A0A096N9H9_PAPAN Loading...

WD repeat-containing protein 55

Nucleolar protein that acts as a modulator of rRNA synthesis. Plays a central role during organogenesis.

AlphaFold DB , UniProt , Accession A0A096N9H9, Species PAPAN (Papio anubis, Olive baboon), Gene WDR55, Length 383 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.7	Very low	37.6	Very low	238 Å²	238	167 Å²	167	100%	1.172	85%	0.849	S	S	*	*				0	117.3	0	-66	170.4	175.4	0	0	106.2
2	D	38.3	Very low	37.8	Very low	120 Å²	120	167.8 Å²	167.8	64%	0.642	86%	0.857	S	S	*	*			cis	-166.6	142	1.6	-125.6	-0.8	0	0	0	107.8
3	R	37.1	Very low	37.9	Very low	211 Å²	211	160.2 Å²	160.2	80%	0.796	85%	0.846	S	S	*	*			trans	64.4	103	141	-60.8	170.1	-167.5	-154.6	-0.9	120.5
4	T	35.4	Very low	37.9	Very low	150 Å²	150	155.6 Å²	155.6	92%	0.92	83%	0.833	S	S	*	*			trans	-79.1	133.2	149.1	39.7	0	0	0	0	110.4
5	C	35.6	Very low	38.3	Very low	109 Å²	109	155.7 Å²	155.7	74%	0.736	83%	0.833	S	S	*	*			trans	-111.4	135.4	175.1	-76.4	0	0	0	0	110.7
6	E	37.2	Very low	38.6	Very low	171 Å²	171	156.9 Å²	156.9	80%	0.799	83%	0.833	S	S	*	*			trans	58.8	107.9	142.1	-63.8	-174.4	144.9	0	0	121
7	E	33.9	Very low	38.9	Very low	200 Å²	200	155.9 Å²	155.9	94%	0.935	83%	0.827	S	S	*	*			trans	-132.2	135	132.7	-75.9	-173.4	158.9	0	0	109.3
8	R	37.4	Very low	39.1	Very low	229 Å²	229	154.8 Å²	154.8	86%	0.864	82%	0.822	S	S	*	*			trans	-118.4	173	165.3	-64.7	-176.7	178.9	-176.1	-0.1	107.6
9	P	45.4	Very low	39.3	Very low	126 Å²	126	152.5 Å²	152.5	82%	0.818	82%	0.817	S	S	*	*				-116.7	156.2	-71.8	32.9	-16.6	0	0	0	109.7
10	A	36	Very low	39.5	Very low	92 Å²	92	151.4 Å²	151.4	76%	0.76	81%	0.811	S	S	*	*			trans	-129.4	114.4	170.9	0	0	0	0	0	110.2
11	E	40	Very low	39.8	Very low	191 Å²	191	149.3 Å²	149.3	89%	0.893	81%	0.808	S	S	*	*			trans	69.2	109	144	-60.3	-178.5	169.9	0	0	118.5	G13	E11-G13 PolarHBondContact O-N 3.03Å
12	D	39.9	Very low	40.4	Very low	177 Å²	177	144.4 Å²	144.4	95%	0.947	79%	0.785	S	S	*	*			trans	-48	102	160.7	-79.6	-35.7	0	0	0	110.5	S14	D12-S14 PolarHBondContact O-N 3.41Å
13	G	38.3	Very low	41.2	Very low	69 Å²	69	147.3 Å²	147.3	71%	0.711	80%	0.795	S	S	*	*			trans	-84.1	96	162.2	0	0	0	0	0	109.1	E11	E11-G13 PolarHBondContact O-N 3.03Å
14	S	38.3	Very low	42.2	Very low	96 Å²	96	141.1 Å²	141.1	67%	0.671	79%	0.789	S	S	*	*			trans	7.3	108	155.8	55.1	0	0	0	0	117.1	D12 E16	D12-S14 PolarHBondContact O-N 3.41Å; S14-E16 VanDerWaalsContact C-N 3.27Å; S14-E16 PolarHBondContact O-N 2.96Å
15	D	43.8	Very low	43.4	Very low	156 Å²	156	138.7 Å²	138.7	83%	0.834	78%	0.776	S	S	*	*			trans	-59	92.1	149.2	-71.1	-43.9	0	0	0	108.4	D17	D15-D17 PolarHBondContact O-N 3.02Å
16	E	43.9	Very low	45.1	Very low	176 Å²	176	138.3 Å²	138.3	82%	0.822	77%	0.77	S	S	*	*			trans	-83.4	78.7	156.3	-72.8	-168.2	167.8	0	0	107.2	S14 D18	S14-E16 VanDerWaalsContact C-N 3.27Å; S14-E16 PolarHBondContact O-N 2.96Å; E16-D18 VanDerWaalsContact C-N 3.32Å; E16-D18 PolarHBondContact O-N 3.27Å
17	D	43.5	Very low	47.3	Very low	139 Å²	139	138 Å²	138	74%	0.743	76%	0.762	S	S	*	*			trans	-58.4	100.4	155.1	-84	-42.3	0	0	0	106.9	D15 P19	D15-D17 PolarHBondContact O-N 3.02Å; D17-P19 WeakPolarHBondContact O-CD 3.35Å; D17-P19 WeakPolarHBondContact O-CG 3.04Å
18	D	41.3	Very low	49.9	Very low	136 Å²	136	134.6 Å²	134.6	73%	0.727	75%	0.748	S	S	*	*			trans	-67.6	103.2	172.8	-154	-5.9	0	0	0	108	E16 D20	E16-D18 VanDerWaalsContact C-N 3.32Å; E16-D18 PolarHBondContact O-N 3.27Å; D18-D20 PolarHBondContact O-N 3.23Å
19	P	44.2	Very low	52.5	Low	112 Å²	112	128.3 Å²	128.3	73%	0.727	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	2.8	-167.6	-1.3	20.1	0	0	0	113.3	D17	D17-P19 WeakPolarHBondContact O-CD 3.35Å; D17-P19 WeakPolarHBondContact O-CG 3.04Å
20	D	42.9	Very low	54.7	Low	130 Å²	130	127.9 Å²	127.9	70%	0.695	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	29.2	-166.2	-92.1	-13.3	0	0	0	114.5	D18 I22	D18-D20 PolarHBondContact O-N 3.23Å; D20-I22 PolarHBondContact O-N 2.87Å
21	S	44.5	Very low	57.5	Low	108 Å²	108	123.8 Å²	123.8	76%	0.755	68%	0.681	S	S	*	*			trans	-85.8	60.6	155.5	58.7	0	0	0	0	110.5	E23	S21-E23 PolarHBondContact O-N 3.19Å
22	I	51.3	Low	60.2	Low	135 Å²	135	114.7 Å²	114.7	69%	0.692	64%	0.638	S	S	*	*			trans	-65.8	93.5	163.2	-58.5	172.2	0	0	0	105.8	D20 A24	D20-I22 PolarHBondContact O-N 2.87Å; I22-A24 PolarHBondContact O-N 3.03Å
23	E	54.8	Low	62.8	Low	180 Å²	180	109.3 Å²	109.3	84%	0.841	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-49	117.6	164.8	-79.1	-175.5	162.2	0	0	107.1	S21	S21-E23 PolarHBondContact O-N 3.19Å
24	A	58	Low	65.6	Low	81 Å²	81	108.5 Å²	108.5	67%	0.669	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-50.8	135.8	179.2	0	0	0	0	0	108.8	I22 T26	I22-A24 PolarHBondContact O-N 3.03Å; A24-T26 PolarHBondContact O-N 3.14Å; A24-T26 VanDerWaalsContact O-N 3.14Å
25	P	61.7	Low	68.5	Low	100 Å²	100	104.6 Å²	104.6	65%	0.649	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-57.1	125.9	-172.9	21.8	-32.5	0	0	0	109.8	R27	P25-R27 PolarHBondContact O-N 3.41Å
26	T	70.6	Confident	71.1	Confident	100 Å²	100	101.6 Å²	101.6	61%	0.613	55%	0.546	S	S	*	.			trans	-63.6	97.9	178.7	45.9	0	0	0	0	109.6	A24 I28	A24-T26 PolarHBondContact O-N 3.14Å; A24-T26 VanDerWaalsContact O-N 3.14Å; T26-I28 PolarHBondContact O-N 2.89Å
27	R	82.9	Confident	73.6	Confident	165 Å²	165	93.9 Å²	93.9	62%	0.623	51%	0.51	S	S	*	.			trans	-83.6	109.9	176	-72.8	-177.6	177.8	176	2	109.1	P25 E71	P25-R27 PolarHBondContact O-N 3.41Å; R27-E71 HydrophobicContact CB-CB 4.41Å; R27-E71 HydrophobicContact CB-CG 4.19Å; R27-E71 VanDerWaalsContact CB-OE2 3.29Å; R27-E71 WeakPolarHBondContact CB-OE2 3.29Å; R27-E71 VanDerWaalsContact CD-OE2 3.24Å; R27-E71 WeakPolarHBondContact CD-OE2 3.39Å; R27-E71 PolarHBondContact O-N 3.25Å
28	I	89.9	Confident	76.1	Confident	128 Å²	128	96.4 Å²	96.4	66%	0.656	52%	0.517	S	S	*	.	B	Isolated β-bridge	trans	-97.8	127.5	175.4	-59.9	173.5	0	0	0	108.3	T26 C69	T26-I28 PolarHBondContact O-N 2.89Å; I28-C69 HydrophobicContact CG2-CB 4.15Å
29	R	91.3	Very high	78.7	Confident	97 Å²	97	90.1 Å²	90.1	37%	0.366	48%	0.484	S	S	.	.			trans	-96.7	167.3	177.2	-59.3	169.7	66.4	86.3	-4.1	110.7	T31 C69 E71	R29-T31 VanDerWaalsContact C-N 3.28Å; R29-T31 VanDerWaalsContact CB-O 3.3Å; R29-T31 WeakPolarHBondContact CB-O 3.24Å; R29-T31 PolarHBondContact O-N 3.04Å; R29-C69 PolarHBondContact N-O 3.38Å; R29-C69 WeakPolarHBondContact O-CB 3.4Å; R29-E71 VanDerWaalsContact CD-CG 3.49Å; R29-E71 HydrophobicContact CG-CG 3.82Å; R29-E71 IonicContact NH1-OE1 2.86Å; R29-E71 PolarHBondContact NH1-OE1 2.77Å; R29-E71 VanDerWaalsContact NH1-OE1 3.08Å
30	D	90.9	Very high	81.3	Confident	117 Å²	117	85.8 Å²	85.8	63%	0.626	46%	0.456	S	S	*	.	S	Bend	trans	-69.9	-28.1	173.6	-64.1	-37.3	0	0	0	112.6	F309	D30-F309 WeakPolarHBondContact O-CE1 3.46Å
31	T	94.7	Very high	83.9	Confident	6 Å²	6	79.6 Å²	79.6	4%	0.037	42%	0.423	C	S	.	.	S	Bend	trans	-139.2	154.4	-179.1	60.4	0	0	0	0	109.7	R29 F309 D323 K351	R29-T31 VanDerWaalsContact C-N 3.28Å; R29-T31 VanDerWaalsContact CB-O 3.3Å; R29-T31 WeakPolarHBondContact CB-O 3.24Å; R29-T31 PolarHBondContact O-N 3.04Å; T31-F309 HydrophobicContact CG2-CD1 4.34Å; T31-F309 HydrophobicContact CG2-CE1 4.33Å; T31-D323 HydrophobicContact CG2-CB 3.84Å; T31-K351 WeakPolarHBondContact OG1-CE 3.36Å; T31-K351 PolarHBondContact OG1-NZ 3.23Å
32	P	96.6	Very high	86.4	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-52.2	158.8	167.2	-22.9	33.1	0	0	0	113.3	Y67 S68 F321	P32-Y67 HydrophobicContact CG-CD2 3.77Å; P32-Y67 HydrophobicContact CG-CG 4.43Å; P32-S68 VanDerWaalsContact CA-O 3.29Å; P32-S68 WeakPolarHBondContact CA-O 3.15Å; P32-S68 WeakPolarHBondContact CB-O 3.37Å; P32-F321 HydrophobicContact CB-CB 4.42Å; P32-F321 HydrophobicContact CB-CD1 4.26Å; P32-F321 HydrophobicContact CB-CD2 3.77Å; P32-F321 HydrophobicContact CB-CE1 4.45Å; P32-F321 HydrophobicContact CB-CE2 4Å; P32-F321 HydrophobicContact CB-CG 3.9Å; P32-F321 HydrophobicContact CB-CZ 4.33Å; P32-F321 HydrophobicContact CG-CB 4.43Å; P32-F321 HydrophobicContact CG-CD1 4.01Å; P32-F321 HydrophobicContact CG-CD2 4.4Å; P32-F321 HydrophobicContact CG-CE1 4.33Å; P32-F321 HydrophobicContact CG-CG 4.04Å
33	E	95.8	Very high	88.5	Confident	64 Å²	64	69.6 Å²	69.6	30%	0.299	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-68.7	152.5	174.7	-66.7	178	119.6	0	0	110.9	I35 G72 F321	E33-I35 PolarHBondContact O-N 3.11Å; E33-G72 PolarHBondContact OE2-N 2.83Å; E33-F321 WeakPolarHBondContact O-CD2 3.29Å; E33-F321 WeakPolarHBondContact O-CE2 3.11Å
34	D	97.3	Very high	90.6	Very high	52 Å²	52	61.7 Å²	61.7	28%	0.278	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-68	128.2	176.7	-67.2	8.4	0	0	0	108.6	L319 K320 K351	D34-L319 WeakPolarHBondContact CA-O 3.48Å; D34-K320 IonicContact OD2-NZ 2.83Å; D34-K320 PolarHBondContact OD2-NZ 2.9Å; D34-K351 IonicContact OD1-NZ 2.77Å
35	I	98.1	Very high	92.5	Very high	15 Å²	15	58.5 Å²	58.5	8%	0.077	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	129	175.2	-60.5	159.4	0	0	0	107.6	E33 L37 L53 F65 T74 R318 L319 F321	E33-I35 PolarHBondContact O-N 3.11Å; I35-L37 HydrophobicContact CG2-CD2 4.05Å; I35-L53 HydrophobicContact CD1-CD2 4.36Å; I35-F65 HydrophobicContact CD1-CB 3.75Å; I35-F65 HydrophobicContact CD1-CD1 4.15Å; I35-F65 HydrophobicContact CD1-CD2 4.05Å; I35-F65 HydrophobicContact CD1-CG 3.71Å; I35-F65 HydrophobicContact CG2-CD1 3.87Å; I35-F65 HydrophobicContact CG2-CD2 4.42Å; I35-F65 HydrophobicContact CG2-CE1 3.58Å; I35-F65 HydrophobicContact CG2-CE2 4.14Å; I35-F65 HydrophobicContact CG2-CG 4.3Å; I35-F65 HydrophobicContact CG2-CZ 3.73Å; I35-T74 HydrophobicContact CD1-CG2 3.9Å; I35-T74 HydrophobicContact CG1-CG2 3.65Å; I35-R318 CarbonylContact O-C 3.57Å; I35-R318 WeakPolarHBondContact O-CA 3.3Å; I35-L319 HydrophobicContact CB-CB 4.1Å; I35-L319 HydrophobicContact CB-CD1 4.36Å; I35-L319 HydrophobicContact CB-CG 4.4Å; I35-L319 HydrophobicContact CD1-CD1 4.27Å; I35-L319 HydrophobicContact CG2-CD1 4.4Å; I35-L319 PolarHBondContact N-O 2.85Å; I35-L319 PolarHBondContact O-N 3.09Å; I35-F321 HydrophobicContact CD1-CE2 3.84Å; I35-F321 HydrophobicContact CD1-CZ 3.93Å; I35-F321 HydrophobicContact CG1-CE2 4.19Å
36	V	98	Very high	94.3	Very high	93 Å²	93	54.7 Å²	54.7	56%	0.564	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	126.6	176.8	-174	0	0	0	0	108.4	R318	V36-R318 VanDerWaalsContact CG2-NH1 3.31Å
37	L	97.1	Very high	95.6	Very high	14 Å²	14	50.2 Å²	50.2	7%	0.073	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-103.4	160.5	176.8	-55.9	178.4	0	0	0	110	I35 A39 A41 F65 Q317 L319	I35-L37 HydrophobicContact CG2-CD2 4.05Å; L37-A39 VanDerWaalsContact CB-O 3.24Å; L37-A39 WeakPolarHBondContact CB-O 3.29Å; L37-A41 HydrophobicContact CD1-CB 3.73Å; L37-F65 HydrophobicContact CD2-CE2 3.95Å; L37-F65 HydrophobicContact CD2-CZ 3.54Å; L37-Q317 PolarHBondContact N-O 2.86Å; L37-L319 HydrophobicContact CD1-CD1 4.31Å; L37-L319 HydrophobicContact CD1-CD2 3.93Å; L37-L319 HydrophobicContact CD1-CG 3.98Å; L37-L319 HydrophobicContact CD2-CD1 4.45Å; L37-L319 HydrophobicContact CG-CG 4.34Å
38	E	95.9	Very high	96.3	Very high	192 Å²	192	45.1 Å²	45.1	90%	0.897	24%	0.236	S	C	*	.	S	Bend	trans	-82.2	-21.3	172	-61.5	-168.7	168.5	0	0	112.1	Q317	E38-Q317 PolarHBondContact O-NE2 2.91Å
39	A	97.2	Very high	96.7	Very high	4 Å²	4	42.4 Å²	42.4	3%	0.033	23%	0.232	C	C	.	.	S	Bend	trans	-140.1	151.2	-179.5	0	0	0	0	0	111	L37 D57 V58	L37-A39 VanDerWaalsContact CB-O 3.24Å; L37-A39 WeakPolarHBondContact CB-O 3.29Å; A39-D57 HydrophobicContact CB-CB 4.22Å; A39-V58 HydrophobicContact CB-CG1 4.01Å
40	P	97.1	Very high	97	Very high	20 Å²	20	42 Å²	42	13%	0.13	23%	0.231	C	C	.	.			trans	-68	144.1	179.1	29.1	-35.1	0	0	0	111.3	D57 V58	P40-D57 WeakPolarHBondContact O-CA 3.43Å; P40-V58 HydrophobicContact CG-CB 4.45Å; P40-V58 HydrophobicContact CG-CG1 3.98Å; P40-V58 PolarHBondContact O-N 3.37Å; P40-V58 VanDerWaalsContact O-N 3.08Å
41	A	97.9	Very high	97.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.2	-178	0	0	0	0	0	112.7	L37 A55 G56 E299 S313	L37-A41 HydrophobicContact CD1-CB 3.73Å; A41-A55 HydrophobicContact CB-CB 4.11Å; A41-G56 CarbonylContact C-O 3.59Å; A41-G56 VanDerWaalsContact CA-O 3.3Å; A41-G56 WeakPolarHBondContact CA-O 3.46Å; A41-G56 WeakPolarHBondContact CB-O 3.4Å; A41-E299 WeakPolarHBondContact O-CB 3.41Å; A41-S313 WeakPolarHBondContact O-CB 3.21Å; A41-S313 PolarHBondContact O-OG 2.86Å
42	S	96.9	Very high	97.4	Very high	32 Å²	32	40.4 Å²	40.4	22%	0.224	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-33.4	172.7	-55.7	0	0	0	0	111.7	G56 R88 E300	S42-G56 PolarHBondContact N-O 3.08Å; S42-G56 VanDerWaalsContact N-O 3.09Å; S42-R88 CarbonylContact C-O 3.54Å; S42-E300 WeakPolarHBondContact O-CB 3.5Å
43	G	96.8	Very high	97.5	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	127.7	175.7	0	0	0	0	0	111.2	A55 G56	G43-A55 CarbonylContact O-C 3.55Å; G43-A55 VanDerWaalsContact O-CA 3.23Å; G43-A55 WeakPolarHBondContact O-CA 3.27Å; G43-G56 PolarHBondContact N-O 3.18Å; G43-G56 VanDerWaalsContact N-O 3.11Å; G43-G56 PolarHBondContact O-N 2.79Å
44	L	98.5	Very high	97.7	Very high	14 Å²	14	37.4 Å²	37.4	7%	0.073	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	129.2	176	-166.8	70.9	0	0	0	111.4	L53 A54 A55 E300 A302 A311 L319	L44-L53 HydrophobicContact CD1-CD1 3.78Å; L44-L53 HydrophobicContact CD1-CD2 4.22Å; L44-L53 HydrophobicContact CD1-CG 4.1Å; L44-L53 HydrophobicContact CG-CD1 4.08Å; L44-A54 WeakPolarHBondContact CA-O 3.42Å; L44-A55 HydrophobicContact CD1-CB 4.35Å; L44-E300 HydrophobicContact CB-CB 4Å; L44-E300 HydrophobicContact CB-CG 3.81Å; L44-A302 HydrophobicContact CD2-CB 4.02Å; L44-A302 HydrophobicContact CG-CB 4.04Å; L44-A311 HydrophobicContact CD2-CB 4.03Å; L44-L319 HydrophobicContact CD1-CD1 4.18Å; L44-L319 HydrophobicContact CD1-CD2 3.84Å
45	A	98.6	Very high	97.7	Very high	14 Å²	14	34.9 Å²	34.9	12%	0.116	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	138.3	175.5	0	0	0	0	0	113	A54 V90 F92	A45-A54 PolarHBondContact N-O 2.98Å; A45-A54 PolarHBondContact O-N 3.46Å; A45-V90 HydrophobicContact CB-CG2 4.03Å; A45-V90 WeakPolarHBondContact CB-O 3.4Å; A45-F92 HydrophobicContact CB-CD2 4.24Å; A45-F92 WeakPolarHBondContact O-CE2 3.47Å
46	F	98.7	Very high	97.8	Very high	21 Å²	21	34.2 Å²	34.2	9%	0.092	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	146.8	168.3	-81.9	-75.3	0	0	0	111.5	L53 Y67 F92 A302 L303 A311 F321	F46-L53 HydrophobicContact CD1-CB 4.24Å; F46-L53 HydrophobicContact CD1-CD1 3.9Å; F46-L53 HydrophobicContact CD2-CD1 4.11Å; F46-L53 HydrophobicContact CE1-CB 4.17Å; F46-L53 HydrophobicContact CE1-CD1 3.93Å; F46-L53 HydrophobicContact CE1-CG 4.47Å; F46-L53 HydrophobicContact CE2-CD1 4.16Å; F46-L53 HydrophobicContact CG-CD1 4.01Å; F46-L53 HydrophobicContact CZ-CD1 4.08Å; F46-Y67 HydrophobicContact CD1-CD1 4.45Å; F46-Y67 AromaticContact CD1-CE1 3.54Å; F46-Y67 HydrophobicContact CD1-CE1 3.54Å; F46-Y67 AromaticContact CD1-CZ 3.86Å; F46-Y67 HydrophobicContact CE1-CD1 4Å; F46-Y67 AromaticContact CE1-CE1 3.36Å; F46-Y67 HydrophobicContact CE1-CE1 3.36Å; F46-Y67 HydrophobicContact CE1-CE2 4.34Å; F46-Y67 AromaticContact CE1-CZ 3.55Å; F46-F92 WeakPolarHBondContact O-CD2 3.35Å; F46-A302 HydrophobicContact CD2-CB 3.74Å; F46-A302 HydrophobicContact CE2-CB 4.18Å; F46-A302 WeakPolarHBondContact CE2-O 3.39Å; F46-L303 WeakPolarHBondContact CD2-O 3.47Å; F46-A311 HydrophobicContact CD2-CB 4.49Å; F46-A311 HydrophobicContact CE2-CB 3.42Å; F46-A311 VanDerWaalsContact CE2-CB 3.42Å; F46-A311 HydrophobicContact CZ-CB 3.55Å; F46-F321 AromaticContact CE1-CE1 3.97Å; F46-F321 HydrophobicContact CE1-CE1 3.97Å; F46-F321 HydrophobicContact CZ-CD1 4.15Å; F46-F321 AromaticContact CZ-CE1 3.8Å; F46-F321 HydrophobicContact CZ-CE1 3.8Å
47	H	98.5	Very high	97.8	Very high	6 Å²	6	30 Å²	30	3%	0.028	17%	0.166	C	C	.	.			trans	-69.2	141.1	170.1	-175.7	-58.9	0	0	0	110.8	A49 R50 L52 F92 G96 H305	H47-A49 PolarHBondContact ND1-N 3.15Å; H47-A49 PolarHBondContact O-N 3.48Å; H47-R50 PolarHBondContact ND1-N 3.17Å; H47-R50 VanDerWaalsContact ND1-N 3.16Å; H47-L52 HydrophobicContact CB-CB 3.77Å; H47-L52 PolarHBondContact N-O 3.43Å; H47-F92 HydrophobicContact CB-CD1 4.34Å; H47-F92 HydrophobicContact CB-CD2 4.09Å; H47-F92 HydrophobicContact CB-CE1 4.29Å; H47-F92 HydrophobicContact CB-CE2 4.02Å; H47-F92 HydrophobicContact CB-CG 4.23Å; H47-F92 HydrophobicContact CB-CZ 4.12Å; H47-F92 AromaticContact CD2-CD1 3.83Å; H47-F92 AromaticContact CD2-CE1 3.84Å; H47-G96 VanDerWaalsContact CE1-CA 3.48Å; H47-G96 WeakPolarHBondContact CE1-CA 3.49Å; H47-G96 WeakPolarHBondContact NE2-CA 3.44Å; H47-G96 PolarHBondContact NE2-O 2.66Å; H47-H305 WeakPolarHBondContact O-CB 3.34Å; H47-H305 PolarHBondContact O-ND1 3.11Å
48	P	97.3	Very high	97.8	Very high	57 Å²	57	32.7 Å²	32.7	37%	0.37	18%	0.182	S	C	.	.	S	Bend	trans	-69.3	-1.3	-173.7	27.1	-38.8	0	0	0	116.4	S93 H305	P48-S93 WeakPolarHBondContact CG-O 3.04Å; P48-H305 VanDerWaalsContact C-CB 3.45Å; P48-H305 WeakPolarHBondContact O-CB 3.16Å
49	A	97	Very high	97.9	Very high	71 Å²	71	28.5 Å²	28.5	59%	0.587	17%	0.166	S	C	*	.	S	Bend	trans	-158.2	-24.9	-167.7	0	0	0	0	0	114.5	H47	H47-A49 PolarHBondContact ND1-N 3.15Å; H47-A49 PolarHBondContact O-N 3.48Å
50	R	97.4	Very high	97.9	Very high	89 Å²	89	28.3 Å²	28.3	34%	0.336	17%	0.165	S	C	.	.	S	Bend	trans	-110	161.2	177.6	-67.2	167	66.1	178.9	8	110	H47 L52 E114 H305	H47-R50 PolarHBondContact ND1-N 3.17Å; H47-R50 VanDerWaalsContact ND1-N 3.16Å; R50-L52 HydrophobicContact CB-CD1 4.26Å; R50-L52 HydrophobicContact CB-CG 4.04Å; R50-L52 PolarHBondContact O-N 3.43Å; R50-E114 IonicContact CZ-OE1 3.58Å; R50-E114 IonicContact NH1-OE1 2.66Å; R50-E114 PolarHBondContact NH1-OE1 3.13Å; R50-E114 IonicContact NH1-OE2 3.66Å; R50-E114 IonicContact NH2-OE1 3.71Å; R50-E114 IonicContact NH2-OE2 3.46Å; R50-E114 PolarHBondContact NH2-OE2 3.11Å; R50-H305 PolarHBondContact O-CE1 3.32Å; R50-H305 PolarHBondContact O-ND1 2.54Å
51	D	97.5	Very high	97.9	Very high	84 Å²	84	30.3 Å²	30.3	45%	0.449	17%	0.174	S	C	.	.	S	Bend	trans	-79.6	58.9	174.1	-63.6	-27	0	0	0	111.1	Y67 H305	D51-Y67 VanDerWaalsContact CA-CE1 3.41Å; D51-Y67 VanDerWaalsContact CA-CZ 3.47Å; D51-Y67 HydrophobicContact CB-CD1 4.33Å; D51-Y67 HydrophobicContact CB-CD2 4.2Å; D51-Y67 HydrophobicContact CB-CE1 3.97Å; D51-Y67 HydrophobicContact CB-CE2 3.83Å; D51-Y67 HydrophobicContact CB-CG 4.45Å; D51-Y67 VanDerWaalsContact O-CD1 3.22Å; D51-Y67 WeakPolarHBondContact O-CD1 3.45Å; D51-Y67 WeakPolarHBondContact O-CE1 3.4Å; D51-Y67 PolarHBondContact O-N 2.89Å; D51-Y67 VanDerWaalsContact O-N 3.11Å; D51-Y67 PolarHBondContact OD1-OH 2.84Å; D51-H305 IonicContact OD1-CE1 3.08Å; D51-H305 PolarHBondContact OD1-CE1 2.94Å; D51-H305 VanDerWaalsContact OD1-CE1 3.29Å
52	L	98.3	Very high	97.9	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.9	175.8	-58.4	177.8	0	0	0	111.3	H47 R50 V64 F65 Y67 L77 F92 V113	H47-L52 HydrophobicContact CB-CB 3.77Å; H47-L52 PolarHBondContact N-O 3.43Å; R50-L52 HydrophobicContact CB-CD1 4.26Å; R50-L52 HydrophobicContact CB-CG 4.04Å; R50-L52 PolarHBondContact O-N 3.43Å; L52-V64 HydrophobicContact CB-CG1 4.15Å; L52-V64 HydrophobicContact CD1-CG1 4.31Å; L52-V64 HydrophobicContact CD2-CG1 4.27Å; L52-V64 HydrophobicContact CG-CG1 4.48Å; L52-F65 CarbonylContact C-O 3.58Å; L52-F65 VanDerWaalsContact CA-O 3.26Å; L52-F65 WeakPolarHBondContact CA-O 3.08Å; L52-Y67 VanDerWaalsContact N-CE1 3.31Å; L52-L77 HydrophobicContact CD2-CD2 4.18Å; L52-F92 HydrophobicContact CB-CZ 4.5Å; L52-V113 HydrophobicContact CD1-CG1 3.93Å
53	L	98.6	Very high	98	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.5	174.6	178.8	65	0	0	0	108.7	I35 L44 F46 V64 F65 Y67 A311 L319 F321	I35-L53 HydrophobicContact CD1-CD2 4.36Å; L44-L53 HydrophobicContact CD1-CD1 3.78Å; L44-L53 HydrophobicContact CD1-CD2 4.22Å; L44-L53 HydrophobicContact CD1-CG 4.1Å; L44-L53 HydrophobicContact CG-CD1 4.08Å; F46-L53 HydrophobicContact CD1-CB 4.24Å; F46-L53 HydrophobicContact CD1-CD1 3.9Å; F46-L53 HydrophobicContact CD2-CD1 4.11Å; F46-L53 HydrophobicContact CE1-CB 4.17Å; F46-L53 HydrophobicContact CE1-CD1 3.93Å; F46-L53 HydrophobicContact CE1-CG 4.47Å; F46-L53 HydrophobicContact CE2-CD1 4.16Å; F46-L53 HydrophobicContact CG-CD1 4.01Å; F46-L53 HydrophobicContact CZ-CD1 4.08Å; L53-V64 WeakPolarHBondContact O-CA 3.48Å; L53-F65 PolarHBondContact N-O 3.41Å; L53-F65 PolarHBondContact O-N 3.45Å; L53-Y67 HydrophobicContact CB-CD1 4.15Å; L53-A311 HydrophobicContact CD1-CB 4.22Å; L53-A311 HydrophobicContact CD2-CB 4.12Å; L53-L319 HydrophobicContact CD2-CB 4.43Å; L53-L319 HydrophobicContact CD2-CD1 3.98Å; L53-F321 HydrophobicContact CD2-CE1 3.93Å; L53-F321 HydrophobicContact CD2-CZ 3.58Å
54	A	98.6	Very high	98.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	141.4	173.6	0	0	0	0	0	110.7	L44 A45 F63 V64 V90 F92 L99	L44-A54 WeakPolarHBondContact CA-O 3.42Å; A45-A54 PolarHBondContact N-O 2.98Å; A45-A54 PolarHBondContact O-N 3.46Å; A54-F63 CarbonylContact C-O 3.58Å; A54-F63 VanDerWaalsContact CA-O 3.25Å; A54-F63 WeakPolarHBondContact CA-O 3.47Å; A54-V64 HydrophobicContact CB-CG2 4.03Å; A54-V90 HydrophobicContact CB-CG2 4.07Å; A54-F92 HydrophobicContact CB-CD2 4.4Å; A54-F92 HydrophobicContact CB-CE2 3.46Å; A54-F92 VanDerWaalsContact CB-CE2 3.46Å; A54-F92 HydrophobicContact CB-CZ 3.68Å; A54-L99 HydrophobicContact CB-CD1 3.72Å; A54-L99 HydrophobicContact CB-CD2 3.91Å
55	A	98.6	Very high	98.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140.5	173	0	0	0	0	0	110.6	A41 G43 L44 V62 F63 F65 L319	A41-A55 HydrophobicContact CB-CB 4.11Å; G43-A55 CarbonylContact O-C 3.55Å; G43-A55 VanDerWaalsContact O-CA 3.23Å; G43-A55 WeakPolarHBondContact O-CA 3.27Å; L44-A55 HydrophobicContact CD1-CB 4.35Å; A55-V62 CarbonylContact O-C 3.49Å; A55-V62 WeakPolarHBondContact O-CA 3.22Å; A55-F63 PolarHBondContact N-O 3.1Å; A55-F63 PolarHBondContact O-N 3.02Å; A55-F65 HydrophobicContact CB-CE2 4.23Å; A55-L319 HydrophobicContact CB-CD1 3.87Å
56	G	98.4	Very high	98	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123.9	173.1	0	0	0	0	0	110.2	A41 S42 G43	A41-G56 CarbonylContact C-O 3.59Å; A41-G56 VanDerWaalsContact CA-O 3.3Å; A41-G56 WeakPolarHBondContact CA-O 3.46Å; A41-G56 WeakPolarHBondContact CB-O 3.4Å; S42-G56 PolarHBondContact N-O 3.08Å; S42-G56 VanDerWaalsContact N-O 3.09Å; G43-G56 PolarHBondContact N-O 3.18Å; G43-G56 VanDerWaalsContact N-O 3.11Å; G43-G56 PolarHBondContact O-N 2.79Å
57	D	98	Very high	98	Very high	6 Å²	6	30.9 Å²	30.9	3%	0.032	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	174.3	-171.7	79.7	11.1	0	0	0	114.9	A39 P40 D59 G60 D61 F63 A86 C87	A39-D57 HydrophobicContact CB-CB 4.22Å; P40-D57 WeakPolarHBondContact O-CA 3.43Å; D57-D59 VanDerWaalsContact C-N 3.27Å; D57-D59 PolarHBondContact O-N 3.44Å; D57-D59 WeakPolarHBondContact OD1-CA 3.09Å; D57-D59 PolarHBondContact OD1-N 3.39Å; D57-G60 PolarHBondContact O-N 3.29Å; D57-G60 PolarHBondContact OD1-N 3.3Å; D57-D61 PolarHBondContact N-O 3.19Å; D57-D61 PolarHBondContact OD1-N 3.16Å; D57-F63 HydrophobicContact CB-CE2 4.37Å; D57-F63 WeakPolarHBondContact OD2-CE2 3.23Å; D57-A86 WeakPolarHBondContact O-CA 3.42Å; D57-C87 PolarHBondContact O-N 3.47Å
58	V	98	Very high	97.9	Very high	69 Å²	69	32.5 Å²	32.5	42%	0.418	19%	0.186	S	C	.	.	S	Bend	trans	-69.4	-20.5	179.6	70.5	0	0	0	0	113.9	A39 P40 A86	A39-V58 HydrophobicContact CB-CG1 4.01Å; P40-V58 HydrophobicContact CG-CB 4.45Å; P40-V58 HydrophobicContact CG-CG1 3.98Å; P40-V58 PolarHBondContact O-N 3.37Å; P40-V58 VanDerWaalsContact O-N 3.08Å; V58-A86 HydrophobicContact CG2-CB 4.3Å; V58-A86 WeakPolarHBondContact O-CA 3.44Å; V58-A86 WeakPolarHBondContact O-CB 3.35Å; V58-A86 PolarHBondContact O-N 3.34Å
59	D	97.7	Very high	97.8	Very high	105 Å²	105	30.9 Å²	30.9	56%	0.561	18%	0.176	S	C	*	.	S	Bend	trans	-82.7	-23.6	177.2	-68.9	-36.9	0	0	0	111.3	D57 K85	D57-D59 VanDerWaalsContact C-N 3.27Å; D57-D59 PolarHBondContact O-N 3.44Å; D57-D59 WeakPolarHBondContact OD1-CA 3.09Å; D57-D59 PolarHBondContact OD1-N 3.39Å; D59-K85 CarbonylContact O-C 3.56Å
60	G	96.9	Very high	97.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	110.8	0.4	179.8	0	0	0	0	0	113.3	D57 H83 K85	D57-G60 PolarHBondContact O-N 3.29Å; D57-G60 PolarHBondContact OD1-N 3.3Å; G60-H83 WeakPolarHBondContact O-CB 3.36Å; G60-K85 WeakPolarHBondContact CA-O 3.44Å
61	D	98.1	Very high	97.3	Very high	61 Å²	61	29.8 Å²	29.8	33%	0.326	16%	0.162	S	C	.	.			trans	-74.9	145.3	176.1	-66.3	-43.4	0	0	0	110.1	D57 F63 G81	D57-D61 PolarHBondContact N-O 3.19Å; D57-D61 PolarHBondContact OD1-N 3.16Å; D61-F63 HydrophobicContact CB-CE2 3.65Å; D61-F63 HydrophobicContact CB-CZ 3.63Å; D61-G81 WeakPolarHBondContact OD1-CA 3.39Å
62	V	98.4	Very high	97	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128	179.4	179	0	0	0	0	108.2	A55 W78 S79 S80 C87 L99 T101 L111	A55-V62 CarbonylContact O-C 3.49Å; A55-V62 WeakPolarHBondContact O-CA 3.22Å; V62-W78 HydrophobicContact CG1-CH2 4.47Å; V62-W78 HydrophobicContact CG1-CZ3 4.25Å; V62-S79 CarbonylContact O-C 3.57Å; V62-S79 VanDerWaalsContact O-CA 3.27Å; V62-S79 WeakPolarHBondContact O-CA 3.26Å; V62-S80 PolarHBondContact N-O 3.5Å; V62-S80 PolarHBondContact O-N 3.41Å; V62-C87 HydrophobicContact CG2-CB 4.26Å; V62-L99 HydrophobicContact CG1-CD2 3.64Å; V62-T101 HydrophobicContact CG1-CG2 4.03Å; V62-T101 HydrophobicContact CG2-CG2 4.02Å; V62-L111 HydrophobicContact CB-CD1 4.42Å; V62-L111 HydrophobicContact CG1-CD1 4.22Å
63	F	98.4	Very high	96.7	Very high	34 Å²	34	31.8 Å²	31.8	15%	0.149	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145.6	-177.9	-54.4	-90.4	0	0	0	110.1	A54 A55 D57 D61 F65	A54-F63 CarbonylContact C-O 3.58Å; A54-F63 VanDerWaalsContact CA-O 3.25Å; A54-F63 WeakPolarHBondContact CA-O 3.47Å; A55-F63 PolarHBondContact N-O 3.1Å; A55-F63 PolarHBondContact O-N 3.02Å; D57-F63 HydrophobicContact CB-CE2 4.37Å; D57-F63 WeakPolarHBondContact OD2-CE2 3.23Å; D61-F63 HydrophobicContact CB-CE2 3.65Å; D61-F63 HydrophobicContact CB-CZ 3.63Å; F63-F65 HydrophobicContact CB-CD2 4.28Å; F63-F65 HydrophobicContact CB-CE1 4.46Å; F63-F65 HydrophobicContact CB-CE2 3.42Å; F63-F65 VanDerWaalsContact CB-CE2 3.42Å; F63-F65 HydrophobicContact CB-CZ 3.52Å; F63-F65 HydrophobicContact CD1-CZ 4.4Å; F63-F65 HydrophobicContact CG-CE2 4.3Å; F63-F65 HydrophobicContact CG-CZ 4.03Å
64	V	98.5	Very high	96.7	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128	165.1	173.5	0	0	0	0	109	L52 L53 A54 L77 W78 F92 L99	L52-V64 HydrophobicContact CB-CG1 4.15Å; L52-V64 HydrophobicContact CD1-CG1 4.31Å; L52-V64 HydrophobicContact CD2-CG1 4.27Å; L52-V64 HydrophobicContact CG-CG1 4.48Å; L53-V64 WeakPolarHBondContact O-CA 3.48Å; A54-V64 HydrophobicContact CB-CG2 4.03Å; V64-L77 HydrophobicContact CG1-CB 4.46Å; V64-L77 HydrophobicContact CG1-CD2 4.33Å; V64-L77 WeakPolarHBondContact O-CB 3.49Å; V64-L77 PolarHBondContact O-N 2.87Å; V64-W78 HydrophobicContact CB-CD2 4.12Å; V64-W78 HydrophobicContact CB-CH2 4.35Å; V64-W78 HydrophobicContact CB-CZ2 3.87Å; V64-W78 HydrophobicContact CG2-CD2 4.26Å; V64-W78 HydrophobicContact CG2-CE3 4.44Å; V64-W78 HydrophobicContact CG2-CH2 3.46Å; V64-W78 VanDerWaalsContact CG2-CH2 3.46Å; V64-W78 HydrophobicContact CG2-CZ2 3.21Å; V64-W78 HydrophobicContact CG2-CZ3 4.07Å; V64-W78 PolarHBondContact N-O 3.3Å; V64-W78 PolarHBondContact O-N 2.95Å; V64-F92 HydrophobicContact CG1-CZ 4.49Å; V64-F92 HydrophobicContact CG2-CZ 4.26Å; V64-L99 HydrophobicContact CG2-CD2 4.03Å
65	F	98.4	Very high	96.6	Very high	12 Å²	12	38.6 Å²	38.6	5%	0.053	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	136	179.8	-57.5	-83.5	0	0	0	110.2	I35 L37 L52 L53 A55 F63 K75 E76 L319	I35-F65 HydrophobicContact CD1-CB 3.75Å; I35-F65 HydrophobicContact CD1-CD1 4.15Å; I35-F65 HydrophobicContact CD1-CD2 4.05Å; I35-F65 HydrophobicContact CD1-CG 3.71Å; I35-F65 HydrophobicContact CG2-CD1 3.87Å; I35-F65 HydrophobicContact CG2-CD2 4.42Å; I35-F65 HydrophobicContact CG2-CE1 3.58Å; I35-F65 HydrophobicContact CG2-CE2 4.14Å; I35-F65 HydrophobicContact CG2-CG 4.3Å; I35-F65 HydrophobicContact CG2-CZ 3.73Å; L37-F65 HydrophobicContact CD2-CE2 3.95Å; L37-F65 HydrophobicContact CD2-CZ 3.54Å; L52-F65 CarbonylContact C-O 3.58Å; L52-F65 VanDerWaalsContact CA-O 3.26Å; L52-F65 WeakPolarHBondContact CA-O 3.08Å; L53-F65 PolarHBondContact N-O 3.41Å; L53-F65 PolarHBondContact O-N 3.45Å; A55-F65 HydrophobicContact CB-CE2 4.23Å; F63-F65 HydrophobicContact CB-CD2 4.28Å; F63-F65 HydrophobicContact CB-CE1 4.46Å; F63-F65 HydrophobicContact CB-CE2 3.42Å; F63-F65 VanDerWaalsContact CB-CE2 3.42Å; F63-F65 HydrophobicContact CB-CZ 3.52Å; F63-F65 HydrophobicContact CD1-CZ 4.4Å; F63-F65 HydrophobicContact CG-CE2 4.3Å; F63-F65 HydrophobicContact CG-CZ 4.03Å; F65-K75 WeakPolarHBondContact CA-O 3.22Å; F65-E76 HydrophobicContact CD1-CB 4Å; F65-E76 HydrophobicContact CD1-CG 4.49Å; F65-E76 HydrophobicContact CE1-CB 3.9Å; F65-E76 HydrophobicContact CE1-CG 4.2Å; F65-L319 HydrophobicContact CD2-CD1 4.2Å; F65-L319 HydrophobicContact CE2-CD1 4.01Å
66	S	97.8	Very high	96.5	Very high	39 Å²	39	43 Å²	43	27%	0.273	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	128.2	160	-178.2	0	0	0	0	107.9	T74 K75	S66-T74 CarbonylContact O-C 3.57Å; S66-T74 VanDerWaalsContact O-CA 3.29Å; S66-T74 WeakPolarHBondContact O-CA 3.44Å; S66-K75 PolarHBondContact N-O 2.88Å; S66-K75 PolarHBondContact O-N 2.88Å
67	Y	97.4	Very high	96.4	Very high	7 Å²	7	46.8 Å²	46.8	3%	0.027	26%	0.256	C	S	.	.			trans	-114.7	146.2	179.8	66.1	-94.3	0	0	0	111.8	P32 F46 D51 L52 L53 F309 F321	P32-Y67 HydrophobicContact CG-CD2 3.77Å; P32-Y67 HydrophobicContact CG-CG 4.43Å; F46-Y67 HydrophobicContact CD1-CD1 4.45Å; F46-Y67 AromaticContact CD1-CE1 3.54Å; F46-Y67 HydrophobicContact CD1-CE1 3.54Å; F46-Y67 AromaticContact CD1-CZ 3.86Å; F46-Y67 HydrophobicContact CE1-CD1 4Å; F46-Y67 AromaticContact CE1-CE1 3.36Å; F46-Y67 HydrophobicContact CE1-CE1 3.36Å; F46-Y67 HydrophobicContact CE1-CE2 4.34Å; F46-Y67 AromaticContact CE1-CZ 3.55Å; D51-Y67 VanDerWaalsContact CA-CE1 3.41Å; D51-Y67 VanDerWaalsContact CA-CZ 3.47Å; D51-Y67 HydrophobicContact CB-CD1 4.33Å; D51-Y67 HydrophobicContact CB-CD2 4.2Å; D51-Y67 HydrophobicContact CB-CE1 3.97Å; D51-Y67 HydrophobicContact CB-CE2 3.83Å; D51-Y67 HydrophobicContact CB-CG 4.45Å; D51-Y67 VanDerWaalsContact O-CD1 3.22Å; D51-Y67 WeakPolarHBondContact O-CD1 3.45Å; D51-Y67 WeakPolarHBondContact O-CE1 3.4Å; D51-Y67 PolarHBondContact O-N 2.89Å; D51-Y67 VanDerWaalsContact O-N 3.11Å; D51-Y67 PolarHBondContact OD1-OH 2.84Å; L52-Y67 VanDerWaalsContact N-CE1 3.31Å; L53-Y67 HydrophobicContact CB-CD1 4.15Å; Y67-F309 HydrophobicContact CE2-CD2 4.08Å; Y67-F309 HydrophobicContact CE2-CE2 4.45Å; Y67-F321 HydrophobicContact CD1-CE1 4.46Å; Y67-F321 HydrophobicContact CD2-CE1 4.42Å; Y67-F321 HydrophobicContact CG-CE1 4.14Å; Y67-F321 HydrophobicContact CG-CZ 4.32Å
68	S	96.8	Very high	96.4	Very high	41 Å²	41	47.5 Å²	47.5	29%	0.287	26%	0.259	S	S	.	.			trans	-148.7	152.4	177.2	179.6	0	0	0	0	110.5	P32 Q70 T74	P32-S68 VanDerWaalsContact CA-O 3.29Å; P32-S68 WeakPolarHBondContact CA-O 3.15Å; P32-S68 WeakPolarHBondContact CB-O 3.37Å; S68-Q70 PolarHBondContact OG-N 3Å; S68-Q70 VanDerWaalsContact OG-N 3.15Å; S68-T74 PolarHBondContact N-OG1 2.92Å; S68-T74 VanDerWaalsContact N-OG1 3.13Å; S68-T74 PolarHBondContact O-OG1 2.89Å
69	C	94.4	Very high	96.4	Very high	23 Å²	23	47.5 Å²	47.5	16%	0.155	26%	0.262	C	S	.	.	S	Bend	trans	-76.2	-12.7	171.8	-67.6	0	0	0	0	112.8	I28 R29 F309	I28-C69 HydrophobicContact CG2-CB 4.15Å; R29-C69 PolarHBondContact N-O 3.38Å; R29-C69 WeakPolarHBondContact O-CB 3.4Å; C69-F309 WeakPolarHBondContact SG-CZ 3.42Å
70	Q	94.4	Very high	96.4	Very high	69 Å²	69	42.9 Å²	42.9	32%	0.322	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-76.7	129.2	174	-176.4	171.7	-19.9	0	0	109.8	S68 G72 E73	S68-Q70 PolarHBondContact OG-N 3Å; S68-Q70 VanDerWaalsContact OG-N 3.15Å; Q70-G72 PolarHBondContact O-N 3.17Å; Q70-E73 HydrophobicContact CB-CB 4.24Å; Q70-E73 HydrophobicContact CB-CG 4.03Å; Q70-E73 HydrophobicContact CG-CG 3.91Å; Q70-E73 PolarHBondContact O-N 3.42Å
71	E	90.4	Very high	96.3	Very high	67 Å²	67	45.1 Å²	45.1	31%	0.313	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	132.7	178.1	-76.3	-176.6	171.7	0	0	111.3	R27 R29 E73	R27-E71 HydrophobicContact CB-CB 4.41Å; R27-E71 HydrophobicContact CB-CG 4.19Å; R27-E71 VanDerWaalsContact CB-OE2 3.29Å; R27-E71 WeakPolarHBondContact CB-OE2 3.29Å; R27-E71 VanDerWaalsContact CD-OE2 3.24Å; R27-E71 WeakPolarHBondContact CD-OE2 3.39Å; R27-E71 PolarHBondContact O-N 3.25Å; R29-E71 VanDerWaalsContact CD-CG 3.49Å; R29-E71 HydrophobicContact CG-CG 3.82Å; R29-E71 IonicContact NH1-OE1 2.86Å; R29-E71 PolarHBondContact NH1-OE1 2.77Å; R29-E71 VanDerWaalsContact NH1-OE1 3.08Å; E71-E73 VanDerWaalsContact C-N 3.29Å; E71-E73 PolarHBondContact O-N 2.88Å
72	G	90.1	Very high	96.2	Very high	56 Å²	56	45.9 Å²	45.9	58%	0.577	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	-6	179.3	0	0	0	0	0	116.1	E33 Q70	E33-G72 PolarHBondContact OE2-N 2.83Å; Q70-G72 PolarHBondContact O-N 3.17Å
73	E	93.8	Very high	96.2	Very high	76 Å²	76	46.1 Å²	46.1	36%	0.355	26%	0.263	S	S	.	.			trans	-90.6	-9.9	-179.6	-73.5	-58.4	149.7	0	0	114.1	Q70 E71 K75	Q70-E73 HydrophobicContact CB-CB 4.24Å; Q70-E73 HydrophobicContact CB-CG 4.03Å; Q70-E73 HydrophobicContact CG-CG 3.91Å; Q70-E73 PolarHBondContact O-N 3.42Å; E71-E73 VanDerWaalsContact C-N 3.29Å; E71-E73 PolarHBondContact O-N 2.88Å; E73-K75 PolarHBondContact O-N 2.92Å; E73-K75 IonicContact OE2-NZ 3.11Å; E73-K75 PolarHBondContact OE2-NZ 2.81Å; E73-K75 VanDerWaalsContact OE2-NZ 3.11Å
74	T	96.8	Very high	96	Very high	27 Å²	27	51.1 Å²	51.1	17%	0.166	29%	0.291	C	S	.	.			trans	-79.5	116.5	172.8	-61.1	0	0	0	0	109.5	I35 S66 S68	I35-T74 HydrophobicContact CD1-CG2 3.9Å; I35-T74 HydrophobicContact CG1-CG2 3.65Å; S66-T74 CarbonylContact O-C 3.57Å; S66-T74 VanDerWaalsContact O-CA 3.29Å; S66-T74 WeakPolarHBondContact O-CA 3.44Å; S68-T74 PolarHBondContact N-OG1 2.92Å; S68-T74 VanDerWaalsContact N-OG1 3.13Å; S68-T74 PolarHBondContact O-OG1 2.89Å
75	K	96.8	Very high	95.9	Very high	116 Å²	116	56.3 Å²	56.3	50%	0.504	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	152.3	-172.3	60.1	-163.1	170.2	-150	0	112.7	F65 S66 E73 L77	F65-K75 WeakPolarHBondContact CA-O 3.22Å; S66-K75 PolarHBondContact N-O 2.88Å; S66-K75 PolarHBondContact O-N 2.88Å; E73-K75 PolarHBondContact O-N 2.92Å; E73-K75 IonicContact OE2-NZ 3.11Å; E73-K75 PolarHBondContact OE2-NZ 2.81Å; E73-K75 VanDerWaalsContact OE2-NZ 3.11Å; K75-L77 PolarHBondContact O-N 3.48Å
76	E	97.4	Very high	95.9	Very high	93 Å²	93	56.2 Å²	56.2	44%	0.435	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	128.8	169.5	-172.8	-177.7	140.8	0	0	109.4	F65 S79	F65-E76 HydrophobicContact CD1-CB 4Å; F65-E76 HydrophobicContact CD1-CG 4.49Å; F65-E76 HydrophobicContact CE1-CB 3.9Å; F65-E76 HydrophobicContact CE1-CG 4.2Å; E76-S79 WeakPolarHBondContact OE1-CB 3.38Å; E76-S79 PolarHBondContact OE1-N 2.79Å; E76-S79 PolarHBondContact OE1-OG 3.19Å
77	L	96.7	Very high	95.9	Very high	80 Å²	80	54.3 Å²	54.3	42%	0.419	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-46.4	173.1	-173	67.2	0	0	0	110.2	L52 V64 K75	L52-L77 HydrophobicContact CD2-CD2 4.18Å; V64-L77 HydrophobicContact CG1-CB 4.46Å; V64-L77 HydrophobicContact CG1-CD2 4.33Å; V64-L77 WeakPolarHBondContact O-CB 3.49Å; V64-L77 PolarHBondContact O-N 2.87Å; K75-L77 PolarHBondContact O-N 3.48Å
78	W	98	Very high	96	Very high	20 Å²	20	57 Å²	57	8%	0.076	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	163	174.7	54.1	-104.2	0	0	0	111.4	V62 V64 L99 L111 V113 G116	V62-W78 HydrophobicContact CG1-CH2 4.47Å; V62-W78 HydrophobicContact CG1-CZ3 4.25Å; V64-W78 HydrophobicContact CB-CD2 4.12Å; V64-W78 HydrophobicContact CB-CH2 4.35Å; V64-W78 HydrophobicContact CB-CZ2 3.87Å; V64-W78 HydrophobicContact CG2-CD2 4.26Å; V64-W78 HydrophobicContact CG2-CE3 4.44Å; V64-W78 HydrophobicContact CG2-CH2 3.46Å; V64-W78 VanDerWaalsContact CG2-CH2 3.46Å; V64-W78 HydrophobicContact CG2-CZ2 3.21Å; V64-W78 HydrophobicContact CG2-CZ3 4.07Å; V64-W78 PolarHBondContact N-O 3.3Å; V64-W78 PolarHBondContact O-N 2.95Å; W78-L99 HydrophobicContact CH2-CD2 3.76Å; W78-L99 HydrophobicContact CZ2-CD2 4.42Å; W78-L111 HydrophobicContact CH2-CB 4.41Å; W78-L111 HydrophobicContact CH2-CD1 3.93Å; W78-L111 HydrophobicContact CZ3-CD1 4.07Å; W78-V113 PolarHBondContact NE1-O 3.1Å; W78-G116 VanDerWaalsContact CD2-CA 3.45Å; W78-G116 VanDerWaalsContact CE2-CA 3.47Å
79	S	97.2	Very high	96	Very high	69 Å²	69	55.7 Å²	55.7	48%	0.483	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	153.8	171.2	38.6	0	0	0	0	111.4	V62 E76	V62-S79 CarbonylContact O-C 3.57Å; V62-S79 VanDerWaalsContact O-CA 3.27Å; V62-S79 WeakPolarHBondContact O-CA 3.26Å; E76-S79 WeakPolarHBondContact OE1-CB 3.38Å; E76-S79 PolarHBondContact OE1-N 2.79Å; E76-S79 PolarHBondContact OE1-OG 3.19Å
80	S	97.1	Very high	96.2	Very high	8 Å²	8	55.1 Å²	55.1	6%	0.056	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	113.4	-177.4	-166.7	0	0	0	0	111.7	V62 H82 G116	V62-S80 PolarHBondContact N-O 3.5Å; V62-S80 PolarHBondContact O-N 3.41Å; S80-H82 PolarHBondContact OG-CD2 3.01Å; S80-G116 PolarHBondContact OG-O 2.89Å
81	G	96.2	Very high	96.4	Very high	47 Å²	47	52.8 Å²	52.8	49%	0.485	29%	0.291	S	S	.	.			trans	-102.1	42	-179.4	0	0	0	0	0	114.3	D61	D61-G81 WeakPolarHBondContact OD1-CA 3.39Å
82	H	96	Very high	96.8	Very high	78 Å²	78	50.4 Å²	50.4	36%	0.361	28%	0.28	S	S	.	.			trans	-79.9	-25	-178.3	-73.8	-52.6	0	0	0	114.1	S80 H109 L118	S80-H82 PolarHBondContact OG-CD2 3.01Å; H82-H109 PolarHBondContact O-CE1 3.43Å; H82-L118 HydrophobicContact CB-CD2 4.34Å; H82-L118 VanDerWaalsContact CD2-CB 3.49Å; H82-L118 WeakPolarHBondContact CD2-CB 3.35Å; H82-L118 WeakPolarHBondContact NE2-CB 2.98Å
83	H	96.7	Very high	97.1	Very high	7 Å²	7	48.3 Å²	48.3	3%	0.032	26%	0.257	C	S	.	.			trans	-78.2	147.6	169.9	-72.8	-64.3	0	0	0	109.9	G60 T101 S103 D105 H109	G60-H83 WeakPolarHBondContact O-CB 3.36Å; H83-T101 PolarHBondContact NE2-OG1 2.82Å; H83-S103 VanDerWaalsContact CE1-CB 3.44Å; H83-S103 WeakPolarHBondContact CE1-CB 3.38Å; H83-S103 VanDerWaalsContact CG-CB 3.48Å; H83-S103 WeakPolarHBondContact ND1-CB 3.27Å; H83-D105 IonicContact CE1-OD1 3.34Å; H83-D105 IonicContact CG-OD2 2.78Å; H83-D105 IonicContact ND1-OD1 3.41Å; H83-D105 PolarHBondContact ND1-OD1 2.9Å; H83-D105 IonicContact ND1-OD2 3.93Å; H83-D105 PolarHBondContact ND1-OD2 3.11Å; H83-H109 AromaticContact CD2-ND1 3.42Å; H83-H109 PolarHBondContact CD2-ND1 3.17Å; H83-H109 AromaticContact CE1-CE1 3.41Å; H83-H109 PolarHBondContact CE1-CE1 2.9Å; H83-H109 VanDerWaalsContact CE1-CE1 3.41Å; H83-H109 AromaticContact CE1-CG 3.59Å; H83-H109 AromaticContact CE1-ND1 3.08Å; H83-H109 PolarHBondContact CE1-ND1 2.9Å; H83-H109 AromaticContact CG-CE1 3.65Å; H83-H109 AromaticContact CG-ND1 3.5Å; H83-H109 AromaticContact ND1-CE1 3.22Å; H83-H109 PolarHBondContact ND1-CE1 3.47Å; H83-H109 AromaticContact ND1-ND1 3.29Å; H83-H109 PolarHBondContact ND1-ND1 3.29Å; H83-H109 AromaticContact NE2-CE1 3.9Å; H83-H109 AromaticContact NE2-CG 3.68Å; H83-H109 AromaticContact NE2-ND1 3.14Å; H83-H109 PolarHBondContact NE2-ND1 3.49Å; H83-H109 VanDerWaalsContact NE2-ND1 3.14Å
84	L	94.6	Very high	97.1	Very high	138 Å²	138	50.1 Å²	50.1	72%	0.723	27%	0.265	S	S	*	.	S	Bend	trans	-104	4.2	-176.8	-58.7	176.5	0	0	0	112.8
85	K	97.8	Very high	97	Very high	110 Å²	110	52.5 Å²	52.5	48%	0.478	28%	0.277	S	S	.	.	S	Bend	trans	-155.6	163.3	-178.1	-59.9	-171.2	178.9	179.7	0	108.6	D59 G60 C87 S103 K104 D105	D59-K85 CarbonylContact O-C 3.56Å; G60-K85 WeakPolarHBondContact CA-O 3.44Å; K85-C87 PolarHBondContact O-N 3.18Å; K85-S103 PolarHBondContact O-OG 2.87Å; K85-K104 HydrophobicContact CB-CB 3.95Å; K85-K104 HydrophobicContact CB-CG 4.38Å; K85-K104 HydrophobicContact CD-CB 4.45Å; K85-K104 HydrophobicContact CD-CG 4.08Å; K85-D105 HydrophobicContact CB-CB 4.29Å; K85-D105 HydrophobicContact CG-CB 4.34Å
86	A	97.9	Very high	96.9	Very high	9 Å²	9	47 Å²	47	7%	0.074	25%	0.253	C	S	.	.			trans	-23.8	117	172.5	0	0	0	0	0	115.4	D57 V58 S103 K104	D57-A86 WeakPolarHBondContact O-CA 3.42Å; V58-A86 HydrophobicContact CG2-CB 4.3Å; V58-A86 WeakPolarHBondContact O-CA 3.44Å; V58-A86 WeakPolarHBondContact O-CB 3.35Å; V58-A86 PolarHBondContact O-N 3.34Å; A86-S103 VanDerWaalsContact O-CA 3.26Å; A86-S103 WeakPolarHBondContact O-CA 3.35Å; A86-S103 WeakPolarHBondContact O-CB 3.42Å; A86-S103 PolarHBondContact O-OG 3.45Å; A86-K104 HydrophobicContact CB-CB 4.24Å; A86-K104 PolarHBondContact O-N 2.75Å
87	C	98.4	Very high	96.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	114.5	167.6	-175.7	0	0	0	0	108	D57 V62 K85 V90 V102	D57-C87 PolarHBondContact O-N 3.47Å; V62-C87 HydrophobicContact CG2-CB 4.26Å; K85-C87 PolarHBondContact O-N 3.18Å; C87-V90 VanDerWaalsContact SG-CG1 3.6Å; C87-V102 CarbonylContact C-O 3.5Å; C87-V102 WeakPolarHBondContact CA-O 3.4Å; C87-V102 PolarHBondContact SG-O 3.38Å; C87-V102 VanDerWaalsContact SG-O 3.39Å
88	R	98.1	Very high	96.8	Very high	62 Å²	62	45.3 Å²	45.3	23%	0.234	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-33.3	-170.4	-73.5	-67.3	-173.2	88.7	-5.4	113.3	S42 V102 I130 N131 D146	S42-R88 CarbonylContact C-O 3.54Å; R88-V102 PolarHBondContact N-O 2.84Å; R88-I130 WeakPolarHBondContact CB-O 3.3Å; R88-I130 WeakPolarHBondContact CG-O 3.3Å; R88-N131 PolarHBondContact NH1-OD1 2.96Å; R88-D146 IonicContact NH1-OD1 3.99Å
89	A	98.3	Very high	96.9	Very high	15 Å²	15	44.4 Å²	44.4	12%	0.124	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	149.4	177.8	0	0	0	0	0	111.1	V102 L133	A89-V102 HydrophobicContact CB-CG2 3.76Å; A89-V102 PolarHBondContact O-N 2.94Å; A89-L133 HydrophobicContact CB-CB 3.91Å
90	V	98.5	Very high	96.9	Very high	11 Å²	11	41.1 Å²	41.1	7%	0.067	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.5	178.3	-57	0	0	0	0	109.2	A45 A54 C87 L99 V100 T101	A45-V90 HydrophobicContact CB-CG2 4.03Å; A45-V90 WeakPolarHBondContact CB-O 3.4Å; A54-V90 HydrophobicContact CB-CG2 4.07Å; C87-V90 VanDerWaalsContact SG-CG1 3.6Å; V90-L99 HydrophobicContact CB-CD1 4.27Å; V90-V100 CarbonylContact C-O 3.58Å; V90-V100 WeakPolarHBondContact CA-O 3.39Å; V90-T101 HydrophobicContact CB-CG2 4.15Å; V90-T101 HydrophobicContact CG1-CG2 3.65Å
91	A	98.3	Very high	97	Very high	19 Å²	19	40.8 Å²	40.8	16%	0.157	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	130.6	177.6	0	0	0	0	0	111.1	V100 L133 L135	A91-V100 PolarHBondContact N-O 3.4Å; A91-V100 PolarHBondContact O-N 2.95Å; A91-L133 HydrophobicContact CB-CD2 3.84Å; A91-L133 HydrophobicContact CB-CG 4.33Å; A91-L135 HydrophobicContact CB-CD1 3.99Å; A91-L135 HydrophobicContact CB-CG 3.93Å
92	F	98.2	Very high	97.1	Very high	18 Å²	18	38.5 Å²	38.5	8%	0.079	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	139.7	170.2	-74.2	-81.3	0	0	0	110.5	A45 F46 H47 L52 A54 V64 K98 L99 V113 L135	A45-F92 HydrophobicContact CB-CD2 4.24Å; A45-F92 WeakPolarHBondContact O-CE2 3.47Å; F46-F92 WeakPolarHBondContact O-CD2 3.35Å; H47-F92 HydrophobicContact CB-CD1 4.34Å; H47-F92 HydrophobicContact CB-CD2 4.09Å; H47-F92 HydrophobicContact CB-CE1 4.29Å; H47-F92 HydrophobicContact CB-CE2 4.02Å; H47-F92 HydrophobicContact CB-CG 4.23Å; H47-F92 HydrophobicContact CB-CZ 4.12Å; H47-F92 AromaticContact CD2-CD1 3.83Å; H47-F92 AromaticContact CD2-CE1 3.84Å; L52-F92 HydrophobicContact CB-CZ 4.5Å; A54-F92 HydrophobicContact CB-CD2 4.4Å; A54-F92 HydrophobicContact CB-CE2 3.46Å; A54-F92 VanDerWaalsContact CB-CE2 3.46Å; A54-F92 HydrophobicContact CB-CZ 3.68Å; V64-F92 HydrophobicContact CG1-CZ 4.49Å; V64-F92 HydrophobicContact CG2-CZ 4.26Å; F92-K98 WeakPolarHBondContact CA-O 3.35Å; F92-L99 HydrophobicContact CD1-CB 4.39Å; F92-L99 HydrophobicContact CD1-CD1 3.91Å; F92-L99 HydrophobicContact CD2-CD1 3.96Å; F92-L99 HydrophobicContact CE1-CB 4.37Å; F92-L99 HydrophobicContact CE1-CD1 3.95Å; F92-L99 HydrophobicContact CE2-CD1 4.01Å; F92-L99 HydrophobicContact CG-CD1 3.93Å; F92-L99 HydrophobicContact CZ-CD1 4Å; F92-V113 HydrophobicContact CD1-CG2 3.76Å; F92-V113 HydrophobicContact CE1-CG1 4.03Å; F92-V113 HydrophobicContact CE1-CG2 3.73Å; F92-L135 VanDerWaalsContact O-CD1 3.25Å; F92-L135 WeakPolarHBondContact O-CD1 3.28Å
93	S	96.8	Very high	97.2	Very high	12 Å²	12	34.8 Å²	34.8	8%	0.084	17%	0.173	C	C	.	.			trans	-62.5	151.1	169.3	54	0	0	0	0	111.4	P48 D95 G96 Q97 K98	P48-S93 WeakPolarHBondContact CG-O 3.04Å; S93-D95 WeakPolarHBondContact CB-OD1 3.43Å; S93-D95 PolarHBondContact O-N 3.41Å; S93-D95 PolarHBondContact OG-OD1 3Å; S93-G96 WeakPolarHBondContact O-CA 3.44Å; S93-G96 PolarHBondContact O-N 3.17Å; S93-Q97 PolarHBondContact OG-N 2.85Å; S93-K98 PolarHBondContact N-O 3.39Å; S93-K98 PolarHBondContact OG-N 3.45Å; S93-K98 PolarHBondContact OG-O 2.93Å
94	E	93.7	Very high	97.3	Very high	114 Å²	114	38.7 Å²	38.7	53%	0.533	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-29.8	-179.7	-69.8	-178.6	175.6	0	0	112.3	G96 K180	E94-G96 VanDerWaalsContact C-N 3.28Å; E94-G96 PolarHBondContact O-N 3.15Å; E94-K180 IonicContact OE1-NZ 3.65Å; E94-K180 PolarHBondContact OE1-NZ 2.85Å; E94-K180 IonicContact OE2-NZ 3.42Å; E94-K180 PolarHBondContact OE2-NZ 2.84Å
95	D	94.4	Very high	97.4	Very high	77 Å²	77	33.6 Å²	33.6	41%	0.412	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-8.1	175.1	71	-3.1	0	0	0	114.1	S93 Q97	S93-D95 WeakPolarHBondContact CB-OD1 3.43Å; S93-D95 PolarHBondContact O-N 3.41Å; S93-D95 PolarHBondContact OG-OD1 3Å; D95-Q97 HydrophobicContact CB-CG 4.4Å; D95-Q97 PolarHBondContact O-N 2.94Å; D95-Q97 PolarHBondContact OD1-N 3.3Å
96	G	95	Very high	97.4	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.01	16%	0.157	C	C	.	.	S	Bend	trans	71.2	6.6	-178.9	0	0	0	0	0	115.6	H47 S93 E94	H47-G96 VanDerWaalsContact CE1-CA 3.48Å; H47-G96 WeakPolarHBondContact CE1-CA 3.49Å; H47-G96 WeakPolarHBondContact NE2-CA 3.44Å; H47-G96 PolarHBondContact NE2-O 2.66Å; S93-G96 WeakPolarHBondContact O-CA 3.44Å; S93-G96 PolarHBondContact O-N 3.17Å; E94-G96 VanDerWaalsContact C-N 3.28Å; E94-G96 PolarHBondContact O-N 3.15Å
97	Q	96	Very high	97.4	Very high	95 Å²	95	31.7 Å²	31.7	44%	0.444	15%	0.154	S	C	.	.	S	Bend	trans	-88.9	-22.2	-174.8	-60.4	-56.9	-58.5	0	0	113.4	S93 D95 V113	S93-Q97 PolarHBondContact OG-N 2.85Å; D95-Q97 HydrophobicContact CB-CG 4.4Å; D95-Q97 PolarHBondContact O-N 2.94Å; D95-Q97 PolarHBondContact OD1-N 3.3Å; Q97-V113 VanDerWaalsContact C-CG2 3.44Å; Q97-V113 WeakPolarHBondContact O-CG2 3.4Å; Q97-V113 PolarHBondContact O-N 2.8Å; Q97-V113 VanDerWaalsContact O-N 3.17Å
98	K	96.9	Very high	97.4	Very high	42 Å²	42	32 Å²	32	18%	0.183	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.9	-173	-53.1	-62.6	158.2	-163	0	111.9	F92 S93 V110 L111 D112 V113 E119	F92-K98 WeakPolarHBondContact CA-O 3.35Å; S93-K98 PolarHBondContact N-O 3.39Å; S93-K98 PolarHBondContact OG-N 3.45Å; S93-K98 PolarHBondContact OG-O 2.93Å; K98-V110 HydrophobicContact CB-CG1 3.93Å; K98-V110 HydrophobicContact CD-CG1 4.16Å; K98-V110 HydrophobicContact CG-CG1 4.15Å; K98-L111 WeakPolarHBondContact CA-O 3.25Å; K98-D112 IonicContact NZ-OD1 2.91Å; K98-D112 PolarHBondContact NZ-OD1 2.84Å; K98-V113 VanDerWaalsContact C-CG2 3.46Å; K98-E119 VanDerWaalsContact CD-OE2 3.28Å; K98-E119 WeakPolarHBondContact CD-OE2 3.37Å; K98-E119 WeakPolarHBondContact CE-OE2 3.48Å; K98-E119 IonicContact NZ-OE1 2.88Å; K98-E119 PolarHBondContact NZ-OE1 2.83Å; K98-E119 IonicContact NZ-OE2 3.29Å; K98-E119 PolarHBondContact NZ-OE2 3.48Å
99	L	98.1	Very high	97.4	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.8	166.2	-175.8	70.7	0	0	0	108.2	A54 V62 V64 W78 V90 F92 T101 L111 V113	A54-L99 HydrophobicContact CB-CD1 3.72Å; A54-L99 HydrophobicContact CB-CD2 3.91Å; V62-L99 HydrophobicContact CG1-CD2 3.64Å; V64-L99 HydrophobicContact CG2-CD2 4.03Å; W78-L99 HydrophobicContact CH2-CD2 3.76Å; W78-L99 HydrophobicContact CZ2-CD2 4.42Å; V90-L99 HydrophobicContact CB-CD1 4.27Å; F92-L99 HydrophobicContact CD1-CB 4.39Å; F92-L99 HydrophobicContact CD1-CD1 3.91Å; F92-L99 HydrophobicContact CD2-CD1 3.96Å; F92-L99 HydrophobicContact CE1-CB 4.37Å; F92-L99 HydrophobicContact CE1-CD1 3.95Å; F92-L99 HydrophobicContact CE2-CD1 4.01Å; F92-L99 HydrophobicContact CG-CD1 3.93Å; F92-L99 HydrophobicContact CZ-CD1 4Å; L99-T101 HydrophobicContact CD2-CG2 4.08Å; L99-T101 HydrophobicContact CG-CG2 3.99Å; L99-L111 HydrophobicContact CB-CB 4.4Å; L99-L111 PolarHBondContact N-O 2.5Å; L99-L111 PolarHBondContact O-N 3.15Å; L99-V113 HydrophobicContact CB-CG2 4.38Å
100	V	98.4	Very high	97.4	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133	174.6	-176.1	0	0	0	0	108.5	V90 A91 I108 H109 V110 L133 L135 L141	V90-V100 CarbonylContact C-O 3.58Å; V90-V100 WeakPolarHBondContact CA-O 3.39Å; A91-V100 PolarHBondContact N-O 3.4Å; A91-V100 PolarHBondContact O-N 2.95Å; V100-I108 HydrophobicContact CG1-CG2 3.79Å; V100-H109 WeakPolarHBondContact CA-O 3.49Å; V100-V110 HydrophobicContact CG2-CG2 4.33Å; V100-L133 HydrophobicContact CB-CD2 4.04Å; V100-L133 HydrophobicContact CG1-CD1 3.93Å; V100-L133 HydrophobicContact CG1-CD2 3.83Å; V100-L133 VanDerWaalsContact O-CD2 3.29Å; V100-L133 WeakPolarHBondContact O-CD2 3.33Å; V100-L135 HydrophobicContact CB-CD2 4.12Å; V100-L135 HydrophobicContact CG1-CD2 4.41Å; V100-L135 HydrophobicContact CG2-CD1 4.42Å; V100-L135 HydrophobicContact CG2-CD2 3.92Å; V100-L141 HydrophobicContact CG1-CD2 4.27Å
101	T	98.5	Very high	97.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	146.5	-178.6	68.8	0	0	0	0	110.8	V62 H83 V90 L99 I108 H109 L111	V62-T101 HydrophobicContact CG1-CG2 4.03Å; V62-T101 HydrophobicContact CG2-CG2 4.02Å; H83-T101 PolarHBondContact NE2-OG1 2.82Å; V90-T101 HydrophobicContact CB-CG2 4.15Å; V90-T101 HydrophobicContact CG1-CG2 3.65Å; L99-T101 HydrophobicContact CD2-CG2 4.08Å; L99-T101 HydrophobicContact CG-CG2 3.99Å; T101-I108 WeakPolarHBondContact O-CA 3.4Å; T101-H109 PolarHBondContact N-O 2.88Å; T101-H109 PolarHBondContact O-N 2.91Å; T101-H109 WeakPolarHBondContact OG1-CB 3.49Å; T101-L111 HydrophobicContact CG2-CD1 4.34Å
102	V	98.6	Very high	97.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	151.9	176.5	-61.7	0	0	0	0	111	C87 R88 A89 I108 I130 L133 T143	C87-V102 CarbonylContact C-O 3.5Å; C87-V102 WeakPolarHBondContact CA-O 3.4Å; C87-V102 PolarHBondContact SG-O 3.38Å; C87-V102 VanDerWaalsContact SG-O 3.39Å; R88-V102 PolarHBondContact N-O 2.84Å; A89-V102 HydrophobicContact CB-CG2 3.76Å; A89-V102 PolarHBondContact O-N 2.94Å; V102-I108 HydrophobicContact CG1-CB 4.5Å; V102-I108 HydrophobicContact CG1-CG1 4.07Å; V102-I108 HydrophobicContact CG1-CG2 4.25Å; V102-I130 HydrophobicContact CB-CB 4.07Å; V102-I130 HydrophobicContact CB-CG2 3.64Å; V102-I130 HydrophobicContact CG1-CG2 4.01Å; V102-I130 HydrophobicContact CG2-CB 4.48Å; V102-I130 HydrophobicContact CG2-CG2 3.83Å; V102-L133 HydrophobicContact CG1-CB 4.06Å; V102-L133 HydrophobicContact CG1-CD1 3.95Å; V102-L133 HydrophobicContact CG1-CD2 4.22Å; V102-L133 HydrophobicContact CG1-CG 4.29Å; V102-L133 HydrophobicContact CG2-CB 3.81Å; V102-T143 HydrophobicContact CG1-CG2 3.98Å
103	S	98.4	Very high	97.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	161.3	-170.9	166.1	0	0	0	0	113.4	H83 K85 A86 D105 K106 A107 I130	H83-S103 VanDerWaalsContact CE1-CB 3.44Å; H83-S103 WeakPolarHBondContact CE1-CB 3.38Å; H83-S103 VanDerWaalsContact CG-CB 3.48Å; H83-S103 WeakPolarHBondContact ND1-CB 3.27Å; K85-S103 PolarHBondContact O-OG 2.87Å; A86-S103 VanDerWaalsContact O-CA 3.26Å; A86-S103 WeakPolarHBondContact O-CA 3.35Å; A86-S103 WeakPolarHBondContact O-CB 3.42Å; A86-S103 PolarHBondContact O-OG 3.45Å; S103-D105 VanDerWaalsContact CB-OD1 3.28Å; S103-D105 WeakPolarHBondContact CB-OD1 3.32Å; S103-D105 PolarHBondContact O-N 2.82Å; S103-D105 VanDerWaalsContact OG-CG 3.32Å; S103-D105 PolarHBondContact OG-N 2.88Å; S103-D105 PolarHBondContact OG-OD1 3.39Å; S103-K106 PolarHBondContact O-N 3.16Å; S103-A107 PolarHBondContact N-O 2.81Å; S103-I130 PolarHBondContact O-N 2.98Å
104	K	98.3	Very high	97.1	Very high	89 Å²	89	31.8 Å²	31.8	39%	0.387	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-15.9	166.4	-175.1	171.3	-169.7	176.2	0	113.6	K85 A86 K106 P129	K85-K104 HydrophobicContact CB-CB 3.95Å; K85-K104 HydrophobicContact CB-CG 4.38Å; K85-K104 HydrophobicContact CD-CB 4.45Å; K85-K104 HydrophobicContact CD-CG 4.08Å; A86-K104 HydrophobicContact CB-CB 4.24Å; A86-K104 PolarHBondContact O-N 2.75Å; K104-K106 PolarHBondContact O-N 2.83Å; K104-P129 HydrophobicContact CB-CB 4.27Å; K104-P129 HydrophobicContact CG-CB 3.9Å; K104-P129 HydrophobicContact CG-CG 3.98Å
105	D	97.7	Very high	96.9	Very high	31 Å²	31	33.4 Å²	33.4	17%	0.166	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-2.9	170.4	78.3	0	0	0	0	114	H83 K85 S103 A107	H83-D105 IonicContact CE1-OD1 3.34Å; H83-D105 IonicContact CG-OD2 2.78Å; H83-D105 IonicContact ND1-OD1 3.41Å; H83-D105 PolarHBondContact ND1-OD1 2.9Å; H83-D105 IonicContact ND1-OD2 3.93Å; H83-D105 PolarHBondContact ND1-OD2 3.11Å; K85-D105 HydrophobicContact CB-CB 4.29Å; K85-D105 HydrophobicContact CG-CB 4.34Å; S103-D105 VanDerWaalsContact CB-OD1 3.28Å; S103-D105 WeakPolarHBondContact CB-OD1 3.32Å; S103-D105 PolarHBondContact O-N 2.82Å; S103-D105 VanDerWaalsContact OG-CG 3.32Å; S103-D105 PolarHBondContact OG-N 2.88Å; S103-D105 PolarHBondContact OG-OD1 3.39Å; D105-A107 VanDerWaalsContact C-N 3.28Å; D105-A107 PolarHBondContact O-N 3.01Å; D105-A107 WeakPolarHBondContact OD1-CA 2.98Å; D105-A107 WeakPolarHBondContact OD1-CB 3.24Å; D105-A107 PolarHBondContact OD1-N 2.59Å
106	K	97.9	Very high	96.9	Very high	78 Å²	78	30 Å²	30	34%	0.339	14%	0.141	S	C	.	.	S	Bend	trans	70.5	19.8	178.4	-37.3	178.7	-174.9	-177.1	0	113.5	S103 K104 K124 A125 G127 A128	S103-K106 PolarHBondContact O-N 3.16Å; K104-K106 PolarHBondContact O-N 2.83Å; K106-K124 PolarHBondContact O-N 3.45Å; K106-A125 PolarHBondContact O-N 3.03Å; K106-G127 WeakPolarHBondContact CD-O 3.34Å; K106-G127 WeakPolarHBondContact CE-O 3.39Å; K106-G127 PolarHBondContact NZ-O 3Å; K106-A128 WeakPolarHBondContact CG-O 3.42Å
107	A	97.8	Very high	96.9	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.008	17%	0.167	C	C	.	.			trans	-108.1	154.9	176.8	0	0	0	0	0	112.1	S103 D105 V122	S103-A107 PolarHBondContact N-O 2.81Å; D105-A107 VanDerWaalsContact C-N 3.28Å; D105-A107 PolarHBondContact O-N 3.01Å; D105-A107 WeakPolarHBondContact OD1-CA 2.98Å; D105-A107 WeakPolarHBondContact OD1-CB 3.24Å; D105-A107 PolarHBondContact OD1-N 2.59Å; A107-V122 VanDerWaalsContact CA-O 3.25Å; A107-V122 WeakPolarHBondContact CA-O 3.34Å
108	I	98.3	Very high	97	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.026	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.9	167	-51.9	167.8	0	0	0	106.6	V100 T101 V102 V122 A125 I130 L141 T143 W153	V100-I108 HydrophobicContact CG1-CG2 3.79Å; T101-I108 WeakPolarHBondContact O-CA 3.4Å; V102-I108 HydrophobicContact CG1-CB 4.5Å; V102-I108 HydrophobicContact CG1-CG1 4.07Å; V102-I108 HydrophobicContact CG1-CG2 4.25Å; I108-V122 HydrophobicContact CB-CB 4.24Å; I108-V122 PolarHBondContact N-O 2.82Å; I108-V122 PolarHBondContact O-N 3.44Å; I108-A125 HydrophobicContact CD1-CB 3.69Å; I108-A125 HydrophobicContact CG1-CB 3.7Å; I108-I130 HydrophobicContact CG1-CD1 4.03Å; I108-L141 HydrophobicContact CD1-CD1 4.21Å; I108-T143 HydrophobicContact CD1-CG2 3.72Å; I108-T143 HydrophobicContact CG1-CG2 4.19Å; I108-W153 HydrophobicContact CD1-CD2 4.09Å; I108-W153 HydrophobicContact CD1-CG 4.24Å; I108-W153 HydrophobicContact CD1-CZ2 4.17Å
109	H	98.2	Very high	97	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	147	171.5	-66.8	152.7	0	0	0	110.8	H82 H83 V100 T101 L111 L118 R120 R121	H82-H109 PolarHBondContact O-CE1 3.43Å; H83-H109 AromaticContact CD2-ND1 3.42Å; H83-H109 PolarHBondContact CD2-ND1 3.17Å; H83-H109 AromaticContact CE1-CE1 3.41Å; H83-H109 PolarHBondContact CE1-CE1 2.9Å; H83-H109 VanDerWaalsContact CE1-CE1 3.41Å; H83-H109 AromaticContact CE1-CG 3.59Å; H83-H109 AromaticContact CE1-ND1 3.08Å; H83-H109 PolarHBondContact CE1-ND1 2.9Å; H83-H109 AromaticContact CG-CE1 3.65Å; H83-H109 AromaticContact CG-ND1 3.5Å; H83-H109 AromaticContact ND1-CE1 3.22Å; H83-H109 PolarHBondContact ND1-CE1 3.47Å; H83-H109 AromaticContact ND1-ND1 3.29Å; H83-H109 PolarHBondContact ND1-ND1 3.29Å; H83-H109 AromaticContact NE2-CE1 3.9Å; H83-H109 AromaticContact NE2-CG 3.68Å; H83-H109 AromaticContact NE2-ND1 3.14Å; H83-H109 PolarHBondContact NE2-ND1 3.49Å; H83-H109 VanDerWaalsContact NE2-ND1 3.14Å; V100-H109 WeakPolarHBondContact CA-O 3.49Å; T101-H109 PolarHBondContact N-O 2.88Å; T101-H109 PolarHBondContact O-N 2.91Å; T101-H109 WeakPolarHBondContact OG1-CB 3.49Å; H109-L111 HydrophobicContact CB-CD2 4.44Å; H109-L118 HydrophobicContact CB-CD1 3.69Å; H109-R120 WeakPolarHBondContact CA-O 3.39Å; H109-R121 WeakPolarHBondContact NE2-CD 3.2Å; H109-R121 WeakPolarHBondContact NE2-CG 3.43Å
110	V	97.6	Very high	96.8	Very high	9 Å²	9	41.5 Å²	41.5	6%	0.055	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	116.3	167.8	-173.4	0	0	0	0	106.8	K98 V100 E119 R120	K98-V110 HydrophobicContact CB-CG1 3.93Å; K98-V110 HydrophobicContact CD-CG1 4.16Å; K98-V110 HydrophobicContact CG-CG1 4.15Å; V100-V110 HydrophobicContact CG2-CG2 4.33Å; V110-E119 PolarHBondContact O-N 3.01Å; V110-R120 HydrophobicContact CB-CB 4.04Å; V110-R120 HydrophobicContact CG2-CB 4.15Å; V110-R120 PolarHBondContact N-O 2.92Å; V110-R120 PolarHBondContact O-N 2.89Å
111	L	97.9	Very high	96.7	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	146.4	-179.1	-53.7	178.8	0	0	0	109.7	V62 W78 K98 L99 T101 H109 R117 L118	V62-L111 HydrophobicContact CB-CD1 4.42Å; V62-L111 HydrophobicContact CG1-CD1 4.22Å; W78-L111 HydrophobicContact CH2-CB 4.41Å; W78-L111 HydrophobicContact CH2-CD1 3.93Å; W78-L111 HydrophobicContact CZ3-CD1 4.07Å; K98-L111 WeakPolarHBondContact CA-O 3.25Å; L99-L111 HydrophobicContact CB-CB 4.4Å; L99-L111 PolarHBondContact N-O 2.5Å; L99-L111 PolarHBondContact O-N 3.15Å; T101-L111 HydrophobicContact CG2-CD1 4.34Å; H109-L111 HydrophobicContact CB-CD2 4.44Å; L111-R117 WeakPolarHBondContact CA-O 3.46Å; L111-L118 HydrophobicContact CD2-CB 4Å; L111-L118 HydrophobicContact CD2-CD1 3.74Å
112	D	97	Very high	96.6	Very high	26 Å²	26	48.9 Å²	48.9	14%	0.139	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	134.6	168.5	-173.4	68.8	0	0	0	111.2	K98 E114 G116 R117 E119	K98-D112 IonicContact NZ-OD1 2.91Å; K98-D112 PolarHBondContact NZ-OD1 2.84Å; D112-E114 PolarHBondContact O-N 3.32Å; D112-E114 PolarHBondContact OD2-N 2.97Å; D112-G116 VanDerWaalsContact O-CA 3.23Å; D112-G116 WeakPolarHBondContact O-CA 3.25Å; D112-G116 PolarHBondContact O-N 2.77Å; D112-R117 HydrophobicContact CB-CB 4.36Å; D112-R117 PolarHBondContact N-O 3.28Å; D112-E119 HydrophobicContact CB-CG 4.26Å
113	V	96.4	Very high	96.5	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-28	-174.1	170.5	0	0	0	0	113.2	L52 W78 F92 Q97 K98 L99	L52-V113 HydrophobicContact CD1-CG1 3.93Å; W78-V113 PolarHBondContact NE1-O 3.1Å; F92-V113 HydrophobicContact CD1-CG2 3.76Å; F92-V113 HydrophobicContact CE1-CG1 4.03Å; F92-V113 HydrophobicContact CE1-CG2 3.73Å; Q97-V113 VanDerWaalsContact C-CG2 3.44Å; Q97-V113 WeakPolarHBondContact O-CG2 3.4Å; Q97-V113 PolarHBondContact O-N 2.8Å; Q97-V113 VanDerWaalsContact O-N 3.17Å; K98-V113 VanDerWaalsContact C-CG2 3.46Å; L99-V113 HydrophobicContact CB-CG2 4.38Å
114	E	93.6	Very high	96.4	Very high	95 Å²	95	60.9 Å²	60.9	44%	0.444	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-38.9	-176.9	-63.3	-59.2	155.5	0	0	112.5	R50 D112	R50-E114 IonicContact CZ-OE1 3.58Å; R50-E114 IonicContact NH1-OE1 2.66Å; R50-E114 PolarHBondContact NH1-OE1 3.13Å; R50-E114 IonicContact NH1-OE2 3.66Å; R50-E114 IonicContact NH2-OE1 3.71Å; R50-E114 IonicContact NH2-OE2 3.46Å; R50-E114 PolarHBondContact NH2-OE2 3.11Å; D112-E114 PolarHBondContact O-N 3.32Å; D112-E114 PolarHBondContact OD2-N 2.97Å
115	Q	90.9	Very high	96.3	Very high	149 Å²	149	56.7 Å²	56.7	70%	0.696	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.9	-2.4	-171.3	-62.1	-172.1	-21.5	0	0	114.5	R117	Q115-R117 PolarHBondContact O-N 2.87Å
116	G	93.6	Very high	96.3	Very high	5 Å²	5	55.5 Å²	55.5	5%	0.052	26%	0.255	C	S	.	.			trans	66.3	15.9	-175.2	0	0	0	0	0	114	W78 S80 D112 L118	W78-G116 VanDerWaalsContact CD2-CA 3.45Å; W78-G116 VanDerWaalsContact CE2-CA 3.47Å; S80-G116 PolarHBondContact OG-O 2.89Å; D112-G116 VanDerWaalsContact O-CA 3.23Å; D112-G116 WeakPolarHBondContact O-CA 3.25Å; D112-G116 PolarHBondContact O-N 2.77Å; G116-L118 PolarHBondContact O-N 2.86Å
117	R	95.6	Very high	96.2	Very high	146 Å²	146	54.8 Å²	54.8	55%	0.551	27%	0.27	S	S	*	.			trans	-72	130	-175.4	-172.9	-176.5	70.4	132.7	2.4	110.4	L111 D112 Q115 E119	L111-R117 WeakPolarHBondContact CA-O 3.46Å; D112-R117 HydrophobicContact CB-CB 4.36Å; D112-R117 PolarHBondContact N-O 3.28Å; Q115-R117 PolarHBondContact O-N 2.87Å; R117-E119 IonicContact NH2-OE1 3.58Å; R117-E119 PolarHBondContact NH2-OE1 3.34Å; R117-E119 PolarHBondContact O-N 2.8Å; R117-E119 VanDerWaalsContact O-N 3.17Å
118	L	97.6	Very high	96.2	Very high	49 Å²	49	55.2 Å²	55.2	26%	0.257	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	112.5	171.5	-176.4	66.9	0	0	0	111.6	H82 H109 L111 G116 R120 R121	H82-L118 HydrophobicContact CB-CD2 4.34Å; H82-L118 VanDerWaalsContact CD2-CB 3.49Å; H82-L118 WeakPolarHBondContact CD2-CB 3.35Å; H82-L118 WeakPolarHBondContact NE2-CB 2.98Å; H109-L118 HydrophobicContact CB-CD1 3.69Å; L111-L118 HydrophobicContact CD2-CB 4Å; L111-L118 HydrophobicContact CD2-CD1 3.74Å; G116-L118 PolarHBondContact O-N 2.86Å; L118-R120 VanDerWaalsContact CD1-O 3.3Å; L118-R120 WeakPolarHBondContact CD1-O 3.33Å; L118-R121 HydrophobicContact CD2-CB 4.33Å
119	E	95.8	Very high	96.3	Very high	81 Å²	81	56.2 Å²	56.2	38%	0.379	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-34.9	176.4	-60.1	-160.1	145.2	0	0	112.2	K98 V110 D112 R117	K98-E119 VanDerWaalsContact CD-OE2 3.28Å; K98-E119 WeakPolarHBondContact CD-OE2 3.37Å; K98-E119 WeakPolarHBondContact CE-OE2 3.48Å; K98-E119 IonicContact NZ-OE1 2.88Å; K98-E119 PolarHBondContact NZ-OE1 2.83Å; K98-E119 IonicContact NZ-OE2 3.29Å; K98-E119 PolarHBondContact NZ-OE2 3.48Å; V110-E119 PolarHBondContact O-N 3.01Å; D112-E119 HydrophobicContact CB-CG 4.26Å; R117-E119 IonicContact NH2-OE1 3.58Å; R117-E119 PolarHBondContact NH2-OE1 3.34Å; R117-E119 PolarHBondContact O-N 2.8Å; R117-E119 VanDerWaalsContact O-N 3.17Å
120	R	95.4	Very high	96.3	Very high	103 Å²	103	56.1 Å²	56.1	39%	0.389	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	138.6	-177.4	-169.4	-175	-66.4	-149.3	2.6	111.6	H109 V110 L118 Q155	H109-R120 WeakPolarHBondContact CA-O 3.39Å; V110-R120 HydrophobicContact CB-CB 4.04Å; V110-R120 HydrophobicContact CG2-CB 4.15Å; V110-R120 PolarHBondContact N-O 2.92Å; V110-R120 PolarHBondContact O-N 2.89Å; L118-R120 VanDerWaalsContact CD1-O 3.3Å; L118-R120 WeakPolarHBondContact CD1-O 3.33Å; R120-Q155 VanDerWaalsContact CZ-O 3.27Å; R120-Q155 PolarHBondContact NH1-O 3.03Å; R120-Q155 PolarHBondContact NH2-O 2.75Å
121	R	96.3	Very high	96.3	Very high	111 Å²	111	57.2 Å²	57.2	42%	0.419	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	120.2	171.4	174.2	170.3	-176.4	144.6	10.5	110.8	H109 L118 S123	H109-R121 WeakPolarHBondContact NE2-CD 3.2Å; H109-R121 WeakPolarHBondContact NE2-CG 3.43Å; L118-R121 HydrophobicContact CD2-CB 4.33Å; R121-S123 PolarHBondContact NE-OG 3.23Å
122	V	96.8	Very high	96.3	Very high	46 Å²	46	57.4 Å²	57.4	28%	0.279	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	91.5	169.2	-173.1	0	0	0	0	107.7	A107 I108 A125 W153	A107-V122 VanDerWaalsContact CA-O 3.25Å; A107-V122 WeakPolarHBondContact CA-O 3.34Å; I108-V122 HydrophobicContact CB-CB 4.24Å; I108-V122 PolarHBondContact N-O 2.82Å; I108-V122 PolarHBondContact O-N 3.44Å; V122-A125 HydrophobicContact CG1-CB 4.05Å; V122-W153 HydrophobicContact CG1-CE3 4.46Å; V122-W153 HydrophobicContact CG1-CH2 4.36Å; V122-W153 HydrophobicContact CG1-CZ3 3.98Å
123	S	95.6	Very high	96.3	Very high	67 Å²	67	57.1 Å²	57.1	47%	0.469	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	148.3	176.7	-65.2	0	0	0	0	111.1	R121 A125	R121-S123 PolarHBondContact NE-OG 3.23Å; S123-A125 PolarHBondContact O-N 2.79Å
124	K	95.1	Very high	96.4	Very high	185 Å²	185	58.1 Å²	58.1	80%	0.804	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	38.1	-178.7	-53.8	178.1	-178.3	176.6	0	111.7	K106 H126	K106-K124 PolarHBondContact O-N 3.45Å; K124-H126 PolarHBondContact O-N 3.27Å
125	A	96.9	Very high	96.6	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.008	28%	0.277	C	S	.	.			trans	-61.4	-32.5	176.8	0	0	0	0	0	110.8	K106 I108 V122 S123 I130 R151 W153	K106-A125 PolarHBondContact O-N 3.03Å; I108-A125 HydrophobicContact CD1-CB 3.69Å; I108-A125 HydrophobicContact CG1-CB 3.7Å; V122-A125 HydrophobicContact CG1-CB 4.05Å; S123-A125 PolarHBondContact O-N 2.79Å; A125-I130 HydrophobicContact CB-CD1 4.01Å; A125-R151 VanDerWaalsContact O-CD 3.3Å; A125-R151 WeakPolarHBondContact O-CD 3.47Å; A125-R151 PolarHBondContact O-NH1 2.78Å; A125-W153 HydrophobicContact CB-CH2 3.86Å; A125-W153 HydrophobicContact CB-CZ2 3.72Å; A125-W153 VanDerWaalsContact O-CH2 3.25Å; A125-W153 WeakPolarHBondContact O-CH2 3.45Å; A125-W153 WeakPolarHBondContact O-CZ2 3.32Å
126	H	97.8	Very high	96.8	Very high	5 Å²	5	48.1 Å²	48.1	2%	0.023	24%	0.244	C	C	.	.			trans	-130	162.7	171.2	-78.5	-109.2	0	0	0	112.1	K124 A128 I130 T143 D145 G149	K124-H126 PolarHBondContact O-N 3.27Å; H126-A128 VanDerWaalsContact CB-O 3.32Å; H126-A128 WeakPolarHBondContact CB-O 3.45Å; H126-I130 HydrophobicContact CB-CD1 4.49Å; H126-I130 HydrophobicContact CB-CG1 3.98Å; H126-T143 PolarHBondContact NE2-OG1 2.92Å; H126-D145 HydrophobicContact CB-CB 4.12Å; H126-D145 IonicContact CE1-OD2 3.67Å; H126-D145 IonicContact CG-OD2 3.81Å; H126-D145 WeakPolarHBondContact ND1-CB 3.28Å; H126-D145 IonicContact ND1-OD2 3.27Å; H126-D145 PolarHBondContact ND1-OD2 3.08Å; H126-G149 PolarHBondContact CE1-O 3.11Å
127	G	97	Very high	96.7	Very high	63 Å²	63	50.5 Å²	50.5	65%	0.649	26%	0.256	S	S	*	.	S	Bend	trans	-75.9	-27.2	171.5	0	0	0	0	0	112.7	K106	K106-G127 WeakPolarHBondContact CD-O 3.34Å; K106-G127 WeakPolarHBondContact CE-O 3.39Å; K106-G127 PolarHBondContact NZ-O 3Å
128	A	98	Very high	96.4	Very high	10 Å²	10	49.1 Å²	49.1	8%	0.083	26%	0.256	C	S	.	.	S	Bend	trans	-112.5	165.6	177.4	0	0	0	0	0	111.3	K106 H126 D145 T147	K106-A128 WeakPolarHBondContact CG-O 3.42Å; H126-A128 VanDerWaalsContact CB-O 3.32Å; H126-A128 WeakPolarHBondContact CB-O 3.45Å; A128-D145 HydrophobicContact CB-CB 4.11Å; A128-T147 HydrophobicContact CB-CG2 3.66Å; A128-T147 WeakPolarHBondContact CB-OG1 3.47Å
129	P	98.4	Very high	96.2	Very high	26 Å²	26	48.7 Å²	48.7	17%	0.169	25%	0.254	C	S	.	.			trans	-49.6	140.6	168.3	-31	39.9	0	0	0	112.9	K104 D145 D146	K104-P129 HydrophobicContact CB-CB 4.27Å; K104-P129 HydrophobicContact CG-CB 3.9Å; K104-P129 HydrophobicContact CG-CG 3.98Å; P129-D145 CarbonylContact O-C 3.56Å; P129-D145 VanDerWaalsContact O-CA 3.23Å; P129-D145 WeakPolarHBondContact O-CA 3.19Å; P129-D145 WeakPolarHBondContact O-CB 3.31Å; P129-D146 HydrophobicContact CB-CB 4.34Å; P129-D146 VanDerWaalsContact CB-OD2 3.29Å; P129-D146 WeakPolarHBondContact CB-OD2 3.32Å; P129-D146 PolarHBondContact O-N 3.36Å
130	I	98.6	Very high	96.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	130.6	178.2	-53.7	169.4	0	0	0	108.2	R88 V102 S103 I108 A125 H126 T143 G144	R88-I130 WeakPolarHBondContact CB-O 3.3Å; R88-I130 WeakPolarHBondContact CG-O 3.3Å; V102-I130 HydrophobicContact CB-CB 4.07Å; V102-I130 HydrophobicContact CB-CG2 3.64Å; V102-I130 HydrophobicContact CG1-CG2 4.01Å; V102-I130 HydrophobicContact CG2-CB 4.48Å; V102-I130 HydrophobicContact CG2-CG2 3.83Å; S103-I130 PolarHBondContact O-N 2.98Å; I108-I130 HydrophobicContact CG1-CD1 4.03Å; A125-I130 HydrophobicContact CB-CD1 4.01Å; H126-I130 HydrophobicContact CB-CD1 4.49Å; H126-I130 HydrophobicContact CB-CG1 3.98Å; I130-T143 HydrophobicContact CG2-CG2 4.41Å; I130-G144 WeakPolarHBondContact CG2-O 3.46Å
131	N	97.8	Very high	96.2	Very high	31 Å²	31	41 Å²	41	17%	0.166	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-42.4	-178.2	-167.3	59.7	0	0	0	112.6	R88 G144 I171	R88-N131 PolarHBondContact NH1-OD1 2.96Å; N131-G144 PolarHBondContact N-O 3.16Å; N131-I171 PolarHBondContact ND2-O 2.91Å
132	S	97.6	Very high	96.3	Very high	5 Å²	5	35.7 Å²	35.7	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	147.2	-173.3	-173.7	0	0	0	0	112.3	T143 G144 M174	S132-T143 WeakPolarHBondContact O-CA 3.16Å; S132-G144 PolarHBondContact N-O 2.99Å; S132-G144 VanDerWaalsContact N-O 3.12Å; S132-G144 PolarHBondContact O-N 2.91Å; S132-M174 WeakPolarHBondContact OG-CE 3.49Å
133	L	98.4	Very high	96.4	Very high	20 Å²	20	33.5 Å²	33.5	11%	0.105	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	133.2	-179.5	171.1	67.8	0	0	0	109.5	A89 A91 V100 V102 L135 L141 T143	A89-L133 HydrophobicContact CB-CB 3.91Å; A91-L133 HydrophobicContact CB-CD2 3.84Å; A91-L133 HydrophobicContact CB-CG 4.33Å; V100-L133 HydrophobicContact CB-CD2 4.04Å; V100-L133 HydrophobicContact CG1-CD1 3.93Å; V100-L133 HydrophobicContact CG1-CD2 3.83Å; V100-L133 VanDerWaalsContact O-CD2 3.29Å; V100-L133 WeakPolarHBondContact O-CD2 3.33Å; V102-L133 HydrophobicContact CG1-CB 4.06Å; V102-L133 HydrophobicContact CG1-CD1 3.95Å; V102-L133 HydrophobicContact CG1-CD2 4.22Å; V102-L133 HydrophobicContact CG1-CG 4.29Å; V102-L133 HydrophobicContact CG2-CB 3.81Å; L133-L135 HydrophobicContact CD1-CD2 4.39Å; L133-L141 HydrophobicContact CD1-CD1 4.13Å; L133-T143 HydrophobicContact CD1-CG2 3.99Å
134	L	98.2	Very high	96.5	Very high	23 Å²	23	30.3 Å²	30.3	12%	0.12	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	130.4	171.2	-179.1	146.3	0	0	0	110.5	V136 L141 A142 M174 L176 L183	L134-V136 HydrophobicContact CD2-CG2 3.79Å; L134-L141 CarbonylContact O-C 3.58Å; L134-L141 WeakPolarHBondContact O-CA 3.39Å; L134-A142 HydrophobicContact CB-CB 4.48Å; L134-A142 PolarHBondContact N-O 2.66Å; L134-A142 PolarHBondContact O-N 2.82Å; L134-M174 HydrophobicContact CB-CB 4.05Å; L134-M174 HydrophobicContact CB-CE 4.02Å; L134-M174 HydrophobicContact CD1-CB 3.95Å; L134-M174 VanDerWaalsContact CD1-O 3.27Å; L134-M174 WeakPolarHBondContact CD1-O 3.28Å; L134-L176 HydrophobicContact CD1-CB 4.13Å; L134-L176 HydrophobicContact CD2-CB 4.02Å; L134-L176 HydrophobicContact CD2-CD1 4.26Å; L134-L176 HydrophobicContact CD2-CD2 4.43Å; L134-L176 HydrophobicContact CD2-CG 4.47Å; L134-L183 HydrophobicContact CD1-CD1 4.38Å; L134-L183 HydrophobicContact CD2-CD1 4.15Å
135	L	97	Very high	96.7	Very high	32 Å²	32	21.8 Å²	21.8	17%	0.168	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.7	171.5	-55.5	-174.8	0	0	0	109.3	A91 F92 V100 L133 L141	A91-L135 HydrophobicContact CB-CD1 3.99Å; A91-L135 HydrophobicContact CB-CG 3.93Å; F92-L135 VanDerWaalsContact O-CD1 3.25Å; F92-L135 WeakPolarHBondContact O-CD1 3.28Å; V100-L135 HydrophobicContact CB-CD2 4.12Å; V100-L135 HydrophobicContact CG1-CD2 4.41Å; V100-L135 HydrophobicContact CG2-CD1 4.42Å; V100-L135 HydrophobicContact CG2-CD2 3.92Å; L133-L135 HydrophobicContact CD1-CD2 4.39Å; L135-L141 HydrophobicContact CD2-CB 3.65Å; L135-L141 HydrophobicContact CD2-CD2 4.37Å
136	V	94.9	Very high	96.7	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	14%	0.144	C	C	.	.			trans	-89.4	-48.7	-180	178	0	0	0	0	110.2	L134 V140 L152 L176 K180 V197	L134-V136 HydrophobicContact CD2-CG2 3.79Å; V136-V140 WeakPolarHBondContact CA-O 3.49Å; V136-V140 HydrophobicContact CB-CB 4.1Å; V136-V140 HydrophobicContact CB-CG1 3.98Å; V136-V140 WeakPolarHBondContact CB-O 3.46Å; V136-V140 HydrophobicContact CG1-CG1 4.39Å; V136-V140 HydrophobicContact CG2-CG1 4.11Å; V136-V140 PolarHBondContact N-O 2.97Å; V136-L152 HydrophobicContact CG2-CD2 4.36Å; V136-L176 HydrophobicContact CB-CD2 4.37Å; V136-L176 HydrophobicContact CG1-CD1 4.06Å; V136-L176 HydrophobicContact CG1-CD2 4.03Å; V136-L176 HydrophobicContact CG2-CD1 4.18Å; V136-K180 HydrophobicContact CG1-CB 4.49Å; V136-K180 VanDerWaalsContact O-CD 3.31Å; V136-K180 WeakPolarHBondContact O-CD 3.25Å; V136-K180 WeakPolarHBondContact O-CE 3.44Å; V136-K180 PolarHBondContact O-NZ 2.98Å; V136-V197 HydrophobicContact CG1-CG1 4.17Å
137	D	92	Very high	96.8	Very high	56 Å²	56	28.1 Å²	28.1	30%	0.299	17%	0.168	S	C	.	.	S	Bend	trans	-150.5	-176.5	174.2	63.2	53.7	0	0	0	109	N139 V140	D137-N139 PolarHBondContact O-N 2.86Å; D137-N139 WeakPolarHBondContact OD1-CA 3.3Å; D137-N139 PolarHBondContact OD1-N 3.44Å; D137-V140 PolarHBondContact N-O 2.93Å; D137-V140 VanDerWaalsContact N-O 3.13Å; D137-V140 PolarHBondContact O-N 2.84Å; D137-V140 PolarHBondContact OD1-N 2.83Å
138	E	90.3	Very high	96.8	Very high	116 Å²	116	25.1 Å²	25.1	54%	0.542	14%	0.137	S	C	.	.	S	Bend	trans	-54.8	-25.7	-179.6	-64.2	179.3	170.3	0	0	113.9
139	N	91.6	Very high	96.8	Very high	40 Å²	40	24.6 Å²	24.6	21%	0.214	13%	0.133	C	C	.	.	S	Bend	trans	-111.6	-29.3	-175.6	-58.8	-88.5	0	0	0	113	D137 D154 Q155 R156	D137-N139 PolarHBondContact O-N 2.86Å; D137-N139 WeakPolarHBondContact OD1-CA 3.3Å; D137-N139 PolarHBondContact OD1-N 3.44Å; N139-D154 CarbonylContact O-C 3.44Å; N139-D154 WeakPolarHBondContact O-CA 3.23Å; N139-Q155 WeakPolarHBondContact O-CG 3.38Å; N139-Q155 PolarHBondContact O-N 2.95Å; N139-R156 PolarHBondContact ND2-NH2 2.79Å; N139-R156 PolarHBondContact OD1-NE 3.11Å
140	V	95.3	Very high	96.8	Very high	15 Å²	15	23.4 Å²	23.4	9%	0.091	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	130.7	-172.3	-177.9	0	0	0	0	110.7	V136 D137 L152 W153 V197	V136-V140 WeakPolarHBondContact CA-O 3.49Å; V136-V140 HydrophobicContact CB-CB 4.1Å; V136-V140 HydrophobicContact CB-CG1 3.98Å; V136-V140 WeakPolarHBondContact CB-O 3.46Å; V136-V140 HydrophobicContact CG1-CG1 4.39Å; V136-V140 HydrophobicContact CG2-CG1 4.11Å; V136-V140 PolarHBondContact N-O 2.97Å; D137-V140 PolarHBondContact N-O 2.93Å; D137-V140 VanDerWaalsContact N-O 3.13Å; D137-V140 PolarHBondContact O-N 2.84Å; D137-V140 PolarHBondContact OD1-N 2.83Å; V140-L152 HydrophobicContact CG1-CD2 4.17Å; V140-W153 VanDerWaalsContact CA-O 3.25Å; V140-W153 WeakPolarHBondContact CA-O 3.42Å; V140-V197 HydrophobicContact CG1-CG1 4.5Å
141	L	97.2	Very high	96.7	Very high	7 Å²	7	25.2 Å²	25.2	4%	0.037	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	152.7	173.8	64.4	93.3	0	0	0	110.8	V100 I108 L133 L134 L135 T143 L152 W153	V100-L141 HydrophobicContact CG1-CD2 4.27Å; I108-L141 HydrophobicContact CD1-CD1 4.21Å; L133-L141 HydrophobicContact CD1-CD1 4.13Å; L134-L141 CarbonylContact O-C 3.58Å; L134-L141 WeakPolarHBondContact O-CA 3.39Å; L135-L141 HydrophobicContact CD2-CB 3.65Å; L135-L141 HydrophobicContact CD2-CD2 4.37Å; L141-T143 HydrophobicContact CD1-CG2 3.77Å; L141-L152 CarbonylContact O-C 3.56Å; L141-L152 WeakPolarHBondContact O-CA 3.35Å; L141-W153 HydrophobicContact CD1-CB 3.94Å; L141-W153 VanDerWaalsContact CD1-CD1 3.43Å; L141-W153 HydrophobicContact CD1-CG 3.91Å; L141-W153 HydrophobicContact CG-CB 3.98Å; L141-W153 HydrophobicContact CG-CG 4.49Å; L141-W153 PolarHBondContact N-O 3.29Å; L141-W153 VanDerWaalsContact N-O 3.16Å; L141-W153 PolarHBondContact O-N 3.08Å
142	A	98.3	Very high	96.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	143.1	174.5	0	0	0	0	0	109.9	L134 R151 L152 M174 L183	L134-A142 HydrophobicContact CB-CB 4.48Å; L134-A142 PolarHBondContact N-O 2.66Å; L134-A142 PolarHBondContact O-N 2.82Å; A142-R151 CarbonylContact C-O 3.58Å; A142-R151 WeakPolarHBondContact CA-O 3.46Å; A142-L152 HydrophobicContact CB-CD2 3.72Å; A142-M174 HydrophobicContact CB-CE 4.24Å; A142-M174 HydrophobicContact CB-SD 4.01Å; A142-L183 HydrophobicContact CB-CD1 4.11Å; A142-L183 HydrophobicContact CB-CD2 3.76Å
143	T	98.6	Very high	96.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	141	173.1	53	0	0	0	0	110.6	V102 I108 H126 I130 S132 L133 L141 I150 R151 W153	V102-T143 HydrophobicContact CG1-CG2 3.98Å; I108-T143 HydrophobicContact CD1-CG2 3.72Å; I108-T143 HydrophobicContact CG1-CG2 4.19Å; H126-T143 PolarHBondContact NE2-OG1 2.92Å; I130-T143 HydrophobicContact CG2-CG2 4.41Å; S132-T143 WeakPolarHBondContact O-CA 3.16Å; L133-T143 HydrophobicContact CD1-CG2 3.99Å; L141-T143 HydrophobicContact CD1-CG2 3.77Å; T143-I150 WeakPolarHBondContact O-CA 3.5Å; T143-R151 PolarHBondContact N-O 3.22Å; T143-R151 PolarHBondContact O-N 3.41Å; T143-W153 PolarHBondContact OG1-NE1 2.8Å
144	G	98.5	Very high	96.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.2	177.2	0	0	0	0	0	111.4	I130 N131 S132 G149	I130-G144 WeakPolarHBondContact CG2-O 3.46Å; N131-G144 PolarHBondContact N-O 3.16Å; S132-G144 PolarHBondContact N-O 2.99Å; S132-G144 VanDerWaalsContact N-O 3.12Å; S132-G144 PolarHBondContact O-N 2.91Å; G144-G149 WeakPolarHBondContact CA-O 3.25Å
145	D	98.3	Very high	96.1	Very high	7 Å²	7	25.6 Å²	25.6	4%	0.037	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	169.4	-179.2	71	39.3	0	0	0	114.3	H126 A128 P129 T147 G148 G149 I171	H126-D145 HydrophobicContact CB-CB 4.12Å; H126-D145 IonicContact CE1-OD2 3.67Å; H126-D145 IonicContact CG-OD2 3.81Å; H126-D145 WeakPolarHBondContact ND1-CB 3.28Å; H126-D145 IonicContact ND1-OD2 3.27Å; H126-D145 PolarHBondContact ND1-OD2 3.08Å; A128-D145 HydrophobicContact CB-CB 4.11Å; P129-D145 CarbonylContact O-C 3.56Å; P129-D145 VanDerWaalsContact O-CA 3.23Å; P129-D145 WeakPolarHBondContact O-CA 3.19Å; P129-D145 WeakPolarHBondContact O-CB 3.31Å; D145-T147 PolarHBondContact O-N 2.88Å; D145-T147 VanDerWaalsContact OD1-CA 3.32Å; D145-T147 WeakPolarHBondContact OD1-CA 3.24Å; D145-T147 PolarHBondContact OD1-N 3.43Å; D145-T147 PolarHBondContact OD1-OG1 2.72Å; D145-G148 PolarHBondContact O-N 2.81Å; D145-G148 PolarHBondContact OD1-N 3.19Å; D145-G149 PolarHBondContact N-O 3.09Å; D145-G149 WeakPolarHBondContact OD1-CA 3.35Å; D145-G149 PolarHBondContact OD1-N 2.62Å; D145-G149 WeakPolarHBondContact OD2-CA 3.46Å; D145-I171 PolarHBondContact O-N 3.08Å
146	D	97.9	Very high	95.9	Very high	53 Å²	53	32 Å²	32	28%	0.283	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-7.3	179.3	-78.5	4.4	0	0	0	113.8	R88 P129 Y170	R88-D146 IonicContact NH1-OD1 3.99Å; P129-D146 HydrophobicContact CB-CB 4.34Å; P129-D146 VanDerWaalsContact CB-OD2 3.29Å; P129-D146 WeakPolarHBondContact CB-OD2 3.32Å; P129-D146 PolarHBondContact O-N 3.36Å; D146-Y170 WeakPolarHBondContact O-CA 3.34Å; D146-Y170 PolarHBondContact O-N 2.74Å
147	T	98	Very high	95.7	Very high	85 Å²	85	37.3 Å²	37.3	52%	0.521	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115	13.8	-178.8	58	0	0	0	0	113.2	A128 D145 G149	A128-T147 HydrophobicContact CB-CG2 3.66Å; A128-T147 WeakPolarHBondContact CB-OG1 3.47Å; D145-T147 PolarHBondContact O-N 2.88Å; D145-T147 VanDerWaalsContact OD1-CA 3.32Å; D145-T147 WeakPolarHBondContact OD1-CA 3.24Å; D145-T147 PolarHBondContact OD1-N 3.43Å; D145-T147 PolarHBondContact OD1-OG1 2.72Å; T147-G149 VanDerWaalsContact C-N 3.28Å; T147-G149 PolarHBondContact O-N 2.95Å
148	G	97.1	Very high	95.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	81.5	6.7	179.5	0	0	0	0	0	114.2	D145 I150 E169	D145-G148 PolarHBondContact O-N 2.81Å; D145-G148 PolarHBondContact OD1-N 3.19Å; G148-I150 PolarHBondContact O-N 2.86Å; G148-E169 WeakPolarHBondContact CA-O 3.21Å; G148-E169 PolarHBondContact N-O 3.4Å
149	G	97.9	Very high	95.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.			trans	-74.3	123	177.2	0	0	0	0	0	111.2	H126 G144 D145 T147 M164	H126-G149 PolarHBondContact CE1-O 3.11Å; G144-G149 WeakPolarHBondContact CA-O 3.25Å; D145-G149 PolarHBondContact N-O 3.09Å; D145-G149 WeakPolarHBondContact OD1-CA 3.35Å; D145-G149 PolarHBondContact OD1-N 2.62Å; D145-G149 WeakPolarHBondContact OD2-CA 3.46Å; T147-G149 VanDerWaalsContact C-N 3.28Å; T147-G149 PolarHBondContact O-N 2.95Å; G149-M164 CarbonylContact C-O 3.55Å; G149-M164 WeakPolarHBondContact CA-O 3.26Å
150	I	98.4	Very high	95.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.2	176.1	-63.8	162.7	0	0	0	109	T143 G148 M162 M164 I171 L183 T185 F195	T143-I150 WeakPolarHBondContact O-CA 3.5Å; G148-I150 PolarHBondContact O-N 2.86Å; I150-M162 HydrophobicContact CG2-CE 4.08Å; I150-M164 HydrophobicContact CB-CB 4.43Å; I150-M164 PolarHBondContact N-O 2.76Å; I150-M164 PolarHBondContact O-N 3.39Å; I150-I171 HydrophobicContact CD1-CD1 3.9Å; I150-I171 HydrophobicContact CD1-CG1 4.43Å; I150-I171 HydrophobicContact CG1-CD1 3.87Å; I150-I171 HydrophobicContact CG1-CG1 3.88Å; I150-L183 HydrophobicContact CG2-CD2 4Å; I150-T185 HydrophobicContact CD1-CG2 3.46Å; I150-T185 VanDerWaalsContact CD1-CG2 3.46Å; I150-T185 HydrophobicContact CG1-CG2 4.27Å; I150-F195 HydrophobicContact CD1-CD2 3.9Å; I150-F195 HydrophobicContact CD1-CE1 4.24Å; I150-F195 HydrophobicContact CD1-CE2 3.22Å; I150-F195 HydrophobicContact CD1-CZ 3.42Å; I150-F195 VanDerWaalsContact CD1-CZ 3.42Å
151	R	98.3	Very high	95.9	Very high	39 Å²	39	42.7 Å²	42.7	15%	0.147	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.3	173.6	-67.4	179.7	172.4	-165.5	-7.5	111.8	A125 A142 T143 W153 P160 M162 D163	A125-R151 VanDerWaalsContact O-CD 3.3Å; A125-R151 WeakPolarHBondContact O-CD 3.47Å; A125-R151 PolarHBondContact O-NH1 2.78Å; A142-R151 CarbonylContact C-O 3.58Å; A142-R151 WeakPolarHBondContact CA-O 3.46Å; T143-R151 PolarHBondContact N-O 3.22Å; T143-R151 PolarHBondContact O-N 3.41Å; R151-W153 HydrophobicContact CB-CZ2 3.88Å; R151-W153 HydrophobicContact CG-CZ2 4.36Å; R151-P160 HydrophobicContact CB-CB 4.19Å; R151-P160 HydrophobicContact CG-CB 4.26Å; R151-M162 WeakPolarHBondContact CA-O 3.36Å; R151-M162 WeakPolarHBondContact CB-O 3.48Å; R151-D163 HydrophobicContact CG-CB 4.24Å; R151-D163 IonicContact CZ-OD2 3.91Å; R151-D163 IonicContact NE-OD1 3.01Å; R151-D163 IonicContact NE-OD2 3.95Å; R151-D163 PolarHBondContact NE-OD2 3.41Å; R151-D163 IonicContact NH2-OD2 2.65Å; R151-D163 PolarHBondContact NH2-OD2 3.14Å
152	L	97.6	Very high	95.7	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	141.6	166.9	-75.8	168.3	0	0	0	109.4	V136 V140 L141 A142 P160 L161 M162 V197	V136-L152 HydrophobicContact CG2-CD2 4.36Å; V140-L152 HydrophobicContact CG1-CD2 4.17Å; L141-L152 CarbonylContact O-C 3.56Å; L141-L152 WeakPolarHBondContact O-CA 3.35Å; A142-L152 HydrophobicContact CB-CD2 3.72Å; L152-P160 CarbonylContact O-C 3.3Å; L152-P160 VanDerWaalsContact O-CA 3.32Å; L152-P160 WeakPolarHBondContact O-CA 3.37Å; L152-L161 HydrophobicContact CB-CB 4.16Å; L152-L161 PolarHBondContact O-N 2.84Å; L152-M162 HydrophobicContact CB-CB 3.95Å; L152-M162 HydrophobicContact CD1-CB 4.14Å; L152-M162 HydrophobicContact CD1-CE 3.65Å; L152-M162 HydrophobicContact CD1-SD 3.87Å; L152-M162 HydrophobicContact CG-CB 4.34Å; L152-M162 HydrophobicContact CG-CE 3.84Å; L152-M162 PolarHBondContact N-O 3.42Å; L152-V197 HydrophobicContact CD1-CB 4.42Å; L152-V197 HydrophobicContact CD1-CG1 4.11Å; L152-V197 HydrophobicContact CD2-CG1 4.47Å
153	W	97.2	Very high	95.7	Very high	19 Å²	19	45.6 Å²	45.6	7%	0.072	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	149.2	-178	-53	85.9	0	0	0	110	I108 V122 A125 V140 L141 T143 R151 P160	I108-W153 HydrophobicContact CD1-CD2 4.09Å; I108-W153 HydrophobicContact CD1-CG 4.24Å; I108-W153 HydrophobicContact CD1-CZ2 4.17Å; V122-W153 HydrophobicContact CG1-CE3 4.46Å; V122-W153 HydrophobicContact CG1-CH2 4.36Å; V122-W153 HydrophobicContact CG1-CZ3 3.98Å; A125-W153 HydrophobicContact CB-CH2 3.86Å; A125-W153 HydrophobicContact CB-CZ2 3.72Å; A125-W153 VanDerWaalsContact O-CH2 3.25Å; A125-W153 WeakPolarHBondContact O-CH2 3.45Å; A125-W153 WeakPolarHBondContact O-CZ2 3.32Å; V140-W153 VanDerWaalsContact CA-O 3.25Å; V140-W153 WeakPolarHBondContact CA-O 3.42Å; L141-W153 HydrophobicContact CD1-CB 3.94Å; L141-W153 VanDerWaalsContact CD1-CD1 3.43Å; L141-W153 HydrophobicContact CD1-CG 3.91Å; L141-W153 HydrophobicContact CG-CB 3.98Å; L141-W153 HydrophobicContact CG-CG 4.49Å; L141-W153 PolarHBondContact N-O 3.29Å; L141-W153 VanDerWaalsContact N-O 3.16Å; L141-W153 PolarHBondContact O-N 3.08Å; T143-W153 PolarHBondContact OG1-NE1 2.8Å; R151-W153 HydrophobicContact CB-CZ2 3.88Å; R151-W153 HydrophobicContact CG-CZ2 4.36Å; W153-P160 HydrophobicContact CD2-CB 4.43Å; W153-P160 HydrophobicContact CE3-CB 4.22Å; W153-P160 HydrophobicContact CH2-CB 4.07Å; W153-P160 HydrophobicContact CH2-CG 4.34Å; W153-P160 HydrophobicContact CZ2-CB 4.29Å; W153-P160 HydrophobicContact CZ3-CB 4.05Å; W153-P160 HydrophobicContact CZ3-CG 4.4Å
154	D	94.9	Very high	95.6	Very high	16 Å²	16	47 Å²	47	9%	0.086	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.4	169.6	-173.8	-18.7	0	0	0	107.3	N139 R156 K157 L161	N139-D154 CarbonylContact O-C 3.44Å; N139-D154 WeakPolarHBondContact O-CA 3.23Å; D154-R156 PolarHBondContact O-N 3.23Å; D154-R156 WeakPolarHBondContact OD1-CB 3.33Å; D154-R156 IonicContact OD1-CZ 2.77Å; D154-R156 PolarHBondContact OD1-N 3.33Å; D154-R156 IonicContact OD1-NE 3.89Å; D154-R156 PolarHBondContact OD1-NE 3.05Å; D154-R156 VanDerWaalsContact OD1-NE 3.08Å; D154-R156 IonicContact OD1-NH2 3.28Å; D154-R156 IonicContact OD2-NE 2.8Å; D154-K157 HydrophobicContact CB-CB 4.34Å; D154-K157 HydrophobicContact CB-CD 4.41Å; D154-K157 HydrophobicContact CB-CG 4.32Å; D154-K157 PolarHBondContact O-N 2.94Å; D154-K157 VanDerWaalsContact O-O 3.06Å; D154-L161 HydrophobicContact CB-CD1 3.85Å; D154-L161 HydrophobicContact CB-CD2 4Å; D154-L161 HydrophobicContact CB-CG 3.95Å
155	Q	89.9	Confident	95.6	Very high	51 Å²	51	55.1 Å²	55.1	24%	0.238	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-12.9	179	-65.6	-174.2	10.1	0	0	113	R120 N139	R120-Q155 VanDerWaalsContact CZ-O 3.27Å; R120-Q155 PolarHBondContact NH1-O 3.03Å; R120-Q155 PolarHBondContact NH2-O 2.75Å; N139-Q155 WeakPolarHBondContact O-CG 3.38Å; N139-Q155 PolarHBondContact O-N 2.95Å
156	R	91.3	Very high	95.6	Very high	165 Å²	165	58 Å²	58	62%	0.623	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-5.8	177.1	-62.5	169.4	-75.3	-159	-10	113.5	N139 D154	N139-R156 PolarHBondContact ND2-NH2 2.79Å; N139-R156 PolarHBondContact OD1-NE 3.11Å; D154-R156 PolarHBondContact O-N 3.23Å; D154-R156 WeakPolarHBondContact OD1-CB 3.33Å; D154-R156 IonicContact OD1-CZ 2.77Å; D154-R156 PolarHBondContact OD1-N 3.33Å; D154-R156 IonicContact OD1-NE 3.89Å; D154-R156 PolarHBondContact OD1-NE 3.05Å; D154-R156 VanDerWaalsContact OD1-NE 3.08Å; D154-R156 IonicContact OD1-NH2 3.28Å; D154-R156 IonicContact OD2-NE 2.8Å
157	K	92.2	Very high	95.6	Very high	113 Å²	113	55.6 Å²	55.6	49%	0.491	27%	0.266	S	S	.	.	S	Bend	trans	-128.8	152.4	-174.3	-59.3	-176.8	-169.6	173.3	0	111.4	D154 L161	D154-K157 HydrophobicContact CB-CB 4.34Å; D154-K157 HydrophobicContact CB-CD 4.41Å; D154-K157 HydrophobicContact CB-CG 4.32Å; D154-K157 PolarHBondContact O-N 2.94Å; D154-K157 VanDerWaalsContact O-O 3.06Å; K157-L161 HydrophobicContact CD-CD2 3.88Å
158	E	89.9	Confident	95.6	Very high	206 Å²	206	59.7 Å²	59.7	96%	0.963	28%	0.279	S	S	*	.	S	Bend	trans	-85.5	133.2	169.4	-66.2	-169	169	0	0	110.3
159	G	91.6	Very high	95.6	Very high	36 Å²	36	64 Å²	64	37%	0.371	30%	0.299	S	S	.	.	S	Bend	trans	84.7	171.2	178.6	0	0	0	0	0	114.8
160	P	95.3	Very high	95.6	Very high	55 Å²	55	67.2 Å²	67.2	36%	0.357	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	138.9	-178.3	30.2	-33.8	0	0	0	111.5	R151 L152 W153	R151-P160 HydrophobicContact CB-CB 4.19Å; R151-P160 HydrophobicContact CG-CB 4.26Å; L152-P160 CarbonylContact O-C 3.3Å; L152-P160 VanDerWaalsContact O-CA 3.32Å; L152-P160 WeakPolarHBondContact O-CA 3.37Å; W153-P160 HydrophobicContact CD2-CB 4.43Å; W153-P160 HydrophobicContact CE3-CB 4.22Å; W153-P160 HydrophobicContact CH2-CB 4.07Å; W153-P160 HydrophobicContact CH2-CG 4.34Å; W153-P160 HydrophobicContact CZ2-CB 4.29Å; W153-P160 HydrophobicContact CZ3-CB 4.05Å; W153-P160 HydrophobicContact CZ3-CG 4.4Å
161	L	94.9	Very high	95.6	Very high	43 Å²	43	67.2 Å²	67.2	23%	0.225	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	-27.5	167.9	-67.2	-177.6	0	0	0	112.6	L152 D154 K157	L152-L161 HydrophobicContact CB-CB 4.16Å; L152-L161 PolarHBondContact O-N 2.84Å; D154-L161 HydrophobicContact CB-CD1 3.85Å; D154-L161 HydrophobicContact CB-CD2 4Å; D154-L161 HydrophobicContact CB-CG 3.95Å; K157-L161 HydrophobicContact CD-CD2 3.88Å
162	M	94.6	Very high	95.6	Very high	9 Å²	9	66.2 Å²	66.2	4%	0.044	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	139.5	-173.3	-171.2	179.9	78.9	0	0	108.8	I150 R151 L152 M164 F195 R200	I150-M162 HydrophobicContact CG2-CE 4.08Å; R151-M162 WeakPolarHBondContact CA-O 3.36Å; R151-M162 WeakPolarHBondContact CB-O 3.48Å; L152-M162 HydrophobicContact CB-CB 3.95Å; L152-M162 HydrophobicContact CD1-CB 4.14Å; L152-M162 HydrophobicContact CD1-CE 3.65Å; L152-M162 HydrophobicContact CD1-SD 3.87Å; L152-M162 HydrophobicContact CG-CB 4.34Å; L152-M162 HydrophobicContact CG-CE 3.84Å; L152-M162 PolarHBondContact N-O 3.42Å; M162-M164 HydrophobicContact CE-CB 4.41Å; M162-M164 HydrophobicContact CE-CG 3.77Å; M162-M164 HydrophobicContact CG-CE 3.52Å; M162-M164 HydrophobicContact CG-CG 3.59Å; M162-M164 HydrophobicContact CG-SD 4.47Å; M162-M164 HydrophobicContact SD-CE 3.81Å; M162-M164 HydrophobicContact SD-CG 3.71Å; M162-F195 HydrophobicContact CE-CB 4.32Å; M162-F195 HydrophobicContact CE-CD1 4.21Å; M162-F195 HydrophobicContact CE-CG 4.48Å; M162-R200 HydrophobicContact CB-CB 4.17Å; M162-R200 HydrophobicContact CG-CB 4.2Å; M162-R200 VanDerWaalsContact SD-C 3.56Å; M162-R200 HydrophobicContact SD-CB 4.22Å
163	D	96.9	Very high	95.7	Very high	59 Å²	59	68 Å²	68	32%	0.316	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	113.5	169.8	-176.2	-4	0	0	0	107.1	R151 R165	R151-D163 HydrophobicContact CG-CB 4.24Å; R151-D163 IonicContact CZ-OD2 3.91Å; R151-D163 IonicContact NE-OD1 3.01Å; R151-D163 IonicContact NE-OD2 3.95Å; R151-D163 PolarHBondContact NE-OD2 3.41Å; R151-D163 IonicContact NH2-OD2 2.65Å; R151-D163 PolarHBondContact NH2-OD2 3.14Å; D163-R165 IonicContact OD1-CZ 3.85Å; D163-R165 IonicContact OD1-NE 3.72Å; D163-R165 PolarHBondContact OD1-NE 2.98Å; D163-R165 IonicContact OD1-NH2 3Å; D163-R165 IonicContact OD2-CZ 3.51Å; D163-R165 IonicContact OD2-NE 3.6Å; D163-R165 IonicContact OD2-NH2 3.3Å; D163-R165 PolarHBondContact OD2-NH2 3.1Å
164	M	97.5	Very high	95.7	Very high	31 Å²	31	67.6 Å²	67.6	15%	0.153	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.5	-173.1	-70.9	-67.7	164.7	0	0	109.2	G149 I150 M162 Q166 F195 R200 F202	G149-M164 CarbonylContact C-O 3.55Å; G149-M164 WeakPolarHBondContact CA-O 3.26Å; I150-M164 HydrophobicContact CB-CB 4.43Å; I150-M164 PolarHBondContact N-O 2.76Å; I150-M164 PolarHBondContact O-N 3.39Å; M162-M164 HydrophobicContact CE-CB 4.41Å; M162-M164 HydrophobicContact CE-CG 3.77Å; M162-M164 HydrophobicContact CG-CE 3.52Å; M162-M164 HydrophobicContact CG-CG 3.59Å; M162-M164 HydrophobicContact CG-SD 4.47Å; M162-M164 HydrophobicContact SD-CE 3.81Å; M162-M164 HydrophobicContact SD-CG 3.71Å; M164-Q166 VanDerWaalsContact CB-OE1 3.31Å; M164-F195 HydrophobicContact CB-CD1 4.09Å; M164-F195 HydrophobicContact CB-CE1 3.62Å; M164-F195 HydrophobicContact CG-CD1 3.95Å; M164-F195 HydrophobicContact CG-CE1 3.93Å; M164-R200 VanDerWaalsContact CE-O 3.25Å; M164-R200 WeakPolarHBondContact CE-O 3.2Å; M164-F202 HydrophobicContact SD-CB 4.06Å
165	R	97.4	Very high	95.9	Very high	169 Å²	169	67.3 Å²	67.3	64%	0.638	32%	0.32	S	S	*	.			trans	-142.6	40.9	-171.6	-55.5	-172.2	-167.9	177.1	4.9	111.8	D163	D163-R165 IonicContact OD1-CZ 3.85Å; D163-R165 IonicContact OD1-NE 3.72Å; D163-R165 PolarHBondContact OD1-NE 2.98Å; D163-R165 IonicContact OD1-NH2 3Å; D163-R165 IonicContact OD2-CZ 3.51Å; D163-R165 IonicContact OD2-NE 3.6Å; D163-R165 IonicContact OD2-NH2 3.3Å; D163-R165 PolarHBondContact OD2-NH2 3.1Å
166	Q	98	Very high	96.2	Very high	68 Å²	68	66.6 Å²	66.6	32%	0.318	32%	0.318	S	S	.	.			trans	-79.1	-29.8	178.3	-72.3	79.4	6.5	0	0	111.7	M164 F202 L205	M164-Q166 VanDerWaalsContact CB-OE1 3.31Å; Q166-F202 HydrophobicContact CB-CD2 3.98Å; Q166-F202 HydrophobicContact CB-CE2 3.79Å; Q166-F202 HydrophobicContact CB-CZ 4.23Å; Q166-F202 HydrophobicContact CG-CB 4.38Å; Q166-F202 HydrophobicContact CG-CD1 4.01Å; Q166-F202 HydrophobicContact CG-CD2 3.68Å; Q166-F202 HydrophobicContact CG-CE1 4.14Å; Q166-F202 HydrophobicContact CG-CE2 3.81Å; Q166-F202 HydrophobicContact CG-CG 3.76Å; Q166-F202 HydrophobicContact CG-CZ 4.02Å; Q166-L205 HydrophobicContact CB-CD1 4.34Å
167	H	98.1	Very high	96.2	Very high	3 Å²	3	59.6 Å²	59.6	1%	0.014	29%	0.293	C	S	.	.			trans	-71.1	146.1	169.9	-76.1	-66.9	0	0	0	110.7	I171 T185 S187 D189 C191 G193 L205	H167-I171 HydrophobicContact CB-CD1 3.87Å; H167-I171 VanDerWaalsContact CD2-CD1 3.47Å; H167-I171 WeakPolarHBondContact CD2-CD1 3.29Å; H167-T185 PolarHBondContact NE2-OG1 2.81Å; H167-S187 VanDerWaalsContact CE1-CB 3.49Å; H167-S187 WeakPolarHBondContact CE1-CB 3.25Å; H167-S187 WeakPolarHBondContact ND1-CB 3.28Å; H167-S187 PolarHBondContact ND1-OG 2.88Å; H167-D189 VanDerWaalsContact CA-OD2 3.25Å; H167-D189 WeakPolarHBondContact CA-OD2 3.44Å; H167-D189 VanDerWaalsContact CB-OD2 3.31Å; H167-D189 WeakPolarHBondContact CB-OD2 3.28Å; H167-D189 IonicContact CE1-OD1 2.74Å; H167-D189 IonicContact CE1-OD2 3.72Å; H167-D189 IonicContact CG-OD2 3.33Å; H167-D189 IonicContact ND1-OD1 2.73Å; H167-D189 PolarHBondContact ND1-OD1 2.68Å; H167-D189 IonicContact ND1-OD2 3.42Å; H167-D189 PolarHBondContact ND1-OD2 3.46Å; H167-C191 PolarHBondContact CE1-O 3.41Å; H167-G193 WeakPolarHBondContact NE2-CA 2.92Å; H167-L205 VanDerWaalsContact CE1-CD2 3.42Å; H167-L205 WeakPolarHBondContact CE1-CD2 3.48Å
168	E	97.6	Very high	96.1	Very high	171 Å²	171	59 Å²	59	80%	0.799	30%	0.301	S	S	*	.	S	Bend	trans	-102.7	-15.9	-175.5	-61	-171.5	153.2	0	0	112.7	D189	E168-D189 HydrophobicContact CB-CB 4.49Å; E168-D189 PolarHBondContact N-OD2 2.99Å
169	E	98.3	Very high	96.2	Very high	89 Å²	89	52.8 Å²	52.8	42%	0.416	28%	0.284	S	S	.	.	S	Bend	trans	-131.9	-178.6	-179.7	-59.6	-164.4	-179.5	0	0	112	G148 S187 G188 D189	G148-E169 WeakPolarHBondContact CA-O 3.21Å; G148-E169 PolarHBondContact N-O 3.4Å; E169-S187 PolarHBondContact O-OG 2.95Å; E169-G188 VanDerWaalsContact OE2-C 3.25Å; E169-D189 HydrophobicContact CB-CB 4.26Å; E169-D189 HydrophobicContact CG-CB 4.21Å
170	Y	98.1	Very high	96.3	Very high	68 Å²	68	54.8 Å²	54.8	27%	0.267	28%	0.283	S	S	.	.			trans	-55.4	139.7	-173.3	65.7	-82.7	0	0	0	113.1	D146 A172 S187 G188 D212	D146-Y170 WeakPolarHBondContact O-CA 3.34Å; D146-Y170 PolarHBondContact O-N 2.74Å; Y170-A172 HydrophobicContact CD2-CB 4.05Å; Y170-A172 HydrophobicContact CE2-CB 3.74Å; Y170-A172 PolarHBondContact O-N 3.08Å; Y170-S187 VanDerWaalsContact O-CA 3.25Å; Y170-S187 WeakPolarHBondContact O-CA 3.39Å; Y170-S187 PolarHBondContact O-OG 3.31Å; Y170-G188 VanDerWaalsContact CE1-CA 3.45Å; Y170-G188 PolarHBondContact O-N 2.97Å; Y170-D212 WeakPolarHBondContact OH-CB 3.3Å; Y170-D212 PolarHBondContact OH-OD2 3.42Å
171	I	98.7	Very high	96.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	108.6	169.2	-53.7	-57.2	0	0	0	108.3	N131 D145 I150 H167 M174	N131-I171 PolarHBondContact ND2-O 2.91Å; D145-I171 PolarHBondContact O-N 3.08Å; I150-I171 HydrophobicContact CD1-CD1 3.9Å; I150-I171 HydrophobicContact CD1-CG1 4.43Å; I150-I171 HydrophobicContact CG1-CD1 3.87Å; I150-I171 HydrophobicContact CG1-CG1 3.88Å; H167-I171 HydrophobicContact CB-CD1 3.87Å; H167-I171 VanDerWaalsContact CD2-CD1 3.47Å; H167-I171 WeakPolarHBondContact CD2-CD1 3.29Å; I171-M174 HydrophobicContact CG2-CG 3.97Å; I171-M174 HydrophobicContact CG2-SD 4.46Å
172	A	98.3	Very high	96.3	Very high	18 Å²	18	56 Å²	56	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	-51.9	-177.9	0	0	0	0	0	111	Y170 A186 L213 T214	Y170-A172 HydrophobicContact CD2-CB 4.05Å; Y170-A172 HydrophobicContact CE2-CB 3.74Å; Y170-A172 PolarHBondContact O-N 3.08Å; A172-A186 PolarHBondContact N-O 2.94Å; A172-L213 WeakPolarHBondContact CB-O 3.39Å; A172-T214 WeakPolarHBondContact CB-O 3.29Å
173	D	98.4	Very high	96.5	Very high	40 Å²	40	55.6 Å²	55.6	21%	0.214	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	163.4	-173.5	-170.9	20.9	0	0	0	111.5	A186 V216	D173-A186 PolarHBondContact O-N 2.82Å; D173-V216 HydrophobicContact CB-CG1 4.15Å; D173-V216 PolarHBondContact OD2-N 3.23Å
174	M	98.6	Very high	96.5	Very high	10 Å²	10	52.8 Å²	52.8	5%	0.049	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	145	-179.4	-62	-172.8	-80.6	0	0	111.8	S132 L134 A142 I171 L183 L184 T185	S132-M174 WeakPolarHBondContact OG-CE 3.49Å; L134-M174 HydrophobicContact CB-CB 4.05Å; L134-M174 HydrophobicContact CB-CE 4.02Å; L134-M174 HydrophobicContact CD1-CB 3.95Å; L134-M174 VanDerWaalsContact CD1-O 3.27Å; L134-M174 WeakPolarHBondContact CD1-O 3.28Å; A142-M174 HydrophobicContact CB-CE 4.24Å; A142-M174 HydrophobicContact CB-SD 4.01Å; I171-M174 HydrophobicContact CG2-CG 3.97Å; I171-M174 HydrophobicContact CG2-SD 4.46Å; M174-L183 HydrophobicContact CB-CD1 4.11Å; M174-L183 HydrophobicContact SD-CD1 4.17Å; M174-L183 HydrophobicContact SD-CD2 4.27Å; M174-L184 CarbonylContact C-O 3.52Å; M174-L184 VanDerWaalsContact CA-O 3.24Å; M174-L184 WeakPolarHBondContact CA-O 3.46Å; M174-T185 HydrophobicContact CG-CG2 3.77Å; M174-T185 HydrophobicContact SD-CG2 4.08Å
175	A	98	Very high	96.6	Very high	10 Å²	10	51.3 Å²	51.3	8%	0.083	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	153.3	172.9	0	0	0	0	0	111.4	L184 V216	A175-L184 HydrophobicContact CB-CB 4.34Å; A175-L184 PolarHBondContact N-O 3.05Å; A175-L184 WeakPolarHBondContact O-CD1 3.36Å; A175-L184 PolarHBondContact O-N 3.3Å; A175-V216 HydrophobicContact CB-CG1 4.05Å; A175-V216 HydrophobicContact CB-CG2 4.14Å
176	L	96.6	Very high	96.7	Very high	36 Å²	36	43.2 Å²	43.2	19%	0.188	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136	-179.1	-168.8	71	0	0	0	111.5	L134 V136 K180 V197 L218	L134-L176 HydrophobicContact CD1-CB 4.13Å; L134-L176 HydrophobicContact CD2-CB 4.02Å; L134-L176 HydrophobicContact CD2-CD1 4.26Å; L134-L176 HydrophobicContact CD2-CD2 4.43Å; L134-L176 HydrophobicContact CD2-CG 4.47Å; V136-L176 HydrophobicContact CB-CD2 4.37Å; V136-L176 HydrophobicContact CG1-CD1 4.06Å; V136-L176 HydrophobicContact CG1-CD2 4.03Å; V136-L176 HydrophobicContact CG2-CD1 4.18Å; L176-K180 HydrophobicContact CD2-CB 4.27Å; L176-K180 HydrophobicContact CD2-CD 4.44Å; L176-K180 HydrophobicContact CD2-CG 3.89Å; L176-V197 HydrophobicContact CD1-CG2 4.43Å; L176-L218 WeakPolarHBondContact O-CD1 3.34Å
177	D	91.3	Very high	96.7	Very high	17 Å²	17	40 Å²	40	9%	0.091	21%	0.211	C	C	.	.			trans	-53.6	135.1	166	179.5	0.6	0	0	0	111.2	A179 K180 L182 W239	D177-A179 PolarHBondContact O-N 2.75Å; D177-A179 VanDerWaalsContact O-N 3.08Å; D177-A179 PolarHBondContact OD1-N 3.28Å; D177-K180 VanDerWaalsContact O-CA 3.32Å; D177-K180 WeakPolarHBondContact O-CA 3.46Å; D177-K180 PolarHBondContact O-N 2.8Å; D177-L182 HydrophobicContact CB-CB 4.09Å; D177-L182 WeakPolarHBondContact CB-O 3.42Å; D177-L182 PolarHBondContact N-O 2.83Å; D177-W239 HydrophobicContact CB-CH2 3.7Å; D177-W239 HydrophobicContact CB-CZ2 3.99Å; D177-W239 VanDerWaalsContact CG-CZ2 3.45Å; D177-W239 WeakPolarHBondContact OD1-CZ2 3.41Å
178	P	89.9	Confident	96.7	Very high	102 Å²	102	40 Å²	40	66%	0.662	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-29.3	171	-27.9	35.5	0	0	0	113.8	K180 L218	P178-K180 PolarHBondContact O-N 3.13Å; P178-L218 HydrophobicContact CG-CD1 4.36Å
179	A	91.4	Very high	96.7	Very high	75 Å²	75	33.1 Å²	33.1	62%	0.62	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	4.5	174	0	0	0	0	0	114.1	D177 K181	D177-A179 PolarHBondContact O-N 2.75Å; D177-A179 VanDerWaalsContact O-N 3.08Å; D177-A179 PolarHBondContact OD1-N 3.28Å; A179-K181 PolarHBondContact O-N 3.03Å; A179-K181 VanDerWaalsContact O-N 3.1Å
180	K	93.4	Very high	96.7	Very high	77 Å²	77	29 Å²	29	34%	0.335	16%	0.162	S	C	.	.	S	Bend	trans	53.3	26.8	-178.1	-54.2	-169.2	169.9	-154.9	0	113.9	E94 V136 L176 D177 P178	E94-K180 IonicContact OE1-NZ 3.65Å; E94-K180 PolarHBondContact OE1-NZ 2.85Å; E94-K180 IonicContact OE2-NZ 3.42Å; E94-K180 PolarHBondContact OE2-NZ 2.84Å; V136-K180 HydrophobicContact CG1-CB 4.49Å; V136-K180 VanDerWaalsContact O-CD 3.31Å; V136-K180 WeakPolarHBondContact O-CD 3.25Å; V136-K180 WeakPolarHBondContact O-CE 3.44Å; V136-K180 PolarHBondContact O-NZ 2.98Å; L176-K180 HydrophobicContact CD2-CB 4.27Å; L176-K180 HydrophobicContact CD2-CD 4.44Å; L176-K180 HydrophobicContact CD2-CG 3.89Å; D177-K180 VanDerWaalsContact O-CA 3.32Å; D177-K180 WeakPolarHBondContact O-CA 3.46Å; D177-K180 PolarHBondContact O-N 2.8Å; P178-K180 PolarHBondContact O-N 3.13Å
181	K	94.1	Very high	96.7	Very high	111 Å²	111	26.3 Å²	26.3	48%	0.483	15%	0.153	S	C	.	.			trans	-96.8	-44.3	-175.7	-179.3	-172.7	170.5	-166.5	0	112.5	A179 V197	A179-K181 PolarHBondContact O-N 3.03Å; A179-K181 VanDerWaalsContact O-N 3.1Å; K181-V197 PolarHBondContact O-N 2.93Å
182	L	96.9	Very high	96.7	Very high	13 Å²	13	26.3 Å²	26.3	7%	0.068	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.3	-177.3	-57.5	179.6	0	0	0	110.3	D177 I194 F195 N196 W239 F242	D177-L182 HydrophobicContact CB-CB 4.09Å; D177-L182 WeakPolarHBondContact CB-O 3.42Å; D177-L182 PolarHBondContact N-O 2.83Å; L182-I194 HydrophobicContact CB-CG2 4.47Å; L182-I194 HydrophobicContact CD1-CG2 4.21Å; L182-I194 HydrophobicContact CD2-CG2 4.2Å; L182-F195 CarbonylContact C-O 3.57Å; L182-F195 WeakPolarHBondContact CA-O 3.42Å; L182-N196 HydrophobicContact CD2-CB 4.41Å; L182-W239 HydrophobicContact CD1-CZ2 4.4Å; L182-F242 HydrophobicContact CD1-CE2 3.91Å; L182-F242 HydrophobicContact CD1-CZ 4.31Å
183	L	98.1	Very high	96.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	128.3	164.8	175.3	70.8	0	0	0	107.2	L134 A142 I150 M174 T185 F195 V197	L134-L183 HydrophobicContact CD1-CD1 4.38Å; L134-L183 HydrophobicContact CD2-CD1 4.15Å; A142-L183 HydrophobicContact CB-CD1 4.11Å; A142-L183 HydrophobicContact CB-CD2 3.76Å; I150-L183 HydrophobicContact CG2-CD2 4Å; M174-L183 HydrophobicContact CB-CD1 4.11Å; M174-L183 HydrophobicContact SD-CD1 4.17Å; M174-L183 HydrophobicContact SD-CD2 4.27Å; L183-T185 HydrophobicContact CD2-CG2 4.29Å; L183-T185 HydrophobicContact CG-CG2 4.15Å; L183-F195 HydrophobicContact CB-CB 4.26Å; L183-F195 PolarHBondContact N-O 2.78Å; L183-F195 PolarHBondContact O-N 3.2Å; L183-V197 HydrophobicContact CB-CG2 3.87Å
184	L	98.5	Very high	96.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.9	175.5	-61.2	89.8	0	0	0	108.2	M174 A175 L192 G193 I194 V216 L218 V225 W239 F242	M174-L184 CarbonylContact C-O 3.52Å; M174-L184 VanDerWaalsContact CA-O 3.24Å; M174-L184 WeakPolarHBondContact CA-O 3.46Å; A175-L184 HydrophobicContact CB-CB 4.34Å; A175-L184 PolarHBondContact N-O 3.05Å; A175-L184 WeakPolarHBondContact O-CD1 3.36Å; A175-L184 PolarHBondContact O-N 3.3Å; L184-L192 HydrophobicContact CB-CD1 4.2Å; L184-L192 HydrophobicContact CD2-CD1 4.42Å; L184-G193 CarbonylContact C-O 3.58Å; L184-G193 WeakPolarHBondContact CA-O 3.12Å; L184-I194 HydrophobicContact CB-CD1 4.46Å; L184-I194 HydrophobicContact CD2-CD1 3.99Å; L184-I194 HydrophobicContact CG-CD1 3.89Å; L184-V216 HydrophobicContact CB-CG2 4.42Å; L184-L218 HydrophobicContact CD1-CD2 4.41Å; L184-L218 HydrophobicContact CD2-CD2 4.08Å; L184-V225 HydrophobicContact CD2-CB 4.35Å; L184-V225 HydrophobicContact CD2-CG1 3.86Å; L184-V225 HydrophobicContact CD2-CG2 3.52Å; L184-W239 HydrophobicContact CD1-CH2 4.18Å; L184-W239 HydrophobicContact CD1-CZ3 4.13Å; L184-W239 HydrophobicContact CD2-CZ3 4.16Å; L184-F242 HydrophobicContact CD2-CD1 4.49Å; L184-F242 HydrophobicContact CD2-CE1 4Å
185	T	98.6	Very high	96.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	132.9	-178.5	54.4	0	0	0	0	110.7	I150 H167 M174 L183 L192 G193 F195	I150-T185 HydrophobicContact CD1-CG2 3.46Å; I150-T185 VanDerWaalsContact CD1-CG2 3.46Å; I150-T185 HydrophobicContact CG1-CG2 4.27Å; H167-T185 PolarHBondContact NE2-OG1 2.81Å; M174-T185 HydrophobicContact CG-CG2 3.77Å; M174-T185 HydrophobicContact SD-CG2 4.08Å; L183-T185 HydrophobicContact CD2-CG2 4.29Å; L183-T185 HydrophobicContact CG-CG2 4.15Å; T185-L192 WeakPolarHBondContact O-CA 3.48Å; T185-G193 PolarHBondContact N-O 2.93Å; T185-G193 PolarHBondContact O-N 3.16Å; T185-G193 WeakPolarHBondContact OG1-CA 3.26Å; T185-G193 PolarHBondContact OG1-O 3.36Å; T185-F195 HydrophobicContact CG2-CD2 4.18Å; T185-F195 HydrophobicContact CG2-CE2 4.21Å; T185-F195 WeakPolarHBondContact OG1-CE2 3.45Å
186	A	98.6	Very high	96.6	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	137.3	168.4	0	0	0	0	0	109.3	A172 D173 L213 V216	A172-A186 PolarHBondContact N-O 2.94Å; D173-A186 PolarHBondContact O-N 2.82Å; A186-L213 HydrophobicContact CB-CB 3.78Å; A186-V216 HydrophobicContact CB-CB 3.92Å; A186-V216 HydrophobicContact CB-CG1 3.95Å
187	S	98.6	Very high	96.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	154.2	-173.5	176.3	0	0	0	0	111.9	H167 E169 Y170 D189 G190 L213	H167-S187 VanDerWaalsContact CE1-CB 3.49Å; H167-S187 WeakPolarHBondContact CE1-CB 3.25Å; H167-S187 WeakPolarHBondContact ND1-CB 3.28Å; H167-S187 PolarHBondContact ND1-OG 2.88Å; E169-S187 PolarHBondContact O-OG 2.95Å; Y170-S187 VanDerWaalsContact O-CA 3.25Å; Y170-S187 WeakPolarHBondContact O-CA 3.39Å; Y170-S187 PolarHBondContact O-OG 3.31Å; S187-D189 VanDerWaalsContact CB-OD1 3.24Å; S187-D189 WeakPolarHBondContact CB-OD1 3.21Å; S187-D189 PolarHBondContact O-N 2.86Å; S187-D189 PolarHBondContact OG-N 2.93Å; S187-D189 PolarHBondContact OG-OD1 2.8Å; S187-D189 PolarHBondContact OG-OD2 2.95Å; S187-G190 PolarHBondContact O-N 3.01Å; S187-L213 CarbonylContact C-O 3.54Å; S187-L213 PolarHBondContact N-O 3.26Å; S187-L213 PolarHBondContact O-N 3.05Å
188	G	98.3	Very high	96.6	Very high	4 Å²	4	29.6 Å²	29.6	4%	0.041	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-27.4	170.8	0	0	0	0	0	113.9	E169 Y170 G190 D212	E169-G188 VanDerWaalsContact OE2-C 3.25Å; Y170-G188 VanDerWaalsContact CE1-CA 3.45Å; Y170-G188 PolarHBondContact O-N 2.97Å; G188-G190 PolarHBondContact O-N 3.07Å; G188-D212 WeakPolarHBondContact O-CA 3.38Å
189	D	97.7	Very high	96.8	Very high	26 Å²	26	32.5 Å²	32.5	14%	0.139	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	6	178	63.4	28.2	0	0	0	114.4	H167 E168 E169 S187 C191	H167-D189 VanDerWaalsContact CA-OD2 3.25Å; H167-D189 WeakPolarHBondContact CA-OD2 3.44Å; H167-D189 VanDerWaalsContact CB-OD2 3.31Å; H167-D189 WeakPolarHBondContact CB-OD2 3.28Å; H167-D189 IonicContact CE1-OD1 2.74Å; H167-D189 IonicContact CE1-OD2 3.72Å; H167-D189 IonicContact CG-OD2 3.33Å; H167-D189 IonicContact ND1-OD1 2.73Å; H167-D189 PolarHBondContact ND1-OD1 2.68Å; H167-D189 IonicContact ND1-OD2 3.42Å; H167-D189 PolarHBondContact ND1-OD2 3.46Å; E168-D189 HydrophobicContact CB-CB 4.49Å; E168-D189 PolarHBondContact N-OD2 2.99Å; E169-D189 HydrophobicContact CB-CB 4.26Å; E169-D189 HydrophobicContact CG-CB 4.21Å; S187-D189 VanDerWaalsContact CB-OD1 3.24Å; S187-D189 WeakPolarHBondContact CB-OD1 3.21Å; S187-D189 PolarHBondContact O-N 2.86Å; S187-D189 PolarHBondContact OG-N 2.93Å; S187-D189 PolarHBondContact OG-OD1 2.8Å; S187-D189 PolarHBondContact OG-OD2 2.95Å; D189-C191 PolarHBondContact O-N 3.44Å; D189-C191 WeakPolarHBondContact OD1-CA 3.17Å; D189-C191 WeakPolarHBondContact OD1-CB 3.41Å; D189-C191 PolarHBondContact OD1-N 2.87Å
190	G	97.8	Very high	97	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.01	15%	0.151	C	C	.	.	S	Bend	trans	73.6	7.6	179.4	0	0	0	0	0	113.9	S187 G188 Q209	S187-G190 PolarHBondContact O-N 3.01Å; G188-G190 PolarHBondContact O-N 3.07Å; G190-Q209 WeakPolarHBondContact O-CG 3.32Å; G190-Q209 PolarHBondContact O-N 2.88Å
191	C	98.5	Very high	97.2	Very high	13 Å²	13	36.2 Å²	36.2	9%	0.088	15%	0.153	C	C	.	.			trans	-104.4	142.1	-177	-58	0	0	0	0	112.9	H167 D189 L205 L213	H167-C191 PolarHBondContact CE1-O 3.41Å; D189-C191 PolarHBondContact O-N 3.44Å; D189-C191 WeakPolarHBondContact OD1-CA 3.17Å; D189-C191 WeakPolarHBondContact OD1-CB 3.41Å; D189-C191 PolarHBondContact OD1-N 2.87Å; C191-L205 HydrophobicContact CB-CB 4.31Å; C191-L205 HydrophobicContact CB-CD2 4.42Å; C191-L213 VanDerWaalsContact C-CD1 3.48Å
192	L	98.7	Very high	97.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	116.2	162.3	175.3	66	0	0	0	108.8	L184 T185 I194 S206 L213 V216 V225 F237 F242	L184-L192 HydrophobicContact CB-CD1 4.2Å; L184-L192 HydrophobicContact CD2-CD1 4.42Å; T185-L192 WeakPolarHBondContact O-CA 3.48Å; L192-I194 HydrophobicContact CD2-CD1 4.25Å; L192-I194 HydrophobicContact CG-CD1 4.09Å; L192-S206 PolarHBondContact N-OG 2.87Å; L192-S206 PolarHBondContact O-N 3.39Å; L192-L213 HydrophobicContact CB-CD1 4.33Å; L192-V216 HydrophobicContact CD1-CG2 4.1Å; L192-V225 HydrophobicContact CD1-CG1 4.41Å; L192-V225 HydrophobicContact CD2-CG1 4.22Å; L192-F237 HydrophobicContact CB-CE1 4.48Å; L192-F237 HydrophobicContact CB-CE2 4.28Å; L192-F237 HydrophobicContact CB-CZ 4.1Å; L192-F237 HydrophobicContact CD2-CB 4.25Å; L192-F237 HydrophobicContact CD2-CD1 4.08Å; L192-F237 HydrophobicContact CD2-CD2 3.76Å; L192-F237 HydrophobicContact CD2-CE1 4.36Å; L192-F237 HydrophobicContact CD2-CE2 4.07Å; L192-F237 HydrophobicContact CD2-CG 3.77Å; L192-F237 HydrophobicContact CD2-CZ 4.35Å; L192-F242 HydrophobicContact CD2-CB 4.44Å; L192-F242 HydrophobicContact CD2-CD1 4.14Å
193	G	98.5	Very high	97.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	142.4	176.2	0	0	0	0	0	113.1	H167 L184 T185	H167-G193 WeakPolarHBondContact NE2-CA 2.92Å; L184-G193 CarbonylContact C-O 3.58Å; L184-G193 WeakPolarHBondContact CA-O 3.12Å; T185-G193 PolarHBondContact N-O 2.93Å; T185-G193 PolarHBondContact O-N 3.16Å; T185-G193 WeakPolarHBondContact OG1-CA 3.26Å; T185-G193 PolarHBondContact OG1-O 3.36Å
194	I	98.5	Very high	97.4	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.015	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.3	179.4	-49.4	-65.9	0	0	0	110.1	L182 L184 L192 E203 L204 F242	L182-I194 HydrophobicContact CB-CG2 4.47Å; L182-I194 HydrophobicContact CD1-CG2 4.21Å; L182-I194 HydrophobicContact CD2-CG2 4.2Å; L184-I194 HydrophobicContact CB-CD1 4.46Å; L184-I194 HydrophobicContact CD2-CD1 3.99Å; L184-I194 HydrophobicContact CG-CD1 3.89Å; L192-I194 HydrophobicContact CD2-CD1 4.25Å; L192-I194 HydrophobicContact CG-CD1 4.09Å; I194-E203 HydrophobicContact CB-CB 4.42Å; I194-E203 HydrophobicContact CG2-CB 4.21Å; I194-E203 PolarHBondContact O-N 2.82Å; I194-L204 HydrophobicContact CB-CG 4.19Å; I194-L204 HydrophobicContact CG1-CD1 3.85Å; I194-L204 HydrophobicContact CG1-CG 4.01Å; I194-L204 PolarHBondContact N-O 3.22Å; I194-L204 PolarHBondContact O-N 2.86Å; I194-F242 HydrophobicContact CD1-CB 3.86Å; I194-F242 HydrophobicContact CD1-CD1 3.75Å; I194-F242 HydrophobicContact CD1-CD2 3.77Å; I194-F242 HydrophobicContact CD1-CE1 4.19Å; I194-F242 HydrophobicContact CD1-CE2 4.21Å; I194-F242 HydrophobicContact CD1-CG 3.52Å; I194-F242 HydrophobicContact CD1-CZ 4.39Å; I194-F242 HydrophobicContact CG1-CB 3.7Å; I194-F242 HydrophobicContact CG1-CD1 4.47Å; I194-F242 HydrophobicContact CG1-CD2 3.78Å; I194-F242 HydrophobicContact CG1-CG 3.75Å; I194-F242 HydrophobicContact CG2-CD2 4.29Å; I194-F242 HydrophobicContact CG2-CE2 4.41Å
195	F	98.2	Very high	97.4	Very high	1 Å²	1	42 Å²	42	0%	0.004	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	138.5	-178.6	-60.3	-92.3	0	0	0	110.8	I150 M162 M164 L182 L183 T185 F202	I150-F195 HydrophobicContact CD1-CD2 3.9Å; I150-F195 HydrophobicContact CD1-CE1 4.24Å; I150-F195 HydrophobicContact CD1-CE2 3.22Å; I150-F195 HydrophobicContact CD1-CZ 3.42Å; I150-F195 VanDerWaalsContact CD1-CZ 3.42Å; M162-F195 HydrophobicContact CE-CB 4.32Å; M162-F195 HydrophobicContact CE-CD1 4.21Å; M162-F195 HydrophobicContact CE-CG 4.48Å; M164-F195 HydrophobicContact CB-CD1 4.09Å; M164-F195 HydrophobicContact CB-CE1 3.62Å; M164-F195 HydrophobicContact CG-CD1 3.95Å; M164-F195 HydrophobicContact CG-CE1 3.93Å; L182-F195 CarbonylContact C-O 3.57Å; L182-F195 WeakPolarHBondContact CA-O 3.42Å; L183-F195 HydrophobicContact CB-CB 4.26Å; L183-F195 PolarHBondContact N-O 2.78Å; L183-F195 PolarHBondContact O-N 3.2Å; T185-F195 HydrophobicContact CG2-CD2 4.18Å; T185-F195 HydrophobicContact CG2-CE2 4.21Å; T185-F195 WeakPolarHBondContact OG1-CE2 3.45Å; F195-F202 HydrophobicContact CD1-CB 4.23Å; F195-F202 HydrophobicContact CD1-CD2 4.23Å; F195-F202 HydrophobicContact CE1-CB 4.09Å; F195-F202 AromaticContact CE1-CD2 3.61Å; F195-F202 HydrophobicContact CE1-CD2 3.61Å; F195-F202 HydrophobicContact CE1-CG 4.35Å; F195-F202 AromaticContact CZ-CD2 3.9Å; F195-F202 HydrophobicContact CZ-CD2 3.9Å; F195-F202 HydrophobicContact CZ-CE2 4.48Å
196	N	97.1	Very high	97.4	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	108.6	177.3	-169.7	-45.9	0	0	0	110.2	L182 K198 R199 R200 R201 E203	L182-N196 HydrophobicContact CD2-CB 4.41Å; N196-K198 PolarHBondContact O-N 3.31Å; N196-K198 PolarHBondContact OD1-N 2.81Å; N196-R199 HydrophobicContact CB-CB 4.15Å; N196-R199 PolarHBondContact O-N 3.3Å; N196-R199 WeakPolarHBondContact OD1-CB 3.45Å; N196-R199 PolarHBondContact OD1-N 2.93Å; N196-R200 WeakPolarHBondContact O-CA 3.32Å; N196-R200 PolarHBondContact O-N 2.83Å; N196-R201 HydrophobicContact CB-CG 4.06Å; N196-R201 PolarHBondContact N-O 2.92Å; N196-R201 PolarHBondContact O-N 2.93Å; N196-E203 HydrophobicContact CB-CG 3.94Å; N196-E203 VanDerWaalsContact CB-OE1 3.27Å; N196-E203 WeakPolarHBondContact CB-OE1 3.39Å; N196-E203 PolarHBondContact ND2-OE1 3Å
197	V	94.9	Very high	97.4	Very high	17 Å²	17	48 Å²	48	10%	0.103	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-46.3	-175.9	178.8	0	0	0	0	111.2	V136 V140 L152 L176 K181 L183 R200	V136-V197 HydrophobicContact CG1-CG1 4.17Å; V140-V197 HydrophobicContact CG1-CG1 4.5Å; L152-V197 HydrophobicContact CD1-CB 4.42Å; L152-V197 HydrophobicContact CD1-CG1 4.11Å; L152-V197 HydrophobicContact CD2-CG1 4.47Å; L176-V197 HydrophobicContact CD1-CG2 4.43Å; K181-V197 PolarHBondContact O-N 2.93Å; L183-V197 HydrophobicContact CB-CG2 3.87Å; V197-R200 PolarHBondContact O-N 3.31Å
198	K	92.8	Very high	97.3	Very high	175 Å²	175	52.5 Å²	52.5	76%	0.761	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-38.6	-176.2	-170.8	170.1	-175.6	170.7	0	112.4	N196	N196-K198 PolarHBondContact O-N 3.31Å; N196-K198 PolarHBondContact OD1-N 2.81Å
199	R	94.6	Very high	97.3	Very high	162 Å²	162	53.8 Å²	53.8	61%	0.611	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-10.3	179.3	-65.4	-173.9	174.8	-174.6	-4.8	113.5	N196 R201	N196-R199 HydrophobicContact CB-CB 4.15Å; N196-R199 PolarHBondContact O-N 3.3Å; N196-R199 WeakPolarHBondContact OD1-CB 3.45Å; N196-R199 PolarHBondContact OD1-N 2.93Å; R199-R201 VanDerWaalsContact C-N 3.34Å; R199-R201 HydrophobicContact CB-CG 3.95Å; R199-R201 PolarHBondContact O-N 2.99Å
200	R	95.4	Very high	97.1	Very high	130 Å²	130	56.2 Å²	56.2	49%	0.491	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	50.3	-175.2	-55.3	118.8	-169.6	-180	3.8	112.3	M162 M164 N196 V197	M162-R200 HydrophobicContact CB-CB 4.17Å; M162-R200 HydrophobicContact CG-CB 4.2Å; M162-R200 VanDerWaalsContact SD-C 3.56Å; M162-R200 HydrophobicContact SD-CB 4.22Å; M164-R200 VanDerWaalsContact CE-O 3.25Å; M164-R200 WeakPolarHBondContact CE-O 3.2Å; N196-R200 WeakPolarHBondContact O-CA 3.32Å; N196-R200 PolarHBondContact O-N 2.83Å; V197-R200 PolarHBondContact O-N 3.31Å
201	R	96	Very high	97	Very high	101 Å²	101	56.2 Å²	56.2	38%	0.381	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	149.6	-178.8	72.1	179.1	-171.4	164.2	14.8	111.8	N196 R199 E203	N196-R201 HydrophobicContact CB-CG 4.06Å; N196-R201 PolarHBondContact N-O 2.92Å; N196-R201 PolarHBondContact O-N 2.93Å; R199-R201 VanDerWaalsContact C-N 3.34Å; R199-R201 HydrophobicContact CB-CG 3.95Å; R199-R201 PolarHBondContact O-N 2.99Å; R201-E203 IonicContact CZ-OE1 3.77Å; R201-E203 VanDerWaalsContact CZ-OE1 3.3Å; R201-E203 IonicContact CZ-OE2 2.95Å; R201-E203 IonicContact NE-OE1 3.79Å; R201-E203 PolarHBondContact NE-OE1 2.95Å; R201-E203 IonicContact NE-OE2 4Å; R201-E203 VanDerWaalsContact NH2-CD 3.32Å; R201-E203 IonicContact NH2-OE1 3.85Å; R201-E203 PolarHBondContact NH2-OE1 2.71Å; R201-E203 IonicContact NH2-OE2 2.84Å; R201-E203 PolarHBondContact NH2-OE2 3.02Å
202	F	97.9	Very high	97	Very high	67 Å²	67	58 Å²	58	29%	0.294	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	138.6	162.2	172.6	-107.3	0	0	0	110.7	M164 Q166 F195 L204 L205	M164-F202 HydrophobicContact SD-CB 4.06Å; Q166-F202 HydrophobicContact CB-CD2 3.98Å; Q166-F202 HydrophobicContact CB-CE2 3.79Å; Q166-F202 HydrophobicContact CB-CZ 4.23Å; Q166-F202 HydrophobicContact CG-CB 4.38Å; Q166-F202 HydrophobicContact CG-CD1 4.01Å; Q166-F202 HydrophobicContact CG-CD2 3.68Å; Q166-F202 HydrophobicContact CG-CE1 4.14Å; Q166-F202 HydrophobicContact CG-CE2 3.81Å; Q166-F202 HydrophobicContact CG-CG 3.76Å; Q166-F202 HydrophobicContact CG-CZ 4.02Å; F195-F202 HydrophobicContact CD1-CB 4.23Å; F195-F202 HydrophobicContact CD1-CD2 4.23Å; F195-F202 HydrophobicContact CE1-CB 4.09Å; F195-F202 AromaticContact CE1-CD2 3.61Å; F195-F202 HydrophobicContact CE1-CD2 3.61Å; F195-F202 HydrophobicContact CE1-CG 4.35Å; F195-F202 AromaticContact CZ-CD2 3.9Å; F195-F202 HydrophobicContact CZ-CD2 3.9Å; F195-F202 HydrophobicContact CZ-CE2 4.48Å; F202-L204 VanDerWaalsContact CE2-O 3.3Å; F202-L204 WeakPolarHBondContact CE2-O 3.03Å; F202-L205 HydrophobicContact CE2-CD2 3.92Å; F202-L205 HydrophobicContact CE2-CG 3.76Å; F202-L205 HydrophobicContact CZ-CB 4.45Å; F202-L205 HydrophobicContact CZ-CG 3.88Å
203	E	97.6	Very high	97	Very high	68 Å²	68	58 Å²	58	32%	0.318	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-54.6	173	-61.6	-76.5	177	0	0	111	I194 N196 R201	I194-E203 HydrophobicContact CB-CB 4.42Å; I194-E203 HydrophobicContact CG2-CB 4.21Å; I194-E203 PolarHBondContact O-N 2.82Å; N196-E203 HydrophobicContact CB-CG 3.94Å; N196-E203 VanDerWaalsContact CB-OE1 3.27Å; N196-E203 WeakPolarHBondContact CB-OE1 3.39Å; N196-E203 PolarHBondContact ND2-OE1 3Å; R201-E203 IonicContact CZ-OE1 3.77Å; R201-E203 VanDerWaalsContact CZ-OE1 3.3Å; R201-E203 IonicContact CZ-OE2 2.95Å; R201-E203 IonicContact NE-OE1 3.79Å; R201-E203 PolarHBondContact NE-OE1 2.95Å; R201-E203 IonicContact NE-OE2 4Å; R201-E203 VanDerWaalsContact NH2-CD 3.32Å; R201-E203 IonicContact NH2-OE1 3.85Å; R201-E203 PolarHBondContact NH2-OE1 2.71Å; R201-E203 IonicContact NH2-OE2 2.84Å; R201-E203 PolarHBondContact NH2-OE2 3.02Å
204	L	98.4	Very high	97	Very high	56 Å²	56	58.8 Å²	58.8	29%	0.293	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	164	177.3	67.6	88.3	0	0	0	113.2	I194 F202 F242	I194-L204 HydrophobicContact CB-CG 4.19Å; I194-L204 HydrophobicContact CG1-CD1 3.85Å; I194-L204 HydrophobicContact CG1-CG 4.01Å; I194-L204 PolarHBondContact N-O 3.22Å; I194-L204 PolarHBondContact O-N 2.86Å; F202-L204 VanDerWaalsContact CE2-O 3.3Å; F202-L204 WeakPolarHBondContact CE2-O 3.03Å; L204-F242 HydrophobicContact CD1-CB 3.89Å; L204-F242 HydrophobicContact CD2-CB 4.34Å
205	L	98.6	Very high	96.9	Very high	53 Å²	53	58.7 Å²	58.7	28%	0.277	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	145.8	157.8	-67.2	-176.2	0	0	0	108.5	Q166 H167 C191 F202	Q166-L205 HydrophobicContact CB-CD1 4.34Å; H167-L205 VanDerWaalsContact CE1-CD2 3.42Å; H167-L205 WeakPolarHBondContact CE1-CD2 3.48Å; C191-L205 HydrophobicContact CB-CB 4.31Å; C191-L205 HydrophobicContact CB-CD2 4.42Å; F202-L205 HydrophobicContact CE2-CD2 3.92Å; F202-L205 HydrophobicContact CE2-CG 3.76Å; F202-L205 HydrophobicContact CZ-CB 4.45Å; F202-L205 HydrophobicContact CZ-CG 3.88Å
206	S	98.6	Very high	96.9	Very high	7 Å²	7	58.9 Å²	58.9	5%	0.049	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-69.9	171.3	170.9	73.4	0	0	0	0	112	L192 F242 G243	L192-S206 PolarHBondContact N-OG 2.87Å; L192-S206 PolarHBondContact O-N 3.39Å; S206-F242 WeakPolarHBondContact CB-O 3.19Å; S206-G243 CarbonylContact C-O 3.6Å; S206-G243 WeakPolarHBondContact CA-O 3.44Å
207	E	98.3	Very high	97	Very high	120 Å²	120	59.5 Å²	59.5	56%	0.561	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-55.1	137	160.1	-69.5	175.3	172.7	0	0	109.7	Q209 G243	E207-Q209 PolarHBondContact O-N 3.2Å; E207-Q209 PolarHBondContact O-NE2 3.08Å; E207-G243 PolarHBondContact N-O 2.86Å
208	P	97.6	Very high	97.1	Very high	95 Å²	95	60 Å²	60	62%	0.617	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-66.3	132.8	177.1	26.2	-32.9	0	0	0	109.9
209	Q	97.6	Very high	97.3	Very high	31 Å²	31	51.7 Å²	51.7	15%	0.145	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-86	166.5	173	-55.1	-48.6	-65.2	0	0	110.6	G190 E207 L213 Y235 T245	G190-Q209 WeakPolarHBondContact O-CG 3.32Å; G190-Q209 PolarHBondContact O-N 2.88Å; E207-Q209 PolarHBondContact O-N 3.2Å; E207-Q209 PolarHBondContact O-NE2 3.08Å; Q209-L213 HydrophobicContact CB-CD2 4.33Å; Q209-L213 HydrophobicContact CG-CD2 4.23Å; Q209-Y235 HydrophobicContact CB-CD2 4.37Å; Q209-Y235 HydrophobicContact CB-CE1 4.12Å; Q209-Y235 HydrophobicContact CB-CE2 3.84Å; Q209-Y235 HydrophobicContact CG-CD1 4.11Å; Q209-Y235 HydrophobicContact CG-CD2 4.14Å; Q209-Y235 HydrophobicContact CG-CE1 4.05Å; Q209-Y235 HydrophobicContact CG-CE2 4.1Å; Q209-Y235 HydrophobicContact CG-CG 4.14Å; Q209-Y235 VanDerWaalsContact OE1-CE1 3.22Å; Q209-T245 HydrophobicContact CG-CG2 4.45Å
210	S	94.4	Very high	97.3	Very high	77 Å²	77	46.6 Å²	46.6	54%	0.538	23%	0.232	S	C	.	.	S	Bend	trans	-69.3	-40	-179	46.8	0	0	0	0	113.1	E231 Y235	S210-E231 WeakPolarHBondContact CB-OE2 3.3Å; S210-E231 PolarHBondContact OG-OE2 3.33Å; S210-Y235 PolarHBondContact OG-OH 2.81Å; S210-Y235 VanDerWaalsContact OG-OH 3.11Å
211	G	94.6	Very high	97.2	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.01	24%	0.237	C	C	.	.	S	Bend	trans	-100	146.4	174.2	0	0	0	0	0	112	E231	G211-E231 PolarHBondContact N-OE2 2.9Å
212	D	98	Very high	97	Very high	50 Å²	50	40.4 Å²	40.4	27%	0.267	23%	0.225	S	C	.	.			trans	-44.9	134.2	166.4	-55.3	34.7	0	0	0	110.4	Y170 G188 T214 S229 S230	Y170-D212 WeakPolarHBondContact OH-CB 3.3Å; Y170-D212 PolarHBondContact OH-OD2 3.42Å; G188-D212 WeakPolarHBondContact O-CA 3.38Å; D212-T214 PolarHBondContact O-N 3.43Å; D212-S229 CarbonylContact O-C 3.56Å; D212-S229 WeakPolarHBondContact O-CA 3.36Å; D212-S229 WeakPolarHBondContact O-CB 3.13Å; D212-S230 PolarHBondContact N-OG 3.01Å; D212-S230 PolarHBondContact O-N 2.82Å
213	L	98.5	Very high	96.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.4	173.7	-57.7	-172.5	0	0	0	108.9	A172 A186 S187 C191 L192 Q209 C227 G228 Y235	A172-L213 WeakPolarHBondContact CB-O 3.39Å; A186-L213 HydrophobicContact CB-CB 3.78Å; S187-L213 CarbonylContact C-O 3.54Å; S187-L213 PolarHBondContact N-O 3.26Å; S187-L213 PolarHBondContact O-N 3.05Å; C191-L213 VanDerWaalsContact C-CD1 3.48Å; L192-L213 HydrophobicContact CB-CD1 4.33Å; Q209-L213 HydrophobicContact CB-CD2 4.33Å; Q209-L213 HydrophobicContact CG-CD2 4.23Å; L213-C227 HydrophobicContact CD1-CB 4.16Å; L213-C227 HydrophobicContact CD2-CB 4.08Å; L213-G228 WeakPolarHBondContact CA-O 3.33Å; L213-Y235 HydrophobicContact CD2-CD2 3.79Å; L213-Y235 HydrophobicContact CD2-CE2 4.13Å
214	T	98.3	Very high	96.8	Very high	17 Å²	17	42.6 Å²	42.6	10%	0.104	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-26.9	-173	55.3	0	0	0	0	113.1	A172 D212 G228 I256	A172-T214 WeakPolarHBondContact CB-O 3.29Å; D212-T214 PolarHBondContact O-N 3.43Å; T214-G228 PolarHBondContact N-O 2.82Å; T214-G228 PolarHBondContact OG1-O 2.97Å; T214-I256 WeakPolarHBondContact CB-O 3.34Å; T214-I256 WeakPolarHBondContact CG2-O 3.31Å; T214-I256 PolarHBondContact OG1-O 3.18Å
215	S	97.8	Very high	96.8	Very high	1 Å²	1	40 Å²	40	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	147.8	-170.5	44.6	0	0	0	0	110.6	C227 G228 M259	S215-C227 CarbonylContact O-C 3.57Å; S215-C227 WeakPolarHBondContact O-CA 3.44Å; S215-G228 PolarHBondContact O-N 2.92Å; S215-M259 WeakPolarHBondContact OG-CE 3.33Å; S215-M259 WeakPolarHBondContact OG-CG 3.5Å
216	V	98.6	Very high	96.8	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.03	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	130.7	179.6	58	0	0	0	0	111.6	D173 A175 L184 A186 L192 V225 A226	D173-V216 HydrophobicContact CB-CG1 4.15Å; D173-V216 PolarHBondContact OD2-N 3.23Å; A175-V216 HydrophobicContact CB-CG1 4.05Å; A175-V216 HydrophobicContact CB-CG2 4.14Å; L184-V216 HydrophobicContact CB-CG2 4.42Å; A186-V216 HydrophobicContact CB-CB 3.92Å; A186-V216 HydrophobicContact CB-CG1 3.95Å; L192-V216 HydrophobicContact CD1-CG2 4.1Å; V216-V225 HydrophobicContact CG2-CG1 3.53Å; V216-A226 WeakPolarHBondContact CA-O 3.45Å
217	T	98.2	Very high	96.8	Very high	16 Å²	16	37.1 Å²	37.1	10%	0.098	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	154.3	176.3	-163.4	0	0	0	0	113.1	M219 V225 A226 M259 P261 L267	T217-M219 HydrophobicContact CG2-CG 4.09Å; T217-M219 HydrophobicContact CG2-SD 4.13Å; T217-V225 WeakPolarHBondContact O-CA 3.43Å; T217-A226 HydrophobicContact CG2-CB 4.22Å; T217-A226 PolarHBondContact N-O 2.82Å; T217-A226 PolarHBondContact O-N 3.1Å; T217-M259 HydrophobicContact CG2-CE 4.42Å; T217-P261 WeakPolarHBondContact OG1-CD 3.17Å; T217-P261 WeakPolarHBondContact OG1-CG 3.41Å; T217-L267 HydrophobicContact CG2-CD2 4.18Å
218	L	97.7	Very high	96.8	Very high	29 Å²	29	31.4 Å²	31.4	15%	0.152	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	133.1	176.1	-59.9	-173.8	0	0	0	110.5	L176 P178 L184 V225 W239	L176-L218 WeakPolarHBondContact O-CD1 3.34Å; P178-L218 HydrophobicContact CG-CD1 4.36Å; L184-L218 HydrophobicContact CD1-CD2 4.41Å; L184-L218 HydrophobicContact CD2-CD2 4.08Å; L218-V225 HydrophobicContact CD2-CB 4.39Å; L218-V225 HydrophobicContact CD2-CG1 4.37Å; L218-V225 HydrophobicContact CD2-CG2 3.78Å; L218-W239 HydrophobicContact CD1-CH2 4.34Å; L218-W239 HydrophobicContact CD1-CZ3 4.02Å; L218-W239 HydrophobicContact CD2-CE3 4.17Å; L218-W239 HydrophobicContact CD2-CZ3 3.59Å; L218-W239 HydrophobicContact CG-CZ3 4.5Å
219	M	96.8	Very high	96.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	164.2	-177.4	-63.6	-62.2	-72.2	0	0	110.8	T217 C221 G222 K223 K224 A226 P261 L267 I281	T217-M219 HydrophobicContact CG2-CG 4.09Å; T217-M219 HydrophobicContact CG2-SD 4.13Å; M219-C221 PolarHBondContact O-N 3.47Å; M219-G222 PolarHBondContact O-N 3.23Å; M219-K223 PolarHBondContact O-N 3Å; M219-K224 HydrophobicContact CB-CB 4.32Å; M219-K224 PolarHBondContact N-O 2.91Å; M219-K224 PolarHBondContact O-N 3.23Å; M219-A226 HydrophobicContact CG-CB 3.99Å; M219-P261 HydrophobicContact SD-CB 3.82Å; M219-L267 HydrophobicContact CE-CB 4.09Å; M219-L267 HydrophobicContact CE-CD2 4.08Å; M219-L267 HydrophobicContact CE-CG 4.33Å; M219-L267 HydrophobicContact CG-CD2 4.2Å; M219-L267 HydrophobicContact SD-CB 4.29Å; M219-L267 HydrophobicContact SD-CD2 4.06Å; M219-I281 HydrophobicContact CE-CB 4.28Å; M219-I281 HydrophobicContact CE-CG1 3.8Å; M219-I281 HydrophobicContact CG-CG1 4.38Å
220	K	94.5	Very high	96.8	Very high	54 Å²	54	27.4 Å²	27.4	24%	0.235	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	48.1	176.9	-48.1	-60.1	-69.4	-162.2	0	112.7	K223 K224 E264 S265 I281 L282	K220-K223 HydrophobicContact CB-CB 4.37Å; K220-K223 VanDerWaalsContact O-CB 3.3Å; K220-K223 WeakPolarHBondContact O-CB 3.32Å; K220-K223 VanDerWaalsContact O-CG 3.32Å; K220-K223 WeakPolarHBondContact O-CG 3.45Å; K220-K223 PolarHBondContact O-N 3.28Å; K220-K224 HydrophobicContact CB-CB 4.42Å; K220-K224 HydrophobicContact CB-CG 4.19Å; K220-K224 HydrophobicContact CG-CB 4.2Å; K220-K224 HydrophobicContact CG-CG 3.92Å; K220-E264 WeakPolarHBondContact CA-O 3.41Å; K220-E264 WeakPolarHBondContact CD-O 3.21Å; K220-E264 PolarHBondContact N-O 2.98Å; K220-S265 PolarHBondContact NZ-OG 3.32Å; K220-I281 PolarHBondContact NZ-O 2.94Å; K220-L282 PolarHBondContact NZ-O 3.31Å; K220-L282 VanDerWaalsContact NZ-O 3.1Å
221	C	92.5	Very high	96.9	Very high	89 Å²	89	28.3 Å²	28.3	60%	0.601	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	45.5	-177.3	-52.3	0	0	0	0	112.1	M219 K223 E264	M219-C221 PolarHBondContact O-N 3.47Å; C221-K223 VanDerWaalsContact C-N 3.26Å; C221-K223 PolarHBondContact O-N 3.43Å; C221-E264 WeakPolarHBondContact CA-OE2 3.45Å; C221-E264 PolarHBondContact N-OE2 3.24Å
222	G	91.8	Very high	97	Very high	12 Å²	12	28.3 Å²	28.3	12%	0.124	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	10.6	-179.3	0	0	0	0	0	114.8	M219 W239	M219-G222 PolarHBondContact O-N 3.23Å; G222-W239 VanDerWaalsContact O-CB 3.29Å; G222-W239 WeakPolarHBondContact O-CB 3.48Å; G222-W239 VanDerWaalsContact O-CD2 3.23Å
223	K	95.4	Very high	96.9	Very high	151 Å²	151	26.7 Å²	26.7	66%	0.657	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-18.5	177.2	-64.4	-180	-178.9	177.8	0	113.1	M219 K220 C221 W239	M219-K223 PolarHBondContact O-N 3Å; K220-K223 HydrophobicContact CB-CB 4.37Å; K220-K223 VanDerWaalsContact O-CB 3.3Å; K220-K223 WeakPolarHBondContact O-CB 3.32Å; K220-K223 VanDerWaalsContact O-CG 3.32Å; K220-K223 WeakPolarHBondContact O-CG 3.45Å; K220-K223 PolarHBondContact O-N 3.28Å; C221-K223 VanDerWaalsContact C-N 3.26Å; C221-K223 PolarHBondContact O-N 3.43Å; K223-W239 WeakPolarHBondContact O-CB 3.43Å; K223-W239 PolarHBondContact O-N 2.64Å
224	K	97.3	Very high	96.9	Very high	31 Å²	31	26.7 Å²	26.7	14%	0.135	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	143.4	-179	-67	-67	-174.9	162.6	0	110.1	M219 K220 F237 N238 S246 L282	M219-K224 HydrophobicContact CB-CB 4.32Å; M219-K224 PolarHBondContact N-O 2.91Å; M219-K224 PolarHBondContact O-N 3.23Å; K220-K224 HydrophobicContact CB-CB 4.42Å; K220-K224 HydrophobicContact CB-CG 4.19Å; K220-K224 HydrophobicContact CG-CB 4.2Å; K220-K224 HydrophobicContact CG-CG 3.92Å; K224-F237 WeakPolarHBondContact CA-O 3.27Å; K224-F237 WeakPolarHBondContact CD-O 3.24Å; K224-N238 WeakPolarHBondContact CE-OD1 3.34Å; K224-N238 PolarHBondContact NZ-OD1 3.26Å; K224-S246 PolarHBondContact NZ-OG 2.81Å; K224-S246 VanDerWaalsContact NZ-OG 3.12Å; K224-L282 HydrophobicContact CD-CD1 4.28Å; K224-L282 HydrophobicContact CG-CD1 4.09Å
225	V	98.4	Very high	96.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.8	165	-171.5	0	0	0	0	106.6	L184 L192 V216 T217 L218 L236 F237 W239 F242	L184-V225 HydrophobicContact CD2-CB 4.35Å; L184-V225 HydrophobicContact CD2-CG1 3.86Å; L184-V225 HydrophobicContact CD2-CG2 3.52Å; L192-V225 HydrophobicContact CD1-CG1 4.41Å; L192-V225 HydrophobicContact CD2-CG1 4.22Å; V216-V225 HydrophobicContact CG2-CG1 3.53Å; T217-V225 WeakPolarHBondContact O-CA 3.43Å; L218-V225 HydrophobicContact CD2-CB 4.39Å; L218-V225 HydrophobicContact CD2-CG1 4.37Å; L218-V225 HydrophobicContact CD2-CG2 3.78Å; V225-L236 CarbonylContact O-C 3.55Å; V225-L236 VanDerWaalsContact O-CA 3.31Å; V225-L236 WeakPolarHBondContact O-CA 3.32Å; V225-F237 HydrophobicContact CB-CB 4.16Å; V225-F237 PolarHBondContact N-O 2.7Å; V225-F237 PolarHBondContact O-N 3.18Å; V225-W239 HydrophobicContact CG2-CE3 4.17Å; V225-W239 HydrophobicContact CG2-CZ3 4.39Å; V225-F242 HydrophobicContact CG2-CD1 4.15Å; V225-F242 HydrophobicContact CG2-CE1 3.7Å
226	A	98.4	Very high	97	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	125.7	173.4	0	0	0	0	0	108.9	V216 T217 M219 I234 Y235 L236 M259 L267	V216-A226 WeakPolarHBondContact CA-O 3.45Å; T217-A226 HydrophobicContact CG2-CB 4.22Å; T217-A226 PolarHBondContact N-O 2.82Å; T217-A226 PolarHBondContact O-N 3.1Å; M219-A226 HydrophobicContact CG-CB 3.99Å; A226-I234 HydrophobicContact CB-CG2 4.18Å; A226-Y235 WeakPolarHBondContact CA-O 3.4Å; A226-L236 HydrophobicContact CB-CD2 3.74Å; A226-M259 WeakPolarHBondContact O-CE 3.38Å; A226-L267 HydrophobicContact CB-CD2 4.11Å
227	C	98.6	Very high	97	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.7	174	-54.4	0	0	0	0	109.9	L213 S215 I234 Y235 F237	L213-C227 HydrophobicContact CD1-CB 4.16Å; L213-C227 HydrophobicContact CD2-CB 4.08Å; S215-C227 CarbonylContact O-C 3.57Å; S215-C227 WeakPolarHBondContact O-CA 3.44Å; C227-I234 CarbonylContact O-C 3.12Å; C227-I234 WeakPolarHBondContact O-CA 3.5Å; C227-Y235 PolarHBondContact N-O 2.95Å; C227-Y235 PolarHBondContact O-N 2.87Å; C227-F237 HydrophobicContact CB-CE2 4.5Å
228	G	98.2	Very high	97	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	154.4	171.7	0	0	0	0	0	109.9	L213 T214 S215	L213-G228 WeakPolarHBondContact CA-O 3.33Å; T214-G228 PolarHBondContact N-O 2.82Å; T214-G228 PolarHBondContact OG1-O 2.97Å; S215-G228 PolarHBondContact O-N 2.92Å
229	S	98.2	Very high	96.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	159	178.8	78.5	0	0	0	0	114.5	D212 E231 G232 T233 I256	D212-S229 CarbonylContact O-C 3.56Å; D212-S229 WeakPolarHBondContact O-CA 3.36Å; D212-S229 WeakPolarHBondContact O-CB 3.13Å; S229-E231 PolarHBondContact O-N 2.91Å; S229-E231 VanDerWaalsContact O-N 3.11Å; S229-E231 PolarHBondContact OG-N 2.84Å; S229-G232 PolarHBondContact O-N 3.33Å; S229-T233 PolarHBondContact N-O 2.83Å; S229-T233 PolarHBondContact OG-N 2.84Å; S229-T233 PolarHBondContact OG-O 2.9Å; S229-I256 CarbonylContact C-O 3.52Å; S229-I256 PolarHBondContact O-N 2.95Å
230	S	97.3	Very high	96.8	Very high	43 Å²	43	35.7 Å²	35.7	30%	0.301	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-16.2	173.2	58.9	0	0	0	0	114	D212 S255	D212-S230 PolarHBondContact N-OG 3.01Å; D212-S230 PolarHBondContact O-N 2.82Å; S230-S255 WeakPolarHBondContact O-CA 3.48Å; S230-S255 WeakPolarHBondContact O-CB 3.34Å
231	E	96.4	Very high	96.9	Very high	96 Å²	96	34.6 Å²	34.6	45%	0.449	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	13.2	175.8	-60.9	-177.6	148.8	0	0	113.3	S210 G211 S229 T233 E254	S210-E231 WeakPolarHBondContact CB-OE2 3.3Å; S210-E231 PolarHBondContact OG-OE2 3.33Å; G211-E231 PolarHBondContact N-OE2 2.9Å; S229-E231 PolarHBondContact O-N 2.91Å; S229-E231 VanDerWaalsContact O-N 3.11Å; S229-E231 PolarHBondContact OG-N 2.84Å; E231-T233 VanDerWaalsContact C-N 3.27Å; E231-T233 PolarHBondContact O-N 3.2Å; E231-E254 CarbonylContact C-O 3.59Å; E231-E254 WeakPolarHBondContact CA-O 3.25Å
232	G	95.7	Very high	97.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	70.8	21.3	178	0	0	0	0	0	113.9	S229 V251 E254	S229-G232 PolarHBondContact O-N 3.33Å; G232-V251 PolarHBondContact O-N 2.65Å; G232-E254 PolarHBondContact N-O 2.89Å; G232-E254 VanDerWaalsContact N-O 3.14Å
233	T	97.5	Very high	97.3	Very high	16 Å²	16	31.9 Å²	31.9	10%	0.098	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	140.3	-179.6	-65.1	0	0	0	0	111	S229 E231 Y235 R248	S229-T233 PolarHBondContact N-O 2.83Å; S229-T233 PolarHBondContact OG-N 2.84Å; S229-T233 PolarHBondContact OG-O 2.9Å; E231-T233 VanDerWaalsContact C-N 3.27Å; E231-T233 PolarHBondContact O-N 3.2Å; T233-Y235 HydrophobicContact CG2-CD1 4.29Å; T233-Y235 HydrophobicContact CG2-CD2 4.35Å; T233-Y235 HydrophobicContact CG2-CE1 3.99Å; T233-Y235 HydrophobicContact CG2-CE2 4.03Å; T233-Y235 HydrophobicContact CG2-CG 4.48Å; T233-R248 HydrophobicContact CG2-CB 4.15Å
234	I	98.4	Very high	97.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120.6	167.4	-62.2	178.6	0	0	0	108.6	A226 C227 L236 R248 F249 V251 I256 M259 L267 T269 V279 I281	A226-I234 HydrophobicContact CB-CG2 4.18Å; C227-I234 CarbonylContact O-C 3.12Å; C227-I234 WeakPolarHBondContact O-CA 3.5Å; I234-L236 HydrophobicContact CG2-CD2 3.92Å; I234-R248 VanDerWaalsContact O-CA 3.29Å; I234-R248 WeakPolarHBondContact O-CA 3.49Å; I234-F249 HydrophobicContact CB-CD1 4.32Å; I234-F249 HydrophobicContact CB-CE1 3.83Å; I234-F249 HydrophobicContact CB-CZ 4.04Å; I234-F249 HydrophobicContact CD1-CE1 4.42Å; I234-F249 HydrophobicContact CD1-CE2 4.33Å; I234-F249 HydrophobicContact CD1-CZ 3.81Å; I234-F249 HydrophobicContact CG1-CZ 4.38Å; I234-F249 HydrophobicContact CG2-CE1 3.99Å; I234-F249 HydrophobicContact CG2-CZ 4.4Å; I234-F249 PolarHBondContact N-O 2.72Å; I234-F249 PolarHBondContact O-N 3.43Å; I234-F249 VanDerWaalsContact O-N 3.09Å; I234-V251 HydrophobicContact CD1-CG2 3.83Å; I234-V251 HydrophobicContact CG1-CG2 4.02Å; I234-I256 HydrophobicContact CD1-CD1 4.18Å; I234-I256 HydrophobicContact CG1-CD1 3.5Å; I234-M259 HydrophobicContact CD1-SD 4.29Å; I234-M259 HydrophobicContact CG1-SD 4.39Å; I234-L267 HydrophobicContact CD1-CD1 4.2Å; I234-T269 HydrophobicContact CD1-CG2 4.21Å; I234-V279 HydrophobicContact CD1-CB 4.39Å; I234-V279 HydrophobicContact CD1-CG1 3.92Å; I234-I281 HydrophobicContact CG2-CD1 4.41Å
235	Y	98.4	Very high	97.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	134.8	172.6	-62.6	-79	0	0	0	110.3	Q209 S210 L213 A226 C227 T233 T245 R248	Q209-Y235 HydrophobicContact CB-CD2 4.37Å; Q209-Y235 HydrophobicContact CB-CE1 4.12Å; Q209-Y235 HydrophobicContact CB-CE2 3.84Å; Q209-Y235 HydrophobicContact CG-CD1 4.11Å; Q209-Y235 HydrophobicContact CG-CD2 4.14Å; Q209-Y235 HydrophobicContact CG-CE1 4.05Å; Q209-Y235 HydrophobicContact CG-CE2 4.1Å; Q209-Y235 HydrophobicContact CG-CG 4.14Å; Q209-Y235 VanDerWaalsContact OE1-CE1 3.22Å; S210-Y235 PolarHBondContact OG-OH 2.81Å; S210-Y235 VanDerWaalsContact OG-OH 3.11Å; L213-Y235 HydrophobicContact CD2-CD2 3.79Å; L213-Y235 HydrophobicContact CD2-CE2 4.13Å; A226-Y235 WeakPolarHBondContact CA-O 3.4Å; C227-Y235 PolarHBondContact N-O 2.95Å; C227-Y235 PolarHBondContact O-N 2.87Å; T233-Y235 HydrophobicContact CG2-CD1 4.29Å; T233-Y235 HydrophobicContact CG2-CD2 4.35Å; T233-Y235 HydrophobicContact CG2-CE1 3.99Å; T233-Y235 HydrophobicContact CG2-CE2 4.03Å; T233-Y235 HydrophobicContact CG2-CG 4.48Å; Y235-T245 HydrophobicContact CD1-CG2 3.85Å; Y235-T245 HydrophobicContact CG-CG2 4.21Å; Y235-R248 HydrophobicContact CD1-CB 3.81Å; Y235-R248 HydrophobicContact CE1-CB 4.22Å
236	L	98.4	Very high	97.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.2	180	-60.1	-178.7	0	0	0	111	V225 A226 I234 S246 D247 I281 L282	V225-L236 CarbonylContact O-C 3.55Å; V225-L236 VanDerWaalsContact O-CA 3.31Å; V225-L236 WeakPolarHBondContact O-CA 3.32Å; A226-L236 HydrophobicContact CB-CD2 3.74Å; I234-L236 HydrophobicContact CG2-CD2 3.92Å; L236-S246 WeakPolarHBondContact O-CA 3.49Å; L236-S246 WeakPolarHBondContact O-CB 3.33Å; L236-S246 PolarHBondContact O-N 3.3Å; L236-S246 PolarHBondContact O-OG 3.34Å; L236-D247 HydrophobicContact CB-CB 4.21Å; L236-D247 HydrophobicContact CD1-CB 4.23Å; L236-D247 PolarHBondContact N-O 3.31Å; L236-D247 PolarHBondContact O-N 2.86Å; L236-I281 HydrophobicContact CD1-CG2 3.93Å; L236-I281 HydrophobicContact CD2-CD1 4.39Å; L236-I281 HydrophobicContact CD2-CG2 3.92Å; L236-L282 HydrophobicContact CD1-CD2 4.43Å; L236-L282 HydrophobicContact CD1-CG 4.37Å
237	F	98.5	Very high	97.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	146	172.8	-58	-100.9	0	0	0	110.6	L192 K224 V225 C227 A244 T245	L192-F237 HydrophobicContact CB-CE1 4.48Å; L192-F237 HydrophobicContact CB-CE2 4.28Å; L192-F237 HydrophobicContact CB-CZ 4.1Å; L192-F237 HydrophobicContact CD2-CB 4.25Å; L192-F237 HydrophobicContact CD2-CD1 4.08Å; L192-F237 HydrophobicContact CD2-CD2 3.76Å; L192-F237 HydrophobicContact CD2-CE1 4.36Å; L192-F237 HydrophobicContact CD2-CE2 4.07Å; L192-F237 HydrophobicContact CD2-CG 3.77Å; L192-F237 HydrophobicContact CD2-CZ 4.35Å; K224-F237 WeakPolarHBondContact CA-O 3.27Å; K224-F237 WeakPolarHBondContact CD-O 3.24Å; V225-F237 HydrophobicContact CB-CB 4.16Å; V225-F237 PolarHBondContact N-O 2.7Å; V225-F237 PolarHBondContact O-N 3.18Å; C227-F237 HydrophobicContact CB-CE2 4.5Å; F237-A244 WeakPolarHBondContact CD1-O 3.39Å; F237-T245 HydrophobicContact CD1-CG2 4.21Å; F237-T245 HydrophobicContact CD2-CG2 4.47Å; F237-T245 HydrophobicContact CE1-CG2 3.53Å; F237-T245 HydrophobicContact CE2-CG2 3.84Å; F237-T245 HydrophobicContact CZ-CG2 3.33Å
238	N	98	Very high	97.2	Very high	75 Å²	75	40 Å²	40	40%	0.401	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	142.4	168.5	-75.1	-34	0	0	0	109.4	K224 N240 G241	K224-N238 WeakPolarHBondContact CE-OD1 3.34Å; K224-N238 PolarHBondContact NZ-OD1 3.26Å; N238-N240 PolarHBondContact O-N 3.47Å; N238-G241 CarbonylContact O-C 3.59Å; N238-G241 VanDerWaalsContact O-C 3.3Å; N238-G241 WeakPolarHBondContact O-CA 3.39Å; N238-G241 PolarHBondContact O-N 2.93Å
239	W	96.7	Very high	97.1	Very high	60 Å²	60	41.4 Å²	41.4	23%	0.227	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	133.2	168.2	-168.1	-104.7	0	0	0	110.8	D177 L182 L184 L218 G222 K223 V225 G241 F242	D177-W239 HydrophobicContact CB-CH2 3.7Å; D177-W239 HydrophobicContact CB-CZ2 3.99Å; D177-W239 VanDerWaalsContact CG-CZ2 3.45Å; D177-W239 WeakPolarHBondContact OD1-CZ2 3.41Å; L182-W239 HydrophobicContact CD1-CZ2 4.4Å; L184-W239 HydrophobicContact CD1-CH2 4.18Å; L184-W239 HydrophobicContact CD1-CZ3 4.13Å; L184-W239 HydrophobicContact CD2-CZ3 4.16Å; L218-W239 HydrophobicContact CD1-CH2 4.34Å; L218-W239 HydrophobicContact CD1-CZ3 4.02Å; L218-W239 HydrophobicContact CD2-CE3 4.17Å; L218-W239 HydrophobicContact CD2-CZ3 3.59Å; L218-W239 HydrophobicContact CG-CZ3 4.5Å; G222-W239 VanDerWaalsContact O-CB 3.29Å; G222-W239 WeakPolarHBondContact O-CB 3.48Å; G222-W239 VanDerWaalsContact O-CD2 3.23Å; K223-W239 WeakPolarHBondContact O-CB 3.43Å; K223-W239 PolarHBondContact O-N 2.64Å; V225-W239 HydrophobicContact CG2-CE3 4.17Å; V225-W239 HydrophobicContact CG2-CZ3 4.39Å; W239-G241 PolarHBondContact O-N 2.68Å; W239-F242 HydrophobicContact CD2-CE1 4.31Å; W239-F242 AromaticContact CD2-CZ 3.87Å; W239-F242 HydrophobicContact CD2-CZ 3.87Å; W239-F242 AromaticContact CE3-CE1 3.77Å; W239-F242 HydrophobicContact CE3-CE1 3.77Å; W239-F242 AromaticContact CE3-CZ 3.67Å; W239-F242 HydrophobicContact CE3-CZ 3.67Å; W239-F242 HydrophobicContact CG-CZ 4.47Å; W239-F242 HydrophobicContact CH2-CZ 4.26Å; W239-F242 HydrophobicContact CZ2-CZ 4.44Å; W239-F242 HydrophobicContact CZ3-CE1 4.08Å; W239-F242 AromaticContact CZ3-CZ 3.87Å; W239-F242 HydrophobicContact CZ3-CZ 3.87Å
240	N	94	Very high	97	Very high	123 Å²	123	44.9 Å²	44.9	66%	0.658	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	6.8	-168.5	-58.9	-45.3	0	0	0	115.5	N238	N238-N240 PolarHBondContact O-N 3.47Å
241	G	96.1	Very high	96.6	Very high	30 Å²	30	43 Å²	43	31%	0.309	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-118.9	50.4	172.5	0	0	0	0	0	110.3	N238 W239 G243	N238-G241 CarbonylContact O-C 3.59Å; N238-G241 VanDerWaalsContact O-C 3.3Å; N238-G241 WeakPolarHBondContact O-CA 3.39Å; N238-G241 PolarHBondContact O-N 2.93Å; W239-G241 PolarHBondContact O-N 2.68Å; G241-G243 VanDerWaalsContact C-N 3.32Å; G241-G243 PolarHBondContact O-N 2.91Å
242	F	97.2	Very high	96.1	Very high	10 Å²	10	47.9 Å²	47.9	4%	0.044	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-13.3	-171.7	-54.4	-60.9	0	0	0	114.1	L182 L184 L192 I194 L204 S206 V225 W239 A244	L182-F242 HydrophobicContact CD1-CE2 3.91Å; L182-F242 HydrophobicContact CD1-CZ 4.31Å; L184-F242 HydrophobicContact CD2-CD1 4.49Å; L184-F242 HydrophobicContact CD2-CE1 4Å; L192-F242 HydrophobicContact CD2-CB 4.44Å; L192-F242 HydrophobicContact CD2-CD1 4.14Å; I194-F242 HydrophobicContact CD1-CB 3.86Å; I194-F242 HydrophobicContact CD1-CD1 3.75Å; I194-F242 HydrophobicContact CD1-CD2 3.77Å; I194-F242 HydrophobicContact CD1-CE1 4.19Å; I194-F242 HydrophobicContact CD1-CE2 4.21Å; I194-F242 HydrophobicContact CD1-CG 3.52Å; I194-F242 HydrophobicContact CD1-CZ 4.39Å; I194-F242 HydrophobicContact CG1-CB 3.7Å; I194-F242 HydrophobicContact CG1-CD1 4.47Å; I194-F242 HydrophobicContact CG1-CD2 3.78Å; I194-F242 HydrophobicContact CG1-CG 3.75Å; I194-F242 HydrophobicContact CG2-CD2 4.29Å; I194-F242 HydrophobicContact CG2-CE2 4.41Å; L204-F242 HydrophobicContact CD1-CB 3.89Å; L204-F242 HydrophobicContact CD2-CB 4.34Å; S206-F242 WeakPolarHBondContact CB-O 3.19Å; V225-F242 HydrophobicContact CG2-CD1 4.15Å; V225-F242 HydrophobicContact CG2-CE1 3.7Å; W239-F242 HydrophobicContact CD2-CE1 4.31Å; W239-F242 AromaticContact CD2-CZ 3.87Å; W239-F242 HydrophobicContact CD2-CZ 3.87Å; W239-F242 AromaticContact CE3-CE1 3.77Å; W239-F242 HydrophobicContact CE3-CE1 3.77Å; W239-F242 AromaticContact CE3-CZ 3.67Å; W239-F242 HydrophobicContact CE3-CZ 3.67Å; W239-F242 HydrophobicContact CG-CZ 4.47Å; W239-F242 HydrophobicContact CH2-CZ 4.26Å; W239-F242 HydrophobicContact CZ2-CZ 4.44Å; W239-F242 HydrophobicContact CZ3-CE1 4.08Å; W239-F242 AromaticContact CZ3-CZ 3.87Å; W239-F242 HydrophobicContact CZ3-CZ 3.87Å; F242-A244 VanDerWaalsContact C-N 3.33Å; F242-A244 PolarHBondContact O-N 3.12Å
243	G	96.4	Very high	95.8	Very high	34 Å²	34	48.7 Å²	48.7	35%	0.351	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.9	-174.9	0	0	0	0	0	114.5	S206 E207 G241	S206-G243 CarbonylContact C-O 3.6Å; S206-G243 WeakPolarHBondContact CA-O 3.44Å; E207-G243 PolarHBondContact N-O 2.86Å; G241-G243 VanDerWaalsContact C-N 3.32Å; G241-G243 PolarHBondContact O-N 2.91Å
244	A	97.2	Very high	95.5	Very high	41 Å²	41	55.8 Å²	55.8	34%	0.339	30%	0.3	S	S	.	.	S	Bend	trans	-148.6	155.7	-178.8	0	0	0	0	0	110.9	F237 F242	F237-A244 WeakPolarHBondContact CD1-O 3.39Å; F242-A244 VanDerWaalsContact C-N 3.33Å; F242-A244 PolarHBondContact O-N 3.12Å
245	T	97.8	Very high	95.4	Very high	45 Å²	45	56.2 Å²	56.2	28%	0.276	30%	0.302	S	S	.	.			trans	-69.2	136.7	179.5	52.7	0	0	0	0	110.8	Q209 Y235 F237	Q209-T245 HydrophobicContact CG-CG2 4.45Å; Y235-T245 HydrophobicContact CD1-CG2 3.85Å; Y235-T245 HydrophobicContact CG-CG2 4.21Å; F237-T245 HydrophobicContact CD1-CG2 4.21Å; F237-T245 HydrophobicContact CD2-CG2 4.47Å; F237-T245 HydrophobicContact CE1-CG2 3.53Å; F237-T245 HydrophobicContact CE2-CG2 3.84Å; F237-T245 HydrophobicContact CZ-CG2 3.33Å
246	S	97.4	Very high	95.3	Very high	49 Å²	49	56.2 Å²	56.2	34%	0.343	30%	0.302	S	S	.	.	S	Bend	trans	-88.3	-27.8	175.9	67.5	0	0	0	0	112.7	K224 L236	K224-S246 PolarHBondContact NZ-OG 2.81Å; K224-S246 VanDerWaalsContact NZ-OG 3.12Å; L236-S246 WeakPolarHBondContact O-CA 3.49Å; L236-S246 WeakPolarHBondContact O-CB 3.33Å; L236-S246 PolarHBondContact O-N 3.3Å; L236-S246 PolarHBondContact O-OG 3.34Å
247	D	97.6	Very high	95.3	Very high	65 Å²	65	58.5 Å²	58.5	35%	0.348	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	160.9	179.8	-165.7	5.3	0	0	0	109.4	L236 N284	L236-D247 HydrophobicContact CB-CB 4.21Å; L236-D247 HydrophobicContact CD1-CB 4.23Å; L236-D247 PolarHBondContact N-O 3.31Å; L236-D247 PolarHBondContact O-N 2.86Å; D247-N284 PolarHBondContact OD2-ND2 2.93Å
248	R	96.3	Very high	95.3	Very high	152 Å²	152	58.7 Å²	58.7	57%	0.574	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.3	149.3	174	67.3	177.5	-171.8	154.2	0.2	111.7	T233 I234 Y235	T233-R248 HydrophobicContact CG2-CB 4.15Å; I234-R248 VanDerWaalsContact O-CA 3.29Å; I234-R248 WeakPolarHBondContact O-CA 3.49Å; Y235-R248 HydrophobicContact CD1-CB 3.81Å; Y235-R248 HydrophobicContact CE1-CB 4.22Å
249	F	96.6	Very high	95.3	Very high	30 Å²	30	55.8 Å²	55.8	13%	0.132	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	144.2	171.7	68.9	-77.8	0	0	0	112.1	I234 V251 V279 I281 N284	I234-F249 HydrophobicContact CB-CD1 4.32Å; I234-F249 HydrophobicContact CB-CE1 3.83Å; I234-F249 HydrophobicContact CB-CZ 4.04Å; I234-F249 HydrophobicContact CD1-CE1 4.42Å; I234-F249 HydrophobicContact CD1-CE2 4.33Å; I234-F249 HydrophobicContact CD1-CZ 3.81Å; I234-F249 HydrophobicContact CG1-CZ 4.38Å; I234-F249 HydrophobicContact CG2-CE1 3.99Å; I234-F249 HydrophobicContact CG2-CZ 4.4Å; I234-F249 PolarHBondContact N-O 2.72Å; I234-F249 PolarHBondContact O-N 3.43Å; I234-F249 VanDerWaalsContact O-N 3.09Å; F249-V251 HydrophobicContact CE2-CG2 4.17Å; F249-V279 HydrophobicContact CE2-CG1 3.57Å; F249-V279 HydrophobicContact CZ-CG1 3.47Å; F249-V279 VanDerWaalsContact CZ-CG1 3.47Å; F249-I281 HydrophobicContact CE1-CD1 4Å; F249-I281 HydrophobicContact CZ-CD1 3.89Å; F249-N284 HydrophobicContact CB-CB 4.45Å; F249-N284 HydrophobicContact CD1-CB 3.56Å; F249-N284 HydrophobicContact CD2-CB 4.18Å; F249-N284 HydrophobicContact CE1-CB 3.71Å; F249-N284 HydrophobicContact CE2-CB 4.31Å; F249-N284 HydrophobicContact CG-CB 3.8Å; F249-N284 HydrophobicContact CZ-CB 4.07Å
250	A	94.8	Very high	95.3	Very high	73 Å²	73	53.7 Å²	53.7	60%	0.603	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	130.5	176.3	0	0	0	0	0	110.8
251	V	88.6	Confident	95.5	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.024	28%	0.278	C	S	.	.			trans	-81.8	140.5	161.9	-178	0	0	0	0	105.8	G232 I234 F249 A253 I256 R277 V279 V286	G232-V251 PolarHBondContact O-N 2.65Å; I234-V251 HydrophobicContact CD1-CG2 3.83Å; I234-V251 HydrophobicContact CG1-CG2 4.02Å; F249-V251 HydrophobicContact CE2-CG2 4.17Å; V251-A253 HydrophobicContact CG1-CB 4.29Å; V251-A253 PolarHBondContact O-N 3.05Å; V251-I256 HydrophobicContact CB-CD1 4.19Å; V251-I256 HydrophobicContact CG2-CD1 3.85Å; V251-R277 VanDerWaalsContact CG1-CD 3.47Å; V251-V279 HydrophobicContact CG2-CG2 4.25Å; V251-V286 HydrophobicContact CB-CG2 4.41Å; V251-V286 HydrophobicContact CG1-CG2 3.89Å; V251-V286 HydrophobicContact CG2-CG2 4.4Å
252	R	86.7	Confident	95.4	Very high	199 Å²	199	49.1 Å²	49.1	75%	0.751	27%	0.265	S	S	*	.	S	Bend	trans	-74.4	65.5	179.8	-63.4	176.1	71.6	165.9	1.2	110	R277	R252-R277 PolarHBondContact O-NH2 2.83Å
253	A	89.5	Confident	95.3	Very high	17 Å²	17	51.2 Å²	51.2	14%	0.14	28%	0.279	C	S	.	.	S	Bend	trans	-146.2	154	-179.6	0	0	0	0	0	107.3	V251	V251-A253 HydrophobicContact CG1-CB 4.29Å; V251-A253 PolarHBondContact O-N 3.05Å
254	E	90.6	Very high	95.1	Very high	165 Å²	165	54.2 Å²	54.2	77%	0.771	28%	0.284	S	S	*	.	S	Bend	trans	-74.5	-39.1	178.1	-65.9	-175.3	173.1	0	0	111.5	E231 G232	E231-E254 CarbonylContact C-O 3.59Å; E231-E254 WeakPolarHBondContact CA-O 3.25Å; G232-E254 PolarHBondContact N-O 2.89Å; G232-E254 VanDerWaalsContact N-O 3.14Å
255	S	95.9	Very high	94.9	Very high	8 Å²	8	53.8 Å²	53.8	6%	0.056	28%	0.279	C	S	.	.			trans	-134	159.2	177	67.8	0	0	0	0	112.1	S230 D257 S271 T272	S230-S255 WeakPolarHBondContact O-CA 3.48Å; S230-S255 WeakPolarHBondContact O-CB 3.34Å; S255-D257 PolarHBondContact OG-OD1 3.2Å; S255-D257 PolarHBondContact OG-OD2 3.01Å; S255-S271 VanDerWaalsContact O-CB 3.23Å; S255-S271 WeakPolarHBondContact O-CB 3.47Å; S255-S271 PolarHBondContact O-OG 3.12Å; S255-T272 WeakPolarHBondContact OG-CB 3.33Å; S255-T272 WeakPolarHBondContact OG-CG2 3.27Å; S255-T272 PolarHBondContact OG-N 3.38Å; S255-T272 PolarHBondContact OG-OG1 2.97Å
256	I	97.9	Very high	94.8	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.267	C	S	.	.			trans	-119.6	122.3	158.4	-66.2	163	0	0	0	105.2	T214 S229 I234 V251 M259 T269 G270	T214-I256 WeakPolarHBondContact CB-O 3.34Å; T214-I256 WeakPolarHBondContact CG2-O 3.31Å; T214-I256 PolarHBondContact OG1-O 3.18Å; S229-I256 CarbonylContact C-O 3.52Å; S229-I256 PolarHBondContact O-N 2.95Å; I234-I256 HydrophobicContact CD1-CD1 4.18Å; I234-I256 HydrophobicContact CG1-CD1 3.5Å; V251-I256 HydrophobicContact CB-CD1 4.19Å; V251-I256 HydrophobicContact CG2-CD1 3.85Å; I256-M259 HydrophobicContact CG2-CG 3.63Å; I256-M259 HydrophobicContact CG2-SD 4.08Å; I256-T269 HydrophobicContact CG2-CG2 4.29Å; I256-G270 WeakPolarHBondContact CA-O 3.43Å
257	D	97.8	Very high	94.8	Very high	49 Å²	49	49.7 Å²	49.7	26%	0.262	25%	0.251	S	S	.	.			trans	-108.6	-35.4	-173.9	-55.3	-59.3	0	0	0	111.2	S255 G270 S271 T272	S255-D257 PolarHBondContact OG-OD1 3.2Å; S255-D257 PolarHBondContact OG-OD2 3.01Å; D257-G270 PolarHBondContact N-O 3.24Å; D257-S271 WeakPolarHBondContact OD2-CA 3.21Å; D257-T272 WeakPolarHBondContact OD2-CG2 3.39Å; D257-T272 PolarHBondContact OD2-N 2.96Å
258	C	97.6	Very high	94.8	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.027	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	151.9	176.5	53	0	0	0	0	111.7	T269 G270 E300	C258-T269 WeakPolarHBondContact O-CA 3.33Å; C258-G270 PolarHBondContact O-N 2.99Å; C258-E300 VanDerWaalsContact CB-OE1 3.28Å; C258-E300 WeakPolarHBondContact CB-OE1 3.49Å
259	M	98.2	Very high	94.9	Very high	13 Å²	13	39.4 Å²	39.4	6%	0.064	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	142.7	177.3	-66.4	-165.4	-56.4	0	0	112	S215 T217 A226 I234 I256 L267 C268 T269	S215-M259 WeakPolarHBondContact OG-CE 3.33Å; S215-M259 WeakPolarHBondContact OG-CG 3.5Å; T217-M259 HydrophobicContact CG2-CE 4.42Å; A226-M259 WeakPolarHBondContact O-CE 3.38Å; I234-M259 HydrophobicContact CD1-SD 4.29Å; I234-M259 HydrophobicContact CG1-SD 4.39Å; I256-M259 HydrophobicContact CG2-CG 3.63Å; I256-M259 HydrophobicContact CG2-SD 4.08Å; M259-L267 HydrophobicContact SD-CD1 4.06Å; M259-L267 HydrophobicContact SD-CD2 4.34Å; M259-C268 VanDerWaalsContact CA-O 3.28Å; M259-C268 WeakPolarHBondContact CA-O 3.5Å; M259-T269 HydrophobicContact CG-CG2 3.93Å; M259-T269 HydrophobicContact SD-CG2 4.06Å
260	V	98	Very high	95	Very high	17 Å²	17	38 Å²	38	10%	0.103	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	131.5	172.7	66.8	0	0	0	0	111.3	L267 C268 L301 L303 L310	V260-L267 CarbonylContact O-C 3.58Å; V260-L267 WeakPolarHBondContact O-CA 3.39Å; V260-L267 WeakPolarHBondContact O-CB 3.19Å; V260-C268 HydrophobicContact CG1-CB 4.1Å; V260-C268 PolarHBondContact N-O 3.25Å; V260-C268 PolarHBondContact O-N 3.34Å; V260-L301 HydrophobicContact CB-CB 4.21Å; V260-L301 HydrophobicContact CG1-CB 3.76Å; V260-L301 HydrophobicContact CG1-CD1 4.25Å; V260-L303 HydrophobicContact CG2-CB 3.93Å; V260-L310 HydrophobicContact CG1-CD1 3.41Å; V260-L310 VanDerWaalsContact CG1-CD1 3.41Å
261	P	97.1	Very high	95.1	Very high	48 Å²	48	34.5 Å²	34.5	31%	0.312	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	131.9	175.6	31	-34.4	0	0	0	110.3	T217 M219	T217-P261 WeakPolarHBondContact OG1-CD 3.17Å; T217-P261 WeakPolarHBondContact OG1-CG 3.41Å; M219-P261 HydrophobicContact SD-CB 3.82Å
262	V	95.3	Very high	95.4	Very high	9 Å²	9	37.1 Å²	37.1	6%	0.055	19%	0.189	C	C	.	.	S	Bend	trans	-100.5	-39.9	175.8	-178.6	0	0	0	0	110.8	L266 C268 M324 R328	V262-L266 PolarHBondContact N-O 3.17Å; V262-C268 HydrophobicContact CG2-CB 4.43Å; V262-C268 VanDerWaalsContact CG2-SG 3.59Å; V262-M324 HydrophobicContact CG2-SD 4.39Å; V262-R328 HydrophobicContact CG1-CG 4.22Å; V262-R328 PolarHBondContact O-NH1 3.35Å; V262-R328 PolarHBondContact O-NH2 3.35Å; V262-R328 VanDerWaalsContact O-NH2 3.17Å
263	T	93.6	Very high	95.8	Very high	54 Å²	54	30.5 Å²	30.5	33%	0.331	17%	0.168	S	C	.	.	S	Bend	trans	-139.9	176.4	173	74.7	0	0	0	0	109.1	S265 L266 R328	T263-S265 PolarHBondContact O-N 2.78Å; T263-S265 PolarHBondContact OG1-N 3.5Å; T263-L266 HydrophobicContact CG2-CB 4.43Å; T263-L266 PolarHBondContact N-O 2.91Å; T263-L266 PolarHBondContact O-N 3Å; T263-L266 VanDerWaalsContact O-O 3.07Å; T263-L266 WeakPolarHBondContact OG1-CB 3.48Å; T263-L266 PolarHBondContact OG1-N 3.18Å; T263-R328 HydrophobicContact CG2-CG 4.41Å
264	E	92.9	Very high	96.1	Very high	96 Å²	96	29.7 Å²	29.7	45%	0.449	16%	0.161	S	C	.	.	S	Bend	trans	-58.1	-22.2	176.5	-64.3	-64.5	177.4	0	0	114.7	K220 C221	K220-E264 WeakPolarHBondContact CA-O 3.41Å; K220-E264 WeakPolarHBondContact CD-O 3.21Å; K220-E264 PolarHBondContact N-O 2.98Å; C221-E264 WeakPolarHBondContact CA-OE2 3.45Å; C221-E264 PolarHBondContact N-OE2 3.24Å
265	S	93.6	Very high	96.4	Very high	33 Å²	33	22.9 Å²	22.9	23%	0.231	13%	0.131	C	C	.	.	S	Bend	trans	-121	-5	-178.7	-52.5	0	0	0	0	113.4	K220 T263 N280 I281	K220-S265 PolarHBondContact NZ-OG 3.32Å; T263-S265 PolarHBondContact O-N 2.78Å; T263-S265 PolarHBondContact OG1-N 3.5Å; S265-N280 CarbonylContact O-C 3.55Å; S265-N280 VanDerWaalsContact O-CA 3.24Å; S265-N280 WeakPolarHBondContact O-CA 3.37Å; S265-N280 PolarHBondContact O-OD1 2.84Å; S265-N280 VanDerWaalsContact O-OD1 3.08Å; S265-I281 PolarHBondContact O-N 3.3Å
266	L	95.2	Very high	96.5	Very high	8 Å²	8	22.5 Å²	22.5	4%	0.042	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	128.1	-173.6	-166.7	72.5	0	0	0	109.9	V262 T263 N280 V287 L327	V262-L266 PolarHBondContact N-O 3.17Å; T263-L266 HydrophobicContact CG2-CB 4.43Å; T263-L266 PolarHBondContact N-O 2.91Å; T263-L266 PolarHBondContact O-N 3Å; T263-L266 VanDerWaalsContact O-O 3.07Å; T263-L266 WeakPolarHBondContact OG1-CB 3.48Å; T263-L266 PolarHBondContact OG1-N 3.18Å; L266-N280 HydrophobicContact CD1-CB 4.13Å; L266-V287 HydrophobicContact CD1-CG2 3.79Å; L266-L327 HydrophobicContact CD2-CD1 3.85Å; L266-L327 HydrophobicContact CD2-CD2 3.94Å; L266-L327 HydrophobicContact CD2-CG 3.52Å
267	L	96.9	Very high	96.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	159.1	174	60.5	79.9	0	0	0	110.2	T217 M219 A226 I234 M259 V260 T269 V279 I281	T217-L267 HydrophobicContact CG2-CD2 4.18Å; M219-L267 HydrophobicContact CE-CB 4.09Å; M219-L267 HydrophobicContact CE-CD2 4.08Å; M219-L267 HydrophobicContact CE-CG 4.33Å; M219-L267 HydrophobicContact CG-CD2 4.2Å; M219-L267 HydrophobicContact SD-CB 4.29Å; M219-L267 HydrophobicContact SD-CD2 4.06Å; A226-L267 HydrophobicContact CB-CD2 4.11Å; I234-L267 HydrophobicContact CD1-CD1 4.2Å; M259-L267 HydrophobicContact SD-CD1 4.06Å; M259-L267 HydrophobicContact SD-CD2 4.34Å; V260-L267 CarbonylContact O-C 3.58Å; V260-L267 WeakPolarHBondContact O-CA 3.39Å; V260-L267 WeakPolarHBondContact O-CB 3.19Å; L267-T269 HydrophobicContact CD1-CG2 3.44Å; L267-T269 VanDerWaalsContact CD1-CG2 3.44Å; L267-V279 HydrophobicContact CD1-CB 3.89Å; L267-V279 HydrophobicContact CD1-CG2 4.44Å; L267-V279 PolarHBondContact N-O 2.84Å; L267-V279 PolarHBondContact O-N 2.85Å; L267-I281 HydrophobicContact CD2-CD1 3.9Å; L267-I281 HydrophobicContact CD2-CG1 3.8Å; L267-I281 HydrophobicContact CG-CD1 4.36Å; L267-I281 HydrophobicContact CG-CG1 4.25Å
268	C	98.1	Very high	96.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	143.4	169.9	-70.7	0	0	0	0	109.5	M259 V260 V262 I276 R277 L301 L310	M259-C268 VanDerWaalsContact CA-O 3.28Å; M259-C268 WeakPolarHBondContact CA-O 3.5Å; V260-C268 HydrophobicContact CG1-CB 4.1Å; V260-C268 PolarHBondContact N-O 3.25Å; V260-C268 PolarHBondContact O-N 3.34Å; V262-C268 HydrophobicContact CG2-CB 4.43Å; V262-C268 VanDerWaalsContact CG2-SG 3.59Å; C268-I276 HydrophobicContact CB-CG2 4.38Å; C268-R277 CarbonylContact C-O 3.6Å; C268-R277 VanDerWaalsContact CA-O 3.26Å; C268-R277 WeakPolarHBondContact CA-O 3.33Å; C268-L301 HydrophobicContact CB-CD1 4.1Å; C268-L310 HydrophobicContact CB-CD2 4.06Å
269	T	98.1	Very high	96.3	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	136.3	176.9	67.3	0	0	0	0	109.8	I234 I256 C258 M259 L267 I276 R277 V279	I234-T269 HydrophobicContact CD1-CG2 4.21Å; I256-T269 HydrophobicContact CG2-CG2 4.29Å; C258-T269 WeakPolarHBondContact O-CA 3.33Å; M259-T269 HydrophobicContact CG-CG2 3.93Å; M259-T269 HydrophobicContact SD-CG2 4.06Å; L267-T269 HydrophobicContact CD1-CG2 3.44Å; L267-T269 VanDerWaalsContact CD1-CG2 3.44Å; T269-I276 WeakPolarHBondContact O-CA 3.38Å; T269-R277 PolarHBondContact N-O 2.76Å; T269-R277 PolarHBondContact O-N 3.46Å; T269-V279 HydrophobicContact CG2-CG2 3.91Å
270	G	97.8	Very high	96.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	148.8	165.1	0	0	0	0	0	110.5	I256 D257 C258	I256-G270 WeakPolarHBondContact CA-O 3.43Å; D257-G270 PolarHBondContact N-O 3.24Å; C258-G270 PolarHBondContact O-N 2.99Å
271	S	97.2	Very high	96.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.112	C	C	.	.			trans	-140.1	158	-173.5	-68.6	0	0	0	0	109.8	S255 D257 D273 G274 R277 V298	S255-S271 VanDerWaalsContact O-CB 3.23Å; S255-S271 WeakPolarHBondContact O-CB 3.47Å; S255-S271 PolarHBondContact O-OG 3.12Å; D257-S271 WeakPolarHBondContact OD2-CA 3.21Å; S271-D273 WeakPolarHBondContact CB-OD1 3.5Å; S271-D273 PolarHBondContact O-N 3.17Å; S271-G274 PolarHBondContact O-N 2.66Å; S271-R277 PolarHBondContact OG-NH1 2.95Å; S271-V298 PolarHBondContact O-N 2.75Å
272	T	96.5	Very high	95.9	Very high	60 Å²	60	20.5 Å²	20.5	37%	0.368	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.4	175.4	46.3	0	0	0	0	113.8	S255 D257 G274 P297	S255-T272 WeakPolarHBondContact OG-CB 3.33Å; S255-T272 WeakPolarHBondContact OG-CG2 3.27Å; S255-T272 PolarHBondContact OG-N 3.38Å; S255-T272 PolarHBondContact OG-OG1 2.97Å; D257-T272 WeakPolarHBondContact OD2-CG2 3.39Å; D257-T272 PolarHBondContact OD2-N 2.96Å; T272-G274 PolarHBondContact O-N 3.33Å; T272-G274 VanDerWaalsContact O-N 3.17Å; T272-P297 WeakPolarHBondContact O-CA 3.41Å
273	D	94.6	Very high	95.8	Very high	59 Å²	59	22 Å²	22	32%	0.316	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-1.7	173.5	69.7	5.3	0	0	0	114.1	S271 V275 R277	S271-D273 WeakPolarHBondContact CB-OD1 3.5Å; S271-D273 PolarHBondContact O-N 3.17Å; D273-V275 PolarHBondContact O-N 3.48Å; D273-V275 WeakPolarHBondContact OD1-CB 3.23Å; D273-V275 PolarHBondContact OD1-N 2.84Å; D273-R277 IonicContact OD1-CZ 3.77Å; D273-R277 IonicContact OD1-NH1 3.31Å; D273-R277 PolarHBondContact OD1-NH1 2.97Å; D273-R277 IonicContact OD1-NH2 3.71Å; D273-R277 IonicContact OD2-CZ 2.75Å; D273-R277 VanDerWaalsContact OD2-CZ 3.27Å; D273-R277 IonicContact OD2-NH1 3.85Å; D273-R277 PolarHBondContact OD2-NH1 2.87Å; D273-R277 IonicContact OD2-NH2 2.93Å; D273-R277 PolarHBondContact OD2-NH2 3.12Å
274	G	95.3	Very high	95.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	79.6	-0.1	178.6	0	0	0	0	0	114.6	S271 T272 Q292 H293 E296	S271-G274 PolarHBondContact O-N 2.66Å; T272-G274 PolarHBondContact O-N 3.33Å; T272-G274 VanDerWaalsContact O-N 3.17Å; G274-Q292 CarbonylContact O-C 3.57Å; G274-Q292 WeakPolarHBondContact O-CA 3.32Å; G274-Q292 WeakPolarHBondContact O-CB 3.49Å; G274-H293 WeakPolarHBondContact CA-O 3.47Å; G274-H293 PolarHBondContact O-N 2.83Å; G274-E296 WeakPolarHBondContact CA-O 3.29Å
275	V	96.9	Very high	95.8	Very high	23 Å²	23	23.1 Å²	23.1	14%	0.139	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	125.6	-175.4	-179.5	0	0	0	0	111.2	D273 R277 S289 Q292	D273-V275 PolarHBondContact O-N 3.48Å; D273-V275 WeakPolarHBondContact OD1-CB 3.23Å; D273-V275 PolarHBondContact OD1-N 2.84Å; V275-R277 HydrophobicContact CG1-CG 4.08Å; V275-R277 PolarHBondContact O-NH1 2.88Å; V275-S289 WeakPolarHBondContact CG1-OG 3.49Å; V275-Q292 HydrophobicContact CG2-CB 4.14Å
276	I	97.6	Very high	95.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	119.9	175.4	-55.4	163.7	0	0	0	108.5	C268 T269 S289 V290 G291 V298 L301 L310 S312 W322	C268-I276 HydrophobicContact CB-CG2 4.38Å; T269-I276 WeakPolarHBondContact O-CA 3.38Å; I276-S289 CarbonylContact O-C 3.59Å; I276-S289 WeakPolarHBondContact O-CA 3.32Å; I276-V290 HydrophobicContact CB-CB 4.26Å; I276-V290 HydrophobicContact CG2-CB 3.96Å; I276-V290 HydrophobicContact CG2-CG1 4.38Å; I276-V290 HydrophobicContact CG2-CG2 4.4Å; I276-V290 PolarHBondContact O-N 3.47Å; I276-G291 PolarHBondContact N-O 2.89Å; I276-V298 HydrophobicContact CG1-CG1 4.47Å; I276-V298 HydrophobicContact CG1-CG2 4.01Å; I276-L301 HydrophobicContact CD1-CD2 4.27Å; I276-L301 HydrophobicContact CG1-CD2 4.39Å; I276-L301 HydrophobicContact CG2-CD1 4.34Å; I276-L301 HydrophobicContact CG2-CD2 4.35Å; I276-L310 HydrophobicContact CG2-CD2 3.95Å; I276-S312 VanDerWaalsContact CD1-CB 3.43Å; I276-S312 VanDerWaalsContact CD1-OG 3.3Å; I276-S312 WeakPolarHBondContact CD1-OG 3.25Å; I276-W322 HydrophobicContact CD1-CD2 4.49Å; I276-W322 HydrophobicContact CD1-CZ2 3.77Å
277	R	96.8	Very high	95.7	Very high	12 Å²	12	24 Å²	24	5%	0.045	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.7	-176	-61.1	170.8	171.5	77.9	-2.5	110.9	V251 R252 C268 T269 S271 D273 V275 V279 V286 L345	V251-R277 VanDerWaalsContact CG1-CD 3.47Å; R252-R277 PolarHBondContact O-NH2 2.83Å; C268-R277 CarbonylContact C-O 3.6Å; C268-R277 VanDerWaalsContact CA-O 3.26Å; C268-R277 WeakPolarHBondContact CA-O 3.33Å; T269-R277 PolarHBondContact N-O 2.76Å; T269-R277 PolarHBondContact O-N 3.46Å; S271-R277 PolarHBondContact OG-NH1 2.95Å; D273-R277 IonicContact OD1-CZ 3.77Å; D273-R277 IonicContact OD1-NH1 3.31Å; D273-R277 PolarHBondContact OD1-NH1 2.97Å; D273-R277 IonicContact OD1-NH2 3.71Å; D273-R277 IonicContact OD2-CZ 2.75Å; D273-R277 VanDerWaalsContact OD2-CZ 3.27Å; D273-R277 IonicContact OD2-NH1 3.85Å; D273-R277 PolarHBondContact OD2-NH1 2.87Å; D273-R277 IonicContact OD2-NH2 2.93Å; D273-R277 PolarHBondContact OD2-NH2 3.12Å; V275-R277 HydrophobicContact CG1-CG 4.08Å; V275-R277 PolarHBondContact O-NH1 2.88Å; R277-V279 HydrophobicContact CB-CG2 4.4Å; R277-V286 HydrophobicContact CB-CG1 4.49Å; R277-L345 HydrophobicContact CG-CD1 4.4Å
278	A	96.6	Very high	95.4	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.5	167.9	0	0	0	0	0	110.3	V287 G288 V290 L327 L348	A278-V287 HydrophobicContact CB-CB 4.21Å; A278-V287 WeakPolarHBondContact O-CB 3.23Å; A278-V287 PolarHBondContact O-N 2.89Å; A278-G288 PolarHBondContact N-O 2.88Å; A278-V290 HydrophobicContact CB-CG2 3.88Å; A278-L327 HydrophobicContact CB-CD1 3.4Å; A278-L327 VanDerWaalsContact CB-CD1 3.4Å; A278-L327 HydrophobicContact CB-CD2 3.82Å; A278-L327 HydrophobicContact CB-CG 4.25Å; A278-L348 HydrophobicContact CB-CD1 3.83Å
279	V	96.6	Very high	95.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.2	-173.8	-171.8	0	0	0	0	110.1	I234 F249 V251 L267 T269 R277 I281 V286	I234-V279 HydrophobicContact CD1-CB 4.39Å; I234-V279 HydrophobicContact CD1-CG1 3.92Å; F249-V279 HydrophobicContact CE2-CG1 3.57Å; F249-V279 HydrophobicContact CZ-CG1 3.47Å; F249-V279 VanDerWaalsContact CZ-CG1 3.47Å; V251-V279 HydrophobicContact CG2-CG2 4.25Å; L267-V279 HydrophobicContact CD1-CB 3.89Å; L267-V279 HydrophobicContact CD1-CG2 4.44Å; L267-V279 PolarHBondContact N-O 2.84Å; L267-V279 PolarHBondContact O-N 2.85Å; T269-V279 HydrophobicContact CG2-CG2 3.91Å; R277-V279 HydrophobicContact CB-CG2 4.4Å; V279-I281 HydrophobicContact CG1-CD1 4.41Å; V279-V286 HydrophobicContact CG2-CG2 4.46Å
280	N	95.8	Very high	95	Very high	14 Å²	14	24.7 Å²	24.7	8%	0.075	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	139.5	175.2	-169.2	83.7	0	0	0	110.5	S265 L266 P283 N284 R285 V287 V332	S265-N280 CarbonylContact O-C 3.55Å; S265-N280 VanDerWaalsContact O-CA 3.24Å; S265-N280 WeakPolarHBondContact O-CA 3.37Å; S265-N280 PolarHBondContact O-OD1 2.84Å; S265-N280 VanDerWaalsContact O-OD1 3.08Å; L266-N280 HydrophobicContact CD1-CB 4.13Å; N280-P283 CarbonylContact C-O 3.47Å; N280-P283 WeakPolarHBondContact ND2-CD 3.18Å; N280-P283 PolarHBondContact ND2-O 2.9Å; N280-N284 WeakPolarHBondContact O-CA 3.19Å; N280-R285 PolarHBondContact N-O 3.04Å; N280-R285 PolarHBondContact O-N 3.03Å; N280-V287 HydrophobicContact CB-CG2 4.05Å; N280-V332 HydrophobicContact CB-CB 4.46Å; N280-V332 HydrophobicContact CB-CG1 4.47Å; N280-V332 HydrophobicContact CB-CG2 3.96Å
281	I	95.1	Very high	94.8	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	118.3	-179.6	-53.9	-55.7	0	0	0	108.7	M219 K220 I234 L236 F249 S265 L267 V279	M219-I281 HydrophobicContact CE-CB 4.28Å; M219-I281 HydrophobicContact CE-CG1 3.8Å; M219-I281 HydrophobicContact CG-CG1 4.38Å; K220-I281 PolarHBondContact NZ-O 2.94Å; I234-I281 HydrophobicContact CG2-CD1 4.41Å; L236-I281 HydrophobicContact CD1-CG2 3.93Å; L236-I281 HydrophobicContact CD2-CD1 4.39Å; L236-I281 HydrophobicContact CD2-CG2 3.92Å; F249-I281 HydrophobicContact CE1-CD1 4Å; F249-I281 HydrophobicContact CZ-CD1 3.89Å; S265-I281 PolarHBondContact O-N 3.3Å; L267-I281 HydrophobicContact CD2-CD1 3.9Å; L267-I281 HydrophobicContact CD2-CG1 3.8Å; L267-I281 HydrophobicContact CG-CD1 4.36Å; L267-I281 HydrophobicContact CG-CG1 4.25Å; V279-I281 HydrophobicContact CG1-CD1 4.41Å
282	L	93.9	Very high	94.8	Very high	63 Å²	63	28.2 Å²	28.2	33%	0.33	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	81.2	179.9	-58.7	173	0	0	0	112.4	K220 K224 L236 N284	K220-L282 PolarHBondContact NZ-O 3.31Å; K220-L282 VanDerWaalsContact NZ-O 3.1Å; K224-L282 HydrophobicContact CD-CD1 4.28Å; K224-L282 HydrophobicContact CG-CD1 4.09Å; L236-L282 HydrophobicContact CD1-CD2 4.43Å; L236-L282 HydrophobicContact CD1-CG 4.37Å; L282-N284 PolarHBondContact N-OD1 2.91Å
283	P	93.8	Very high	94.8	Very high	40 Å²	40	25.4 Å²	25.4	26%	0.26	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	cis	-78.8	132.6	11.2	29.2	-36	0	0	0	114.6	N280 R285 V332	N280-P283 CarbonylContact C-O 3.47Å; N280-P283 WeakPolarHBondContact ND2-CD 3.18Å; N280-P283 PolarHBondContact ND2-O 2.9Å; P283-R285 PolarHBondContact O-N 2.82Å; P283-V332 HydrophobicContact CG-CG1 3.95Å
284	N	94.4	Very high	94.8	Very high	48 Å²	48	26.7 Å²	26.7	26%	0.257	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	110	-175.9	-60.6	-15.1	0	0	0	111.4	D247 F249 N280 L282	D247-N284 PolarHBondContact OD2-ND2 2.93Å; F249-N284 HydrophobicContact CB-CB 4.45Å; F249-N284 HydrophobicContact CD1-CB 3.56Å; F249-N284 HydrophobicContact CD2-CB 4.18Å; F249-N284 HydrophobicContact CE1-CB 3.71Å; F249-N284 HydrophobicContact CE2-CB 4.31Å; F249-N284 HydrophobicContact CG-CB 3.8Å; F249-N284 HydrophobicContact CZ-CB 4.07Å; N280-N284 WeakPolarHBondContact O-CA 3.19Å; L282-N284 PolarHBondContact N-OD1 2.91Å
285	R	91.5	Very high	94.5	Very high	126 Å²	126	29.9 Å²	29.9	48%	0.475	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	133.6	-175.5	179.8	171.9	175.7	-177.4	-3.5	112.8	N280 P283 V287	N280-R285 PolarHBondContact N-O 3.04Å; N280-R285 PolarHBondContact O-N 3.03Å; P283-R285 PolarHBondContact O-N 2.82Å; R285-V287 PolarHBondContact O-N 3.3Å
286	V	93.9	Very high	94.5	Very high	35 Å²	35	32.2 Å²	32.2	21%	0.212	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	117.6	163.1	-173.9	0	0	0	0	108.9	V251 R277 V279 L345	V251-V286 HydrophobicContact CB-CG2 4.41Å; V251-V286 HydrophobicContact CG1-CG2 3.89Å; V251-V286 HydrophobicContact CG2-CG2 4.4Å; R277-V286 HydrophobicContact CB-CG1 4.49Å; V279-V286 HydrophobicContact CG2-CG2 4.46Å; V286-L345 HydrophobicContact CG1-CD2 4.07Å
287	V	92.4	Very high	94.5	Very high	23 Å²	23	34.1 Å²	34.1	14%	0.139	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-43.8	-178.5	-179.7	0	0	0	0	110.4	L266 A278 N280 R285 V330 V332 L348	L266-V287 HydrophobicContact CD1-CG2 3.79Å; A278-V287 HydrophobicContact CB-CB 4.21Å; A278-V287 WeakPolarHBondContact O-CB 3.23Å; A278-V287 PolarHBondContact O-N 2.89Å; N280-V287 HydrophobicContact CB-CG2 4.05Å; R285-V287 PolarHBondContact O-N 3.3Å; V287-V330 HydrophobicContact CG1-CB 4.45Å; V287-V330 HydrophobicContact CG1-CG1 3.74Å; V287-V330 HydrophobicContact CG1-CG2 4.47Å; V287-V332 HydrophobicContact CG2-CG2 3.94Å; V287-L348 HydrophobicContact CB-CD1 4.25Å; V287-L348 HydrophobicContact CG1-CD1 3.84Å; V287-L348 HydrophobicContact CG1-CD2 4.36Å
288	G	90	Very high	94.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.3	-175.5	-178	0	0	0	0	0	112.4	A278 R346	A278-G288 PolarHBondContact N-O 2.88Å; G288-R346 CarbonylContact C-O 3.58Å; G288-R346 VanDerWaalsContact CA-O 3.25Å; G288-R346 WeakPolarHBondContact CA-O 3.45Å
289	S	93.7	Very high	94.6	Very high	12 Å²	12	36.6 Å²	36.6	8%	0.084	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	130.9	174.3	175.2	0	0	0	0	109.8	V275 I276 G291 R346 L348 T352	V275-S289 WeakPolarHBondContact CG1-OG 3.49Å; I276-S289 CarbonylContact O-C 3.59Å; I276-S289 WeakPolarHBondContact O-CA 3.32Å; S289-G291 PolarHBondContact OG-N 3.42Å; S289-G291 PolarHBondContact OG-O 3.04Å; S289-R346 PolarHBondContact N-O 3.2Å; S289-L348 WeakPolarHBondContact O-CB 3.45Å; S289-L348 PolarHBondContact O-N 2.9Å; S289-T352 WeakPolarHBondContact O-CG2 3.39Å
290	V	94.6	Very high	94.7	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-36.1	174.2	174.6	0	0	0	0	110.6	I276 A278 L310 W322 M324 L327 S349 T352	I276-V290 HydrophobicContact CB-CB 4.26Å; I276-V290 HydrophobicContact CG2-CB 3.96Å; I276-V290 HydrophobicContact CG2-CG1 4.38Å; I276-V290 HydrophobicContact CG2-CG2 4.4Å; I276-V290 PolarHBondContact O-N 3.47Å; A278-V290 HydrophobicContact CB-CG2 3.88Å; V290-L310 HydrophobicContact CG1-CD2 4.17Å; V290-W322 HydrophobicContact CG1-CB 3.78Å; V290-W322 HydrophobicContact CG1-CD2 4.36Å; V290-W322 HydrophobicContact CG1-CG 3.95Å; V290-M324 HydrophobicContact CG1-CE 3.63Å; V290-L327 HydrophobicContact CG2-CD2 4.11Å; V290-S349 WeakPolarHBondContact O-CB 3.25Å; V290-T352 WeakPolarHBondContact O-CG2 3.46Å
291	G	93.8	Very high	94.9	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.1	177.2	-169.2	0	0	0	0	0	111	I276 S289 W322	I276-G291 PolarHBondContact N-O 2.89Å; S289-G291 PolarHBondContact OG-N 3.42Å; S289-G291 PolarHBondContact OG-O 3.04Å; G291-W322 VanDerWaalsContact CA-CH2 3.49Å
292	Q	96.1	Very high	95	Very high	75 Å²	75	39.4 Å²	39.4	35%	0.35	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	154	173.3	66.2	-176.6	50.1	0	0	113.1	G274 V275 P294	G274-Q292 CarbonylContact O-C 3.57Å; G274-Q292 WeakPolarHBondContact O-CA 3.32Å; G274-Q292 WeakPolarHBondContact O-CB 3.49Å; V275-Q292 HydrophobicContact CG2-CB 4.14Å; Q292-P294 HydrophobicContact CG-CG 4.39Å
293	H	96.9	Very high	95.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.217	C	C	.	.			trans	-97.2	105.4	156.9	-65.9	-102.3	0	0	0	106.3	G274 G295 E296 S312 G314 D316 R318 K320	G274-H293 WeakPolarHBondContact CA-O 3.47Å; G274-H293 PolarHBondContact O-N 2.83Å; H293-G295 PolarHBondContact O-N 2.74Å; H293-E296 HydrophobicContact CB-CB 4.36Å; H293-E296 PolarHBondContact O-N 2.73Å; H293-S312 WeakPolarHBondContact NE2-CB 3.33Å; H293-S312 PolarHBondContact NE2-OG 2.91Å; H293-G314 PolarHBondContact CE1-N 2.94Å; H293-D316 IonicContact CE1-OD1 3.8Å; H293-D316 IonicContact CG-OD1 3.08Å; H293-D316 IonicContact CG-OD2 3.96Å; H293-D316 IonicContact ND1-OD1 3.92Å; H293-D316 PolarHBondContact ND1-OD1 3.47Å; H293-D316 IonicContact ND1-OD2 2.83Å; H293-D316 PolarHBondContact ND1-OD2 3.4Å; H293-R318 PolarHBondContact CE1-O 3.37Å; H293-K320 VanDerWaalsContact CE1-CD 3.49Å; H293-K320 WeakPolarHBondContact CE1-CD 3.39Å
294	P	94.2	Very high	95.4	Very high	86 Å²	86	36.9 Å²	36.9	56%	0.558	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	107.3	-166.9	-25.5	34.2	0	0	0	113.6	Q292 E296	Q292-P294 HydrophobicContact CG-CG 4.39Å; P294-E296 VanDerWaalsContact C-N 3.25Å; P294-E296 PolarHBondContact O-N 3.33Å
295	G	89.8	Confident	95.4	Very high	67 Å²	67	38.4 Å²	38.4	69%	0.691	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.3	9.7	176.4	0	0	0	0	0	115.2	H293	H293-G295 PolarHBondContact O-N 2.74Å
296	E	97	Very high	95.5	Very high	73 Å²	73	35.2 Å²	35.2	34%	0.341	21%	0.208	S	C	.	.	S	Bend	trans	-124.6	133.9	-174.1	-68.3	-67.1	173.9	0	0	110.5	G274 H293 P294 H315 D316	G274-E296 WeakPolarHBondContact CA-O 3.29Å; H293-E296 HydrophobicContact CB-CB 4.36Å; H293-E296 PolarHBondContact O-N 2.73Å; P294-E296 VanDerWaalsContact C-N 3.25Å; P294-E296 PolarHBondContact O-N 3.33Å; E296-H315 HydrophobicContact CB-CB 4.21Å; E296-H315 IonicContact OE2-CD2 3.76Å; E296-H315 IonicContact OE2-CG 3.57Å; E296-D316 HydrophobicContact CB-CB 4.01Å; E296-D316 HydrophobicContact CG-CB 3.9Å
297	P	97.8	Very high	95.5	Very high	39 Å²	39	34 Å²	34	25%	0.253	20%	0.202	S	C	.	.			trans	-53.6	143.9	-179.1	-29.5	35.1	0	0	0	114.5	T272 G314 H315	T272-P297 WeakPolarHBondContact O-CA 3.41Å; P297-G314 CarbonylContact O-C 3.45Å; P297-G314 VanDerWaalsContact O-CA 3.32Å; P297-G314 WeakPolarHBondContact O-CA 3.24Å; P297-H315 HydrophobicContact CB-CB 4.35Å; P297-H315 HydrophobicContact CG-CB 4.39Å; P297-H315 PolarHBondContact O-N 3.29Å
298	V	98.3	Very high	95.6	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	111.5	168	-173.7	0	0	0	0	108.7	S271 I276 L301	S271-V298 PolarHBondContact O-N 2.75Å; I276-V298 HydrophobicContact CG1-CG1 4.47Å; I276-V298 HydrophobicContact CG1-CG2 4.01Å; V298-L301 HydrophobicContact CG1-CD2 3.97Å; V298-L301 HydrophobicContact CG1-CG 4.3Å
299	E	97.9	Very high	95.9	Very high	62 Å²	62	39.8 Å²	39.8	29%	0.29	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-46.1	-176	-59.7	-70.5	172.5	0	0	111.2	A41 S313 H315	A41-E299 WeakPolarHBondContact O-CB 3.41Å; E299-S313 PolarHBondContact N-O 3.49Å; E299-H315 IonicContact OE1-CE1 3.25Å; E299-H315 IonicContact OE1-CG 3.03Å; E299-H315 IonicContact OE1-ND1 3.72Å; E299-H315 PolarHBondContact OE1-ND1 2.74Å
300	E	98.3	Very high	96.1	Very high	56 Å²	56	39.2 Å²	39.2	26%	0.262	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	152.3	-175.2	-166.6	57.5	-81	0	0	113	S42 L44 C258 S312 S313	S42-E300 WeakPolarHBondContact O-CB 3.5Å; L44-E300 HydrophobicContact CB-CB 4Å; L44-E300 HydrophobicContact CB-CG 3.81Å; C258-E300 VanDerWaalsContact CB-OE1 3.28Å; C258-E300 WeakPolarHBondContact CB-OE1 3.49Å; E300-S312 WeakPolarHBondContact O-CA 3.35Å; E300-S313 PolarHBondContact O-N 2.92Å
301	L	98.5	Very high	96.3	Very high	10 Å²	10	39 Å²	39	5%	0.052	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136	176.5	-68.3	179.2	0	0	0	111.8	V260 C268 I276 V298 L310 A311 S312	V260-L301 HydrophobicContact CB-CB 4.21Å; V260-L301 HydrophobicContact CG1-CB 3.76Å; V260-L301 HydrophobicContact CG1-CD1 4.25Å; C268-L301 HydrophobicContact CB-CD1 4.1Å; I276-L301 HydrophobicContact CD1-CD2 4.27Å; I276-L301 HydrophobicContact CG1-CD2 4.39Å; I276-L301 HydrophobicContact CG2-CD1 4.34Å; I276-L301 HydrophobicContact CG2-CD2 4.35Å; V298-L301 HydrophobicContact CG1-CD2 3.97Å; V298-L301 HydrophobicContact CG1-CG 4.3Å; L301-L310 HydrophobicContact CB-CD1 4.34Å; L301-L310 HydrophobicContact CD2-CD1 4.39Å; L301-L310 HydrophobicContact CD2-CD2 4.41Å; L301-L310 HydrophobicContact CD2-CG 4.46Å; L301-A311 WeakPolarHBondContact CA-O 3.42Å; L301-S312 VanDerWaalsContact CD2-CB 3.41Å
302	A	98.4	Very high	96.5	Very high	8 Å²	8	39 Å²	39	7%	0.066	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	144.1	174.9	0	0	0	0	0	111.5	L44 F46 L310 A311	L44-A302 HydrophobicContact CD2-CB 4.02Å; L44-A302 HydrophobicContact CG-CB 4.04Å; F46-A302 HydrophobicContact CD2-CB 3.74Å; F46-A302 HydrophobicContact CE2-CB 4.18Å; F46-A302 WeakPolarHBondContact CE2-O 3.39Å; A302-L310 WeakPolarHBondContact O-CA 3.49Å; A302-A311 PolarHBondContact N-O 3.14Å; A302-A311 PolarHBondContact O-N 3.01Å
303	L	98	Very high	96.6	Very high	44 Å²	44	35.5 Å²	35.5	23%	0.23	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	130.9	176.1	-171	74	0	0	0	110.4	F46 V260 M324	F46-L303 WeakPolarHBondContact CD2-O 3.47Å; V260-L303 HydrophobicContact CG2-CB 3.93Å; L303-M324 HydrophobicContact CD1-CG 4.04Å
304	S	97.7	Very high	96.6	Very high	5 Å²	5	35.5 Å²	35.5	4%	0.035	20%	0.2	C	C	.	.			trans	-58.9	150.4	176.2	55.6	0	0	0	0	112.3	C306 G307 R308 F309	S304-C306 PolarHBondContact O-N 3.04Å; S304-G307 WeakPolarHBondContact O-CA 3.3Å; S304-G307 PolarHBondContact O-N 3.24Å; S304-G307 PolarHBondContact OG-N 3.06Å; S304-R308 PolarHBondContact OG-N 2.78Å; S304-F309 WeakPolarHBondContact CB-O 3.29Å; S304-F309 PolarHBondContact N-O 3.38Å; S304-F309 PolarHBondContact OG-N 2.74Å; S304-F309 PolarHBondContact OG-O 2.77Å
305	H	95.3	Very high	96.8	Very high	80 Å²	80	35.6 Å²	35.6	37%	0.37	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.7	179.2	70.9	-90.7	0	0	0	113	H47 P48 R50 D51 G307	H47-H305 WeakPolarHBondContact O-CB 3.34Å; H47-H305 PolarHBondContact O-ND1 3.11Å; P48-H305 VanDerWaalsContact C-CB 3.45Å; P48-H305 WeakPolarHBondContact O-CB 3.16Å; R50-H305 PolarHBondContact O-CE1 3.32Å; R50-H305 PolarHBondContact O-ND1 2.54Å; D51-H305 IonicContact OD1-CE1 3.08Å; D51-H305 PolarHBondContact OD1-CE1 2.94Å; D51-H305 VanDerWaalsContact OD1-CE1 3.29Å; H305-G307 VanDerWaalsContact C-N 3.26Å
306	C	93.6	Very high	97.1	Very high	60 Å²	60	34.1 Å²	34.1	41%	0.405	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-7	175.6	64.7	0	0	0	0	113.1	S304 R308	S304-C306 PolarHBondContact O-N 3.04Å; C306-R308 PolarHBondContact O-N 2.92Å
307	G	92.6	Very high	97.1	Very high	9 Å²	9	34.3 Å²	34.3	9%	0.093	17%	0.17	C	C	.	.	S	Bend	trans	69.2	7.4	179.4	0	0	0	0	0	114.9	S304 H305 R328	S304-G307 WeakPolarHBondContact O-CA 3.3Å; S304-G307 PolarHBondContact O-N 3.24Å; S304-G307 PolarHBondContact OG-N 3.06Å; H305-G307 VanDerWaalsContact C-N 3.26Å; G307-R328 PolarHBondContact O-NE 3.34Å; G307-R328 PolarHBondContact O-NH2 2.78Å
308	R	94.1	Very high	97.1	Very high	135 Å²	135	37 Å²	37	51%	0.509	18%	0.176	S	C	.	.	S	Bend	trans	-82	-41	-179	-70.7	-174.7	59.8	-170.8	-5.8	112.7	S304 C306 M324	S304-R308 PolarHBondContact OG-N 2.78Å; C306-R308 PolarHBondContact O-N 2.92Å; R308-M324 WeakPolarHBondContact O-CB 3.5Å; R308-M324 PolarHBondContact O-N 2.97Å
309	F	97.1	Very high	97.1	Very high	9 Å²	9	36.9 Å²	36.9	4%	0.039	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.1	-175.5	-52.8	-58.2	0	0	0	111.6	D30 T31 Y67 C69 S304 F321 W322	D30-F309 WeakPolarHBondContact O-CE1 3.46Å; T31-F309 HydrophobicContact CG2-CD1 4.34Å; T31-F309 HydrophobicContact CG2-CE1 4.33Å; Y67-F309 HydrophobicContact CE2-CD2 4.08Å; Y67-F309 HydrophobicContact CE2-CE2 4.45Å; C69-F309 WeakPolarHBondContact SG-CZ 3.42Å; S304-F309 WeakPolarHBondContact CB-O 3.29Å; S304-F309 PolarHBondContact N-O 3.38Å; S304-F309 PolarHBondContact OG-N 2.74Å; S304-F309 PolarHBondContact OG-O 2.77Å; F309-F321 HydrophobicContact CB-CD1 4.38Å; F309-W322 WeakPolarHBondContact CA-O 3.25Å
310	L	98.2	Very high	97.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.3	160.2	175.6	75.5	0	0	0	107.3	V260 C268 I276 V290 L301 A302 F321 W322 M324	V260-L310 HydrophobicContact CG1-CD1 3.41Å; V260-L310 VanDerWaalsContact CG1-CD1 3.41Å; C268-L310 HydrophobicContact CB-CD2 4.06Å; I276-L310 HydrophobicContact CG2-CD2 3.95Å; V290-L310 HydrophobicContact CG1-CD2 4.17Å; L301-L310 HydrophobicContact CB-CD1 4.34Å; L301-L310 HydrophobicContact CD2-CD1 4.39Å; L301-L310 HydrophobicContact CD2-CD2 4.41Å; L301-L310 HydrophobicContact CD2-CG 4.46Å; A302-L310 WeakPolarHBondContact O-CA 3.49Å; L310-F321 CarbonylContact O-C 3.46Å; L310-F321 WeakPolarHBondContact O-CA 3.43Å; L310-W322 HydrophobicContact CB-CB 4.28Å; L310-W322 PolarHBondContact N-O 3.11Å; L310-W322 PolarHBondContact O-N 3.44Å; L310-M324 HydrophobicContact CB-CE 3.75Å; L310-M324 HydrophobicContact CB-CG 3.93Å; L310-M324 HydrophobicContact CB-SD 3.64Å; L310-M324 HydrophobicContact CD2-CE 4.16Å; L310-M324 HydrophobicContact CD2-SD 4.2Å; L310-M324 HydrophobicContact CG-SD 4.49Å
311	A	98.5	Very high	97.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	141.8	167.3	0	0	0	0	0	109.4	L44 F46 L53 L301 A302 K320 F321	L44-A311 HydrophobicContact CD2-CB 4.03Å; F46-A311 HydrophobicContact CD2-CB 4.49Å; F46-A311 HydrophobicContact CE2-CB 3.42Å; F46-A311 VanDerWaalsContact CE2-CB 3.42Å; F46-A311 HydrophobicContact CZ-CB 3.55Å; L53-A311 HydrophobicContact CD1-CB 4.22Å; L53-A311 HydrophobicContact CD2-CB 4.12Å; L301-A311 WeakPolarHBondContact CA-O 3.42Å; A302-A311 PolarHBondContact N-O 3.14Å; A302-A311 PolarHBondContact O-N 3.01Å; A311-K320 CarbonylContact C-O 3.57Å; A311-K320 VanDerWaalsContact CA-O 3.28Å; A311-K320 WeakPolarHBondContact CA-O 3.47Å; A311-F321 HydrophobicContact CB-CD1 4.42Å; A311-F321 HydrophobicContact CB-CE1 4.4Å
312	S	98.5	Very high	97.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.5	170.9	58.6	0	0	0	0	110.3	I276 H293 E300 L301 L319 K320 W322	I276-S312 VanDerWaalsContact CD1-CB 3.43Å; I276-S312 VanDerWaalsContact CD1-OG 3.3Å; I276-S312 WeakPolarHBondContact CD1-OG 3.25Å; H293-S312 WeakPolarHBondContact NE2-CB 3.33Å; H293-S312 PolarHBondContact NE2-OG 2.91Å; E300-S312 WeakPolarHBondContact O-CA 3.35Å; L301-S312 VanDerWaalsContact CD2-CB 3.41Å; S312-L319 WeakPolarHBondContact O-CA 2.88Å; S312-K320 PolarHBondContact N-O 2.86Å; S312-K320 PolarHBondContact O-N 2.85Å; S312-W322 PolarHBondContact OG-NE1 2.82Å
313	S	98.5	Very high	96.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	127.4	169	-172.7	0	0	0	0	108.8	A41 E299 E300	A41-S313 WeakPolarHBondContact O-CB 3.21Å; A41-S313 PolarHBondContact O-OG 2.86Å; E299-S313 PolarHBondContact N-O 3.49Å; E300-S313 PolarHBondContact O-N 2.92Å
314	G	97.3	Very high	96.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	160	177.3	0	0	0	0	0	112.6	H293 P297 D316 Q317 R318	H293-G314 PolarHBondContact CE1-N 2.94Å; P297-G314 CarbonylContact O-C 3.45Å; P297-G314 VanDerWaalsContact O-CA 3.32Å; P297-G314 WeakPolarHBondContact O-CA 3.24Å; G314-D316 WeakPolarHBondContact CA-OD1 3.31Å; G314-D316 PolarHBondContact O-N 2.75Å; G314-Q317 PolarHBondContact O-N 2.92Å; G314-Q317 VanDerWaalsContact O-N 3.11Å; G314-R318 PolarHBondContact N-O 2.83Å
315	H	96.8	Very high	96.2	Very high	89 Å²	89	34 Å²	34	41%	0.412	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-16.7	171.4	-150.2	80.3	0	0	0	112.6	E296 P297 E299 Q317	E296-H315 HydrophobicContact CB-CB 4.21Å; E296-H315 IonicContact OE2-CD2 3.76Å; E296-H315 IonicContact OE2-CG 3.57Å; P297-H315 HydrophobicContact CB-CB 4.35Å; P297-H315 HydrophobicContact CG-CB 4.39Å; P297-H315 PolarHBondContact O-N 3.29Å; E299-H315 IonicContact OE1-CE1 3.25Å; E299-H315 IonicContact OE1-CG 3.03Å; E299-H315 IonicContact OE1-ND1 3.72Å; E299-H315 PolarHBondContact OE1-ND1 2.74Å; H315-Q317 PolarHBondContact O-N 3.45Å
316	D	96.5	Very high	95.6	Very high	36 Å²	36	35.5 Å²	35.5	19%	0.193	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	7.2	169.3	72.4	-17	0	0	0	114.3	H293 E296 G314 R318 K320	H293-D316 IonicContact CE1-OD1 3.8Å; H293-D316 IonicContact CG-OD1 3.08Å; H293-D316 IonicContact CG-OD2 3.96Å; H293-D316 IonicContact ND1-OD1 3.92Å; H293-D316 PolarHBondContact ND1-OD1 3.47Å; H293-D316 IonicContact ND1-OD2 2.83Å; H293-D316 PolarHBondContact ND1-OD2 3.4Å; E296-D316 HydrophobicContact CB-CB 4.01Å; E296-D316 HydrophobicContact CG-CB 3.9Å; G314-D316 WeakPolarHBondContact CA-OD1 3.31Å; G314-D316 PolarHBondContact O-N 2.75Å; D316-R318 PolarHBondContact O-N 3.4Å; D316-R318 PolarHBondContact OD1-N 2.93Å; D316-K320 WeakPolarHBondContact OD2-CE 3.39Å
317	Q	97.9	Very high	95.1	Very high	76 Å²	76	32.7 Å²	32.7	36%	0.355	16%	0.157	S	C	.	.	S	Bend	trans	61.4	31.5	178.8	-48.5	178.8	-37	0	0	112.9	L37 E38 G314 H315	L37-Q317 PolarHBondContact N-O 2.86Å; E38-Q317 PolarHBondContact O-NE2 2.91Å; G314-Q317 PolarHBondContact O-N 2.92Å; G314-Q317 VanDerWaalsContact O-N 3.11Å; H315-Q317 PolarHBondContact O-N 3.45Å
318	R	97.9	Very high	94.7	Very high	96 Å²	96	37.2 Å²	37.2	36%	0.362	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.5	178.8	-65.3	176.6	-179.1	-83.7	-7.2	111.6	I35 V36 H293 G314 D316 K320	I35-R318 CarbonylContact O-C 3.57Å; I35-R318 WeakPolarHBondContact O-CA 3.3Å; V36-R318 VanDerWaalsContact CG2-NH1 3.31Å; H293-R318 PolarHBondContact CE1-O 3.37Å; G314-R318 PolarHBondContact N-O 2.83Å; D316-R318 PolarHBondContact O-N 3.4Å; D316-R318 PolarHBondContact OD1-N 2.93Å; R318-K320 HydrophobicContact CB-CG 4.23Å
319	L	98.3	Very high	94.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	109.8	161.9	-47	179.3	0	0	0	108	D34 I35 L37 L44 L53 A55 F65 S312	D34-L319 WeakPolarHBondContact CA-O 3.48Å; I35-L319 HydrophobicContact CB-CB 4.1Å; I35-L319 HydrophobicContact CB-CD1 4.36Å; I35-L319 HydrophobicContact CB-CG 4.4Å; I35-L319 HydrophobicContact CD1-CD1 4.27Å; I35-L319 HydrophobicContact CG2-CD1 4.4Å; I35-L319 PolarHBondContact N-O 2.85Å; I35-L319 PolarHBondContact O-N 3.09Å; L37-L319 HydrophobicContact CD1-CD1 4.31Å; L37-L319 HydrophobicContact CD1-CD2 3.93Å; L37-L319 HydrophobicContact CD1-CG 3.98Å; L37-L319 HydrophobicContact CD2-CD1 4.45Å; L37-L319 HydrophobicContact CG-CG 4.34Å; L44-L319 HydrophobicContact CD1-CD1 4.18Å; L44-L319 HydrophobicContact CD1-CD2 3.84Å; L53-L319 HydrophobicContact CD2-CB 4.43Å; L53-L319 HydrophobicContact CD2-CD1 3.98Å; A55-L319 HydrophobicContact CB-CD1 3.87Å; F65-L319 HydrophobicContact CD2-CD1 4.2Å; F65-L319 HydrophobicContact CE2-CD1 4.01Å; S312-L319 WeakPolarHBondContact O-CA 2.88Å
320	K	98.3	Very high	93.3	Very high	28 Å²	28	36.5 Å²	36.5	12%	0.122	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	140	-178.4	-64.8	-175.4	178	-77.2	0	110.6	D34 H293 A311 S312 D316 R318 W322	D34-K320 IonicContact OD2-NZ 2.83Å; D34-K320 PolarHBondContact OD2-NZ 2.9Å; H293-K320 VanDerWaalsContact CE1-CD 3.49Å; H293-K320 WeakPolarHBondContact CE1-CD 3.39Å; A311-K320 CarbonylContact C-O 3.57Å; A311-K320 VanDerWaalsContact CA-O 3.28Å; A311-K320 WeakPolarHBondContact CA-O 3.47Å; S312-K320 PolarHBondContact N-O 2.86Å; S312-K320 PolarHBondContact O-N 2.85Å; D316-K320 WeakPolarHBondContact OD2-CE 3.39Å; R318-K320 HydrophobicContact CB-CG 4.23Å; K320-W322 HydrophobicContact CB-CH2 4.44Å; K320-W322 HydrophobicContact CB-CZ2 3.65Å; K320-W322 HydrophobicContact CD-CH2 3.93Å; K320-W322 HydrophobicContact CD-CZ2 3.64Å; K320-W322 HydrophobicContact CG-CZ2 4.29Å
321	F	98	Very high	92.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.7	175.5	-62.5	-95.4	0	0	0	111.5	P32 E33 I35 F46 L53 Y67 F309 L310 A311 K351	P32-F321 HydrophobicContact CB-CB 4.42Å; P32-F321 HydrophobicContact CB-CD1 4.26Å; P32-F321 HydrophobicContact CB-CD2 3.77Å; P32-F321 HydrophobicContact CB-CE1 4.45Å; P32-F321 HydrophobicContact CB-CE2 4Å; P32-F321 HydrophobicContact CB-CG 3.9Å; P32-F321 HydrophobicContact CB-CZ 4.33Å; P32-F321 HydrophobicContact CG-CB 4.43Å; P32-F321 HydrophobicContact CG-CD1 4.01Å; P32-F321 HydrophobicContact CG-CD2 4.4Å; P32-F321 HydrophobicContact CG-CE1 4.33Å; P32-F321 HydrophobicContact CG-CG 4.04Å; E33-F321 WeakPolarHBondContact O-CD2 3.29Å; E33-F321 WeakPolarHBondContact O-CE2 3.11Å; I35-F321 HydrophobicContact CD1-CE2 3.84Å; I35-F321 HydrophobicContact CD1-CZ 3.93Å; I35-F321 HydrophobicContact CG1-CE2 4.19Å; F46-F321 AromaticContact CE1-CE1 3.97Å; F46-F321 HydrophobicContact CE1-CE1 3.97Å; F46-F321 HydrophobicContact CZ-CD1 4.15Å; F46-F321 AromaticContact CZ-CE1 3.8Å; F46-F321 HydrophobicContact CZ-CE1 3.8Å; L53-F321 HydrophobicContact CD2-CE1 3.93Å; L53-F321 HydrophobicContact CD2-CZ 3.58Å; Y67-F321 HydrophobicContact CD1-CE1 4.46Å; Y67-F321 HydrophobicContact CD2-CE1 4.42Å; Y67-F321 HydrophobicContact CG-CE1 4.14Å; Y67-F321 HydrophobicContact CG-CZ 4.32Å; F309-F321 HydrophobicContact CB-CD1 4.38Å; L310-F321 CarbonylContact O-C 3.46Å; L310-F321 WeakPolarHBondContact O-CA 3.43Å; A311-F321 HydrophobicContact CB-CD1 4.42Å; A311-F321 HydrophobicContact CB-CE1 4.4Å; F321-K351 PolarHBondContact O-NZ 2.98Å
322	W	97.1	Very high	91	Very high	6 Å²	6	43.7 Å²	43.7	2%	0.023	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.5	179.6	-42.8	93.7	0	0	0	110.6	I276 V290 G291 F309 L310 S312 K320 M324 K351	I276-W322 HydrophobicContact CD1-CD2 4.49Å; I276-W322 HydrophobicContact CD1-CZ2 3.77Å; V290-W322 HydrophobicContact CG1-CB 3.78Å; V290-W322 HydrophobicContact CG1-CD2 4.36Å; V290-W322 HydrophobicContact CG1-CG 3.95Å; G291-W322 VanDerWaalsContact CA-CH2 3.49Å; F309-W322 WeakPolarHBondContact CA-O 3.25Å; L310-W322 HydrophobicContact CB-CB 4.28Å; L310-W322 PolarHBondContact N-O 3.11Å; L310-W322 PolarHBondContact O-N 3.44Å; S312-W322 PolarHBondContact OG-NE1 2.82Å; K320-W322 HydrophobicContact CB-CH2 4.44Å; K320-W322 HydrophobicContact CB-CZ2 3.65Å; K320-W322 HydrophobicContact CD-CH2 3.93Å; K320-W322 HydrophobicContact CD-CZ2 3.64Å; K320-W322 HydrophobicContact CG-CZ2 4.29Å; W322-M324 HydrophobicContact CB-CE 3.72Å; W322-K351 HydrophobicContact CE3-CB 4.13Å; W322-K351 HydrophobicContact CE3-CD 4.31Å; W322-K351 HydrophobicContact CZ3-CB 3.68Å; W322-K351 HydrophobicContact CZ3-CD 4.24Å
323	D	94.3	Very high	89.6	Confident	31 Å²	31	49.5 Å²	49.5	17%	0.166	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	124.6	175.1	-179.7	18.3	0	0	0	111.2	T31 A325	T31-D323 HydrophobicContact CG2-CB 3.84Å; D323-A325 VanDerWaalsContact OD1-CB 3.27Å; D323-A325 WeakPolarHBondContact OD1-CB 3.46Å; D323-A325 PolarHBondContact OD1-N 3.22Å
324	M	92.5	Very high	87.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.301	C	S	.	.			trans	-92.8	-5.1	179.8	-61.9	-64	91.9	0	0	113.3	V262 V290 L303 R308 L310 W322 Q326 L327 R328	V262-M324 HydrophobicContact CG2-SD 4.39Å; V290-M324 HydrophobicContact CG1-CE 3.63Å; L303-M324 HydrophobicContact CD1-CG 4.04Å; R308-M324 WeakPolarHBondContact O-CB 3.5Å; R308-M324 PolarHBondContact O-N 2.97Å; L310-M324 HydrophobicContact CB-CE 3.75Å; L310-M324 HydrophobicContact CB-CG 3.93Å; L310-M324 HydrophobicContact CB-SD 3.64Å; L310-M324 HydrophobicContact CD2-CE 4.16Å; L310-M324 HydrophobicContact CD2-SD 4.2Å; L310-M324 HydrophobicContact CG-SD 4.49Å; W322-M324 HydrophobicContact CB-CE 3.72Å; M324-Q326 PolarHBondContact O-N 3.19Å; M324-L327 HydrophobicContact CE-CD2 4.44Å; M324-L327 PolarHBondContact O-N 3.22Å; M324-L327 VanDerWaalsContact O-N 3.15Å; M324-L327 HydrophobicContact SD-CD2 3.8Å; M324-R328 WeakPolarHBondContact O-CG 3.47Å; M324-R328 PolarHBondContact O-N 3.41Å
325	A	88.7	Confident	85.6	Confident	58 Å²	58	65.5 Å²	65.5	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-58.2	-47	-178.1	0	0	0	0	0	111.9	D323 L327 A329	D323-A325 VanDerWaalsContact OD1-CB 3.27Å; D323-A325 WeakPolarHBondContact OD1-CB 3.46Å; D323-A325 PolarHBondContact OD1-N 3.22Å; A325-L327 VanDerWaalsContact C-N 3.32Å; A325-L327 PolarHBondContact O-N 2.94Å; A325-A329 PolarHBondContact O-N 3.34Å
326	Q	82.4	Confident	83.3	Confident	112 Å²	112	72.1 Å²	72.1	52%	0.523	36%	0.358	S	S	.	.	H	α-helix	trans	-64.2	-38.5	177	-63.1	-170.1	42.4	0	0	112	M324 A329	M324-Q326 PolarHBondContact O-N 3.19Å; Q326-A329 PolarHBondContact O-N 3.44Å
327	L	84.7	Confident	81.2	Confident	2 Å²	2	80.9 Å²	80.9	1%	0.01	39%	0.389	C	S	.	.	H	α-helix	trans	-69.6	-39.1	-176.9	-176.4	64.1	0	0	0	112.1	L266 A278 V290 M324 A325 A329 V330 L348	L266-L327 HydrophobicContact CD2-CD1 3.85Å; L266-L327 HydrophobicContact CD2-CD2 3.94Å; L266-L327 HydrophobicContact CD2-CG 3.52Å; A278-L327 HydrophobicContact CB-CD1 3.4Å; A278-L327 VanDerWaalsContact CB-CD1 3.4Å; A278-L327 HydrophobicContact CB-CD2 3.82Å; A278-L327 HydrophobicContact CB-CG 4.25Å; V290-L327 HydrophobicContact CG2-CD2 4.11Å; M324-L327 HydrophobicContact CE-CD2 4.44Å; M324-L327 PolarHBondContact O-N 3.22Å; M324-L327 VanDerWaalsContact O-N 3.15Å; M324-L327 HydrophobicContact SD-CD2 3.8Å; A325-L327 VanDerWaalsContact C-N 3.32Å; A325-L327 PolarHBondContact O-N 2.94Å; L327-A329 VanDerWaalsContact C-N 3.26Å; L327-A329 PolarHBondContact O-N 2.82Å; L327-V330 WeakPolarHBondContact O-CB 3.32Å; L327-V330 WeakPolarHBondContact O-CG2 3.4Å; L327-V330 PolarHBondContact O-N 3.25Å; L327-V330 VanDerWaalsContact O-N 3.16Å; L327-L348 HydrophobicContact CD1-CD1 3.57Å
328	R	83.4	Confident	78.6	Confident	104 Å²	104	89.5 Å²	89.5	39%	0.392	42%	0.418	S	S	.	.	H	α-helix	trans	-66.2	-27.1	176.5	-72.3	177.7	-179.2	-72.2	-6	113.3	V262 T263 G307 M324 V330	V262-R328 HydrophobicContact CG1-CG 4.22Å; V262-R328 PolarHBondContact O-NH1 3.35Å; V262-R328 PolarHBondContact O-NH2 3.35Å; V262-R328 VanDerWaalsContact O-NH2 3.17Å; T263-R328 HydrophobicContact CG2-CG 4.41Å; G307-R328 PolarHBondContact O-NE 3.34Å; G307-R328 PolarHBondContact O-NH2 2.78Å; M324-R328 WeakPolarHBondContact O-CG 3.47Å; M324-R328 PolarHBondContact O-N 3.41Å; R328-V330 PolarHBondContact O-N 3.19Å
329	A	81.4	Confident	76.5	Confident	79 Å²	79	93.9 Å²	93.9	65%	0.653	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-9.5	176.2	0	0	0	0	0	113.3	A325 Q326 L327 V331	A325-A329 PolarHBondContact O-N 3.34Å; Q326-A329 PolarHBondContact O-N 3.44Å; L327-A329 VanDerWaalsContact C-N 3.26Å; L327-A329 PolarHBondContact O-N 2.82Å; A329-V331 PolarHBondContact O-N 3Å
330	V	79.9	Confident	73.9	Confident	50 Å²	50	103.8 Å²	103.8	30%	0.303	48%	0.483	S	S	.	.			trans	-74.4	113.9	-178.9	-177.2	0	0	0	0	110.6	V287 L327 R328 V332	V287-V330 HydrophobicContact CG1-CB 4.45Å; V287-V330 HydrophobicContact CG1-CG1 3.74Å; V287-V330 HydrophobicContact CG1-CG2 4.47Å; L327-V330 WeakPolarHBondContact O-CB 3.32Å; L327-V330 WeakPolarHBondContact O-CG2 3.4Å; L327-V330 PolarHBondContact O-N 3.25Å; L327-V330 VanDerWaalsContact O-N 3.16Å; R328-V330 PolarHBondContact O-N 3.19Å; V330-V332 HydrophobicContact CG1-CG2 4.23Å
331	V	75.9	Confident	71.3	Confident	123 Å²	123	112.8 Å²	112.8	75%	0.745	52%	0.522	S	S	*	.			trans	-90.7	123.5	167.2	-177.4	0	0	0	0	108.8	A329	A329-V331 PolarHBondContact O-N 3Å
332	V	73.8	Confident	68.9	Low	27 Å²	27	116.1 Å²	116.1	16%	0.164	56%	0.556	C	S	.	*			trans	-97.2	105.4	175.8	-175.8	0	0	0	0	108.7	N280 P283 V287 V330	N280-V332 HydrophobicContact CB-CB 4.46Å; N280-V332 HydrophobicContact CB-CG1 4.47Å; N280-V332 HydrophobicContact CB-CG2 3.96Å; P283-V332 HydrophobicContact CG-CG1 3.95Å; V287-V332 HydrophobicContact CG2-CG2 3.94Å; V330-V332 HydrophobicContact CG1-CG2 4.23Å
333	D	68.5	Low	66.7	Low	122 Å²	122	118.4 Å²	118.4	65%	0.652	58%	0.582	S	S	*	*			trans	-64.4	143.8	174.3	-75.4	-33	0	0	0	112	Y335	D333-Y335 PolarHBondContact O-N 3.28Å
334	D	59.8	Low	65.1	Low	144 Å²	144	122.5 Å²	122.5	77%	0.77	61%	0.61	S	S	*	*	S	Bend	trans	-64.7	-22.9	175.9	-69.5	-30.8	0	0	0	113.1
335	Y	51.4	Low	63.9	Low	192 Å²	192	125.5 Å²	125.5	75%	0.753	63%	0.626	S	S	*	*	S	Bend	trans	-90.6	112.8	-175.2	-157.7	-94.9	0	0	0	112.5	D333 R337	D333-Y335 PolarHBondContact O-N 3.28Å; Y335-R337 PolarHBondContact O-N 3.2Å
336	R	49.3	Very low	63.3	Low	228 Å²	228	131.3 Å²	131.3	86%	0.86	64%	0.635	S	S	*	*			trans	-70.8	88.2	176.5	-162.7	178.2	-170.5	177.5	4.9	110.7	R338	R336-R338 PolarHBondContact O-N 3.39Å; R336-R338 VanDerWaalsContact O-N 3.12Å
337	R	52	Low	62.8	Low	220 Å²	220	127 Å²	127	83%	0.83	62%	0.619	S	S	*	*			trans	-58.8	117.9	164.5	-77.4	-173.7	176.9	178.8	1.2	108.4	Y335 K339	Y335-R337 PolarHBondContact O-N 3.2Å; R337-K339 PolarHBondContact O-N 3.14Å
338	R	43.3	Very low	62.4	Low	258 Å²	258	127.6 Å²	127.6	97%	0.974	62%	0.622	S	S	*	*			trans	-54.8	102.8	173.7	-90.3	179.9	170	175.5	-3.1	108.9	R336	R336-R338 PolarHBondContact O-N 3.39Å; R336-R338 VanDerWaalsContact O-N 3.12Å
339	K	52.9	Low	61.8	Low	188 Å²	188	123.2 Å²	123.2	82%	0.817	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-91.2	139	167.9	-116.8	-175.1	178.8	-172.3	0	108.9	R337	R337-K339 PolarHBondContact O-N 3.14Å
340	K	44	Very low	61.1	Low	208 Å²	208	123.6 Å²	123.6	90%	0.904	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-51.5	135.1	174.2	-83.5	-179.8	171	-177.9	0	110
341	K	43.4	Very low	60.5	Low	217 Å²	217	124 Å²	124	94%	0.943	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	141.7	175.3	-79.5	-179	171.1	-176.7	0	109.9
342	G	47.6	Very low	59.4	Low	69 Å²	69	118.6 Å²	118.6	71%	0.711	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	119.7	-5.8	155.9	0	0	0	0	0	118.8
343	G	52.5	Low	58.1	Low	55 Å²	55	125.4 Å²	125.4	57%	0.567	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-83.8	154.1	-179.2	0	0	0	0	0	114.5
344	P	59	Low	56.6	Low	117 Å²	117	124.6 Å²	124.6	76%	0.76	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-57.6	155.2	171.7	23.7	-32.4	0	0	0	111.7
345	L	67.3	Low	55.6	Low	62 Å²	62	123.9 Å²	123.9	33%	0.325	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-57	142.7	176.9	-73.2	172.3	0	0	0	110	R277 V286 A347	R277-L345 HydrophobicContact CG-CD1 4.4Å; V286-L345 HydrophobicContact CG1-CD2 4.07Å; L345-A347 PolarHBondContact O-N 3.06Å
346	R	76.4	Confident	54.9	Low	180 Å²	180	121.7 Å²	121.7	68%	0.679	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-66.2	124.8	176.4	-177.2	-177.4	177.9	-174.5	0.1	109.1	G288 S289 L348	G288-R346 CarbonylContact C-O 3.58Å; G288-R346 VanDerWaalsContact CA-O 3.25Å; G288-R346 WeakPolarHBondContact CA-O 3.45Å; S289-R346 PolarHBondContact N-O 3.2Å; R346-L348 HydrophobicContact CG-CD2 4.36Å
347	A	72.3	Confident	54.4	Low	23 Å²	23	117.7 Å²	117.7	19%	0.19	60%	0.595	C	S	.	*	B	Isolated β-bridge	trans	-59.3	129.4	165.6	0	0	0	0	0	111.8	L345 T352 W353	L345-A347 PolarHBondContact O-N 3.06Å; A347-T352 HydrophobicContact CB-CG2 4.33Å; A347-T352 WeakPolarHBondContact CB-OG1 3.13Å; A347-W353 HydrophobicContact CB-CD2 3.96Å; A347-W353 HydrophobicContact CB-CE3 3.68Å; A347-W353 HydrophobicContact CB-CH2 3.41Å; A347-W353 VanDerWaalsContact CB-CH2 3.41Å; A347-W353 HydrophobicContact CB-CZ2 3.67Å; A347-W353 HydrophobicContact CB-CZ3 3.41Å; A347-W353 VanDerWaalsContact CB-CZ3 3.41Å
348	L	75.9	Confident	54.2	Low	14 Å²	14	115.8 Å²	115.8	7%	0.073	59%	0.593	C	S	.	*			trans	-113.6	-5.5	178.1	-57	178.7	0	0	0	113.6	A278 V287 S289 L327 R346	A278-L348 HydrophobicContact CB-CD1 3.83Å; V287-L348 HydrophobicContact CB-CD1 4.25Å; V287-L348 HydrophobicContact CG1-CD1 3.84Å; V287-L348 HydrophobicContact CG1-CD2 4.36Å; S289-L348 WeakPolarHBondContact O-CB 3.45Å; S289-L348 PolarHBondContact O-N 2.9Å; L327-L348 HydrophobicContact CD1-CD1 3.57Å; R346-L348 HydrophobicContact CG-CD2 4.36Å
349	S	71.8	Confident	53.9	Low	11 Å²	11	110.6 Å²	110.6	8%	0.077	58%	0.578	C	S	.	*	S	Bend	trans	-132.8	147.8	173.5	178.2	0	0	0	0	109.8	V290 K351 T352	V290-S349 WeakPolarHBondContact O-CB 3.25Å; S349-K351 PolarHBondContact O-N 2.98Å; S349-K351 VanDerWaalsContact O-N 3.16Å; S349-K351 PolarHBondContact OG-N 3.22Å; S349-T352 WeakPolarHBondContact O-CB 3.38Å; S349-T352 PolarHBondContact O-N 3.43Å; S349-T352 VanDerWaalsContact O-N 3.11Å; S349-T352 PolarHBondContact O-OG1 2.92Å
350	S	65.8	Low	53.3	Low	88 Å²	88	105.3 Å²	105.3	62%	0.615	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-58.5	-25.4	174.6	52	0	0	0	0	112.9	T352	S350-T352 VanDerWaalsContact C-N 3.33Å; S350-T352 PolarHBondContact O-N 2.86Å
351	K	68.6	Low	52.7	Low	59 Å²	59	99 Å²	99	26%	0.257	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-79	-5.9	178.4	-67.5	-172.6	178.2	-178.1	0	115	T31 D34 F321 W322 S349 W353	T31-K351 WeakPolarHBondContact OG1-CE 3.36Å; T31-K351 PolarHBondContact OG1-NZ 3.23Å; D34-K351 IonicContact OD1-NZ 2.77Å; F321-K351 PolarHBondContact O-NZ 2.98Å; W322-K351 HydrophobicContact CE3-CB 4.13Å; W322-K351 HydrophobicContact CE3-CD 4.31Å; W322-K351 HydrophobicContact CZ3-CB 3.68Å; W322-K351 HydrophobicContact CZ3-CD 4.24Å; S349-K351 PolarHBondContact O-N 2.98Å; S349-K351 VanDerWaalsContact O-N 3.16Å; S349-K351 PolarHBondContact OG-N 3.22Å; K351-W353 VanDerWaalsContact C-N 3.32Å; K351-W353 PolarHBondContact O-N 2.67Å
352	T	52.7	Low	52.3	Low	9 Å²	9	95.1 Å²	95.1	6%	0.055	55%	0.552	C	S	.	*	G	3₁₀ helix	trans	-68.5	-28.1	-176.2	43.1	0	0	0	0	114.1	S289 V290 A347 S349 S350	S289-T352 WeakPolarHBondContact O-CG2 3.39Å; V290-T352 WeakPolarHBondContact O-CG2 3.46Å; A347-T352 HydrophobicContact CB-CG2 4.33Å; A347-T352 WeakPolarHBondContact CB-OG1 3.13Å; S349-T352 WeakPolarHBondContact O-CB 3.38Å; S349-T352 PolarHBondContact O-N 3.43Å; S349-T352 VanDerWaalsContact O-N 3.11Å; S349-T352 PolarHBondContact O-OG1 2.92Å; S350-T352 VanDerWaalsContact C-N 3.33Å; S350-T352 PolarHBondContact O-N 2.86Å
353	W	46.1	Very low	51.5	Low	169 Å²	169	102.7 Å²	102.7	64%	0.64	56%	0.559	S	S	*	*			trans	-127.9	87.8	178	-62.3	-41.7	0	0	0	109.1	A347 K351 T355	A347-W353 HydrophobicContact CB-CD2 3.96Å; A347-W353 HydrophobicContact CB-CE3 3.68Å; A347-W353 HydrophobicContact CB-CH2 3.41Å; A347-W353 VanDerWaalsContact CB-CH2 3.41Å; A347-W353 HydrophobicContact CB-CZ2 3.67Å; A347-W353 HydrophobicContact CB-CZ3 3.41Å; A347-W353 VanDerWaalsContact CB-CZ3 3.41Å; K351-W353 VanDerWaalsContact C-N 3.32Å; K351-W353 PolarHBondContact O-N 2.67Å; W353-T355 PolarHBondContact O-N 2.87Å
354	S	36.5	Very low	50.9	Low	105 Å²	105	109.1 Å²	109.1	73%	0.734	57%	0.574	S	S	*	*			trans	-67.9	117.8	154.8	-172.3	0	0	0	0	106.2	D356	S354-D356 PolarHBondContact O-N 3.47Å
355	T	38	Very low	49.7	Very low	129 Å²	129	112.8 Å²	112.8	79%	0.791	58%	0.581	S	S	*	*	S	Bend	trans	-64.7	82.4	177.1	46	0	0	0	0	110.2	W353	W353-T355 PolarHBondContact O-N 2.87Å
356	D	36.7	Very low	48	Very low	146 Å²	146	113.1 Å²	113.1	78%	0.781	60%	0.6	S	S	*	*			trans	-138.5	86.9	151.3	-87.6	-37	0	0	0	105.6	S354 F358	S354-D356 PolarHBondContact O-N 3.47Å; D356-F358 PolarHBondContact O-N 2.94Å
357	D	40	Very low	46.4	Very low	144 Å²	144	113.9 Å²	113.9	77%	0.77	61%	0.611	S	S	*	*			trans	-62.7	77	172.1	-90.6	-26.9	0	0	0	109.6	F359 A360	D357-F359 PolarHBondContact O-N 2.8Å; D357-A360 HydrophobicContact CB-CB 3.95Å; D357-A360 PolarHBondContact O-N 2.64Å
358	F	47.2	Very low	44.7	Very low	181 Å²	181	120.3 Å²	120.3	79%	0.794	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-20.1	173.6	-174.5	-101	0	0	0	111.9	D356	D356-F358 PolarHBondContact O-N 2.94Å
359	F	36.3	Very low	42.5	Very low	149 Å²	149	125.1 Å²	125.1	65%	0.654	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	8.5	-179.3	-75.2	-82.6	0	0	0	115.3	D357 G361 L362	D357-F359 PolarHBondContact O-N 2.8Å; F359-G361 PolarHBondContact O-N 3.47Å; F359-L362 HydrophobicContact CD1-CD1 3.89Å; F359-L362 HydrophobicContact CE1-CD1 4.16Å; F359-L362 PolarHBondContact O-N 3.11Å
360	A	41	Very low	40.5	Very low	77 Å²	77	133.9 Å²	133.9	64%	0.636	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-9.9	175	0	0	0	0	0	114.1	D357	D357-A360 HydrophobicContact CB-CB 3.95Å; D357-A360 PolarHBondContact O-N 2.64Å
361	G	31.9	Very low	39.1	Very low	74 Å²	74	134.1 Å²	134.1	76%	0.763	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-14.1	178.6	0	0	0	0	0	116	F359 R363	F359-G361 PolarHBondContact O-N 3.47Å; G361-R363 PolarHBondContact O-N 3.28Å
362	L	35	Very low	37.3	Very low	137 Å²	137	140.5 Å²	140.5	72%	0.717	76%	0.757	S	S	*	*			trans	-94.7	73	177.8	-86.7	152.5	0	0	0	109.4	F359 E364	F359-L362 HydrophobicContact CD1-CD1 3.89Å; F359-L362 HydrophobicContact CE1-CD1 4.16Å; F359-L362 PolarHBondContact O-N 3.11Å; L362-E364 PolarHBondContact O-N 2.85Å
363	R	30.8	Very low	36.2	Very low	227 Å²	227	149.6 Å²	149.6	86%	0.857	80%	0.799	S	S	*	*			trans	-61	122.2	157.8	-89.3	-179.2	171.3	177.4	-2.8	107.5	G361 E365	G361-R363 PolarHBondContact O-N 3.28Å; R363-E365 PolarHBondContact O-N 2.94Å; R363-E365 VanDerWaalsContact O-N 3.14Å
364	E	40.5	Very low	35.6	Very low	191 Å²	191	150.8 Å²	150.8	89%	0.893	81%	0.812	S	S	*	*			trans	-55.4	115.1	155.1	-71.1	178.7	157	0	0	106.9	L362 G366	L362-E364 PolarHBondContact O-N 2.85Å; E364-G366 PolarHBondContact O-N 2.86Å; E364-G366 VanDerWaalsContact O-N 3.11Å
365	E	32	Very low	35.4	Very low	194 Å²	194	154.2 Å²	154.2	91%	0.907	81%	0.813	S	S	*	*			trans	-60.1	114.5	169.2	-74.5	-175	158.6	0	0	107.5	R363 E367	R363-E365 PolarHBondContact O-N 2.94Å; R363-E365 VanDerWaalsContact O-N 3.14Å; E365-E367 PolarHBondContact O-N 3.06Å
366	G	33.4	Very low	35.1	Very low	69 Å²	69	155.5 Å²	155.5	71%	0.711	81%	0.81	S	S	*	*			trans	-64.5	131.2	-179.3	0	0	0	0	0	111.4	E364 D368	E364-G366 PolarHBondContact O-N 2.86Å; E364-G366 VanDerWaalsContact O-N 3.11Å; G366-D368 VanDerWaalsContact C-N 3.28Å; G366-D368 PolarHBondContact O-N 3.43Å
367	E	41.1	Very low	34.9	Very low	196 Å²	196	158.1 Å²	158.1	92%	0.916	82%	0.818	S	S	*	*			trans	-61.9	92.5	153.4	-72.3	-179	151.7	0	0	108.3	E365	E365-E367 PolarHBondContact O-N 3.06Å
368	D	36.6	Very low	34.7	Very low	158 Å²	158	158.2 Å²	158.2	85%	0.845	82%	0.824	S	S	*	*			trans	-155.3	85.1	163.1	-97.1	-29.7	0	0	0	109.7	G366	G366-D368 VanDerWaalsContact C-N 3.28Å; G366-D368 PolarHBondContact O-N 3.43Å
369	S	30.8	Very low	34	Very low	114 Å²	114	153.4 Å²	153.4	80%	0.797	83%	0.825	S	S	*	*			trans	-169.9	106	143.8	49.2	0	0	0	0	110.7
370	M	29.4	Very low	33.9	Very low	195 Å²	195	153.1 Å²	153.1	96%	0.961	83%	0.83	S	S	*	*				171.2	83.5	128.2	-88.6	-154.4	-174.9	0	0	108.9
371	A	35.5	Very low	33.9	Very low	93 Å²	93	155.7 Å²	155.7	77%	0.769	83%	0.833	S	S	*	*			trans	-146.5	85.4	158.1	0	0	0	0	0	107.6
372	Q	31.3	Very low	34.4	Very low	193 Å²	193	157.3 Å²	157.3	90%	0.902	83%	0.833	S	S	*	*			trans	177	98.8	150.9	-102.1	166.5	17.1	0	0	109.6
373	E	30.9	Very low	34.7	Very low	201 Å²	201	162.2 Å²	162.2	94%	0.939	86%	0.86	S	S	*	*			trans	-154.3	80.7	148.3	-113	176.5	-157.9	0	0	107.8
374	E	32.1	Very low	34.9	Very low	194 Å²	194	159 Å²	159	91%	0.907	86%	0.86	S	S	*	*			trans	-128.3	108.2	152.3	-88.6	-170.2	169.9	0	0	106.2
375	K	32.7	Very low	34.6	Very low	176 Å²	176	157.3 Å²	157.3	77%	0.765	86%	0.859	S	S	*	*			trans	-162.1	121.8	141.8	-106.5	-171.7	-178.6	-154.7	0	111.2
376	E	31.5	Very low	34.7	Very low	156 Å²	156	155.3 Å²	155.3	73%	0.729	86%	0.856	S	S	*	*			trans	67.2	101.6	139.6	-68.4	165.4	-161.4	0	0	117.8
377	E	32.4	Very low	34.8	Very low	201 Å²	201	160.4 Å²	160.4	94%	0.939	86%	0.864	S	S	*	*				-157.7	110.5	118.4	-108.3	175	-166.6	0	0	110.2
378	T	36.8	Very low	34.4	Very low	147 Å²	147	158.1 Å²	158.1	90%	0.902	86%	0.861	S	S	*	*			trans	-111.8	132.5	167.5	47.2	0	0	0	0	108.8
379	G	31.8	Very low	34.2	Very low	79 Å²	79	158.1 Å²	158.1	81%	0.814	86%	0.862	S	S	*	*			trans	104.2	136	167.6	0	0	0	0	0	112.7
380	D	35.2	Very low	34.5	Very low	143 Å²	143	161.3 Å²	161.3	77%	0.765	87%	0.867	S	S	*	*			cis	-171.5	148.6	9.1	-156.3	9.2	0	0	0	108.7
381	D	40.3	Very low	34.9	Very low	132 Å²	132	158.7 Å²	158.7	71%	0.706	86%	0.86	S	S	*	*			trans	45.4	127.8	148.6	-74.7	-17	0	0	0	124.1
382	S	42.3	Very low	34.8	Very low	108 Å²	108	164.2 Å²	164.2	76%	0.755	87%	0.867	S	S	*	*				146.5	135.1	104	52.2	0	0	0	0	115.8
383	D	40.4	Very low	35.1	Very low	240 Å²	240	161.5 Å²	161.5	100%	1.283	86%	0.864	S	S	*	*			trans	76.9	0	162.7	-63	-13.7	0	0	0	122.2

Retrieved 383 of 383 residues in 125 ms (Link to these results)

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