²	85	89.7 Å²	89.7	39%	0.394	50%	0.504	S	S	.	.	B	Isolated β-bridge	trans	-81.8	149.9	178.1	-64.2	-75.7	0	0	0	111.8	P240 Q241 E242	P240-H316 WeakPolarHBondContact O-CB 3.24Å; P240-H316 PolarHBondContact O-CD2 2.8Å; P240-H316 PolarHBondContact O-N 2.86Å; Q241-H316 CarbonylContact C-O 3.57Å; Q241-H316 WeakPolarHBondContact CA-O 3.23Å; Q241-H316 HydrophobicContact CG-CB 4.4Å; E242-H316 PolarHBondContact N-O 3.08Å
317	D	90	Very high	77.5	Confident	106 Å²	106	92.6 Å²	92.6	57%	0.567	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-66	149.4	171.8	-60.4	-51.3	0	0	0	110.6	K290	K290-D317 WeakPolarHBondContact CE-OD1 3.31Å; K290-D317 VanDerWaalsContact NZ-CG 3.28Å; K290-D317 IonicContact NZ-OD1 3.67Å; K290-D317 PolarHBondContact NZ-OD1 3.33Å; K290-D317 IonicContact NZ-OD2 3.67Å
318	V	82.4	Confident	75.4	Confident	75 Å²	75	97.8 Å²	97.8	46%	0.455	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-65.6	131	167.9	-173.5	0	0	0	0	107.6	E242 N320	E242-V318 HydrophobicContact CB-CG2 4.47Å; E242-V318 WeakPolarHBondContact O-CG2 3.16Å; V318-N320 PolarHBondContact O-N 2.93Å
319	P	73.3	Confident	73	Confident	88 Å²	88	100.6 Å²	100.6	57%	0.571	56%	0.561	S	S	*	*			trans	-58.7	115.3	174.3	-18.4	28.8	0	0	0	108.7	T321	P319-T321 VanDerWaalsContact C-N 3.35Å; P319-T321 PolarHBondContact O-N 3.24Å
320	N	64.8	Low	70.6	Confident	144 Å²	144	104.8 Å²	104.8	77%	0.77	59%	0.59	S	S	*	*			trans	-63.1	97.5	173.4	-82.4	-6.5	0	0	0	108.7	V318 L322	V318-N320 PolarHBondContact O-N 2.93Å; N320-L322 PolarHBondContact O-N 2.7Å
321	T	56	Low	68.3	Low	126 Å²	126	106.5 Å²	106.5	77%	0.773	60%	0.602	S	S	*	*			trans	-70.5	84.3	159.8	49.2	0	0	0	0	107	P319 L323	P319-T321 VanDerWaalsContact C-N 3.35Å; P319-T321 PolarHBondContact O-N 3.24Å; T321-L323 VanDerWaalsContact C-N 3.25Å; T321-L323 PolarHBondContact O-N 3.25Å
322	L	53.7	Low	65.7	Low	154 Å²	154	110.6 Å²	110.6	81%	0.806	63%	0.633	S	S	*	*			trans	-59.7	99	160.9	-65.9	176.7	0	0	0	106.2	N320	N320-L322 PolarHBondContact O-N 2.7Å
323	L	53.8	Low	63.1	Low	151 Å²	151	112.6 Å²	112.6	79%	0.791	65%	0.645	S	S	*	*			trans	-50.8	124.3	165.2	-75	155.6	0	0	0	106.4	T321 T325	T321-L323 VanDerWaalsContact C-N 3.25Å; T321-L323 PolarHBondContact O-N 3.25Å; L323-T325 PolarHBondContact O-N 2.83Å
324	P	49.5	Very low	60.4	Low	118 Å²	118	116.6 Å²	116.6	77%	0.766	68%	0.678	S	S	*	*			trans	-61.8	111.6	177.9	23.3	-30.4	0	0	0	107.8	T326	P324-T326 PolarHBondContact O-N 2.63Å
325	T	47.5	Very low	57.6	Low	128 Å²	128	118 Å²	118	79%	0.785	69%	0.692	S	S	*	*			trans	-54.7	115.5	173.7	-34.3	0	0	0	0	107.2	L323 I327	L323-T325 PolarHBondContact O-N 2.83Å; T325-I327 PolarHBondContact O-N 2.01Å
326	T	48.3	Very low	55.1	Low	129 Å²	129	124 Å²	124	79%	0.791	73%	0.728	S	S	*	*			trans	-61.5	103.9	176.9	-50.9	0	0	0	0	108.1	P324 I328	P324-T326 PolarHBondContact O-N 2.63Å; T326-I328 PolarHBondContact O-N 2.95Å
327	I	52.9	Low	52.5	Low	156 Å²	156	126.5 Å²	126.5	80%	0.8	75%	0.749	S	S	*	*			trans	-72.8	110.7	171.1	-37.2	175.1	0	0	0	105.7	T325 P329	T325-I327 PolarHBondContact O-N 2.01Å; I327-P329 VanDerWaalsContact O-CD 3.31Å; I327-P329 WeakPolarHBondContact O-CD 3.49Å
328	I	50.6	Low	50.1	Low	148 Å²	148	126.7 Å²	126.7	76%	0.759	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-69.5	118.6	170	-57.5	170.9	0	0	0	106.5	T326 S330	T326-I328 PolarHBondContact O-N 2.95Å; I328-S330 PolarHBondContact O-N 3.21Å
329	P	43.5	Very low	48.1	Very low	111 Å²	111	129.7 Å²	129.7	72%	0.721	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-73.6	117.2	177.5	27.5	-29.9	0	0	0	109.6	I327 L331	I327-P329 VanDerWaalsContact O-CD 3.31Å; I327-P329 WeakPolarHBondContact O-CD 3.49Å; P329-L331 PolarHBondContact O-N 2.92Å
330	S	43.5	Very low	46.6	Very low	106 Å²	106	131.2 Å²	131.2	74%	0.741	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-68.4	123.3	162.9	50.9	0	0	0	0	109.1	I328 T332	I328-S330 PolarHBondContact O-N 3.21Å; S330-T332 PolarHBondContact O-N 2.57Å
331	L	47.5	Very low	45.6	Very low	169 Å²	169	129.3 Å²	129.3	89%	0.885	79%	0.785	S	S	*	*			trans	-68.8	108.4	-179.6	-142.2	89.2	0	0	0	109.9	P329	P329-L331 PolarHBondContact O-N 2.92Å
332	T	41.5	Very low	44.8	Very low	132 Å²	132	130.3 Å²	130.3	81%	0.81	78%	0.784	S	S	*	*			trans	-139.3	109.7	156.5	33.4	0	0	0	0	110.5	S330	S330-T332 PolarHBondContact O-N 2.57Å
333	T	42	Very low	43.8	Very low	133 Å²	133	128.8 Å²	128.8	82%	0.816	78%	0.782	S	S	*	*			trans	-59.1	132	164.2	44.3	0	0	0	0	111
334	A	41.3	Very low	42.9	Very low	85 Å²	85	127.3 Å²	127.3	70%	0.702	78%	0.779	S	S	*	*				178.8	123.5	121.6	0	0	0	0	0	113
335	T	38.3	Very low	42.5	Very low	131 Å²	131	126.8 Å²	126.8	80%	0.804	78%	0.778	S	S	*	*			trans	63.4	104.4	136.8	57.9	0	0	0	0	120.5
336	V	42.8	Very low	42.6	Very low	130 Å²	130	126.1 Å²	126.1	79%	0.788	78%	0.776	S	S	*	*			trans	-51.8	129.6	153.6	176.8	0	0	0	0	110.9
337	T	39.9	Very low	41.8	Very low	136 Å²	136	126 Å²	126	83%	0.834	78%	0.775	S	S	*	*			trans	-139.3	119.8	152.2	-16	0	0	0	0	109.5
338	T	37.9	Very low	41	Very low	111 Å²	111	124.6 Å²	124.6	68%	0.681	77%	0.774	S	S	*	*			trans	-88.2	128.4	179.3	-39.6	0	0	0	0	108.9
339	T	41.3	Very low	40.3	Very low	138 Å²	138	122.6 Å²	122.6	85%	0.847	77%	0.773	S	S	*	*			trans	-142.4	118.2	155.5	46.3	0	0	0	0	110.3
340	V	42.4	Very low	39.9	Very low	119 Å²	119	121.7 Å²	121.7	72%	0.721	78%	0.775	S	S	*	*			trans	-79.1	136.4	168.4	172.2	0	0	0	0	108.4	I342	V340-I342 HydrophobicContact CG1-CD1 4.34Å; V340-I342 HydrophobicContact CG1-CG1 4.16Å
341	A	42.8	Very low	39.3	Very low	105 Å²	105	123.1 Å²	123.1	87%	0.868	78%	0.779	S	S	*	*			trans	-142.7	120.1	158.7	0	0	0	0	0	109.8
342	I	39.4	Very low	38.5	Very low	146 Å²	146	121.8 Å²	121.8	75%	0.749	78%	0.778	S	S	*	*			trans	-102.4	132.1	174.7	-61.7	162.9	0	0	0	106.1	V340	V340-I342 HydrophobicContact CG1-CD1 4.34Å; V340-I342 HydrophobicContact CG1-CG1 4.16Å
343	T	32.7	Very low	38	Very low	123 Å²	123	120.7 Å²	120.7	76%	0.755	78%	0.776	S	S	*	*				178	130.6	129.6	28	0	0	0	0	114.8
344	T	34.9	Very low	37.6	Very low	119 Å²	119	119.9 Å²	119.9	73%	0.73	78%	0.776	S	S	*	*			trans	69.3	106.2	139.7	60.2	0	0	0	0	123.8
345	S	41.4	Very low	37.4	Very low	107 Å²	107	123.3 Å²	123.3	75%	0.748	78%	0.781	S	S	*	*				15.6	148.5	127	53.5	0	0	0	0	120.9
346	P	49.3	Very low	37.1	Very low	114 Å²	114	128.3 Å²	128.3	74%	0.74	79%	0.785	S	S	*	*				-143.7	164.2	52	32.1	-8.5	0	0	0	119.4
347	T	32.2	Very low	36.6	Very low	127 Å²	127	129.6 Å²	129.6	78%	0.779	79%	0.788	S	S	*	*			trans	3.6	132.3	148.1	4.4	0	0	0	0	117
348	T	35.2	Very low	36.9	Very low	127 Å²	127	128.3 Å²	128.3	78%	0.779	78%	0.782	S	S	*	*				-171.7	158.6	51.1	35.4	0	0	0	0	104.8
349	S	35.9	Very low	37.1	Very low	106 Å²	106	131.1 Å²	131.1	74%	0.741	79%	0.792	S	S	*	*			cis	179.5	142.6	44.7	23.9	0	0	0	0	108.2
350	A	35.2	Very low	36.6	Very low	91 Å²	91	129.4 Å²	129.4	75%	0.752	79%	0.792	S	S	*	*			trans	68.8	131.4	140.6	0	0	0	0	0	122.5
351	T	32	Very low	36.5	Very low	136 Å²	136	132.2 Å²	132.2	83%	0.834	80%	0.802	S	S	*	*			trans	91.5	87.8	144.9	-5.9	0	0	0	0	117.8
352	T	29.2	Very low	36.2	Very low	141 Å²	141	132 Å²	132	87%	0.865	80%	0.8	S	S	*	*			trans	-96.8	113.1	161.3	39.7	0	0	0	0	110.4
353	S	32.4	Very low	35.9	Very low	110 Å²	110	128.5 Å²	128.5	77%	0.769	80%	0.801	S	S	*	*			trans	-113.5	97.6	154.5	46.5	0	0	0	0	107.8
354	S	33.7	Very low	36.2	Very low	116 Å²	116	132 Å²	132	81%	0.811	81%	0.808	S	S	*	*			trans	-85.7	116.4	177.1	63.2	0	0	0	0	111.3
355	I	35.5	Very low	36.3	Very low	156 Å²	156	134.3 Å²	134.3	80%	0.8	82%	0.816	S	S	*	*			trans	-33.3	136.9	153.9	-66.5	158.4	0	0	0	112.7
356	R	33.5	Very low	37	Very low	237 Å²	237	131.9 Å²	131.9	89%	0.894	81%	0.808	S	S	*	*			trans	-81.7	131.5	165.4	-74.2	178	-178	172.9	0.1	109
357	D	32	Very low	36.9	Very low	157 Å²	157	131.3 Å²	131.3	84%	0.84	80%	0.804	S	S	*	*			trans	-95.4	140.8	155.3	-102.4	-36.4	0	0	0	110.1
358	P	45.1	Very low	38.2	Very low	109 Å²	109	131.4 Å²	131.4	71%	0.708	80%	0.8	S	S	*	*			trans	-96.5	110.1	179.4	34.4	-26	0	0	0	110.7
359	N	42.3	Very low	39.3	Very low	170 Å²	170	133.4 Å²	133.4	91%	0.909	80%	0.8	S	S	*	*			trans	-156.2	91.4	153.2	-110.7	-9.2	0	0	0	109.7
360	A	31.7	Very low	40.4	Very low	102 Å²	102	132.4 Å²	132.4	84%	0.843	80%	0.798	S	S	*	*			trans	-156.8	103.1	161.4	0	0	0	0	0	108.3
361	L	39.9	Very low	41.5	Very low	178 Å²	178	134 Å²	134	93%	0.932	79%	0.794	S	S	*	*			trans	-87.2	142.2	162.3	-124.2	99.3	0	0	0	109.1
362	A	36.3	Very low	43	Very low	99 Å²	99	131.9 Å²	131.9	82%	0.818	78%	0.776	S	S	*	*			trans	76	81.3	161.8	0	0	0	0	0	118.2
363	G	33.8	Very low	44.9	Very low	74 Å²	74	127.1 Å²	127.1	76%	0.763	76%	0.755	S	S	*	*			trans	-92.7	112.8	148.6	0	0	0	0	0	110
364	Q	37.8	Very low	46.9	Very low	195 Å²	195	123.7 Å²	123.7	91%	0.911	74%	0.737	S	S	*	*			trans	-72.1	120.8	161.2	-82.1	-170.9	-13	0	0	108.5	G366	Q364-G366 PolarHBondContact O-N 3.47Å
365	N	38	Very low	49	Very low	168 Å²	168	123 Å²	123	90%	0.898	72%	0.724	S	S	*	*			trans	-74.1	115.8	164.8	-71.9	-22.9	0	0	0	108.2
366	G	56.1	Low	51.2	Low	56 Å²	56	119.6 Å²	119.6	58%	0.577	71%	0.71	S	S	*	*			trans	-67	159.4	170.1	0	0	0	0	0	111.7	Q364 D368	Q364-G366 PolarHBondContact O-N 3.47Å; G366-D368 PolarHBondContact O-N 3.38Å
367	P	48.2	Very low	53.5	Low	102 Å²	102	111.2 Å²	111.2	66%	0.662	69%	0.691	S	S	*	*			trans	-66.5	133.4	-176.3	26.9	-32.4	0	0	0	111.2	H369	P367-H369 PolarHBondContact O-N 2.86Å; P367-H369 VanDerWaalsContact O-N 3.08Å
368	D	58.6	Low	56.1	Low	129 Å²	129	108.1 Å²	108.1	69%	0.69	68%	0.678	S	S	*	*			trans	-55	112	180	-65.9	-43.5	0	0	0	111.3	G366 A370 L371	G366-D368 PolarHBondContact O-N 3.38Å; D368-A370 PolarHBondContact O-N 2.57Å; D368-L371 PolarHBondContact O-N 3.36Å
369	H	58.1	Low	58.1	Low	170 Å²	170	107 Å²	107	79%	0.787	67%	0.669	S	S	*	*	H	α-helix	trans	-54.9	-15.3	176.5	-70.1	-81.3	0	0	0	113.7	P367 G373	P367-H369 PolarHBondContact O-N 2.86Å; P367-H369 VanDerWaalsContact O-N 3.08Å; H369-G373 PolarHBondContact O-N 3.14Å
370	A	59.3	Low	60.5	Low	84 Å²	84	102.5 Å²	102.5	69%	0.694	65%	0.647	S	S	*	*	H	α-helix	trans	-73.3	-35.3	175.1	0	0	0	0	0	113.5	D368 G374	D368-A370 PolarHBondContact O-N 2.57Å; A370-G374 PolarHBondContact O-N 2.87Å
371	L	58.5	Low	63.3	Low	126 Å²	126	104.2 Å²	104.2	66%	0.66	64%	0.636	S	S	*	*	H	α-helix	trans	-72.7	-38.2	-179.9	-170.6	69.9	0	0	0	111.1	D368 G374 I375	D368-L371 PolarHBondContact O-N 3.36Å; L371-G374 PolarHBondContact O-N 2.79Å; L371-I375 HydrophobicContact CG-CD1 4.37Å; L371-I375 WeakPolarHBondContact O-CG1 3.35Å; L371-I375 PolarHBondContact O-N 2.66Å; L371-I375 VanDerWaalsContact O-N 3.16Å
372	I	62.4	Low	65.8	Low	90 Å²	90	99.5 Å²	99.5	46%	0.462	61%	0.614	S	S	.	*	H	α-helix	trans	-66.6	-39.6	177.9	-56.8	174.3	0	0	0	110.3	G374 V376	I372-G374 PolarHBondContact O-N 2.92Å; I372-V376 VanDerWaalsContact O-CG2 3.27Å; I372-V376 WeakPolarHBondContact O-CG2 3.47Å; I372-V376 PolarHBondContact O-N 2.91Å; I372-V376 VanDerWaalsContact O-N 3.15Å
373	G	69.6	Low	68.4	Low	42 Å²	42	98 Å²	98	43%	0.433	60%	0.595	S	S	.	*	H	α-helix	trans	-63.9	-38.4	174.6	0	0	0	0	0	113.6	H369 A377	H369-G373 PolarHBondContact O-N 3.14Å; G373-A377 WeakPolarHBondContact O-CB 3.3Å; G373-A377 PolarHBondContact O-N 2.73Å
374	G	73.6	Confident	71.2	Confident	38 Å²	38	99.5 Å²	99.5	39%	0.392	59%	0.585	S	S	.	*	H	α-helix	trans	-65.5	-44.1	177.5	0	0	0	0	0	113.1	A370 L371 I372 A377 V378	A370-G374 PolarHBondContact O-N 2.87Å; L371-G374 PolarHBondContact O-N 2.79Å; I372-G374 PolarHBondContact O-N 2.92Å; G374-A377 PolarHBondContact O-N 2.82Å; G374-V378 WeakPolarHBondContact O-CG2 3.49Å; G374-V378 PolarHBondContact O-N 2.71Å; G374-V378 VanDerWaalsContact O-N 3.07Å
375	I	78.8	Confident	73.7	Confident	102 Å²	102	92.7 Å²	92.7	52%	0.523	56%	0.558	S	S	.	*	H	α-helix	trans	-65.6	-43.2	179	-64.5	167.4	0	0	0	110.5	L371 A377 V378 V379	L371-I375 HydrophobicContact CG-CD1 4.37Å; L371-I375 WeakPolarHBondContact O-CG1 3.35Å; L371-I375 PolarHBondContact O-N 2.66Å; L371-I375 VanDerWaalsContact O-N 3.16Å; I375-A377 VanDerWaalsContact C-N 3.33Å; I375-A377 PolarHBondContact O-N 3.41Å; I375-V378 PolarHBondContact O-N 2.67Å; I375-V379 HydrophobicContact CG2-CG2 4.44Å; I375-V379 WeakPolarHBondContact O-CG2 3.45Å; I375-V379 PolarHBondContact O-N 2.76Å
376	V	82.6	Confident	76.1	Confident	84 Å²	84	87.8 Å²	87.8	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-62.2	-41.4	177.3	174.1	0	0	0	0	111	I372 V378 V379 V380	I372-V376 VanDerWaalsContact O-CG2 3.27Å; I372-V376 WeakPolarHBondContact O-CG2 3.47Å; I372-V376 PolarHBondContact O-N 2.91Å; I372-V376 VanDerWaalsContact O-N 3.15Å; V376-V378 PolarHBondContact O-N 2.85Å; V376-V379 PolarHBondContact O-N 2.8Å; V376-V380 HydrophobicContact CG1-CG2 4.38Å; V376-V380 WeakPolarHBondContact O-CB 3.39Å; V376-V380 VanDerWaalsContact O-CG2 3.25Å; V376-V380 WeakPolarHBondContact O-CG2 3.46Å; V376-V380 PolarHBondContact O-N 3.32Å
377	A	80.3	Confident	77.8	Confident	60 Å²	60	90.5 Å²	90.5	50%	0.496	54%	0.537	S	S	.	.	H	α-helix	trans	-63.7	-40.8	177.5	0	0	0	0	0	112.8	G373 G374 I375 V380 F381	G373-A377 WeakPolarHBondContact O-CB 3.3Å; G373-A377 PolarHBondContact O-N 2.73Å; G374-A377 PolarHBondContact O-N 2.82Å; I375-A377 VanDerWaalsContact C-N 3.33Å; I375-A377 PolarHBondContact O-N 3.41Å; A377-V380 PolarHBondContact O-N 2.94Å; A377-F381 WeakPolarHBondContact O-CB 3.21Å; A377-F381 PolarHBondContact O-N 3.13Å
378	V	86.8	Confident	79.7	Confident	93 Å²	93	91.4 Å²	91.4	56%	0.564	53%	0.531	S	S	*	.	H	α-helix	trans	-66.8	-43	177.8	173.6	0	0	0	0	111	G374 I375 V376 V380 F381 V382	G374-V378 WeakPolarHBondContact O-CG2 3.49Å; G374-V378 PolarHBondContact O-N 2.71Å; G374-V378 VanDerWaalsContact O-N 3.07Å; I375-V378 PolarHBondContact O-N 2.67Å; V376-V378 PolarHBondContact O-N 2.85Å; V378-V380 PolarHBondContact O-N 3.31Å; V378-F381 PolarHBondContact O-N 2.73Å; V378-V382 HydrophobicContact CG1-CG2 4.35Å; V378-V382 VanDerWaalsContact O-CG2 3.31Å; V378-V382 WeakPolarHBondContact O-CG2 3.5Å; V378-V382 PolarHBondContact O-N 2.91Å
379	V	88.1	Confident	81.1	Confident	86 Å²	86	90.8 Å²	90.8	52%	0.521	53%	0.527	S	S	.	.	H	α-helix	trans	-64.2	-42.4	178	174	0	0	0	0	111.1	I375 V376 F381 V382 T383	I375-V379 HydrophobicContact CG2-CG2 4.44Å; I375-V379 WeakPolarHBondContact O-CG2 3.45Å; I375-V379 PolarHBondContact O-N 2.76Å; V376-V379 PolarHBondContact O-N 2.8Å; V379-F381 VanDerWaalsContact C-N 3.34Å; V379-F381 PolarHBondContact O-N 2.92Å; V379-V382 PolarHBondContact O-N 2.81Å; V379-T383 HydrophobicContact CG1-CG2 4.42Å; V379-T383 WeakPolarHBondContact O-CB 3.43Å; V379-T383 VanDerWaalsContact O-CG2 3.26Å; V379-T383 WeakPolarHBondContact O-CG2 3.22Å; V379-T383 PolarHBondContact O-N 3.38Å; V379-T383 PolarHBondContact O-OG1 2.75Å
380	V	91.6	Very high	82.2	Confident	74 Å²	74	87.6 Å²	87.6	45%	0.448	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-39.8	175.5	173	0	0	0	0	111.2	V376 A377 V378 T383 L384	V376-V380 HydrophobicContact CG1-CG2 4.38Å; V376-V380 WeakPolarHBondContact O-CB 3.39Å; V376-V380 VanDerWaalsContact O-CG2 3.25Å; V376-V380 WeakPolarHBondContact O-CG2 3.46Å; V376-V380 PolarHBondContact O-N 3.32Å; A377-V380 PolarHBondContact O-N 2.94Å; V378-V380 PolarHBondContact O-N 3.31Å; V380-T383 WeakPolarHBondContact CA-OG1 3.27Å; V380-T383 PolarHBondContact O-OG1 3.29Å; V380-L384 HydrophobicContact CG1-CD1 3.97Å; V380-L384 HydrophobicContact CG1-CG 4.47Å; V380-L384 WeakPolarHBondContact O-CB 3.49Å; V380-L384 VanDerWaalsContact O-CG 3.27Å; V380-L384 WeakPolarHBondContact O-CG 3.45Å; V380-L384 PolarHBondContact O-N 2.69Å
381	F	91.6	Very high	83.3	Confident	139 Å²	139	85.5 Å²	85.5	61%	0.61	50%	0.502	S	S	*	.	H	α-helix	trans	-67.1	-43.4	178.4	-174.5	-99.1	0	0	0	112.9	A377 V378 V379 L384 C385	A377-F381 WeakPolarHBondContact O-CB 3.21Å; A377-F381 PolarHBondContact O-N 3.13Å; V378-F381 PolarHBondContact O-N 2.73Å; V379-F381 VanDerWaalsContact C-N 3.34Å; V379-F381 PolarHBondContact O-N 2.92Å; F381-L384 PolarHBondContact O-N 2.92Å; F381-C385 WeakPolarHBondContact O-CB 3.39Å; F381-C385 PolarHBondContact O-N 2.83Å; F381-C385 PolarHBondContact O-SG 3.25Å; F381-C385 VanDerWaalsContact O-SG 3.38Å
382	V	92.1	Very high	84.3	Confident	79 Å²	79	87.1 Å²	87.1	48%	0.479	50%	0.499	S	S	.	.	H	α-helix	trans	-67.2	-39.6	178.8	173.2	0	0	0	0	111.4	V378 V379 C385 S386	V378-V382 HydrophobicContact CG1-CG2 4.35Å; V378-V382 VanDerWaalsContact O-CG2 3.31Å; V378-V382 WeakPolarHBondContact O-CG2 3.5Å; V378-V382 PolarHBondContact O-N 2.91Å; V379-V382 PolarHBondContact O-N 2.81Å; V382-C385 PolarHBondContact O-N 2.71Å; V382-S386 WeakPolarHBondContact O-CB 3.42Å; V382-S386 PolarHBondContact O-N 2.74Å; V382-S386 PolarHBondContact O-OG 2.95Å
383	T	91.7	Very high	85.1	Confident	67 Å²	67	89.1 Å²	89.1	41%	0.411	50%	0.502	S	S	.	.	H	α-helix	trans	-66	-44	176.9	49.5	0	0	0	0	111.7	V379 V380 C385 S386 I387	V379-T383 HydrophobicContact CG1-CG2 4.42Å; V379-T383 WeakPolarHBondContact O-CB 3.43Å; V379-T383 VanDerWaalsContact O-CG2 3.26Å; V379-T383 WeakPolarHBondContact O-CG2 3.22Å; V379-T383 PolarHBondContact O-N 3.38Å; V379-T383 PolarHBondContact O-OG1 2.75Å; V380-T383 WeakPolarHBondContact CA-OG1 3.27Å; V380-T383 PolarHBondContact O-OG1 3.29Å; T383-C385 PolarHBondContact O-N 2.78Å; T383-S386 PolarHBondContact O-N 3.38Å; T383-I387 WeakPolarHBondContact O-CG1 3.17Å; T383-I387 PolarHBondContact O-N 2.99Å
384	L	92.4	Very high	85.3	Confident	105 Å²	105	92.2 Å²	92.2	55%	0.55	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-40.8	174.5	-72.2	173.5	0	0	0	112.5	V380 F381 S386 I387 F388	V380-L384 HydrophobicContact CG1-CD1 3.97Å; V380-L384 HydrophobicContact CG1-CG 4.47Å; V380-L384 WeakPolarHBondContact O-CB 3.49Å; V380-L384 VanDerWaalsContact O-CG 3.27Å; V380-L384 WeakPolarHBondContact O-CG 3.45Å; V380-L384 PolarHBondContact O-N 2.69Å; F381-L384 PolarHBondContact O-N 2.92Å; L384-S386 VanDerWaalsContact C-N 3.34Å; L384-S386 PolarHBondContact O-N 3.33Å; L384-I387 PolarHBondContact O-N 3.12Å; L384-F388 WeakPolarHBondContact O-CB 3.41Å; L384-F388 PolarHBondContact O-N 2.99Å
385	C	89.8	Confident	85.1	Confident	52 Å²	52	93.3 Å²	93.3	35%	0.351	51%	0.513	S	S	.	.	H	α-helix	trans	-62.8	-41.3	174.4	-76.7	0	0	0	0	111.9	F381 V382 T383 F388 L389	F381-C385 WeakPolarHBondContact O-CB 3.39Å; F381-C385 PolarHBondContact O-N 2.83Å; F381-C385 PolarHBondContact O-SG 3.25Å; F381-C385 VanDerWaalsContact O-SG 3.38Å; V382-C385 PolarHBondContact O-N 2.71Å; T383-C385 PolarHBondContact O-N 2.78Å; C385-F388 PolarHBondContact O-N 3.16Å; C385-L389 WeakPolarHBondContact O-CB 3.39Å; C385-L389 VanDerWaalsContact O-CG 3.29Å; C385-L389 WeakPolarHBondContact O-CG 3.41Å; C385-L389 PolarHBondContact O-N 2.8Å
386	S	88.7	Confident	84.8	Confident	65 Å²	65	99.2 Å²	99.2	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-65.2	-42.9	178.5	-58.2	0	0	0	0	111.6	V382 T383 L384 F388 L389 L390	V382-S386 WeakPolarHBondContact O-CB 3.42Å; V382-S386 PolarHBondContact O-N 2.74Å; V382-S386 PolarHBondContact O-OG 2.95Å; T383-S386 PolarHBondContact O-N 3.38Å; L384-S386 VanDerWaalsContact C-N 3.34Å; L384-S386 PolarHBondContact O-N 3.33Å; S386-F388 VanDerWaalsContact C-N 3.34Å; S386-F388 PolarHBondContact O-N 2.89Å; S386-L389 PolarHBondContact O-N 2.88Å; S386-L390 VanDerWaalsContact O-CB 3.29Å; S386-L390 WeakPolarHBondContact O-CB 3.11Å; S386-L390 PolarHBondContact O-N 3.45Å
387	I	90.4	Very high	83.8	Confident	114 Å²	114	101.1 Å²	101.1	59%	0.585	53%	0.532	S	S	*	.	H	α-helix	trans	-62.6	-42	175.1	-68	166.2	0	0	0	110.7	T383 L384 L390 G391	T383-I387 WeakPolarHBondContact O-CG1 3.17Å; T383-I387 PolarHBondContact O-N 2.99Å; L384-I387 PolarHBondContact O-N 3.12Å; I387-L390 PolarHBondContact O-N 2.96Å; I387-G391 PolarHBondContact O-N 2.88Å
388	F	89.8	Confident	82.5	Confident	121 Å²	121	106.4 Å²	106.4	53%	0.531	54%	0.544	S	S	.	.	H	α-helix	trans	-67.3	-40.6	178.5	-172	-99.2	0	0	0	112.5	L384 C385 S386 G391 R392	L384-F388 WeakPolarHBondContact O-CB 3.41Å; L384-F388 PolarHBondContact O-N 2.99Å; C385-F388 PolarHBondContact O-N 3.16Å; S386-F388 VanDerWaalsContact C-N 3.34Å; S386-F388 PolarHBondContact O-N 2.89Å; F388-G391 PolarHBondContact O-N 3.08Å; F388-R392 HydrophobicContact CE1-CG 4.22Å; F388-R392 VanDerWaalsContact CE1-NE 3.33Å; F388-R392 HydrophobicContact CZ-CG 4.5Å; F388-R392 PolarHBondContact O-N 2.84Å
389	L	86.1	Confident	81.1	Confident	116 Å²	116	104.9 Å²	104.9	61%	0.607	55%	0.547	S	S	*	.	H	α-helix	trans	-65.2	-42.2	174.3	-72.2	171.9	0	0	0	111.5	C385 S386 R392 Y393	C385-L389 WeakPolarHBondContact O-CB 3.39Å; C385-L389 VanDerWaalsContact O-CG 3.29Å; C385-L389 WeakPolarHBondContact O-CG 3.41Å; C385-L389 PolarHBondContact O-N 2.8Å; S386-L389 PolarHBondContact O-N 2.88Å; L389-R392 PolarHBondContact O-N 3.05Å; L389-Y393 WeakPolarHBondContact O-CB 3.39Å; L389-Y393 PolarHBondContact O-N 2.8Å
390	L	81.6	Confident	79.4	Confident	103 Å²	103	106 Å²	106	54%	0.539	55%	0.554	S	S	.	*	H	α-helix	trans	-64.7	-42.2	175.6	-167.1	71.2	0	0	0	111.3	S386 I387 R392 Y393 L394	S386-L390 VanDerWaalsContact O-CB 3.29Å; S386-L390 WeakPolarHBondContact O-CB 3.11Å; S386-L390 PolarHBondContact O-N 3.45Å; I387-L390 PolarHBondContact O-N 2.96Å; L390-R392 PolarHBondContact O-N 2.85Å; L390-Y393 WeakPolarHBondContact O-CB 3.21Å; L390-Y393 PolarHBondContact O-N 2.79Å; L390-L394 HydrophobicContact CG-CD1 4.26Å; L390-L394 WeakPolarHBondContact O-CB 3.17Å; L390-L394 VanDerWaalsContact O-CG 3.31Å; L390-L394 WeakPolarHBondContact O-CG 3.43Å; L390-L394 PolarHBondContact O-N 2.9Å
391	G	82.5	Confident	77.3	Confident	40 Å²	40	109.8 Å²	109.8	41%	0.412	56%	0.562	S	S	.	*	H	α-helix	trans	-61.5	-41.2	174.1	0	0	0	0	0	112.5	I387 F388 A395	I387-G391 PolarHBondContact O-N 2.88Å; F388-G391 PolarHBondContact O-N 3.08Å; G391-A395 WeakPolarHBondContact O-CB 3.27Å; G391-A395 PolarHBondContact O-N 2.8Å
392	R	80.8	Confident	75.2	Confident	160 Å²	160	109.2 Å²	109.2	60%	0.604	56%	0.564	S	S	*	*	H	α-helix	trans	-68	-36.8	173.4	-80.7	-168.6	163.7	179.5	-0.9	112.9	F388 L389 L390 R396	F388-R392 HydrophobicContact CE1-CG 4.22Å; F388-R392 VanDerWaalsContact CE1-NE 3.33Å; F388-R392 HydrophobicContact CZ-CG 4.5Å; F388-R392 PolarHBondContact O-N 2.84Å; L389-R392 PolarHBondContact O-N 3.05Å; L390-R392 PolarHBondContact O-N 2.85Å; R392-R396 WeakPolarHBondContact O-CB 3.46Å; R392-R396 PolarHBondContact O-N 3.5Å
393	Y	78.7	Confident	73.3	Confident	132 Å²	132	108.5 Å²	108.5	52%	0.518	56%	0.56	S	S	.	*	H	α-helix	trans	-63.4	-51.5	175.2	178	-96.3	0	0	0	110.5	L389 L390 A395 R396 H397	L389-Y393 WeakPolarHBondContact O-CB 3.39Å; L389-Y393 PolarHBondContact O-N 2.8Å; L390-Y393 WeakPolarHBondContact O-CB 3.21Å; L390-Y393 PolarHBondContact O-N 2.79Å; Y393-A395 VanDerWaalsContact C-N 3.32Å; Y393-A395 PolarHBondContact O-N 3.23Å; Y393-R396 PolarHBondContact O-N 2.82Å; Y393-R396 VanDerWaalsContact O-N 3.14Å; Y393-H397 AromaticContact CD2-CD2 3.56Å; Y393-H397 AromaticContact CD2-NE2 3.86Å; Y393-H397 AromaticContact CE2-CD2 3.3Å; Y393-H397 WeakPolarHBondContact CE2-CD2 3.44Å; Y393-H397 AromaticContact CE2-NE2 3.32Å; Y393-H397 VanDerWaalsContact CE2-NE2 3.32Å; Y393-H397 WeakPolarHBondContact CE2-NE2 3.38Å; Y393-H397 AromaticContact CZ-CD2 3.58Å; Y393-H397 AromaticContact CZ-NE2 3.85Å; Y393-H397 WeakPolarHBondContact O-CB 3.39Å; Y393-H397 PolarHBondContact O-CD2 2.64Å; Y393-H397 VanDerWaalsContact O-CD2 3.32Å; Y393-H397 PolarHBondContact O-N 3.48Å
394	L	73.2	Confident	71.2	Confident	106 Å²	106	111.4 Å²	111.4	56%	0.555	57%	0.573	S	S	*	*	H	α-helix	trans	-63	-37.1	176.8	-67.4	173.1	0	0	0	112.1	L390 H397 K398	L390-L394 HydrophobicContact CG-CD1 4.26Å; L390-L394 WeakPolarHBondContact O-CB 3.17Å; L390-L394 VanDerWaalsContact O-CG 3.31Å; L390-L394 WeakPolarHBondContact O-CG 3.43Å; L390-L394 PolarHBondContact O-N 2.9Å; L394-H397 CarbonylContact O-C 3.19Å; L394-H397 PolarHBondContact O-N 3.39Å; L394-K398 WeakPolarHBondContact O-CG 3.3Å; L394-K398 PolarHBondContact O-N 2.94Å
395	A	70	Confident	69.3	Low	62 Å²	62	113.9 Å²	113.9	51%	0.512	58%	0.582	S	S	.	*	H	α-helix	trans	-67.6	-35.4	174.6	0	0	0	0	0	112.9	G391 Y393	G391-A395 WeakPolarHBondContact O-CB 3.27Å; G391-A395 PolarHBondContact O-N 2.8Å; Y393-A395 VanDerWaalsContact C-N 3.32Å; Y393-A395 PolarHBondContact O-N 3.23Å
396	R	72.3	Confident	67.4	Low	226 Å²	226	115 Å²	115	85%	0.853	60%	0.595	S	S	*	*	H	α-helix	trans	-74.3	-32.4	174.7	-86.4	-173.3	174.5	167.3	-1.7	112.9	R392 Y393 K398	R392-R396 WeakPolarHBondContact O-CB 3.46Å; R392-R396 PolarHBondContact O-N 3.5Å; Y393-R396 PolarHBondContact O-N 2.82Å; Y393-R396 VanDerWaalsContact O-N 3.14Å; R396-K398 VanDerWaalsContact C-N 3.34Å
397	H	61.3	Low	65.5	Low	124 Å²	124	121.4 Å²	121.4	57%	0.574	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	29	179.5	-73.1	-81.9	0	0	0	113.3	Y393 L394 G399	Y393-H397 AromaticContact CD2-CD2 3.56Å; Y393-H397 AromaticContact CD2-NE2 3.86Å; Y393-H397 AromaticContact CE2-CD2 3.3Å; Y393-H397 WeakPolarHBondContact CE2-CD2 3.44Å; Y393-H397 AromaticContact CE2-NE2 3.32Å; Y393-H397 VanDerWaalsContact CE2-NE2 3.32Å; Y393-H397 WeakPolarHBondContact CE2-NE2 3.38Å; Y393-H397 AromaticContact CZ-CD2 3.58Å; Y393-H397 AromaticContact CZ-NE2 3.85Å; Y393-H397 WeakPolarHBondContact O-CB 3.39Å; Y393-H397 PolarHBondContact O-CD2 2.64Å; Y393-H397 VanDerWaalsContact O-CD2 3.32Å; Y393-H397 PolarHBondContact O-N 3.48Å; L394-H397 CarbonylContact O-C 3.19Å; L394-H397 PolarHBondContact O-N 3.39Å; H397-G399 PolarHBondContact O-N 3.46Å
398	K	52.8	Low	63.8	Low	170 Å²	170	119.2 Å²	119.2	74%	0.739	62%	0.62	S	S	*	*			trans	-71.6	81.2	164.9	-75	-171.1	175	-177.3	0	110.1	L394 R396	L394-K398 WeakPolarHBondContact O-CG 3.3Å; L394-K398 PolarHBondContact O-N 2.94Å; R396-K398 VanDerWaalsContact C-N 3.34Å
399	G	57.8	Low	61.9	Low	61 Å²	61	117.2 Å²	117.2	63%	0.629	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-85	124.8	163.8	0	0	0	0	0	110	H397 Y401	H397-G399 PolarHBondContact O-N 3.46Å; G399-Y401 PolarHBondContact O-N 3.34Å
400	T	51.7	Low	60.4	Low	111 Å²	111	120.9 Å²	120.9	68%	0.681	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-72.3	117.2	161.7	41.2	0	0	0	0	108
401	Y	47.7	Very low	59.1	Low	153 Å²	153	123.8 Å²	123.8	60%	0.6	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-97.1	132.3	168.2	59.5	-85.7	0	0	0	109	G399 T403	G399-Y401 PolarHBondContact O-N 3.34Å; Y401-T403 HydrophobicContact CD2-CG2 3.72Å; Y401-T403 HydrophobicContact CE2-CG2 3.68Å
402	L	46.8	Very low	57.7	Low	127 Å²	127	123.6 Å²	123.6	67%	0.665	65%	0.65	S	S	*	*			trans	-83.9	115.6	171.8	-77.8	150.6	0	0	0	107.2	A429	L402-A429 HydrophobicContact CD2-CB 4.13Å
403	T	54.2	Low	56.7	Low	63 Å²	63	121.7 Å²	121.7	39%	0.387	66%	0.659	S	S	.	*			trans	-85.3	122.7	165.9	53	0	0	0	0	108.1	Y401 E405	Y401-T403 HydrophobicContact CD2-CG2 3.72Å; Y401-T403 HydrophobicContact CE2-CG2 3.68Å; T403-E405 PolarHBondContact O-N 3.41Å
404	N	45.8	Very low	55.9	Low	129 Å²	129	119.7 Å²	119.7	69%	0.69	66%	0.657	S	S	*	*			trans	-79.9	77.6	168.4	-76	-14.4	0	0	0	107.9	A406	N404-A406 PolarHBondContact O-N 2.87Å
405	E	53.6	Low	55.1	Low	157 Å²	157	118.3 Å²	118.3	73%	0.734	66%	0.661	S	S	*	*			trans	-77.2	107.6	166.4	-73.8	-170.5	171.5	0	0	108.5	T403 K407	T403-E405 PolarHBondContact O-N 3.41Å; E405-K407 PolarHBondContact O-N 2.99Å
406	A	49.6	Very low	54.6	Low	75 Å²	75	121.3 Å²	121.3	62%	0.62	67%	0.668	S	S	*	*			trans	-68	115.7	168.1	0	0	0	0	0	108.4	N404 G408	N404-A406 PolarHBondContact O-N 2.87Å; A406-G408 PolarHBondContact O-N 3.02Å
407	K	48.3	Very low	53.9	Low	200 Å²	200	113.2 Å²	113.2	87%	0.87	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	110.4	178	-151.8	169.8	-169.1	162.6	0	108.8	E405	E405-K407 PolarHBondContact O-N 2.99Å
408	G	55.8	Low	53.6	Low	68 Å²	68	109.3 Å²	109.3	70%	0.701	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	142.5	7.8	171.2	0	0	0	0	0	118.1	A406 E410	A406-G408 PolarHBondContact O-N 3.02Å; G408-E410 PolarHBondContact O-N 2.8Å
409	A	48.6	Very low	53.7	Low	79 Å²	79	106.5 Å²	106.5	65%	0.653	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-84.3	0.5	-175.6	0	0	0	0	0	115.6
410	E	54.9	Low	53.4	Low	193 Å²	193	109.5 Å²	109.5	90%	0.902	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-82.1	-13.5	-175.4	-73	-172.2	156.8	0	0	114.7	G408	G408-E410 PolarHBondContact O-N 2.8Å
411	D	55.2	Low	53.2	Low	164 Å²	164	109.9 Å²	109.9	88%	0.877	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-122.2	21.7	-175.9	-73.8	-39.8	0	0	0	114.7
412	A	53.3	Low	53.3	Low	35 Å²	35	105.5 Å²	105.5	29%	0.289	62%	0.619	S	S	.	*			trans	-94.4	125.2	175.9	0	0	0	0	0	111.2	D414 A418	A412-D414 PolarHBondContact O-N 3.36Å; A412-A418 HydrophobicContact CB-CB 4.27Å
413	P	58.8	Low	53.5	Low	121 Å²	121	108 Å²	108	79%	0.786	63%	0.627	S	S	*	*	S	Bend	trans	-71.6	-13.2	-175.3	24.8	-29.3	0	0	0	114.2
414	D	62.7	Low	53.4	Low	89 Å²	89	108.5 Å²	108.5	48%	0.476	64%	0.644	S	S	.	*	S	Bend	trans	-163	156.9	-174.1	48.1	-7.5	0	0	0	113.2	A412 D416 T417	A412-D414 PolarHBondContact O-N 3.36Å; D414-D416 PolarHBondContact O-N 2.98Å; D414-T417 PolarHBondContact O-N 3.16Å; D414-T417 PolarHBondContact OD1-OG1 3.14Å
415	A	56.1	Low	53.3	Low	77 Å²	77	106.8 Å²	106.8	64%	0.636	64%	0.643	S	S	*	*	H	α-helix	trans	-66.8	-29.5	-166	0	0	0	0	0	114.7
416	D	59.3	Low	53.1	Low	126 Å²	126	108.5 Å²	108.5	67%	0.674	65%	0.65	S	S	*	*	H	α-helix	trans	-74.4	-28.4	-179.8	-71.6	-26	0	0	0	112	D414 I419	D414-D416 PolarHBondContact O-N 2.98Å; D416-I419 PolarHBondContact O-N 2.88Å
417	T	58.2	Low	52.9	Low	56 Å²	56	109.9 Å²	109.9	34%	0.344	65%	0.651	S	S	.	*	H	α-helix	trans	-75.6	-26.1	179.9	-44.4	0	0	0	0	112.1	D414	D414-T417 PolarHBondContact O-N 3.16Å; D414-T417 PolarHBondContact OD1-OG1 3.14Å
418	A	54.6	Low	52.7	Low	41 Å²	41	108 Å²	108	34%	0.339	65%	0.651	S	S	.	*	H	α-helix	trans	-71.8	-29.6	176	0	0	0	0	0	113.2	A412	A412-A418 HydrophobicContact CB-CB 4.27Å
419	I	53.9	Low	52.2	Low	111 Å²	111	107.6 Å²	107.6	57%	0.569	64%	0.64	S	S	*	*	H	α-helix	trans	-75.9	-38.1	-176.3	-61.3	171.7	0	0	0	111	D416 N421 A422	D416-I419 PolarHBondContact O-N 2.88Å; I419-N421 PolarHBondContact O-N 3.26Å; I419-A422 PolarHBondContact O-N 2.87Å
420	I	53.1	Low	52.3	Low	124 Å²	124	111.3 Å²	111.3	64%	0.636	64%	0.644	S	S	*	*	H	α-helix	trans	-69.3	-34.7	-178.4	-57.4	174	0	0	0	111.4	A422	I420-A422 VanDerWaalsContact C-N 3.26Å; I420-A422 PolarHBondContact O-N 3.07Å
421	N	47.2	Very low	51.8	Low	120 Å²	120	108.2 Å²	108.2	64%	0.642	63%	0.63	S	S	*	*	H	α-helix	trans	-73.4	-16	177.9	-73.4	-23.1	0	0	0	113.5	I419	I419-N421 PolarHBondContact O-N 3.26Å
422	A	49.2	Very low	51.2	Low	61 Å²	61	107.8 Å²	107.8	50%	0.504	62%	0.62	S	S	.	*	H	α-helix	trans	-81.1	-21.1	179	0	0	0	0	0	113.6	I419 I420 G424	I419-A422 PolarHBondContact O-N 2.87Å; I420-A422 VanDerWaalsContact C-N 3.26Å; I420-A422 PolarHBondContact O-N 3.07Å; A422-G424 VanDerWaalsContact C-N 3.33Å; A422-G424 PolarHBondContact O-N 3.19Å
423	E	50.2	Low	50.7	Low	179 Å²	179	112.2 Å²	112.2	84%	0.836	63%	0.633	S	S	*	*	S	Bend	trans	-81.8	-6.3	-178.5	-83.4	-179	145.1	0	0	114.2
424	G	53	Low	50.2	Low	73 Å²	73	113 Å²	113	75%	0.753	63%	0.626	S	S	*	*	S	Bend	trans	-106.1	-9.7	-172.5	0	0	0	0	0	117.7	A422	A422-G424 VanDerWaalsContact C-N 3.33Å; A422-G424 PolarHBondContact O-N 3.19Å
425	S	43.9	Very low	49.4	Very low	94 Å²	94	117.7 Å²	117.7	66%	0.657	64%	0.639	S	S	*	*	S	Bend	trans	-123.5	125.1	-167.1	-143.7	0	0	0	0	113.1	V427	S425-V427 PolarHBondContact O-N 2.96Å; S425-V427 VanDerWaalsContact O-N 3.15Å
426	Q	50.1	Low	48.6	Very low	192 Å²	192	123.2 Å²	123.2	90%	0.897	65%	0.648	S	S	*	*			trans	-56.9	116.3	175	-83.6	-174.3	-43.8	0	0	110.6	N428	Q426-N428 PolarHBondContact O-N 2.99Å; Q426-N428 VanDerWaalsContact O-N 3.11Å
427	V	45	Very low	47.7	Very low	104 Å²	104	128.6 Å²	128.6	63%	0.63	68%	0.675	S	S	*	*			trans	-70.4	102.4	180	-176.4	0	0	0	0	109.9	S425	S425-V427 PolarHBondContact O-N 2.96Å; S425-V427 VanDerWaalsContact O-N 3.15Å
428	N	44.5	Very low	47.2	Very low	161 Å²	161	132.3 Å²	132.3	86%	0.861	69%	0.692	S	S	*	*			trans	-85.9	107.9	159	-88.1	-20.3	0	0	0	108	Q426	Q426-N428 PolarHBondContact O-N 2.99Å; Q426-N428 VanDerWaalsContact O-N 3.11Å
429	A	45.2	Very low	46.8	Very low	59 Å²	59	137.1 Å²	137.1	49%	0.488	71%	0.71	S	S	.	*			trans	-75.2	125.2	176.8	0	0	0	0	0	110.6	L402	L402-A429 HydrophobicContact CD2-CB 4.13Å
430	E	50.6	Low	46.4	Very low	158 Å²	158	138.5 Å²	138.5	74%	0.738	72%	0.718	S	S	*	*			trans	-103	127.3	176.8	-157.8	169	-170	0	0	109.6	K432	E430-K432 PolarHBondContact O-N 2.92Å
431	E	43.1	Very low	46	Very low	128 Å²	128	139.4 Å²	139.4	60%	0.598	72%	0.723	S	S	*	*			trans	-82.1	100	-173.3	-167.4	-168.5	161.1	0	0	110.7	K433	E431-K433 WeakPolarHBondContact OE1-CE 3.34Å; E431-K433 IonicContact OE1-NZ 2.7Å; E431-K433 PolarHBondContact OE1-NZ 3.23Å
432	K	43.6	Very low	45.9	Very low	155 Å²	155	140.6 Å²	140.6	67%	0.674	73%	0.728	S	S	*	*			trans	-101.1	131	174.2	-142.5	-177.1	-176.6	-165.5	0	110.9	E430 E434	E430-K432 PolarHBondContact O-N 2.92Å; K432-E434 IonicContact NZ-OE1 3.85Å
433	K	41.9	Very low	45.7	Very low	127 Å²	127	145.9 Å²	145.9	55%	0.552	74%	0.743	S	S	*	*			trans	-106.5	111.7	179	-77.8	173.5	177.9	141.4	0	110	E431	E431-K433 WeakPolarHBondContact OE1-CE 3.34Å; E431-K433 IonicContact OE1-NZ 2.7Å; E431-K433 PolarHBondContact OE1-NZ 3.23Å
434	E	47.8	Very low	45.4	Very low	139 Å²	139	143.5 Å²	143.5	65%	0.65	74%	0.736	S	S	*	*			trans	-112.9	143.5	168.3	-71.6	-172.5	179.7	0	0	110.9	K432	K432-E434 IonicContact NZ-OE1 3.85Å
435	Y	46.3	Very low	44.8	Very low	187 Å²	187	148.9 Å²	148.9	73%	0.733	74%	0.735	S	S	*	*			trans	-110	124	-177	-59	-89.1	0	0	0	108.4
436	F	39.7	Very low	44.9	Very low	192 Å²	192	153.5 Å²	153.5	84%	0.842	74%	0.741	S	S	*	*			trans	-71.6	130.9	168.1	-81.7	-88.5	0	0	0	109.3
437	I	40.6	Very low	44.4	Very low	240 Å²	240	150 Å²	150	100%	1.231	73%	0.727	S	S	*	*			trans	-70.6	0	173.7	-59.8	173.2	0	0	0	109.7

Retrieved 437 of 437 residues in 1654.1 ms (Link to these results)

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