A0AA82N7T7_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N7T7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 296 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.5	Very low	43.2	Very low	247 Å²	247	177 Å²	177	100%	1.217	89%	0.887	S	S	*	*				0	118.8	0	-84.1	176.7	170.9	0	0	108.8
2	R	41.9	Very low	43.2	Very low	242 Å²	242	171.8 Å²	171.8	91%	0.913	87%	0.871	S	S	*	*			trans	46.3	98	159.6	-70.5	-177.9	170.4	177.5	-3.2	120.3
3	H	37.7	Very low	43.5	Very low	187 Å²	187	173.2 Å²	173.2	87%	0.866	87%	0.868	S	S	*	*			trans	-61.4	146.4	143.6	-69.7	-81.8	0	0	0	110.6
4	T	48.4	Very low	43.5	Very low	137 Å²	137	175.6 Å²	175.6	84%	0.84	86%	0.864	S	S	*	*			trans	-138	108	163.7	-42.8	0	0	0	0	108.9
5	L	45.9	Very low	43.8	Very low	161 Å²	161	172 Å²	172	84%	0.843	86%	0.856	S	S	*	*			trans	-72	133	-178.2	-80.5	148.6	0	0	0	111	R7	L5-R7 PolarHBondContact O-N 3.4Å
6	L	42.7	Very low	43.9	Very low	176 Å²	176	168.3 Å²	168.3	92%	0.921	85%	0.845	S	S	*	*			trans	-65.2	114.2	170.7	-157.2	77	0	0	0	108.9	C8	L6-C8 PolarHBondContact O-N 3.41Å
7	R	42	Very low	43.9	Very low	238 Å²	238	164.4 Å²	164.4	90%	0.898	83%	0.832	S	S	*	*			trans	-75.2	113.7	176.7	-89.2	-179.7	167.4	177.7	-4.4	110.1	L5 L9	L5-R7 PolarHBondContact O-N 3.4Å; R7-L9 PolarHBondContact O-N 3.14Å
8	C	43.8	Very low	43.5	Very low	128 Å²	128	163.7 Å²	163.7	87%	0.865	83%	0.829	S	S	*	*			trans	-59.1	119.7	161.5	-78.3	0	0	0	0	110.3	L6 S10	L6-C8 PolarHBondContact O-N 3.41Å; C8-S10 PolarHBondContact O-N 3.22Å
9	L	41.1	Very low	43.1	Very low	168 Å²	168	166.6 Å²	166.6	88%	0.88	83%	0.829	S	S	*	*			trans	-78.5	100.3	163.6	-91.7	135.5	0	0	0	108.4	R7 M11	R7-L9 PolarHBondContact O-N 3.14Å; L9-M11 PolarHBondContact O-N 3.32Å
10	S	43.6	Very low	43.1	Very low	103 Å²	103	163.9 Å²	163.9	72%	0.72	82%	0.824	S	S	*	*			trans	-73.8	102.9	166.7	172.4	0	0	0	0	108.7	C8 T12	C8-S10 PolarHBondContact O-N 3.22Å; S10-T12 PolarHBondContact O-N 2.86Å
11	M	43.7	Very low	42.7	Very low	160 Å²	160	166.1 Å²	166.1	79%	0.788	83%	0.825	S	S	*	*			trans	-71.6	102.5	166.9	-88.7	-93.6	174.6	0	0	108.9	L9 F13	L9-M11 PolarHBondContact O-N 3.32Å; M11-F13 PolarHBondContact O-N 2.82Å
12	T	43.4	Very low	42.2	Very low	115 Å²	115	160.8 Å²	160.8	71%	0.706	81%	0.806	S	S	*	*			trans	-70.3	106	167.4	14.1	0	0	0	0	109.2	S10 Y14	S10-T12 PolarHBondContact O-N 2.86Å; T12-Y14 PolarHBondContact O-N 2.85Å
13	F	47.2	Very low	42	Very low	189 Å²	189	155.6 Å²	155.6	83%	0.829	79%	0.791	S	S	*	*			trans	-72.8	109.8	166.1	-91.2	-93	0	0	0	109	M11 V15	M11-F13 PolarHBondContact O-N 2.82Å; F13-V15 PolarHBondContact O-N 2.77Å
14	Y	42.9	Very low	42.4	Very low	207 Å²	207	149.3 Å²	149.3	81%	0.812	77%	0.768	S	S	*	*			trans	-72.8	107.9	164	-84.4	-88.3	0	0	0	108.3	T12 V16	T12-Y14 PolarHBondContact O-N 2.85Å; Y14-V16 PolarHBondContact O-N 3Å; Y14-V16 VanDerWaalsContact O-N 3.11Å
15	V	48.8	Very low	42.7	Very low	122 Å²	122	146 Å²	146	74%	0.739	74%	0.741	S	S	*	*			trans	-72.8	98.8	165	-179.2	0	0	0	0	106.8	F13 V17	F13-V15 PolarHBondContact O-N 2.77Å; V15-V17 VanDerWaalsContact C-N 3.32Å; V15-V17 HydrophobicContact CG1-CG2 3.76Å; V15-V17 PolarHBondContact O-N 2.85Å; V15-V17 VanDerWaalsContact O-N 3.08Å
16	V	44.5	Very low	43.3	Very low	112 Å²	112	139.7 Å²	139.7	68%	0.679	71%	0.711	S	S	*	*			trans	-74.5	93.4	165.5	-175.9	0	0	0	0	106.3	Y14 L18	Y14-V16 PolarHBondContact O-N 3Å; Y14-V16 VanDerWaalsContact O-N 3.11Å; V16-L18 HydrophobicContact CG1-CD2 4.06Å; V16-L18 HydrophobicContact CG1-CG 3.96Å; V16-L18 PolarHBondContact O-N 3.11Å
17	V	44.5	Very low	44	Very low	103 Å²	103	134 Å²	134	62%	0.624	68%	0.679	S	S	*	*			trans	-70.2	91	164.6	-178	0	0	0	0	106.2	V15 W19	V15-V17 VanDerWaalsContact C-N 3.32Å; V15-V17 HydrophobicContact CG1-CG2 3.76Å; V15-V17 PolarHBondContact O-N 2.85Å; V15-V17 VanDerWaalsContact O-N 3.08Å; V17-W19 PolarHBondContact O-N 2.84Å
18	L	37.2	Very low	45.5	Very low	151 Å²	151	126 Å²	126	79%	0.791	66%	0.655	S	S	*	*			trans	-67.5	89.3	160.8	-70.1	170.4	0	0	0	105.9	V16	V16-L18 HydrophobicContact CG1-CD2 4.06Å; V16-L18 HydrophobicContact CG1-CG 3.96Å; V16-L18 PolarHBondContact O-N 3.11Å
19	W	35.9	Very low	47.1	Very low	219 Å²	219	119.9 Å²	119.9	83%	0.83	61%	0.613	S	S	*	*			trans	-54.4	124.2	161.3	-95.8	-10.6	0	0	0	106.7	V17 Y21	V17-W19 PolarHBondContact O-N 2.84Å; W19-Y21 PolarHBondContact O-N 2.78Å
20	P	41.6	Very low	49	Very low	112 Å²	112	112.3 Å²	112.3	73%	0.727	57%	0.574	S	S	*	*			trans	-58.6	115	169.4	25.6	-29.4	0	0	0	105	T22	P20-T22 PolarHBondContact O-N 3.15Å
21	Y	34.9	Very low	50.6	Low	211 Å²	211	114.1 Å²	114.1	83%	0.827	57%	0.572	S	S	*	*			trans	-48.9	109.6	169.7	-97.5	-102	0	0	0	106	W19 F23	W19-Y21 PolarHBondContact O-N 2.78Å; Y21-F23 PolarHBondContact O-N 3.02Å
22	T	33.8	Very low	52.2	Low	135 Å²	135	110 Å²	110	83%	0.828	55%	0.552	S	S	*	*			trans	-63.7	89	161.7	45.9	0	0	0	0	105	P20 S24	P20-T22 PolarHBondContact O-N 3.15Å; T22-S24 PolarHBondContact O-N 3.15Å
23	F	37.9	Very low	53.7	Low	134 Å²	134	107.9 Å²	107.9	59%	0.588	54%	0.537	S	S	*	.			trans	-50.4	116.4	167.2	-104.6	-92.6	0	0	0	105.9	Y21 K25 E27	Y21-F23 PolarHBondContact O-N 3.02Å; F23-K25 PolarHBondContact O-N 3.23Å; F23-E27 HydrophobicContact CD1-CB 4.3Å
24	S	47.5	Very low	55.1	Low	55 Å²	55	105.3 Å²	105.3	39%	0.385	53%	0.527	S	S	.	.			trans	-64.9	127.8	179.5	178.2	0	0	0	0	106.2	T22 S26 E27	T22-S24 PolarHBondContact O-N 3.15Å; S24-S26 WeakPolarHBondContact CB-OG 3.46Å; S24-S26 PolarHBondContact O-N 2.77Å; S24-S26 PolarHBondContact OG-OG 2.97Å; S24-E27 PolarHBondContact N-OE2 3.3Å; S24-E27 WeakPolarHBondContact O-CB 3.3Å; S24-E27 PolarHBondContact O-N 3.17Å
25	K	53.9	Low	56.7	Low	66 Å²	66	96.8 Å²	96.8	29%	0.287	50%	0.496	S	S	.	.	H	α-helix	trans	-51.7	-25.2	179.9	-71.1	166.7	177	-176.2	0	113.5	F23 E27 Y54 D92 T224	F23-K25 PolarHBondContact O-N 3.23Å; K25-E27 PolarHBondContact O-N 2.98Å; K25-Y54 PolarHBondContact O-OH 3.29Å; K25-D92 VanDerWaalsContact CB-OD2 3.26Å; K25-D92 WeakPolarHBondContact CB-OD2 2.84Å; K25-D92 WeakPolarHBondContact CD-OD1 3.33Å; K25-D92 WeakPolarHBondContact CD-OD2 3.39Å; K25-D92 WeakPolarHBondContact CE-OD1 3.36Å; K25-D92 IonicContact NZ-OD1 3.4Å; K25-D92 PolarHBondContact NZ-OD1 3.39Å; K25-T224 HydrophobicContact CG-CG2 4.47Å
26	S	57.7	Low	57.7	Low	29 Å²	29	92.2 Å²	92.2	20%	0.203	47%	0.466	C	S	.	.	H	α-helix	trans	-58	-33.8	171.5	59.9	0	0	0	0	113.1	S24 I29 C30	S24-S26 WeakPolarHBondContact CB-OG 3.46Å; S24-S26 PolarHBondContact O-N 2.77Å; S24-S26 PolarHBondContact OG-OG 2.97Å; S26-I29 WeakPolarHBondContact O-CG2 3.46Å; S26-C30 WeakPolarHBondContact O-CB 3.25Å; S26-C30 PolarHBondContact O-N 3.29Å; S26-C30 PolarHBondContact O-SG 3.35Å
27	E	58.2	Low	59.3	Low	56 Å²	56	93.2 Å²	93.2	26%	0.262	46%	0.463	S	S	.	.	H	α-helix	trans	-68	-40.8	-172.7	-75	162.7	175.1	0	0	112	F23 S24 K25 I29 C30 E31 K190	F23-E27 HydrophobicContact CD1-CB 4.3Å; S24-E27 PolarHBondContact N-OE2 3.3Å; S24-E27 WeakPolarHBondContact O-CB 3.3Å; S24-E27 PolarHBondContact O-N 3.17Å; K25-E27 PolarHBondContact O-N 2.98Å; E27-I29 PolarHBondContact O-N 3.4Å; E27-C30 WeakPolarHBondContact O-CB 3.44Å; E27-C30 PolarHBondContact O-N 3.07Å; E27-C30 VanDerWaalsContact O-N 3.13Å; E27-E31 WeakPolarHBondContact O-CG 3.31Å; E27-E31 PolarHBondContact O-N 3.35Å; E27-K190 IonicContact OE1-NZ 2.69Å
28	D	73	Confident	60.9	Low	71 Å²	71	91.2 Å²	91.2	38%	0.38	45%	0.445	S	S	.	.	H	α-helix	trans	-58.1	-49.6	-178.6	-67.5	-3.5	0	0	0	112.7	C30 E31 D32 L35	D28-C30 VanDerWaalsContact C-N 3.28Å; D28-C30 PolarHBondContact O-N 3.1Å; D28-E31 PolarHBondContact O-N 3.13Å; D28-D32 PolarHBondContact O-N 2.81Å; D28-L35 HydrophobicContact CB-CD1 4.15Å
29	I	78	Confident	63.3	Low	0 Å²	0	88.6 Å²	88.6	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-73.2	-22.8	-179.9	-169	160.4	0	0	0	113.4	S26 E27 E31 L35 Q36 Y54 I187 K200 P202	S26-I29 WeakPolarHBondContact O-CG2 3.46Å; E27-I29 PolarHBondContact O-N 3.4Å; I29-E31 VanDerWaalsContact C-N 3.32Å; I29-L35 HydrophobicContact CB-CB 4.48Å; I29-L35 HydrophobicContact CD1-CB 4.46Å; I29-L35 HydrophobicContact CG1-CB 4.14Å; I29-Q36 HydrophobicContact CD1-CB 3.73Å; I29-Q36 HydrophobicContact CG1-CB 4.27Å; I29-Y54 HydrophobicContact CB-CD2 4.49Å; I29-Y54 HydrophobicContact CB-CE2 3.72Å; I29-Y54 HydrophobicContact CD1-CD1 3.98Å; I29-Y54 HydrophobicContact CD1-CD2 3.89Å; I29-Y54 HydrophobicContact CD1-CE1 3.94Å; I29-Y54 HydrophobicContact CD1-CE2 3.83Å; I29-Y54 HydrophobicContact CD1-CG 3.96Å; I29-Y54 HydrophobicContact CG1-CE2 4.29Å; I29-Y54 HydrophobicContact CG2-CE2 4.32Å; I29-Y54 WeakPolarHBondContact CG2-OH 3.24Å; I29-I187 HydrophobicContact CD1-CD1 4.33Å; I29-I187 HydrophobicContact CG2-CD1 3.96Å; I29-I187 HydrophobicContact CG2-CG2 4.01Å; I29-K200 HydrophobicContact CD1-CB 4.33Å; I29-K200 HydrophobicContact CG1-CB 4.21Å; I29-K200 HydrophobicContact CG1-CG 4.23Å; I29-P202 HydrophobicContact CD1-CG 3.46Å; I29-P202 VanDerWaalsContact CD1-CG 3.46Å
30	C	80.3	Confident	65.7	Low	9 Å²	9	80.7 Å²	80.7	6%	0.061	40%	0.403	C	S	.	.	H	α-helix	trans	-75.1	-27.3	175.5	-68.5	0	0	0	0	111.8	S26 E27 D28 C189	S26-C30 WeakPolarHBondContact O-CB 3.25Å; S26-C30 PolarHBondContact O-N 3.29Å; S26-C30 PolarHBondContact O-SG 3.35Å; E27-C30 WeakPolarHBondContact O-CB 3.44Å; E27-C30 PolarHBondContact O-N 3.07Å; E27-C30 VanDerWaalsContact O-N 3.13Å; D28-C30 VanDerWaalsContact C-N 3.28Å; D28-C30 PolarHBondContact O-N 3.1Å; C30-C189 WeakPolarHBondContact CA-SG 3.06Å; C30-C189 HydrophobicContact CB-CB 3.63Å; C30-C189 WeakPolarHBondContact CB-SG 3.39Å; C30-C189 WeakPolarHBondContact SG-CA 3.33Å; C30-C189 WeakPolarHBondContact SG-CB 3.4Å; C30-C189 CovalentContact SG-SG 2.01Å; C30-C189 PolarHBondContact SG-SG 3.4Å
31	E	78	Confident	68.1	Low	141 Å²	141	78.4 Å²	78.4	66%	0.659	39%	0.386	S	S	*	.	H	α-helix	trans	-87	-38.8	174.2	-67.4	-178	-176.8	0	0	112.9	E27 D28 I29	E27-E31 WeakPolarHBondContact O-CG 3.31Å; E27-E31 PolarHBondContact O-N 3.35Å; D28-E31 PolarHBondContact O-N 3.13Å; I29-E31 VanDerWaalsContact C-N 3.32Å
32	D	77.1	Confident	70.6	Confident	72 Å²	72	69 Å²	69	39%	0.385	35%	0.35	S	S	.	.			trans	-113.4	102	179.2	-175.6	-1.9	0	0	0	112.1	D28 E34 L35	D28-D32 PolarHBondContact O-N 2.81Å; D32-E34 PolarHBondContact O-N 3.38Å; D32-E34 VanDerWaalsContact OD1-CB 3.32Å; D32-E34 WeakPolarHBondContact OD1-CB 3.12Å; D32-E34 PolarHBondContact OD1-N 3.11Å; D32-L35 HydrophobicContact CB-CD1 3.89Å; D32-L35 HydrophobicContact CB-CG 3.87Å; D32-L35 WeakPolarHBondContact O-CB 3.03Å; D32-L35 PolarHBondContact O-N 3.3Å
33	N	73.6	Confident	73.3	Confident	72 Å²	72	64.2 Å²	64.2	39%	0.385	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-66.4	-21.5	-179.2	-164.6	66.9	0	0	0	113.5	L35 Q36 K200	N33-L35 VanDerWaalsContact C-N 3.27Å; N33-L35 PolarHBondContact O-N 3.44Å; N33-Q36 PolarHBondContact ND2-NE2 3.11Å; N33-Q36 WeakPolarHBondContact O-CG 3.49Å; N33-Q36 PolarHBondContact O-NE2 3.01Å; N33-Q36 PolarHBondContact OD1-NE2 3.21Å; N33-K200 PolarHBondContact OD1-NZ 2.79Å
34	E	77.4	Confident	75.9	Confident	134 Å²	134	62.3 Å²	62.3	63%	0.626	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-72.3	-24.5	178.7	-63.3	-62.4	135.8	0	0	111.4	D32 Q36 H37 R38	D32-E34 PolarHBondContact O-N 3.38Å; D32-E34 VanDerWaalsContact OD1-CB 3.32Å; D32-E34 WeakPolarHBondContact OD1-CB 3.12Å; D32-E34 PolarHBondContact OD1-N 3.11Å; E34-Q36 PolarHBondContact O-N 3.23Å; E34-H37 PolarHBondContact O-N 2.88Å; E34-H37 VanDerWaalsContact O-N 3.08Å; E34-R38 PolarHBondContact O-N 3.19Å
35	L	76	Confident	78.1	Confident	28 Å²	28	63.5 Å²	63.5	15%	0.147	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-60.5	-32.1	179.7	-69.5	-179.9	0	0	0	112.8	D28 I29 D32 N33 H37 R38 Y54	D28-L35 HydrophobicContact CB-CD1 4.15Å; I29-L35 HydrophobicContact CB-CB 4.48Å; I29-L35 HydrophobicContact CD1-CB 4.46Å; I29-L35 HydrophobicContact CG1-CB 4.14Å; D32-L35 HydrophobicContact CB-CD1 3.89Å; D32-L35 HydrophobicContact CB-CG 3.87Å; D32-L35 WeakPolarHBondContact O-CB 3.03Å; D32-L35 PolarHBondContact O-N 3.3Å; N33-L35 VanDerWaalsContact C-N 3.27Å; N33-L35 PolarHBondContact O-N 3.44Å; L35-H37 PolarHBondContact O-N 3.34Å; L35-R38 VanDerWaalsContact O-CB 3.25Å; L35-R38 WeakPolarHBondContact O-CB 3.39Å; L35-R38 PolarHBondContact O-N 2.95Å; L35-Y54 HydrophobicContact CB-CD2 4.16Å
36	Q	71.7	Confident	80	Confident	26 Å²	26	67.5 Å²	67.5	12%	0.121	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-68.2	-22.2	179.6	86.9	-167.4	-55.2	0	0	113.5	I29 N33 E34	I29-Q36 HydrophobicContact CD1-CB 3.73Å; I29-Q36 HydrophobicContact CG1-CB 4.27Å; N33-Q36 PolarHBondContact ND2-NE2 3.11Å; N33-Q36 WeakPolarHBondContact O-CG 3.49Å; N33-Q36 PolarHBondContact O-NE2 3.01Å; N33-Q36 PolarHBondContact OD1-NE2 3.21Å; E34-Q36 PolarHBondContact O-N 3.23Å
37	H	78	Confident	81.7	Confident	133 Å²	133	68.6 Å²	68.6	62%	0.616	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-107.1	5.4	179.1	-61.1	-48.9	0	0	0	112.5	E34 L35 Q39	E34-H37 PolarHBondContact O-N 2.88Å; E34-H37 VanDerWaalsContact O-N 3.08Å; L35-H37 PolarHBondContact O-N 3.34Å; H37-Q39 PolarHBondContact O-N 2.84Å; H37-Q39 VanDerWaalsContact O-N 3.11Å
38	R	78.1	Confident	83.5	Confident	61 Å²	61	67.3 Å²	67.3	23%	0.23	34%	0.341	C	S	.	.			trans	-60.8	116.6	-177	-174.7	175.4	-175.4	-175	-5.7	110.5	E34 L35 H53 K253	E34-R38 PolarHBondContact O-N 3.19Å; L35-R38 VanDerWaalsContact O-CB 3.25Å; L35-R38 WeakPolarHBondContact O-CB 3.39Å; L35-R38 PolarHBondContact O-N 2.95Å; R38-H53 WeakPolarHBondContact O-CA 3.29Å; R38-H53 PolarHBondContact O-ND1 3.04Å; R38-K253 VanDerWaalsContact NH2-NZ 3.14Å
39	Q	86.7	Confident	84.6	Confident	96 Å²	96	64 Å²	64	45%	0.449	32%	0.323	S	S	.	.			trans	-135.8	105.9	168.7	173.1	178.5	-22.7	0	0	108.2	H37 V41	H37-Q39 PolarHBondContact O-N 2.84Å; H37-Q39 VanDerWaalsContact O-N 3.11Å; Q39-V41 HydrophobicContact CG-CG2 4.35Å
40	N	86.7	Confident	85.4	Confident	54 Å²	54	64.2 Å²	64.2	29%	0.289	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	99.8	175.6	-66.4	-2.4	0	0	0	108.5	I42 S51 L52	N40-I42 HydrophobicContact CB-CD1 4.31Å; N40-I42 PolarHBondContact O-N 3.47Å; N40-S51 CarbonylContact O-C 3.51Å; N40-S51 WeakPolarHBondContact O-CA 3.5Å; N40-L52 HydrophobicContact CB-CB 4.35Å; N40-L52 PolarHBondContact N-O 3.32Å; N40-L52 PolarHBondContact O-N 3.5Å
41	V	91.1	Very high	85.9	Confident	63 Å²	63	63.8 Å²	63.8	38%	0.382	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	118.4	172.3	-179	0	0	0	0	108.3	Q39 Q44 Q49	Q39-V41 HydrophobicContact CG-CG2 4.35Å; V41-Q44 HydrophobicContact CG1-CB 4.03Å; V41-Q49 HydrophobicContact CG1-CG 3.95Å
42	I	88.6	Confident	86.5	Confident	15 Å²	15	57.2 Å²	57.2	8%	0.077	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-47.3	-175.1	-55.9	-52.1	0	0	0	110.4	N40 Y50 L52 K250 A251 D269	N40-I42 HydrophobicContact CB-CD1 4.31Å; N40-I42 PolarHBondContact O-N 3.47Å; I42-Y50 HydrophobicContact CB-CD1 3.83Å; I42-Y50 HydrophobicContact CG1-CD1 3.86Å; I42-Y50 HydrophobicContact CG1-CE1 4.13Å; I42-Y50 HydrophobicContact CG2-CD1 4.21Å; I42-Y50 PolarHBondContact N-O 3.49Å; I42-L52 HydrophobicContact CD1-CD1 3.85Å; I42-L52 HydrophobicContact CD1-CG 4.08Å; I42-L52 HydrophobicContact CG1-CD1 4.2Å; I42-L52 HydrophobicContact CG1-CG 3.98Å; I42-K250 HydrophobicContact CG2-CB 3.97Å; I42-K250 HydrophobicContact CG2-CD 4.14Å; I42-K250 VanDerWaalsContact O-CD 3.25Å; I42-K250 WeakPolarHBondContact O-CD 3.37Å; I42-A251 HydrophobicContact CD1-CB 3.59Å; I42-D269 WeakPolarHBondContact CG2-O 3.19Å
43	V	90.9	Very high	87.2	Confident	34 Å²	34	54.1 Å²	54.1	21%	0.206	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	144.6	178.5	57	0	0	0	0	108.8	Y48 Q49 Y50 D269	V43-Y48 HydrophobicContact CG1-CD1 4.19Å; V43-Y48 HydrophobicContact CG1-CE1 3.72Å; V43-Q49 WeakPolarHBondContact O-CA 3.38Å; V43-Y50 PolarHBondContact N-O 3.09Å; V43-Y50 PolarHBondContact O-N 3.24Å; V43-D269 HydrophobicContact CG1-CB 3.79Å
44	Q	92	Very high	87.8	Confident	94 Å²	94	51.5 Å²	51.5	44%	0.439	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	134.8	178	-168.8	-171	-91.3	0	0	109.8	V41 Y48 Q49 K209 W210	V41-Q44 HydrophobicContact CG1-CB 4.03Å; Q44-Y48 WeakPolarHBondContact CA-O 3.44Å; Q44-Q49 HydrophobicContact CB-CG 4.26Å; Q44-Q49 HydrophobicContact CG-CB 4.2Å; Q44-Q49 HydrophobicContact CG-CG 4.04Å; Q44-Q49 VanDerWaalsContact OE1-OE1 3.05Å; Q44-K209 VanDerWaalsContact NE2-NZ 3.16Å; Q44-W210 HydrophobicContact CG-CZ2 4.01Å
45	N	93.1	Very high	88.3	Confident	79 Å²	79	45.5 Å²	45.5	42%	0.422	23%	0.231	S	C	.	.			trans	-134.3	-160.9	164.7	64.9	37.9	0	0	0	109.1	S47 Y48 W210	N45-S47 PolarHBondContact OD1-N 3.48Å; N45-S47 PolarHBondContact OD1-OG 3.48Å; N45-Y48 PolarHBondContact N-O 3.34Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.29Å; N45-Y48 VanDerWaalsContact OD1-CB 3.31Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.28Å; N45-Y48 PolarHBondContact OD1-N 3.49Å; N45-W210 VanDerWaalsContact O-CH2 3.24Å; N45-W210 WeakPolarHBondContact O-CH2 2.96Å
46	D	93	Very high	89.1	Confident	150 Å²	150	44.2 Å²	44.2	80%	0.802	22%	0.224	S	C	*	.	S	Bend	trans	-75.7	-19.4	-175.9	-68.4	-25	0	0	0	114.8
47	S	94.9	Very high	90	Very high	52 Å²	52	43 Å²	43	36%	0.364	22%	0.218	S	C	.	.	S	Bend	trans	-123.7	-5.2	-176.5	61.6	0	0	0	0	114	N45 T61 R62	N45-S47 PolarHBondContact OD1-N 3.48Å; N45-S47 PolarHBondContact OD1-OG 3.48Å; S47-T61 CarbonylContact O-C 3.55Å; S47-T61 WeakPolarHBondContact O-CA 3.21Å; S47-R62 PolarHBondContact O-N 2.91Å
48	Y	95.8	Very high	90.9	Very high	30 Å²	30	36.7 Å²	36.7	12%	0.118	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.9	-173.5	-174	-106.3	0	0	0	112.4	V43 Q44 N45 K59 I60 T61 D269	V43-Y48 HydrophobicContact CG1-CD1 4.19Å; V43-Y48 HydrophobicContact CG1-CE1 3.72Å; Q44-Y48 WeakPolarHBondContact CA-O 3.44Å; N45-Y48 PolarHBondContact N-O 3.34Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.29Å; N45-Y48 VanDerWaalsContact OD1-CB 3.31Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.28Å; N45-Y48 PolarHBondContact OD1-N 3.49Å; Y48-K59 HydrophobicContact CE2-CD 3.98Å; Y48-K59 HydrophobicContact CE2-CG 3.52Å; Y48-I60 CarbonylContact C-O 3.52Å; Y48-I60 VanDerWaalsContact CA-O 3.25Å; Y48-I60 WeakPolarHBondContact CA-O 3.32Å; Y48-I60 WeakPolarHBondContact CD2-O 3.46Å; Y48-T61 HydrophobicContact CD2-CG2 4.43Å; Y48-D269 VanDerWaalsContact CE1-OD1 3.32Å; Y48-D269 WeakPolarHBondContact CE1-OD1 3.44Å; Y48-D269 PolarHBondContact OH-OD2 3.18Å
49	Q	95.5	Very high	91.7	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.009	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	132.8	166.4	-171.5	-171.3	-71.7	0	0	110.1	V41 V43 Q44 K59 I60 W210	V41-Q49 HydrophobicContact CG1-CG 3.95Å; V43-Q49 WeakPolarHBondContact O-CA 3.38Å; Q44-Q49 HydrophobicContact CB-CG 4.26Å; Q44-Q49 HydrophobicContact CG-CB 4.2Å; Q44-Q49 HydrophobicContact CG-CG 4.04Å; Q44-Q49 VanDerWaalsContact OE1-OE1 3.05Å; Q49-K59 CarbonylContact O-C 3.5Å; Q49-K59 WeakPolarHBondContact O-CA 3.36Å; Q49-I60 HydrophobicContact CB-CB 4.25Å; Q49-I60 PolarHBondContact N-O 3.26Å; Q49-I60 PolarHBondContact O-N 2.83Å; Q49-W210 HydrophobicContact CB-CH2 4.47Å; Q49-W210 HydrophobicContact CB-CZ2 3.73Å
50	Y	94	Very high	92.2	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.3	166.9	-176.7	-113.5	0	0	0	110	I42 V43 L52 S57 M58 K59 K266 D269	I42-Y50 HydrophobicContact CB-CD1 3.83Å; I42-Y50 HydrophobicContact CG1-CD1 3.86Å; I42-Y50 HydrophobicContact CG1-CE1 4.13Å; I42-Y50 HydrophobicContact CG2-CD1 4.21Å; I42-Y50 PolarHBondContact N-O 3.49Å; V43-Y50 PolarHBondContact N-O 3.09Å; V43-Y50 PolarHBondContact O-N 3.24Å; Y50-L52 HydrophobicContact CE1-CD2 4.03Å; Y50-L52 WeakPolarHBondContact OH-CD2 2.97Å; Y50-S57 WeakPolarHBondContact OH-CB 3.47Å; Y50-S57 PolarHBondContact OH-OG 2.67Å; Y50-M58 WeakPolarHBondContact CA-O 2.96Å; Y50-K59 HydrophobicContact CD2-CB 4.13Å; Y50-K266 WeakPolarHBondContact OH-CE 3.31Å; Y50-D269 HydrophobicContact CD1-CB 4.03Å; Y50-D269 HydrophobicContact CG-CB 4.45Å
51	S	92.2	Very high	92.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	147.5	-177.2	52.7	0	0	0	0	112.3	N40 H53 S57 M58	N40-S51 CarbonylContact O-C 3.51Å; N40-S51 WeakPolarHBondContact O-CA 3.5Å; S51-H53 PolarHBondContact OG-NE2 3.05Å; S51-S57 CarbonylContact O-C 3.59Å; S51-S57 WeakPolarHBondContact O-CA 3.48Å; S51-M58 PolarHBondContact N-O 2.82Å; S51-M58 PolarHBondContact O-N 2.01Å; S51-M58 VanDerWaalsContact OG-CE 3.29Å; S51-M58 WeakPolarHBondContact OG-CE 3.07Å; S51-M58 PolarHBondContact OG-O 3.3Å
52	L	90.3	Very high	93	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.016	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	135.5	176.3	-57.8	172.5	0	0	0	110.2	N40 I42 Y50 A251 I255	N40-L52 HydrophobicContact CB-CB 4.35Å; N40-L52 PolarHBondContact N-O 3.32Å; N40-L52 PolarHBondContact O-N 3.5Å; I42-L52 HydrophobicContact CD1-CD1 3.85Å; I42-L52 HydrophobicContact CD1-CG 4.08Å; I42-L52 HydrophobicContact CG1-CD1 4.2Å; I42-L52 HydrophobicContact CG1-CG 3.98Å; Y50-L52 HydrophobicContact CE1-CD2 4.03Å; Y50-L52 WeakPolarHBondContact OH-CD2 2.97Å; L52-A251 HydrophobicContact CD1-CB 4.26Å; L52-I255 HydrophobicContact CD1-CG2 3.56Å; L52-I255 HydrophobicContact CD2-CG2 4.21Å
53	H	90.9	Very high	93.4	Very high	7 Å²	7	34.5 Å²	34.5	3%	0.032	17%	0.173	C	C	.	.			trans	-129.9	-177	178.9	-58.3	-97.7	0	0	0	109.8	R38 S51 N55 Y56 I204	R38-H53 WeakPolarHBondContact O-CA 3.29Å; R38-H53 PolarHBondContact O-ND1 3.04Å; S51-H53 PolarHBondContact OG-NE2 3.05Å; H53-N55 PolarHBondContact O-N 3.32Å; H53-Y56 CarbonylContact C-O 3.54Å; H53-Y56 WeakPolarHBondContact CA-O 3.18Å; H53-Y56 WeakPolarHBondContact CB-O 3.38Å; H53-Y56 PolarHBondContact N-O 2.66Å; H53-I204 HydrophobicContact CB-CD1 3.41Å; H53-I204 VanDerWaalsContact CB-CD1 3.41Å; H53-I204 HydrophobicContact CB-CG1 3.71Å
54	Y	87.3	Confident	93.6	Very high	17 Å²	17	36.2 Å²	36.2	7%	0.067	18%	0.179	C	C	.	.	S	Bend	trans	-66.9	121	172.7	-175.2	-99.7	0	0	0	111.3	K25 I29 L35 Y56 Y91 I187 P202	K25-Y54 PolarHBondContact O-OH 3.29Å; I29-Y54 HydrophobicContact CB-CD2 4.49Å; I29-Y54 HydrophobicContact CB-CE2 3.72Å; I29-Y54 HydrophobicContact CD1-CD1 3.98Å; I29-Y54 HydrophobicContact CD1-CD2 3.89Å; I29-Y54 HydrophobicContact CD1-CE1 3.94Å; I29-Y54 HydrophobicContact CD1-CE2 3.83Å; I29-Y54 HydrophobicContact CD1-CG 3.96Å; I29-Y54 HydrophobicContact CG1-CE2 4.29Å; I29-Y54 HydrophobicContact CG2-CE2 4.32Å; I29-Y54 WeakPolarHBondContact CG2-OH 3.24Å; L35-Y54 HydrophobicContact CB-CD2 4.16Å; Y54-Y56 PolarHBondContact O-N 3.5Å; Y54-Y91 HydrophobicContact CD1-CD1 4.3Å; Y54-Y91 AromaticContact CD1-CE1 3.96Å; Y54-Y91 HydrophobicContact CD1-CE1 3.96Å; Y54-Y91 HydrophobicContact CE1-CD1 4.34Å; Y54-Y91 HydrophobicContact CE1-CE1 4.45Å; Y54-I187 HydrophobicContact CD1-CD1 4.37Å; Y54-I187 HydrophobicContact CE1-CD1 3.47Å; Y54-I187 VanDerWaalsContact CE1-CD1 3.47Å; Y54-P202 HydrophobicContact CD1-CB 3.92Å; Y54-P202 HydrophobicContact CD1-CG 3.59Å; Y54-P202 HydrophobicContact CE1-CG 4.04Å; Y54-P202 HydrophobicContact CG-CB 4.46Å; Y54-P202 HydrophobicContact CG-CG 4.29Å
55	N	87.6	Confident	93.7	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.043	20%	0.197	C	C	.	.	S	Bend	trans	56.5	-3.6	-177.7	-74.8	3.3	0	0	0	117.5	H53 Y91 D92 I222	H53-N55 PolarHBondContact O-N 3.32Å; N55-Y91 HydrophobicContact CB-CD1 3.74Å; N55-Y91 HydrophobicContact CB-CE1 3.97Å; N55-D92 PolarHBondContact ND2-OD2 3.26Å; N55-I222 WeakPolarHBondContact O-CG1 3.41Å; N55-I222 PolarHBondContact O-N 2.87Å
56	Y	91.7	Very high	93.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.1	175	-74	-93.4	0	0	0	112	H53 Y54 Y91 I183 I204 E220 V221	H53-Y56 CarbonylContact C-O 3.54Å; H53-Y56 WeakPolarHBondContact CA-O 3.18Å; H53-Y56 WeakPolarHBondContact CB-O 3.38Å; H53-Y56 PolarHBondContact N-O 2.66Å; Y54-Y56 PolarHBondContact O-N 3.5Å; Y56-Y91 HydrophobicContact CD2-CD1 4.35Å; Y56-Y91 AromaticContact CD2-CE1 3.83Å; Y56-Y91 HydrophobicContact CD2-CE1 3.83Å; Y56-Y91 HydrophobicContact CD2-CE2 4.13Å; Y56-Y91 AromaticContact CD2-CZ 3.72Å; Y56-Y91 AromaticContact CE2-CD1 3.98Å; Y56-Y91 HydrophobicContact CE2-CD1 3.98Å; Y56-Y91 AromaticContact CE2-CD2 3.69Å; Y56-Y91 HydrophobicContact CE2-CD2 3.69Å; Y56-Y91 AromaticContact CE2-CE1 3.81Å; Y56-Y91 HydrophobicContact CE2-CE1 3.81Å; Y56-Y91 AromaticContact CE2-CE2 3.53Å; Y56-Y91 HydrophobicContact CE2-CE2 3.53Å; Y56-Y91 AromaticContact CE2-CG 3.92Å; Y56-Y91 HydrophobicContact CE2-CG 3.92Å; Y56-Y91 AromaticContact CE2-CZ 3.59Å; Y56-Y91 PolarHBondContact OH-N 3.45Å; Y56-I183 HydrophobicContact CD1-CD1 4.28Å; Y56-I183 HydrophobicContact CD2-CD1 4Å; Y56-I183 HydrophobicContact CE1-CD1 4.39Å; Y56-I183 HydrophobicContact CE2-CD1 4.14Å; Y56-I183 HydrophobicContact CG-CD1 4.06Å; Y56-I204 HydrophobicContact CD2-CD1 4.43Å; Y56-I204 HydrophobicContact CG-CD1 4.42Å; Y56-E220 CarbonylContact C-O 3.42Å; Y56-E220 VanDerWaalsContact CA-O 3.31Å; Y56-E220 WeakPolarHBondContact CA-O 3.43Å; Y56-V221 HydrophobicContact CD1-CG2 4.24Å; Y56-V221 HydrophobicContact CE1-CB 4.37Å; Y56-V221 HydrophobicContact CE1-CG2 3.52Å
57	S	92	Very high	93.4	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.007	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	146.1	155.1	66.7	0	0	0	0	109.7	Y50 S51 Y219 E220	Y50-S57 WeakPolarHBondContact OH-CB 3.47Å; Y50-S57 PolarHBondContact OH-OG 2.67Å; S51-S57 CarbonylContact O-C 3.59Å; S51-S57 WeakPolarHBondContact O-CA 3.48Å; S57-Y219 WeakPolarHBondContact O-CA 3.28Å; S57-E220 PolarHBondContact N-O 2.72Å; S57-E220 PolarHBondContact O-N 3.17Å
58	M	95.6	Very high	93.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	119.9	177.5	-178.9	-176.9	66.1	0	0	109.3	Y50 S51 I60 I204 V217 E218 Y219	Y50-M58 WeakPolarHBondContact CA-O 2.96Å; S51-M58 PolarHBondContact N-O 2.82Å; S51-M58 PolarHBondContact O-N 2.01Å; S51-M58 VanDerWaalsContact OG-CE 3.29Å; S51-M58 WeakPolarHBondContact OG-CE 3.07Å; S51-M58 PolarHBondContact OG-O 3.3Å; M58-I60 HydrophobicContact CE-CD1 3.79Å; M58-I60 HydrophobicContact CE-CG1 4.32Å; M58-I60 HydrophobicContact CG-CG1 4.17Å; M58-I60 HydrophobicContact SD-CD1 4.11Å; M58-I60 HydrophobicContact SD-CG1 4.31Å; M58-I204 HydrophobicContact SD-CG2 4.13Å; M58-V217 HydrophobicContact CG-CG1 3.81Å; M58-V217 HydrophobicContact SD-CG1 4.02Å; M58-E218 CarbonylContact C-O 3.57Å; M58-E218 VanDerWaalsContact CA-O 3.3Å; M58-E218 WeakPolarHBondContact CA-O 3.01Å; M58-Y219 HydrophobicContact CB-CD1 4.05Å; M58-Y219 HydrophobicContact CB-CE1 4.03Å; M58-Y219 HydrophobicContact CG-CD1 4.08Å; M58-Y219 HydrophobicContact CG-CE1 3.71Å; M58-Y219 HydrophobicContact SD-CE1 3.7Å
59	K	96.1	Very high	92.3	Very high	52 Å²	52	36.6 Å²	36.6	23%	0.226	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.7	172.2	-176.2	-178.8	126	-145.8	0	108.8	Y48 Q49 Y50 V217 E218	Y48-K59 HydrophobicContact CE2-CD 3.98Å; Y48-K59 HydrophobicContact CE2-CG 3.52Å; Q49-K59 CarbonylContact O-C 3.5Å; Q49-K59 WeakPolarHBondContact O-CA 3.36Å; Y50-K59 HydrophobicContact CD2-CB 4.13Å; K59-V217 CarbonylContact O-C 3.41Å; K59-V217 WeakPolarHBondContact O-CA 3.32Å; K59-E218 HydrophobicContact CB-CB 4.3Å; K59-E218 WeakPolarHBondContact CE-OE2 3.36Å; K59-E218 PolarHBondContact N-O 2.92Å; K59-E218 IonicContact NZ-OE1 2.83Å; K59-E218 PolarHBondContact NZ-OE1 3.11Å; K59-E218 IonicContact NZ-OE2 2.78Å; K59-E218 PolarHBondContact NZ-OE2 3.32Å; K59-E218 PolarHBondContact O-N 2.85Å
60	I	97.9	Very high	91.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.8	177.1	-56.3	179.6	0	0	0	107.5	Y48 Q49 M58 V206 W210 T215 L216 V217	Y48-I60 CarbonylContact C-O 3.52Å; Y48-I60 VanDerWaalsContact CA-O 3.25Å; Y48-I60 WeakPolarHBondContact CA-O 3.32Å; Y48-I60 WeakPolarHBondContact CD2-O 3.46Å; Q49-I60 HydrophobicContact CB-CB 4.25Å; Q49-I60 PolarHBondContact N-O 3.26Å; Q49-I60 PolarHBondContact O-N 2.83Å; M58-I60 HydrophobicContact CE-CD1 3.79Å; M58-I60 HydrophobicContact CE-CG1 4.32Å; M58-I60 HydrophobicContact CG-CG1 4.17Å; M58-I60 HydrophobicContact SD-CD1 4.11Å; M58-I60 HydrophobicContact SD-CG1 4.31Å; I60-V206 HydrophobicContact CD1-CG1 4.36Å; I60-W210 HydrophobicContact CD1-CB 4.02Å; I60-W210 VanDerWaalsContact CD1-CD1 3.5Å; I60-W210 HydrophobicContact CD1-CD2 4.36Å; I60-W210 HydrophobicContact CD1-CG 3.74Å; I60-W210 HydrophobicContact CG2-CB 3.91Å; I60-W210 HydrophobicContact CG2-CD2 3.76Å; I60-W210 HydrophobicContact CG2-CE3 3.7Å; I60-W210 HydrophobicContact CG2-CG 3.86Å; I60-W210 HydrophobicContact CG2-CZ3 4.45Å; I60-T215 HydrophobicContact CG2-CG2 3.66Å; I60-L216 CarbonylContact C-O 3.56Å; I60-L216 WeakPolarHBondContact CA-O 3.47Å; I60-V217 HydrophobicContact CG1-CG1 4.26Å; I60-V217 HydrophobicContact CG1-CG2 4.21Å; I60-V217 HydrophobicContact CG2-CG2 4.41Å
61	T	97.5	Very high	90.8	Very high	24 Å²	24	45.7 Å²	45.7	15%	0.147	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.6	177.7	-43	0	0	0	0	110	S47 Y48 Q64 L216	S47-T61 CarbonylContact O-C 3.55Å; S47-T61 WeakPolarHBondContact O-CA 3.21Å; Y48-T61 HydrophobicContact CD2-CG2 4.43Å; T61-Q64 HydrophobicContact CG2-CG 3.92Å; T61-Q64 VanDerWaalsContact CG2-NE2 3.28Å; T61-Q64 WeakPolarHBondContact O-CG 3.46Å; T61-L216 PolarHBondContact N-O 3.23Å; T61-L216 PolarHBondContact O-N 3.33Å
62	R	96.8	Very high	90.7	Very high	56 Å²	56	51.6 Å²	51.6	21%	0.211	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	164.6	176.6	-65.4	-171.2	65.1	-140.2	-11.8	112	S47 Q64 W210 E214 T215	S47-R62 PolarHBondContact O-N 2.91Å; R62-Q64 PolarHBondContact O-N 3.41Å; R62-Q64 PolarHBondContact O-NE2 3.35Å; R62-W210 HydrophobicContact CG-CE3 3.79Å; R62-W210 HydrophobicContact CG-CZ3 3.69Å; R62-E214 CarbonylContact C-O 3.52Å; R62-T215 HydrophobicContact CG-CG2 4.29Å
63	H	95.4	Very high	90.9	Very high	111 Å²	111	52.5 Å²	52.5	51%	0.514	28%	0.275	S	S	.	.	S	Bend	trans	57	39.4	177.2	-54	-62.9	0	0	0	112.4	E214	H63-E214 WeakPolarHBondContact CA-O 3.07Å; H63-E214 PolarHBondContact N-O 3.36Å; H63-E214 IonicContact ND1-OE2 3.53Å; H63-E214 PolarHBondContact ND1-OE2 3.44Å
64	Q	95.3	Very high	91.2	Very high	71 Å²	71	57.3 Å²	57.3	33%	0.332	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-90.8	147.4	177.7	-63.3	-58.4	-71.1	0	0	110.3	T61 R62 Y166 E214 L216	T61-Q64 HydrophobicContact CG2-CG 3.92Å; T61-Q64 VanDerWaalsContact CG2-NE2 3.28Å; T61-Q64 WeakPolarHBondContact O-CG 3.46Å; R62-Q64 PolarHBondContact O-N 3.41Å; R62-Q64 PolarHBondContact O-NE2 3.35Å; Q64-Y166 HydrophobicContact CB-CE2 4.34Å; Q64-Y166 PolarHBondContact O-OH 3.09Å; Q64-Y166 VanDerWaalsContact O-OH 3.07Å; Q64-E214 PolarHBondContact N-O 3.46Å; Q64-L216 HydrophobicContact CB-CB 4.07Å; Q64-L216 HydrophobicContact CG-CB 3.88Å
65	L	94	Very high	91.6	Very high	155 Å²	155	63.1 Å²	63.1	81%	0.812	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-72.8	160	167.6	-62.8	176.4	0	0	0	110.2
66	H	91.3	Very high	92	Very high	43 Å²	43	65.7 Å²	65.7	20%	0.199	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-59.8	127.8	174.8	-169.1	-78	0	0	0	109.4	I68 T154 Y166 E168	H66-I68 PolarHBondContact ND1-N 3.45Å; H66-I68 VanDerWaalsContact ND1-N 3.18Å; H66-I68 PolarHBondContact ND1-O 2.04Å; H66-I68 PolarHBondContact O-N 2.55Å; H66-T154 PolarHBondContact NE2-OG1 2.89Å; H66-T154 VanDerWaalsContact NE2-OG1 3.09Å; H66-Y166 HydrophobicContact CB-CD1 4.32Å; H66-Y166 HydrophobicContact CB-CE1 3.75Å; H66-Y166 AromaticContact CD2-CD1 3.35Å; H66-Y166 WeakPolarHBondContact CD2-CD1 2.99Å; H66-Y166 AromaticContact CD2-CE1 3.37Å; H66-Y166 WeakPolarHBondContact CD2-CE1 3.44Å; H66-Y166 AromaticContact CG-CD1 3.96Å; H66-Y166 AromaticContact CG-CE1 3.82Å; H66-Y166 PolarHBondContact N-OH 2.76Å; H66-Y166 AromaticContact NE2-CD1 3.98Å; H66-E168 IonicContact CD2-OE2 3.69Å
67	P	90.1	Very high	92	Very high	52 Å²	52	69.4 Å²	69.4	34%	0.338	36%	0.362	S	S	.	.	S	Bend	trans	-70	-14.4	-171.3	26.3	-35.4	0	0	0	114.1	L156 Y166 L216	P67-L156 HydrophobicContact CB-CD2 4.29Å; P67-L156 HydrophobicContact CG-CD1 3.75Å; P67-L156 HydrophobicContact CG-CD2 4.05Å; P67-Y166 HydrophobicContact CG-CG 4.3Å; P67-L216 HydrophobicContact CG-CD1 4.48Å
68	I	88.5	Confident	92.1	Very high	22 Å²	22	74.3 Å²	74.3	11%	0.113	39%	0.389	C	S	.	.			trans	-116.7	131.6	178.5	-62	160.5	0	0	0	109.5	H66 F73 L128 M133 A135 T154 L156	H66-I68 PolarHBondContact ND1-N 3.45Å; H66-I68 VanDerWaalsContact ND1-N 3.18Å; H66-I68 PolarHBondContact ND1-O 2.04Å; H66-I68 PolarHBondContact O-N 2.55Å; I68-F73 HydrophobicContact CD1-CZ 3.99Å; I68-F73 HydrophobicContact CG2-CE2 4.06Å; I68-F73 HydrophobicContact CG2-CZ 4.35Å; I68-L128 HydrophobicContact CG2-CD2 4.28Å; I68-M133 HydrophobicContact CD1-CE 3.78Å; I68-M133 HydrophobicContact CD1-SD 4.32Å; I68-M133 HydrophobicContact CG1-CE 4.03Å; I68-A135 HydrophobicContact CD1-CB 3.29Å; I68-T154 HydrophobicContact CD1-CG2 4.37Å; I68-L156 HydrophobicContact CD1-CD2 3.46Å; I68-L156 VanDerWaalsContact CD1-CD2 3.46Å; I68-L156 HydrophobicContact CD1-CG 3.96Å; I68-L156 HydrophobicContact CG1-CD2 3.66Å
69	V	79.4	Confident	92.2	Very high	140 Å²	140	78.7 Å²	78.7	85%	0.848	41%	0.412	S	S	*	.			trans	-99.1	-9.2	174.9	-173	0	0	0	0	112
70	S	81.3	Confident	92.3	Very high	43 Å²	43	78.6 Å²	78.6	30%	0.301	41%	0.412	S	S	.	.			trans	-75.2	135.5	-177.2	-177	0	0	0	0	113.2	N72 F73	S70-N72 PolarHBondContact OG-N 2.87Å; S70-F73 WeakPolarHBondContact O-CE2 3.48Å
71	D	75.3	Confident	92.3	Very high	155 Å²	155	82.5 Å²	82.5	83%	0.829	43%	0.429	S	S	*	.			trans	-94.6	6.2	173.4	-68.9	-39.4	0	0	0	113.4	F73	D71-F73 PolarHBondContact O-N 3.47Å
72	N	89.8	Confident	92.3	Very high	123 Å²	123	82 Å²	82	66%	0.658	43%	0.426	S	S	*	.			trans	-77.9	27.7	-175.2	-66	-22.3	0	0	0	114.3	S70 L128	S70-N72 PolarHBondContact OG-N 2.87Å; N72-L128 HydrophobicContact CB-CD1 4Å
73	F	95.3	Very high	92.3	Very high	23 Å²	23	85.8 Å²	85.8	10%	0.101	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-73.6	135.5	177.2	-76.8	-93.4	0	0	0	110.9	I68 S70 D71 E126 L128 A135 K137	I68-F73 HydrophobicContact CD1-CZ 3.99Å; I68-F73 HydrophobicContact CG2-CE2 4.06Å; I68-F73 HydrophobicContact CG2-CZ 4.35Å; S70-F73 WeakPolarHBondContact O-CE2 3.48Å; D71-F73 PolarHBondContact O-N 3.47Å; F73-E126 HydrophobicContact CB-CB 4.02Å; F73-E126 HydrophobicContact CB-CG 4.36Å; F73-E126 HydrophobicContact CD1-CB 3.95Å; F73-E126 HydrophobicContact CG-CB 4.31Å; F73-L128 HydrophobicContact CD1-CB 3.81Å; F73-L128 HydrophobicContact CE1-CB 3.75Å; F73-L128 HydrophobicContact CE2-CB 4.47Å; F73-L128 HydrophobicContact CE2-CD2 4.22Å; F73-L128 HydrophobicContact CG-CB 4.21Å; F73-L128 HydrophobicContact CZ-CB 4.1Å; F73-L128 HydrophobicContact CZ-CD2 4.25Å; F73-A135 HydrophobicContact CE1-CB 3.77Å; F73-A135 HydrophobicContact CZ-CB 3.87Å; F73-K137 HydrophobicContact CE1-CB 4.22Å
74	I	95.9	Very high	92.3	Very high	107 Å²	107	81.3 Å²	81.3	55%	0.549	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.7	173.6	-57.6	174.6	0	0	0	108.5	F76 E126 I127	I74-F76 HydrophobicContact CB-CE2 3.81Å; I74-F76 HydrophobicContact CB-CZ 4.16Å; I74-F76 HydrophobicContact CG2-CD2 4.42Å; I74-F76 HydrophobicContact CG2-CE1 4.39Å; I74-F76 HydrophobicContact CG2-CE2 3.66Å; I74-F76 HydrophobicContact CG2-CZ 3.66Å; I74-F76 VanDerWaalsContact O-CD2 3.24Å; I74-F76 WeakPolarHBondContact O-CD2 3.47Å; I74-F76 VanDerWaalsContact O-CE2 3.29Å; I74-F76 WeakPolarHBondContact O-CE2 3.24Å; I74-E126 CarbonylContact O-C 3.54Å; I74-E126 WeakPolarHBondContact O-CA 3.3Å; I74-I127 PolarHBondContact N-O 3.35Å; I74-I127 PolarHBondContact O-N 2.97Å
75	K	96.2	Very high	92.3	Very high	140 Å²	140	82.7 Å²	82.7	61%	0.609	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	140	178.6	-74.4	-178.8	179.5	-170.7	0	112	L125 E126	K75-L125 CarbonylContact C-O 3.57Å; K75-L125 WeakPolarHBondContact CA-O 3.3Å; K75-E126 HydrophobicContact CB-CG 4.49Å; K75-E126 HydrophobicContact CD-CG 4.45Å; K75-E126 WeakPolarHBondContact CE-OE2 3.43Å; K75-E126 HydrophobicContact CG-CG 3.5Å
76	F	96.1	Very high	92.3	Very high	61 Å²	61	76.4 Å²	76.4	27%	0.268	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	141.4	178.1	-64.4	-87	0	0	0	111.2	I74 Q80 L125 I127	I74-F76 HydrophobicContact CB-CE2 3.81Å; I74-F76 HydrophobicContact CB-CZ 4.16Å; I74-F76 HydrophobicContact CG2-CD2 4.42Å; I74-F76 HydrophobicContact CG2-CE1 4.39Å; I74-F76 HydrophobicContact CG2-CE2 3.66Å; I74-F76 HydrophobicContact CG2-CZ 3.66Å; I74-F76 VanDerWaalsContact O-CD2 3.24Å; I74-F76 WeakPolarHBondContact O-CD2 3.47Å; I74-F76 VanDerWaalsContact O-CE2 3.29Å; I74-F76 WeakPolarHBondContact O-CE2 3.24Å; F76-Q80 HydrophobicContact CB-CG 3.88Å; F76-Q80 HydrophobicContact CD1-CG 3.67Å; F76-Q80 VanDerWaalsContact CD1-NE2 3.3Å; F76-Q80 HydrophobicContact CD2-CG 4.09Å; F76-Q80 HydrophobicContact CE1-CG 4.18Å; F76-Q80 HydrophobicContact CG-CG 3.6Å; F76-L125 HydrophobicContact CB-CD2 4.3Å; F76-L125 HydrophobicContact CB-CG 4.44Å; F76-L125 PolarHBondContact N-O 2.83Å; F76-I127 HydrophobicContact CD2-CB 4.32Å; F76-I127 HydrophobicContact CD2-CD1 3.77Å; F76-I127 HydrophobicContact CD2-CG1 4.09Å; F76-I127 HydrophobicContact CE2-CB 3.91Å; F76-I127 HydrophobicContact CE2-CD1 3.83Å; F76-I127 HydrophobicContact CE2-CG1 4.14Å
77	S	92.7	Very high	92.3	Very high	78 Å²	78	82 Å²	82	55%	0.545	42%	0.422	S	S	.	.	S	Bend	trans	-81.7	-27.8	176.4	48.2	0	0	0	0	113.3	K102	S77-K102 VanDerWaalsContact O-CD 3.28Å; S77-K102 WeakPolarHBondContact O-CD 3.48Å; S77-K102 WeakPolarHBondContact O-CE 3.38Å; S77-K102 PolarHBondContact O-NZ 3.15Å
78	D	94.2	Very high	92.5	Very high	105 Å²	105	80 Å²	80	56%	0.561	41%	0.408	S	S	*	.	S	Bend	trans	-134.5	172	-167	-55.2	-63.4	0	0	0	111.5	Q80	D78-Q80 PolarHBondContact O-NE2 3.06Å
79	N	97	Very high	92.7	Very high	92 Å²	92	84.4 Å²	84.4	49%	0.492	43%	0.426	S	S	.	.			trans	-53.7	143.7	175.6	-64.8	-3.4	0	0	0	111.7	I100 D101 K102	N79-I100 CarbonylContact C-O 3.49Å; N79-I100 VanDerWaalsContact CA-O 3.26Å; N79-I100 WeakPolarHBondContact CA-O 3.47Å; N79-I100 WeakPolarHBondContact CB-O 3.32Å; N79-D101 PolarHBondContact OD1-OD1 2.94Å; N79-K102 WeakPolarHBondContact OD1-CB 3.25Å; N79-K102 PolarHBondContact OD1-N 2.75Å
80	Q	97.9	Very high	93.4	Very high	49 Å²	49	77.9 Å²	77.9	23%	0.229	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	144.9	-175.2	-64.9	-55	-51.1	0	0	111.9	F76 D78 V82 Y99 I100 L125 I127	F76-Q80 HydrophobicContact CB-CG 3.88Å; F76-Q80 HydrophobicContact CD1-CG 3.67Å; F76-Q80 VanDerWaalsContact CD1-NE2 3.3Å; F76-Q80 HydrophobicContact CD2-CG 4.09Å; F76-Q80 HydrophobicContact CE1-CG 4.18Å; F76-Q80 HydrophobicContact CG-CG 3.6Å; D78-Q80 PolarHBondContact O-NE2 3.06Å; Q80-V82 HydrophobicContact CB-CG2 4.42Å; Q80-Y99 CarbonylContact O-C 3.57Å; Q80-Y99 WeakPolarHBondContact O-CA 3.2Å; Q80-I100 HydrophobicContact CB-CB 4.45Å; Q80-I100 PolarHBondContact N-O 2.9Å; Q80-I100 PolarHBondContact O-N 2.98Å; Q80-L125 HydrophobicContact CG-CD2 4.15Å; Q80-I127 HydrophobicContact CB-CD1 3.74Å; Q80-I127 HydrophobicContact CG-CD1 3.67Å
81	K	97.9	Very high	93.8	Very high	82 Å²	82	76.2 Å²	76.2	36%	0.357	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.8	162.5	-171.6	-179.4	-173.5	176.4	0	108.1	Y83 S97 F98 Y99	K81-Y83 HydrophobicContact CD-CE2 4.25Å; K81-Y83 VanDerWaalsContact CE-OH 3.31Å; K81-Y83 WeakPolarHBondContact CE-OH 3.25Å; K81-Y83 HydrophobicContact CG-CE2 4.39Å; K81-Y83 PolarHBondContact NZ-OH 3.09Å; K81-S97 WeakPolarHBondContact CE-OG 3.24Å; K81-F98 WeakPolarHBondContact CA-O 3.4Å; K81-Y99 HydrophobicContact CB-CD1 3.96Å; K81-Y99 HydrophobicContact CB-CE1 3.79Å; K81-Y99 HydrophobicContact CD-CE1 3.77Å; K81-Y99 HydrophobicContact CD-CE2 4.38Å; K81-Y99 HydrophobicContact CG-CD1 4.12Å; K81-Y99 HydrophobicContact CG-CE1 3.78Å; K81-Y99 HydrophobicContact CG-CE2 4.49Å; K81-Y99 PolarHBondContact NZ-OH 3.07Å
82	V	97.3	Very high	94.3	Very high	13 Å²	13	71.8 Å²	71.8	8%	0.079	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.5	-177.5	177.3	0	0	0	0	110.1	Q80 S97 F98 I100 I127 V134	Q80-V82 HydrophobicContact CB-CG2 4.42Å; V82-S97 VanDerWaalsContact O-CA 3.23Å; V82-S97 WeakPolarHBondContact O-CA 3.49Å; V82-S97 WeakPolarHBondContact O-CB 3.47Å; V82-F98 HydrophobicContact CB-CD2 4.12Å; V82-F98 HydrophobicContact CB-CE2 3.72Å; V82-F98 HydrophobicContact CB-CZ 4.05Å; V82-F98 HydrophobicContact CG1-CE2 4.1Å; V82-F98 HydrophobicContact CG1-CZ 3.92Å; V82-F98 HydrophobicContact CG2-CE2 4.2Å; V82-F98 PolarHBondContact N-O 3.16Å; V82-F98 PolarHBondContact O-N 3.46Å; V82-F98 VanDerWaalsContact O-N 3.08Å; V82-I100 HydrophobicContact CB-CD1 4.49Å; V82-I100 HydrophobicContact CG2-CD1 3.48Å; V82-I100 VanDerWaalsContact CG2-CD1 3.48Å; V82-I100 HydrophobicContact CG2-CG1 4.31Å; V82-I127 HydrophobicContact CG2-CD1 4.17Å; V82-I127 HydrophobicContact CG2-CG2 4.5Å; V82-V134 HydrophobicContact CG1-CG1 4.4Å; V82-V134 HydrophobicContact CG1-CG2 4.45Å
83	Y	97.3	Very high	94.3	Very high	136 Å²	136	67.3 Å²	67.3	53%	0.533	33%	0.328	S	S	.	.			trans	-108.5	103.8	166.7	-61.1	-86.6	0	0	0	106.9	K81 N129	K81-Y83 HydrophobicContact CD-CE2 4.25Å; K81-Y83 VanDerWaalsContact CE-OH 3.31Å; K81-Y83 WeakPolarHBondContact CE-OH 3.25Å; K81-Y83 HydrophobicContact CG-CE2 4.39Å; K81-Y83 PolarHBondContact NZ-OH 3.09Å; Y83-N129 PolarHBondContact O-ND2 3.26Å
84	P	96.2	Very high	94.2	Very high	17 Å²	17	70.4 Å²	70.4	11%	0.11	35%	0.346	C	S	.	.			trans	-60.7	148.4	178.9	-23.5	36.1	0	0	0	111	F86 F88 F98 V134	P84-F86 HydrophobicContact CB-CD1 4.37Å; P84-F86 HydrophobicContact CB-CD2 4.29Å; P84-F86 HydrophobicContact CB-CE1 4.17Å; P84-F86 HydrophobicContact CB-CE2 4.14Å; P84-F86 HydrophobicContact CB-CG 4.43Å; P84-F86 HydrophobicContact CB-CZ 4.08Å; P84-F86 PolarHBondContact O-N 2.89Å; P84-F86 VanDerWaalsContact O-N 3.14Å; P84-F88 HydrophobicContact CG-CE1 4.06Å; P84-F98 HydrophobicContact CG-CD1 3.95Å; P84-F98 HydrophobicContact CG-CE1 3.38Å; P84-F98 HydrophobicContact CG-CZ 4.22Å; P84-V134 HydrophobicContact CB-CG2 4.03Å; P84-V134 HydrophobicContact CG-CG2 4.29Å
85	N	94.1	Very high	94.2	Very high	101 Å²	101	65.7 Å²	65.7	54%	0.54	32%	0.322	S	S	.	.	S	Bend	trans	-78.4	12.2	176.7	-62	-33.3	0	0	0	113.1	N129	N85-N129 PolarHBondContact N-OD1 3.14Å; N85-N129 PolarHBondContact ND2-O 2.7Å
86	F	94.8	Very high	94.1	Very high	22 Å²	22	66 Å²	66	10%	0.096	32%	0.321	C	S	.	.	S	Bend	trans	-145.7	158.9	-178.9	54.1	-95.7	0	0	0	109.8	P84 F88 M133 V134 A159	P84-F86 HydrophobicContact CB-CD1 4.37Å; P84-F86 HydrophobicContact CB-CD2 4.29Å; P84-F86 HydrophobicContact CB-CE1 4.17Å; P84-F86 HydrophobicContact CB-CE2 4.14Å; P84-F86 HydrophobicContact CB-CG 4.43Å; P84-F86 HydrophobicContact CB-CZ 4.08Å; P84-F86 PolarHBondContact O-N 2.89Å; P84-F86 VanDerWaalsContact O-N 3.14Å; F86-F88 HydrophobicContact CD2-CB 4.15Å; F86-F88 AromaticContact CD2-CD1 3.99Å; F86-F88 HydrophobicContact CD2-CD1 3.99Å; F86-F88 HydrophobicContact CD2-CG 4.45Å; F86-F88 HydrophobicContact CE2-CB 4.14Å; F86-F88 AromaticContact CE2-CD1 3.59Å; F86-F88 HydrophobicContact CE2-CD1 3.59Å; F86-F88 HydrophobicContact CE2-CE1 4.29Å; F86-F88 HydrophobicContact CE2-CG 4.06Å; F86-M133 VanDerWaalsContact CE1-C 3.47Å; F86-M133 VanDerWaalsContact CE1-CA 3.46Å; F86-V134 HydrophobicContact CE1-CG2 4.01Å; F86-V134 HydrophobicContact CZ-CG2 3.95Å; F86-A159 HydrophobicContact CB-CB 3.99Å; F86-A159 HydrophobicContact CD1-CB 4.4Å; F86-A159 VanDerWaalsContact CD2-CA 3.41Å; F86-A159 HydrophobicContact CD2-CB 3.69Å; F86-A159 HydrophobicContact CE2-CB 4.24Å; F86-A159 HydrophobicContact CG-CB 3.76Å
87	F	91.8	Very high	94.1	Very high	162 Å²	162	64.8 Å²	64.8	71%	0.711	32%	0.319	S	S	*	.			trans	-92.6	136.8	170.3	-62.7	-81.4	0	0	0	109.5	Y96	F87-Y96 HydrophobicContact CD1-CD1 4.04Å; F87-Y96 HydrophobicContact CD1-CE1 4Å; F87-Y96 AromaticContact CE1-CD1 3.74Å; F87-Y96 HydrophobicContact CE1-CD1 3.74Å; F87-Y96 AromaticContact CE1-CE1 3.76Å; F87-Y96 HydrophobicContact CE1-CE1 3.76Å
88	F	94	Very high	94.4	Very high	10 Å²	10	61 Å²	61	4%	0.044	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	162.9	172.4	77	-77.5	0	0	0	110.7	P84 F86 V95 F98 F108 I157 A159	P84-F88 HydrophobicContact CG-CE1 4.06Å; F86-F88 HydrophobicContact CD2-CB 4.15Å; F86-F88 AromaticContact CD2-CD1 3.99Å; F86-F88 HydrophobicContact CD2-CD1 3.99Å; F86-F88 HydrophobicContact CD2-CG 4.45Å; F86-F88 HydrophobicContact CE2-CB 4.14Å; F86-F88 AromaticContact CE2-CD1 3.59Å; F86-F88 HydrophobicContact CE2-CD1 3.59Å; F86-F88 HydrophobicContact CE2-CE1 4.29Å; F86-F88 HydrophobicContact CE2-CG 4.06Å; F88-V95 HydrophobicContact CD1-CB 4.12Å; F88-V95 HydrophobicContact CD1-CG1 4.48Å; F88-V95 HydrophobicContact CD2-CB 4.49Å; F88-V95 HydrophobicContact CE1-CB 3.59Å; F88-V95 HydrophobicContact CE1-CG1 3.53Å; F88-V95 HydrophobicContact CE1-CG2 4.4Å; F88-V95 HydrophobicContact CE2-CB 4.01Å; F88-V95 HydrophobicContact CE2-CG1 4.38Å; F88-V95 HydrophobicContact CE2-CG2 3.94Å; F88-V95 HydrophobicContact CZ-CB 3.53Å; F88-V95 HydrophobicContact CZ-CG1 3.48Å; F88-V95 VanDerWaalsContact CZ-CG1 3.48Å; F88-V95 HydrophobicContact CZ-CG2 3.86Å; F88-V95 PolarHBondContact O-N 3.49Å; F88-F98 HydrophobicContact CE1-CD1 4.33Å; F88-F98 HydrophobicContact CE1-CE1 4.15Å; F88-F98 HydrophobicContact CZ-CD1 4.28Å; F88-F98 HydrophobicContact CZ-CE1 4.26Å; F88-F108 HydrophobicContact CE2-CE1 4.35Å; F88-F108 HydrophobicContact CZ-CD1 4.42Å; F88-F108 AromaticContact CZ-CE1 3.84Å; F88-F108 HydrophobicContact CZ-CE1 3.84Å; F88-F108 HydrophobicContact CZ-CZ 4.49Å; F88-I157 HydrophobicContact CD2-CG2 4.05Å; F88-I157 HydrophobicContact CE1-CG2 4.11Å; F88-I157 HydrophobicContact CE2-CG2 3.6Å; F88-I157 HydrophobicContact CG-CG2 4.47Å; F88-I157 HydrophobicContact CZ-CG2 3.63Å; F88-A159 WeakPolarHBondContact CB-O 3.5Å
89	K	92.5	Very high	94.6	Very high	113 Å²	113	62.2 Å²	62.2	49%	0.491	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	137.9	172.7	-71.1	-176.8	172.4	-174.8	0	110	S93 D94	K89-S93 WeakPolarHBondContact CA-O 3.42Å; K89-D94 WeakPolarHBondContact CE-OD1 3.31Å; K89-D94 VanDerWaalsContact CG-OD1 3.32Å; K89-D94 WeakPolarHBondContact CG-OD1 3.38Å
90	Y	93.9	Very high	94.7	Very high	3 Å²	3	58 Å²	58	1%	0.012	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	113.6	166.2	179.6	-101.2	0	0	0	108.1	D92 S93 F108 G111 L112 I163 T184	Y90-D92 PolarHBondContact O-N 3.37Å; Y90-D92 VanDerWaalsContact O-N 3.12Å; Y90-S93 PolarHBondContact N-O 3.04Å; Y90-S93 PolarHBondContact O-N 3.07Å; Y90-S93 VanDerWaalsContact O-N 3.12Å; Y90-F108 HydrophobicContact CD1-CB 4.42Å; Y90-F108 AromaticContact CD1-CD2 3.57Å; Y90-F108 HydrophobicContact CD1-CD2 3.57Å; Y90-F108 HydrophobicContact CD1-CE2 4.15Å; Y90-F108 HydrophobicContact CD1-CG 4.2Å; Y90-F108 AromaticContact CD2-CD2 3.84Å; Y90-F108 HydrophobicContact CD2-CD2 3.84Å; Y90-F108 AromaticContact CD2-CE2 3.53Å; Y90-F108 HydrophobicContact CD2-CE2 3.53Å; Y90-F108 HydrophobicContact CD2-CZ 4.23Å; Y90-F108 AromaticContact CE1-CD2 3.72Å; Y90-F108 HydrophobicContact CE1-CD2 3.72Å; Y90-F108 HydrophobicContact CE1-CE2 4.2Å; Y90-F108 AromaticContact CE2-CD2 3.97Å; Y90-F108 HydrophobicContact CE2-CD2 3.97Å; Y90-F108 AromaticContact CE2-CE2 3.58Å; Y90-F108 HydrophobicContact CE2-CE2 3.58Å; Y90-F108 AromaticContact CG-CD2 3.61Å; Y90-F108 HydrophobicContact CG-CD2 3.61Å; Y90-F108 AromaticContact CG-CE2 3.8Å; Y90-F108 HydrophobicContact CG-CE2 3.8Å; Y90-F108 HydrophobicContact CG-CG 4.2Å; Y90-F108 AromaticContact CZ-CD2 3.88Å; Y90-F108 AromaticContact CZ-CE2 3.9Å; Y90-G111 VanDerWaalsContact CE1-CA 3.41Å; Y90-L112 PolarHBondContact OH-O 3.34Å; Y90-I163 HydrophobicContact CD2-CD1 3.71Å; Y90-I163 HydrophobicContact CE2-CD1 3.52Å; Y90-T184 WeakPolarHBondContact CE1-O 2.92Å; Y90-T184 PolarHBondContact OH-N 3.31Å; Y90-T184 PolarHBondContact OH-O 2.74Å
91	Y	90.3	Very high	94.6	Very high	9 Å²	9	58.1 Å²	58.1	4%	0.035	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	54	-113.7	-161.6	-70.3	-100.1	0	0	0	109.9	Y54 N55 Y56 T185 P202	Y54-Y91 HydrophobicContact CD1-CD1 4.3Å; Y54-Y91 AromaticContact CD1-CE1 3.96Å; Y54-Y91 HydrophobicContact CD1-CE1 3.96Å; Y54-Y91 HydrophobicContact CE1-CD1 4.34Å; Y54-Y91 HydrophobicContact CE1-CE1 4.45Å; N55-Y91 HydrophobicContact CB-CD1 3.74Å; N55-Y91 HydrophobicContact CB-CE1 3.97Å; Y56-Y91 HydrophobicContact CD2-CD1 4.35Å; Y56-Y91 AromaticContact CD2-CE1 3.83Å; Y56-Y91 HydrophobicContact CD2-CE1 3.83Å; Y56-Y91 HydrophobicContact CD2-CE2 4.13Å; Y56-Y91 AromaticContact CD2-CZ 3.72Å; Y56-Y91 AromaticContact CE2-CD1 3.98Å; Y56-Y91 HydrophobicContact CE2-CD1 3.98Å; Y56-Y91 AromaticContact CE2-CD2 3.69Å; Y56-Y91 HydrophobicContact CE2-CD2 3.69Å; Y56-Y91 AromaticContact CE2-CE1 3.81Å; Y56-Y91 HydrophobicContact CE2-CE1 3.81Å; Y56-Y91 AromaticContact CE2-CE2 3.53Å; Y56-Y91 HydrophobicContact CE2-CE2 3.53Å; Y56-Y91 AromaticContact CE2-CG 3.92Å; Y56-Y91 HydrophobicContact CE2-CG 3.92Å; Y56-Y91 AromaticContact CE2-CZ 3.59Å; Y56-Y91 PolarHBondContact OH-N 3.45Å; Y91-T185 HydrophobicContact CD1-CG2 3.67Å; Y91-T185 HydrophobicContact CD2-CG2 3.7Å; Y91-T185 HydrophobicContact CE1-CG2 3.69Å; Y91-T185 HydrophobicContact CE2-CG2 3.7Å; Y91-T185 HydrophobicContact CG-CG2 3.68Å; Y91-P202 HydrophobicContact CE1-CB 4.44Å
92	D	84.5	Confident	94.5	Very high	62 Å²	62	56.5 Å²	56.5	33%	0.332	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	4.5	-178.2	-65.8	-43.2	0	0	0	113.3	K25 N55 Y90	K25-D92 VanDerWaalsContact CB-OD2 3.26Å; K25-D92 WeakPolarHBondContact CB-OD2 2.84Å; K25-D92 WeakPolarHBondContact CD-OD1 3.33Å; K25-D92 WeakPolarHBondContact CD-OD2 3.39Å; K25-D92 WeakPolarHBondContact CE-OD1 3.36Å; K25-D92 IonicContact NZ-OD1 3.4Å; K25-D92 PolarHBondContact NZ-OD1 3.39Å; N55-D92 PolarHBondContact ND2-OD2 3.26Å; Y90-D92 PolarHBondContact O-N 3.37Å; Y90-D92 VanDerWaalsContact O-N 3.12Å
93	S	89.8	Confident	94.3	Very high	29 Å²	29	59.8 Å²	59.8	20%	0.203	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.8	-175	-45.6	0	0	0	0	110.2	K89 Y90 E110	K89-S93 WeakPolarHBondContact CA-O 3.42Å; Y90-S93 PolarHBondContact N-O 3.04Å; Y90-S93 PolarHBondContact O-N 3.07Å; Y90-S93 VanDerWaalsContact O-N 3.12Å; S93-E110 PolarHBondContact OG-OE2 3.11Å
94	D	93.6	Very high	94.2	Very high	87 Å²	87	53.5 Å²	53.5	47%	0.465	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	130.6	175.3	-67.1	-48.7	0	0	0	110.6	K89 Y96	K89-D94 WeakPolarHBondContact CE-OD1 3.31Å; K89-D94 VanDerWaalsContact CG-OD1 3.32Å; K89-D94 WeakPolarHBondContact CG-OD1 3.38Å; D94-Y96 HydrophobicContact CB-CD2 4.49Å; D94-Y96 HydrophobicContact CB-CE2 3.71Å
95	V	95.7	Very high	94.3	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.055	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	109.6	-179.1	-176.6	0	0	0	0	110.4	F88 F98 F108	F88-V95 HydrophobicContact CD1-CB 4.12Å; F88-V95 HydrophobicContact CD1-CG1 4.48Å; F88-V95 HydrophobicContact CD2-CB 4.49Å; F88-V95 HydrophobicContact CE1-CB 3.59Å; F88-V95 HydrophobicContact CE1-CG1 3.53Å; F88-V95 HydrophobicContact CE1-CG2 4.4Å; F88-V95 HydrophobicContact CE2-CB 4.01Å; F88-V95 HydrophobicContact CE2-CG1 4.38Å; F88-V95 HydrophobicContact CE2-CG2 3.94Å; F88-V95 HydrophobicContact CZ-CB 3.53Å; F88-V95 HydrophobicContact CZ-CG1 3.48Å; F88-V95 VanDerWaalsContact CZ-CG1 3.48Å; F88-V95 HydrophobicContact CZ-CG2 3.86Å; F88-V95 PolarHBondContact O-N 3.49Å; V95-F98 HydrophobicContact CG1-CB 4.47Å; V95-F98 HydrophobicContact CG1-CD1 3.95Å; V95-F108 HydrophobicContact CG1-CD1 3.86Å; V95-F108 HydrophobicContact CG1-CE1 4.35Å; V95-F108 HydrophobicContact CG2-CD1 4.05Å; V95-F108 HydrophobicContact CG2-CG 4.44Å
96	Y	94.7	Very high	94.5	Very high	147 Å²	147	48.8 Å²	48.8	58%	0.576	24%	0.237	S	C	*	.	S	Bend	trans	-95.3	-27.6	175	-60.2	-85.6	0	0	0	112.9	F87 D94	F87-Y96 HydrophobicContact CD1-CD1 4.04Å; F87-Y96 HydrophobicContact CD1-CE1 4Å; F87-Y96 AromaticContact CE1-CD1 3.74Å; F87-Y96 HydrophobicContact CE1-CD1 3.74Å; F87-Y96 AromaticContact CE1-CE1 3.76Å; F87-Y96 HydrophobicContact CE1-CE1 3.76Å; D94-Y96 HydrophobicContact CB-CD2 4.49Å; D94-Y96 HydrophobicContact CB-CE2 3.71Å
97	S	96.8	Very high	94.6	Very high	34 Å²	34	49.6 Å²	49.6	24%	0.238	25%	0.247	C	C	.	.			trans	-158.9	158.1	176.4	69.4	0	0	0	0	109.6	K81 V82	K81-S97 WeakPolarHBondContact CE-OG 3.24Å; V82-S97 VanDerWaalsContact O-CA 3.23Å; V82-S97 WeakPolarHBondContact O-CA 3.49Å; V82-S97 WeakPolarHBondContact O-CB 3.47Å
98	F	97.9	Very high	94.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	163	174.5	54.9	-104.6	0	0	0	111.5	K81 V82 P84 F88 V95 I100 I106 A107 F108 V134 I157	K81-F98 WeakPolarHBondContact CA-O 3.4Å; V82-F98 HydrophobicContact CB-CD2 4.12Å; V82-F98 HydrophobicContact CB-CE2 3.72Å; V82-F98 HydrophobicContact CB-CZ 4.05Å; V82-F98 HydrophobicContact CG1-CE2 4.1Å; V82-F98 HydrophobicContact CG1-CZ 3.92Å; V82-F98 HydrophobicContact CG2-CE2 4.2Å; V82-F98 PolarHBondContact N-O 3.16Å; V82-F98 PolarHBondContact O-N 3.46Å; V82-F98 VanDerWaalsContact O-N 3.08Å; P84-F98 HydrophobicContact CG-CD1 3.95Å; P84-F98 HydrophobicContact CG-CE1 3.38Å; P84-F98 HydrophobicContact CG-CZ 4.22Å; F88-F98 HydrophobicContact CE1-CD1 4.33Å; F88-F98 HydrophobicContact CE1-CE1 4.15Å; F88-F98 HydrophobicContact CZ-CD1 4.28Å; F88-F98 HydrophobicContact CZ-CE1 4.26Å; V95-F98 HydrophobicContact CG1-CB 4.47Å; V95-F98 HydrophobicContact CG1-CD1 3.95Å; F98-I100 HydrophobicContact CD2-CG1 3.98Å; F98-I100 HydrophobicContact CE2-CD1 3.94Å; F98-I100 HydrophobicContact CE2-CG1 3.83Å; F98-I106 HydrophobicContact CB-CG2 4.18Å; F98-I106 HydrophobicContact CD2-CG2 3.45Å; F98-I106 VanDerWaalsContact CD2-CG2 3.45Å; F98-I106 HydrophobicContact CE2-CG2 3.9Å; F98-I106 HydrophobicContact CG-CG2 3.93Å; F98-A107 WeakPolarHBondContact CA-O 3.32Å; F98-A107 WeakPolarHBondContact CB-O 3.28Å; F98-F108 HydrophobicContact CB-CD1 3.64Å; F98-F108 HydrophobicContact CB-CE1 3.89Å; F98-F108 HydrophobicContact CD1-CD1 4.25Å; F98-F108 AromaticContact CD1-CE1 3.85Å; F98-F108 HydrophobicContact CD1-CE1 3.85Å; F98-F108 HydrophobicContact CE1-CE1 4.49Å; F98-F108 HydrophobicContact CG-CD1 4.2Å; F98-F108 AromaticContact CG-CE1 3.94Å; F98-F108 HydrophobicContact CG-CE1 3.94Å; F98-V134 HydrophobicContact CZ-CB 4.13Å; F98-V134 HydrophobicContact CZ-CG1 3.9Å; F98-V134 HydrophobicContact CZ-CG2 4.15Å; F98-I157 HydrophobicContact CE1-CD1 4.15Å; F98-I157 HydrophobicContact CE2-CD1 4.45Å; F98-I157 HydrophobicContact CZ-CD1 3.95Å
99	Y	98.3	Very high	94.8	Very high	130 Å²	130	50.4 Å²	50.4	51%	0.51	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.9	178.6	-69.6	-88.5	0	0	0	110.1	Q80 K81 I106 A107	Q80-Y99 CarbonylContact O-C 3.57Å; Q80-Y99 WeakPolarHBondContact O-CA 3.2Å; K81-Y99 HydrophobicContact CB-CD1 3.96Å; K81-Y99 HydrophobicContact CB-CE1 3.79Å; K81-Y99 HydrophobicContact CD-CE1 3.77Å; K81-Y99 HydrophobicContact CD-CE2 4.38Å; K81-Y99 HydrophobicContact CG-CD1 4.12Å; K81-Y99 HydrophobicContact CG-CE1 3.78Å; K81-Y99 HydrophobicContact CG-CE2 4.49Å; K81-Y99 PolarHBondContact NZ-OH 3.07Å; Y99-I106 CarbonylContact O-C 3.53Å; Y99-I106 WeakPolarHBondContact O-CA 3.14Å; Y99-A107 PolarHBondContact N-O 3.38Å; Y99-A107 PolarHBondContact O-N 2.77Å
100	I	98.4	Very high	94.6	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.2	173.7	-60.8	168	0	0	0	108	N79 Q80 V82 F98 A105 I106 L125 I127 V136 W138	N79-I100 CarbonylContact C-O 3.49Å; N79-I100 VanDerWaalsContact CA-O 3.26Å; N79-I100 WeakPolarHBondContact CA-O 3.47Å; N79-I100 WeakPolarHBondContact CB-O 3.32Å; Q80-I100 HydrophobicContact CB-CB 4.45Å; Q80-I100 PolarHBondContact N-O 2.9Å; Q80-I100 PolarHBondContact O-N 2.98Å; V82-I100 HydrophobicContact CB-CD1 4.49Å; V82-I100 HydrophobicContact CG2-CD1 3.48Å; V82-I100 VanDerWaalsContact CG2-CD1 3.48Å; V82-I100 HydrophobicContact CG2-CG1 4.31Å; F98-I100 HydrophobicContact CD2-CG1 3.98Å; F98-I100 HydrophobicContact CE2-CD1 3.94Å; F98-I100 HydrophobicContact CE2-CG1 3.83Å; I100-A105 WeakPolarHBondContact CA-O 3.01Å; I100-I106 HydrophobicContact CG1-CG1 4.35Å; I100-L125 HydrophobicContact CG2-CD1 3.8Å; I100-L125 HydrophobicContact CG2-CD2 3.91Å; I100-I127 HydrophobicContact CD1-CD1 3.43Å; I100-I127 VanDerWaalsContact CD1-CD1 3.43Å; I100-I127 HydrophobicContact CD1-CG1 3.91Å; I100-V136 HydrophobicContact CD1-CB 4.43Å; I100-V136 HydrophobicContact CD1-CG1 4Å; I100-V136 HydrophobicContact CD1-CG2 3.51Å; I100-V136 HydrophobicContact CG1-CG1 4.46Å; I100-V136 HydrophobicContact CG1-CG2 4.22Å; I100-V136 HydrophobicContact CG2-CG1 3.72Å; I100-W138 HydrophobicContact CG2-CZ2 3.96Å
101	D	96.7	Very high	94.7	Very high	53 Å²	53	47.8 Å²	47.8	28%	0.283	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127.8	170.2	-163.3	-45	0	0	0	109.6	N79 T103 G104 A105 W138	N79-D101 PolarHBondContact OD1-OD1 2.94Å; D101-T103 PolarHBondContact O-N 3.12Å; D101-T103 VanDerWaalsContact OD1-CB 3.31Å; D101-T103 WeakPolarHBondContact OD1-CB 3.44Å; D101-T103 WeakPolarHBondContact OD1-CG2 3.33Å; D101-T103 PolarHBondContact OD1-N 3.39Å; D101-T103 PolarHBondContact OD1-OG1 2.95Å; D101-T103 PolarHBondContact OD2-OG1 3.08Å; D101-G104 PolarHBondContact O-N 3.27Å; D101-A105 HydrophobicContact CB-CB 3.93Å; D101-A105 PolarHBondContact N-O 2.89Å; D101-A105 PolarHBondContact O-N 2.93Å; D101-W138 PolarHBondContact O-NE1 2.03Å
102	K	95.3	Very high	95	Very high	47 Å²	47	50.1 Å²	50.1	20%	0.204	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.8	176.4	-162.2	-165.2	-176.1	173.7	0	112	S77 N79 G104 P122 S123 L125 W138	S77-K102 VanDerWaalsContact O-CD 3.28Å; S77-K102 WeakPolarHBondContact O-CD 3.48Å; S77-K102 WeakPolarHBondContact O-CE 3.38Å; S77-K102 PolarHBondContact O-NZ 3.15Å; N79-K102 WeakPolarHBondContact OD1-CB 3.25Å; N79-K102 PolarHBondContact OD1-N 2.75Å; K102-G104 PolarHBondContact O-N 2.8Å; K102-P122 HydrophobicContact CD-CB 4.22Å; K102-P122 HydrophobicContact CG-CB 4.04Å; K102-P122 WeakPolarHBondContact O-CB 3.4Å; K102-S123 WeakPolarHBondContact CE-O 3.29Å; K102-S123 PolarHBondContact NZ-O 2.78Å; K102-L125 HydrophobicContact CG-CB 4.03Å; K102-W138 VanDerWaalsContact O-CD1 3.3Å
103	T	94.2	Very high	95.7	Very high	83 Å²	83	47.2 Å²	47.2	51%	0.509	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.7	178.3	64.8	0	0	0	0	114.1	D101 P122 F140	D101-T103 PolarHBondContact O-N 3.12Å; D101-T103 VanDerWaalsContact OD1-CB 3.31Å; D101-T103 WeakPolarHBondContact OD1-CB 3.44Å; D101-T103 WeakPolarHBondContact OD1-CG2 3.33Å; D101-T103 PolarHBondContact OD1-N 3.39Å; D101-T103 PolarHBondContact OD1-OG1 2.95Å; D101-T103 PolarHBondContact OD2-OG1 3.08Å; T103-P122 HydrophobicContact CG2-CG 4.08Å; T103-F140 WeakPolarHBondContact O-CE1 2.94Å
104	G	95.3	Very high	96.1	Very high	4 Å²	4	46.8 Å²	46.8	4%	0.041	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	112	58.2	175	0	0	0	0	0	113.6	D101 K102 I115	D101-G104 PolarHBondContact O-N 3.27Å; K102-G104 PolarHBondContact O-N 2.8Å; G104-I115 CarbonylContact O-C 3.58Å; G104-I115 WeakPolarHBondContact O-CA 3.34Å; G104-I115 PolarHBondContact O-N 2.83Å; G104-I115 VanDerWaalsContact O-O 3.13Å
105	A	97.6	Very high	96.2	Very high	19 Å²	19	43 Å²	43	16%	0.157	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	152.7	170.3	0	0	0	0	0	112.6	I100 D101 L112 V113	I100-A105 WeakPolarHBondContact CA-O 3.01Å; D101-A105 HydrophobicContact CB-CB 3.93Å; D101-A105 PolarHBondContact N-O 2.89Å; D101-A105 PolarHBondContact O-N 2.93Å; A105-L112 HydrophobicContact CB-CD1 3.91Å; A105-V113 CarbonylContact C-O 3.45Å; A105-V113 VanDerWaalsContact CA-O 3.29Å; A105-V113 WeakPolarHBondContact CA-O 3.32Å
106	I	98.3	Very high	96.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	111.7	163.6	-54	-179	0	0	0	107.5	F98 Y99 I100 F108 L112 V113 V136 W138 C155 I157	F98-I106 HydrophobicContact CB-CG2 4.18Å; F98-I106 HydrophobicContact CD2-CG2 3.45Å; F98-I106 VanDerWaalsContact CD2-CG2 3.45Å; F98-I106 HydrophobicContact CE2-CG2 3.9Å; F98-I106 HydrophobicContact CG-CG2 3.93Å; Y99-I106 CarbonylContact O-C 3.53Å; Y99-I106 WeakPolarHBondContact O-CA 3.14Å; I100-I106 HydrophobicContact CG1-CG1 4.35Å; I106-F108 HydrophobicContact CG2-CD1 4.49Å; I106-F108 HydrophobicContact CG2-CE1 3.77Å; I106-F108 HydrophobicContact CG2-CE2 4.48Å; I106-F108 HydrophobicContact CG2-CZ 3.77Å; I106-L112 WeakPolarHBondContact O-CA 3.41Å; I106-V113 HydrophobicContact CB-CB 4.1Å; I106-V113 HydrophobicContact CB-CG2 4.32Å; I106-V113 PolarHBondContact N-O 2.89Å; I106-V113 PolarHBondContact O-N 2.85Å; I106-V136 HydrophobicContact CD1-CB 4.24Å; I106-V136 HydrophobicContact CD1-CG2 3.83Å; I106-W138 HydrophobicContact CD1-CH2 3.8Å; I106-W138 HydrophobicContact CD1-CZ2 4.45Å; I106-W138 HydrophobicContact CG1-CH2 3.68Å; I106-W138 HydrophobicContact CG1-CZ2 3.91Å; I106-C155 HydrophobicContact CD1-CB 4.16Å; I106-I157 HydrophobicContact CD1-CD1 3.77Å; I106-I157 HydrophobicContact CG2-CD1 4.23Å
107	A	97.9	Very high	95.8	Very high	38 Å²	38	40.2 Å²	40.2	31%	0.314	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.1	-179.9	0	0	0	0	0	110.8	F98 Y99 L112	F98-A107 WeakPolarHBondContact CA-O 3.32Å; F98-A107 WeakPolarHBondContact CB-O 3.28Å; Y99-A107 PolarHBondContact N-O 3.38Å; Y99-A107 PolarHBondContact O-N 2.77Å; A107-L112 HydrophobicContact CB-CD1 4.18Å
108	F	96.4	Very high	95.4	Very high	18 Å²	18	39.3 Å²	39.3	8%	0.079	20%	0.204	C	C	.	.			trans	-94	175.9	166.3	-48.6	-66.1	0	0	0	109.5	F88 Y90 V95 F98 I106 E110 G111 V113 I157	F88-F108 HydrophobicContact CE2-CE1 4.35Å; F88-F108 HydrophobicContact CZ-CD1 4.42Å; F88-F108 AromaticContact CZ-CE1 3.84Å; F88-F108 HydrophobicContact CZ-CE1 3.84Å; F88-F108 HydrophobicContact CZ-CZ 4.49Å; Y90-F108 HydrophobicContact CD1-CB 4.42Å; Y90-F108 AromaticContact CD1-CD2 3.57Å; Y90-F108 HydrophobicContact CD1-CD2 3.57Å; Y90-F108 HydrophobicContact CD1-CE2 4.15Å; Y90-F108 HydrophobicContact CD1-CG 4.2Å; Y90-F108 AromaticContact CD2-CD2 3.84Å; Y90-F108 HydrophobicContact CD2-CD2 3.84Å; Y90-F108 AromaticContact CD2-CE2 3.53Å; Y90-F108 HydrophobicContact CD2-CE2 3.53Å; Y90-F108 HydrophobicContact CD2-CZ 4.23Å; Y90-F108 AromaticContact CE1-CD2 3.72Å; Y90-F108 HydrophobicContact CE1-CD2 3.72Å; Y90-F108 HydrophobicContact CE1-CE2 4.2Å; Y90-F108 AromaticContact CE2-CD2 3.97Å; Y90-F108 HydrophobicContact CE2-CD2 3.97Å; Y90-F108 AromaticContact CE2-CE2 3.58Å; Y90-F108 HydrophobicContact CE2-CE2 3.58Å; Y90-F108 AromaticContact CG-CD2 3.61Å; Y90-F108 HydrophobicContact CG-CD2 3.61Å; Y90-F108 AromaticContact CG-CE2 3.8Å; Y90-F108 HydrophobicContact CG-CE2 3.8Å; Y90-F108 HydrophobicContact CG-CG 4.2Å; Y90-F108 AromaticContact CZ-CD2 3.88Å; Y90-F108 AromaticContact CZ-CE2 3.9Å; V95-F108 HydrophobicContact CG1-CD1 3.86Å; V95-F108 HydrophobicContact CG1-CE1 4.35Å; V95-F108 HydrophobicContact CG2-CD1 4.05Å; V95-F108 HydrophobicContact CG2-CG 4.44Å; F98-F108 HydrophobicContact CB-CD1 3.64Å; F98-F108 HydrophobicContact CB-CE1 3.89Å; F98-F108 HydrophobicContact CD1-CD1 4.25Å; F98-F108 AromaticContact CD1-CE1 3.85Å; F98-F108 HydrophobicContact CD1-CE1 3.85Å; F98-F108 HydrophobicContact CE1-CE1 4.49Å; F98-F108 HydrophobicContact CG-CD1 4.2Å; F98-F108 AromaticContact CG-CE1 3.94Å; F98-F108 HydrophobicContact CG-CE1 3.94Å; I106-F108 HydrophobicContact CG2-CD1 4.49Å; I106-F108 HydrophobicContact CG2-CE1 3.77Å; I106-F108 HydrophobicContact CG2-CE2 4.48Å; I106-F108 HydrophobicContact CG2-CZ 3.77Å; F108-E110 VanDerWaalsContact C-N 3.31Å; F108-E110 PolarHBondContact O-N 2.93Å; F108-G111 PolarHBondContact N-O 2.87Å; F108-V113 HydrophobicContact CE2-CG2 3.84Å; F108-V113 HydrophobicContact CZ-CG2 4.17Å; F108-I157 HydrophobicContact CE1-CD1 4.12Å; F108-I157 HydrophobicContact CZ-CD1 3.84Å
109	H	91.6	Very high	94.7	Very high	171 Å²	171	42.9 Å²	42.9	79%	0.792	22%	0.224	S	C	*	.	S	Bend	trans	-55.5	-44.8	179.8	-176.7	53.4	0	0	0	112.9
110	E	90	Very high	94.1	Very high	52 Å²	52	37.6 Å²	37.6	24%	0.243	20%	0.204	C	C	.	.	S	Bend	trans	-123.3	14.3	-178.4	-62.7	176.4	139.2	0	0	111.9	S93 F108 T185 Q186 Y188	S93-E110 PolarHBondContact OG-OE2 3.11Å; F108-E110 VanDerWaalsContact C-N 3.31Å; F108-E110 PolarHBondContact O-N 2.93Å; E110-T185 CarbonylContact O-C 3.59Å; E110-T185 VanDerWaalsContact O-CA 3.24Å; E110-T185 WeakPolarHBondContact O-CA 3.46Å; E110-T185 PolarHBondContact O-OG1 2.84Å; E110-T185 VanDerWaalsContact O-OG1 3.06Å; E110-Q186 PolarHBondContact O-N 2.89Å; E110-Y188 HydrophobicContact CG-CE2 4.29Å; E110-Y188 WeakPolarHBondContact OE1-CD2 3.47Å; E110-Y188 WeakPolarHBondContact OE1-CE2 3.4Å
111	G	95.6	Very high	93.7	Very high	9 Å²	9	43.2 Å²	43.2	9%	0.093	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	156.9	-163.3	0	0	0	0	0	113.9	Y90 F108 T184	Y90-G111 VanDerWaalsContact CE1-CA 3.41Å; F108-G111 PolarHBondContact N-O 2.87Å; G111-T184 WeakPolarHBondContact CA-O 3.32Å
112	L	97.2	Very high	93.4	Very high	59 Å²	59	43 Å²	43	31%	0.309	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	126	-179.7	-173.4	70.6	0	0	0	111.1	Y90 A105 I106 A107 F114 I183 T184	Y90-L112 PolarHBondContact OH-O 3.34Å; A105-L112 HydrophobicContact CB-CD1 3.91Å; I106-L112 WeakPolarHBondContact O-CA 3.41Å; A107-L112 HydrophobicContact CB-CD1 4.18Å; L112-F114 HydrophobicContact CD2-CB 3.95Å; L112-F114 HydrophobicContact CD2-CD1 4.47Å; L112-F114 HydrophobicContact CG-CB 4.13Å; L112-I183 CarbonylContact O-C 3.51Å; L112-I183 WeakPolarHBondContact O-CA 3.37Å; L112-T184 HydrophobicContact CB-CG2 3.81Å; L112-T184 HydrophobicContact CD2-CG2 4.43Å; L112-T184 PolarHBondContact N-O 3Å; L112-T184 PolarHBondContact O-N 3.47Å
113	V	98.2	Very high	93.3	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.1	152.7	-173.1	0	0	0	0	106.9	A105 I106 F108 I163 L165 G182 I183	A105-V113 CarbonylContact C-O 3.45Å; A105-V113 VanDerWaalsContact CA-O 3.29Å; A105-V113 WeakPolarHBondContact CA-O 3.32Å; I106-V113 HydrophobicContact CB-CB 4.1Å; I106-V113 HydrophobicContact CB-CG2 4.32Å; I106-V113 PolarHBondContact N-O 2.89Å; I106-V113 PolarHBondContact O-N 2.85Å; F108-V113 HydrophobicContact CE2-CG2 3.84Å; F108-V113 HydrophobicContact CZ-CG2 4.17Å; V113-I163 HydrophobicContact CG2-CD1 4.08Å; V113-L165 HydrophobicContact CG1-CD2 4.07Å; V113-G182 WeakPolarHBondContact CA-O 3.44Å; V113-I183 HydrophobicContact CB-CG2 4.45Å; V113-I183 HydrophobicContact CG1-CG2 4.28Å; V113-I183 HydrophobicContact CG2-CG2 4.02Å
114	F	97.5	Very high	93.2	Very high	20 Å²	20	40.6 Å²	40.6	9%	0.088	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.3	-176.9	59	-88.8	0	0	0	111.4	L112 Q180 I181 G182 T184 K203 N205	L112-F114 HydrophobicContact CD2-CB 3.95Å; L112-F114 HydrophobicContact CD2-CD1 4.47Å; L112-F114 HydrophobicContact CG-CB 4.13Å; F114-Q180 HydrophobicContact CD2-CB 4.3Å; F114-Q180 HydrophobicContact CE2-CB 3.98Å; F114-I181 VanDerWaalsContact CE2-C 3.43Å; F114-I181 VanDerWaalsContact O-CA 3.31Å; F114-I181 WeakPolarHBondContact O-CA 3.43Å; F114-G182 VanDerWaalsContact CD1-O 3.31Å; F114-G182 WeakPolarHBondContact CD1-O 3.28Å; F114-G182 WeakPolarHBondContact CE1-O 3.14Å; F114-G182 VanDerWaalsContact CE2-N 3.33Å; F114-G182 PolarHBondContact N-O 2.92Å; F114-G182 PolarHBondContact O-N 3.49Å; F114-T184 HydrophobicContact CD1-CG2 4.14Å; F114-T184 HydrophobicContact CE1-CG2 4.18Å; F114-K203 HydrophobicContact CE1-CG 4.19Å; F114-K203 HydrophobicContact CZ-CD 4.29Å; F114-K203 HydrophobicContact CZ-CG 4.13Å; F114-N205 WeakPolarHBondContact CZ-OD1 3.2Å
115	I	96.5	Very high	93.3	Very high	7 Å²	7	40.4 Å²	40.4	4%	0.036	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	100.3	172.8	-61.5	166.5	0	0	0	106.9	G104 I117 W138 F140 I153 I181	G104-I115 CarbonylContact O-C 3.58Å; G104-I115 WeakPolarHBondContact O-CA 3.34Å; G104-I115 PolarHBondContact O-N 2.83Å; G104-I115 VanDerWaalsContact O-O 3.13Å; I115-I117 HydrophobicContact CG2-CD1 4.07Å; I115-I117 HydrophobicContact CG2-CG1 4.13Å; I115-W138 HydrophobicContact CD1-CD2 4.16Å; I115-W138 HydrophobicContact CD1-CE3 3.53Å; I115-W138 HydrophobicContact CD1-CH2 4Å; I115-W138 HydrophobicContact CD1-CZ3 3.45Å; I115-W138 VanDerWaalsContact CD1-CZ3 3.45Å; I115-F140 HydrophobicContact CG2-CE2 4.17Å; I115-F140 HydrophobicContact CG2-CZ 4.16Å; I115-I153 HydrophobicContact CD1-CB 4.31Å; I115-I153 HydrophobicContact CD1-CG2 3.7Å; I115-I153 HydrophobicContact CG2-CD1 3.66Å; I115-I181 HydrophobicContact CG1-CG2 4.27Å; I115-I181 HydrophobicContact CG2-CD1 4.29Å; I115-I181 HydrophobicContact CG2-CG1 4.31Å
116	N	93.4	Very high	93.3	Very high	85 Å²	85	41 Å²	41	46%	0.455	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	107	174.9	-178	10.4	0	0	0	109.1	L179 Q180	N116-L179 WeakPolarHBondContact O-CA 3.26Å; N116-Q180 HydrophobicContact CB-CB 4.37Å; N116-Q180 WeakPolarHBondContact CB-O 3.25Å; N116-Q180 PolarHBondContact N-O 3.04Å; N116-Q180 PolarHBondContact O-N 2.79Å
117	I	89.7	Confident	93.3	Very high	12 Å²	12	41.6 Å²	41.6	6%	0.062	22%	0.216	C	C	.	.			trans	-114.9	123.7	174.4	-53.9	167.5	0	0	0	107.8	I115 I120 F140 A151 I153 I174 L179	I115-I117 HydrophobicContact CG2-CD1 4.07Å; I115-I117 HydrophobicContact CG2-CG1 4.13Å; I117-I120 HydrophobicContact CB-CD1 3.38Å; I117-I120 HydrophobicContact CB-CG1 3.78Å; I117-I120 HydrophobicContact CD1-CD1 3.59Å; I117-I120 HydrophobicContact CG1-CD1 4.07Å; I117-I120 HydrophobicContact CG2-CD1 3.39Å; I117-I120 HydrophobicContact CG2-CG1 3.86Å; I117-F140 HydrophobicContact CD1-CD2 4.37Å; I117-F140 HydrophobicContact CD1-CE2 4.42Å; I117-A151 HydrophobicContact CD1-CB 3.94Å; I117-I153 HydrophobicContact CD1-CD1 3.58Å; I117-I174 HydrophobicContact CG2-CD1 3.53Å; I117-I174 HydrophobicContact CG2-CG1 4Å; I117-I174 HydrophobicContact CG2-CG2 4.07Å; I117-L179 HydrophobicContact CB-CD1 4.13Å; I117-L179 HydrophobicContact CG1-CD1 3.64Å; I117-L179 HydrophobicContact CG2-CD1 4.11Å
118	P	86.6	Confident	93.2	Very high	16 Å²	16	40.6 Å²	40.6	10%	0.104	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	156.5	179.6	31	-37.8	0	0	0	111.5	I120 I174 R175	P118-I120 PolarHBondContact O-N 2.78Å; P118-I120 VanDerWaalsContact O-N 3.15Å; P118-I174 HydrophobicContact CG-CG2 4.07Å; P118-R175 HydrophobicContact CG-CB 4.13Å
119	D	83.7	Confident	93.1	Very high	75 Å²	75	42.1 Å²	42.1	40%	0.401	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	14.9	169.4	-49.9	-49.3	0	0	0	114.8	F149 R175	D119-F149 HydrophobicContact CB-CE1 4.47Å; D119-R175 IonicContact OD1-NH1 3.06Å; D119-R175 PolarHBondContact OD1-NH1 2.84Å; D119-R175 VanDerWaalsContact OD1-NH1 3.13Å; D119-R175 WeakPolarHBondContact OD2-CD 3.28Å; D119-R175 IonicContact OD2-CZ 3.57Å; D119-R175 IonicContact OD2-NE 3.88Å; D119-R175 IonicContact OD2-NH1 3.13Å; D119-R175 PolarHBondContact OD2-NH1 2.95Å
120	I	86.9	Confident	93.2	Very high	19 Å²	19	36.6 Å²	36.6	10%	0.097	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	155.6	173.8	67.7	180	0	0	0	112.6	I117 P118 F140 K141 F149 A151	I117-I120 HydrophobicContact CB-CD1 3.38Å; I117-I120 HydrophobicContact CB-CG1 3.78Å; I117-I120 HydrophobicContact CD1-CD1 3.59Å; I117-I120 HydrophobicContact CG1-CD1 4.07Å; I117-I120 HydrophobicContact CG2-CD1 3.39Å; I117-I120 HydrophobicContact CG2-CG1 3.86Å; P118-I120 PolarHBondContact O-N 2.78Å; P118-I120 VanDerWaalsContact O-N 3.15Å; I120-F140 HydrophobicContact CB-CB 4.04Å; I120-F140 HydrophobicContact CD1-CB 3.27Å; I120-F140 HydrophobicContact CD1-CD1 4.17Å; I120-F140 HydrophobicContact CD1-CD2 4.05Å; I120-F140 HydrophobicContact CD1-CG 3.61Å; I120-F140 HydrophobicContact CG1-CB 3.79Å; I120-F140 HydrophobicContact CG1-CD1 4.28Å; I120-F140 HydrophobicContact CG1-CG 4.16Å; I120-K141 CarbonylContact C-O 3.55Å; I120-K141 WeakPolarHBondContact CA-O 3.43Å; I120-F149 HydrophobicContact CG2-CD1 3.64Å; I120-F149 HydrophobicContact CG2-CE1 3.31Å; I120-F149 HydrophobicContact CG2-CZ 4.37Å; I120-A151 HydrophobicContact CD1-CB 3.69Å
121	Y	88.5	Confident	93.3	Very high	120 Å²	120	41.9 Å²	41.9	47%	0.471	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.1	-175.3	-62.2	-92.9	0	0	0	110.6	S123 F140 K141 N143	Y121-S123 PolarHBondContact O-N 2.79Å; Y121-F140 CarbonylContact O-C 3.58Å; Y121-F140 WeakPolarHBondContact O-CA 3.43Å; Y121-K141 PolarHBondContact N-O 3.23Å; Y121-K141 PolarHBondContact O-N 3.08Å; Y121-N143 HydrophobicContact CD2-CB 4.44Å; Y121-N143 WeakPolarHBondContact CD2-OD1 3.38Å; Y121-N143 HydrophobicContact CE2-CB 3.97Å; Y121-N143 WeakPolarHBondContact CE2-ND2 3.45Å; Y121-N143 WeakPolarHBondContact CE2-OD1 3.38Å; Y121-N143 PolarHBondContact OH-ND2 2.87Å
122	P	91.6	Very high	93.1	Very high	48 Å²	48	48.2 Å²	48.2	31%	0.312	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	126.9	179.2	29.1	-36.6	0	0	0	111.4	K102 T103 F140	K102-P122 HydrophobicContact CD-CB 4.22Å; K102-P122 HydrophobicContact CG-CB 4.04Å; K102-P122 WeakPolarHBondContact O-CB 3.4Å; T103-P122 HydrophobicContact CG2-CG 4.08Å; P122-F140 HydrophobicContact CB-CD1 4.43Å
123	S	91.8	Very high	93	Very high	22 Å²	22	46.1 Å²	46.1	15%	0.154	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-70.7	174.8	-179.6	0	0	0	0	109.8	K102 Y121 S139 K141	K102-S123 WeakPolarHBondContact CE-O 3.29Å; K102-S123 PolarHBondContact NZ-O 2.78Å; Y121-S123 PolarHBondContact O-N 2.79Å; S123-S139 WeakPolarHBondContact CA-O 3.31Å; S123-S139 VanDerWaalsContact CB-O 3.32Å; S123-S139 WeakPolarHBondContact CB-O 3.26Å; S123-S139 PolarHBondContact N-O 3.19Å; S123-K141 WeakPolarHBondContact OG-CE 3.36Å; S123-K141 PolarHBondContact OG-NZ 3.22Å
124	D	93.7	Very high	93	Very high	57 Å²	57	46 Å²	46	31%	0.305	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	141.6	-170.3	-56.2	-76	0	0	0	110.4	S139	D124-S139 PolarHBondContact N-O 3.29Å; D124-S139 PolarHBondContact O-N 3.24Å
125	L	97.1	Very high	93	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126	170.6	173.9	63.9	0	0	0	108.5	K75 F76 Q80 I100 K102 I127 V136 W138	K75-L125 CarbonylContact C-O 3.57Å; K75-L125 WeakPolarHBondContact CA-O 3.3Å; F76-L125 HydrophobicContact CB-CD2 4.3Å; F76-L125 HydrophobicContact CB-CG 4.44Å; F76-L125 PolarHBondContact N-O 2.83Å; Q80-L125 HydrophobicContact CG-CD2 4.15Å; I100-L125 HydrophobicContact CG2-CD1 3.8Å; I100-L125 HydrophobicContact CG2-CD2 3.91Å; K102-L125 HydrophobicContact CG-CB 4.03Å; L125-I127 HydrophobicContact CD1-CG1 4.41Å; L125-I127 HydrophobicContact CD2-CD1 4.44Å; L125-I127 HydrophobicContact CG-CD1 4.49Å; L125-I127 HydrophobicContact CG-CG1 4.41Å; L125-V136 HydrophobicContact CD1-CG1 3.62Å; L125-W138 HydrophobicContact CD1-CG 4.43Å
126	E	97.2	Very high	93.1	Very high	32 Å²	32	44.8 Å²	44.8	15%	0.15	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.4	-176.6	-82.4	177.2	-74.2	0	0	109.5	F73 I74 K75 V136 K137	F73-E126 HydrophobicContact CB-CB 4.02Å; F73-E126 HydrophobicContact CB-CG 4.36Å; F73-E126 HydrophobicContact CD1-CB 3.95Å; F73-E126 HydrophobicContact CG-CB 4.31Å; I74-E126 CarbonylContact O-C 3.54Å; I74-E126 WeakPolarHBondContact O-CA 3.3Å; K75-E126 HydrophobicContact CB-CG 4.49Å; K75-E126 HydrophobicContact CD-CG 4.45Å; K75-E126 WeakPolarHBondContact CE-OE2 3.43Å; K75-E126 HydrophobicContact CG-CG 3.5Å; E126-V136 WeakPolarHBondContact O-CA 3.38Å; E126-K137 HydrophobicContact CB-CB 3.99Å; E126-K137 PolarHBondContact N-O 3.11Å; E126-K137 PolarHBondContact O-N 3.48Å
127	I	97.4	Very high	93.3	Very high	11 Å²	11	42.3 Å²	42.3	6%	0.056	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	137.3	-177.9	-55.9	165	0	0	0	110.2	I74 F76 Q80 V82 I100 L125 V134 A135 V136	I74-I127 PolarHBondContact N-O 3.35Å; I74-I127 PolarHBondContact O-N 2.97Å; F76-I127 HydrophobicContact CD2-CB 4.32Å; F76-I127 HydrophobicContact CD2-CD1 3.77Å; F76-I127 HydrophobicContact CD2-CG1 4.09Å; F76-I127 HydrophobicContact CE2-CB 3.91Å; F76-I127 HydrophobicContact CE2-CD1 3.83Å; F76-I127 HydrophobicContact CE2-CG1 4.14Å; Q80-I127 HydrophobicContact CB-CD1 3.74Å; Q80-I127 HydrophobicContact CG-CD1 3.67Å; V82-I127 HydrophobicContact CG2-CD1 4.17Å; V82-I127 HydrophobicContact CG2-CG2 4.5Å; I100-I127 HydrophobicContact CD1-CD1 3.43Å; I100-I127 VanDerWaalsContact CD1-CD1 3.43Å; I100-I127 HydrophobicContact CD1-CG1 3.91Å; L125-I127 HydrophobicContact CD1-CG1 4.41Å; L125-I127 HydrophobicContact CD2-CD1 4.44Å; L125-I127 HydrophobicContact CG-CD1 4.49Å; L125-I127 HydrophobicContact CG-CG1 4.41Å; I127-V134 HydrophobicContact CG2-CG1 4.19Å; I127-A135 CarbonylContact C-O 3.47Å; I127-A135 WeakPolarHBondContact CA-O 3.45Å; I127-V136 HydrophobicContact CG1-CG1 4.41Å
128	L	96.2	Very high	93.6	Very high	18 Å²	18	41.8 Å²	41.8	9%	0.094	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	127.9	168	172.5	67.4	0	0	0	107.6	I68 N72 F73 M133 V134 A135	I68-L128 HydrophobicContact CG2-CD2 4.28Å; N72-L128 HydrophobicContact CB-CD1 4Å; F73-L128 HydrophobicContact CD1-CB 3.81Å; F73-L128 HydrophobicContact CE1-CB 3.75Å; F73-L128 HydrophobicContact CE2-CB 4.47Å; F73-L128 HydrophobicContact CE2-CD2 4.22Å; F73-L128 HydrophobicContact CG-CB 4.21Å; F73-L128 HydrophobicContact CZ-CB 4.1Å; F73-L128 HydrophobicContact CZ-CD2 4.25Å; L128-M133 HydrophobicContact CD2-CE 3.52Å; L128-M133 HydrophobicContact CG-CE 4.18Å; L128-V134 CarbonylContact O-C 3.6Å; L128-V134 WeakPolarHBondContact O-CA 3.37Å; L128-A135 HydrophobicContact CB-CB 4.29Å; L128-A135 PolarHBondContact N-O 3.27Å; L128-A135 PolarHBondContact O-N 2.94Å
129	N	95.6	Very high	94	Very high	50 Å²	50	41.8 Å²	41.8	27%	0.267	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	109.5	-179.9	176.4	16.7	0	0	0	108.6	Y83 N85 V134	Y83-N129 PolarHBondContact O-ND2 3.26Å; N85-N129 PolarHBondContact N-OD1 3.14Å; N85-N129 PolarHBondContact ND2-O 2.7Å; N129-V134 HydrophobicContact CB-CG2 4.23Å; N129-V134 WeakPolarHBondContact OD1-CG2 3.46Å
130	N	93.4	Very high	94.5	Very high	54 Å²	54	38.6 Å²	38.6	29%	0.289	19%	0.19	S	C	.	.			trans	-124.5	-173.3	177.2	70.2	18.2	0	0	0	110	E132 M133	N130-E132 PolarHBondContact O-N 2.93Å; N130-E132 PolarHBondContact OD1-N 2.88Å; N130-M133 PolarHBondContact N-O 2.94Å; N130-M133 PolarHBondContact OD1-N 2.92Å; N130-M133 PolarHBondContact OD1-O 3.35Å; N130-M133 VanDerWaalsContact OD1-O 3.05Å
131	E	92.2	Very high	94.7	Very high	163 Å²	163	42.9 Å²	42.9	76%	0.762	21%	0.208	S	C	*	.	S	Bend	trans	-70.6	-16.7	-176.9	-62.5	-179	175	0	0	113.7
132	E	91.2	Very high	94.5	Very high	142 Å²	142	38.3 Å²	38.3	66%	0.664	19%	0.194	S	C	*	.	S	Bend	trans	-101.5	-35.9	-174.9	-62.1	178.6	173.1	0	0	112.6	N130 A159	N130-E132 PolarHBondContact O-N 2.93Å; N130-E132 PolarHBondContact OD1-N 2.88Å; E132-A159 PolarHBondContact O-N 2.81Å; E132-A159 VanDerWaalsContact O-N 3.08Å
133	M	95.5	Very high	93.5	Very high	15 Å²	15	41.3 Å²	41.3	7%	0.074	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	159.7	-173.1	65.2	88.5	-178.6	0	0	113.9	I68 F86 L128 N130 A135 I157 Y158	I68-M133 HydrophobicContact CD1-CE 3.78Å; I68-M133 HydrophobicContact CD1-SD 4.32Å; I68-M133 HydrophobicContact CG1-CE 4.03Å; F86-M133 VanDerWaalsContact CE1-C 3.47Å; F86-M133 VanDerWaalsContact CE1-CA 3.46Å; L128-M133 HydrophobicContact CD2-CE 3.52Å; L128-M133 HydrophobicContact CG-CE 4.18Å; N130-M133 PolarHBondContact N-O 2.94Å; N130-M133 PolarHBondContact OD1-N 2.92Å; N130-M133 PolarHBondContact OD1-O 3.35Å; N130-M133 VanDerWaalsContact OD1-O 3.05Å; M133-A135 HydrophobicContact CE-CB 4.15Å; M133-A135 HydrophobicContact SD-CB 3.67Å; M133-I157 CarbonylContact C-O 3.54Å; M133-I157 WeakPolarHBondContact CA-O 3.37Å; M133-I157 VanDerWaalsContact CB-O 3.28Å; M133-I157 WeakPolarHBondContact CB-O 3.29Å; M133-Y158 HydrophobicContact CB-CD1 3.87Å; M133-Y158 HydrophobicContact CB-CE1 4.26Å; M133-Y158 HydrophobicContact CB-CG 4.45Å
134	V	97.2	Very high	92.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.2	162.6	-177.8	0	0	0	0	108.6	V82 P84 F86 F98 I127 L128 N129 V136 L156 I157	V82-V134 HydrophobicContact CG1-CG1 4.4Å; V82-V134 HydrophobicContact CG1-CG2 4.45Å; P84-V134 HydrophobicContact CB-CG2 4.03Å; P84-V134 HydrophobicContact CG-CG2 4.29Å; F86-V134 HydrophobicContact CE1-CG2 4.01Å; F86-V134 HydrophobicContact CZ-CG2 3.95Å; F98-V134 HydrophobicContact CZ-CB 4.13Å; F98-V134 HydrophobicContact CZ-CG1 3.9Å; F98-V134 HydrophobicContact CZ-CG2 4.15Å; I127-V134 HydrophobicContact CG2-CG1 4.19Å; L128-V134 CarbonylContact O-C 3.6Å; L128-V134 WeakPolarHBondContact O-CA 3.37Å; N129-V134 HydrophobicContact CB-CG2 4.23Å; N129-V134 WeakPolarHBondContact OD1-CG2 3.46Å; V134-V136 HydrophobicContact CG1-CG2 4.1Å; V134-L156 CarbonylContact O-C 3.51Å; V134-L156 WeakPolarHBondContact O-CA 3.38Å; V134-I157 PolarHBondContact N-O 3.13Å; V134-I157 PolarHBondContact O-N 3.43Å
135	A	97.7	Very high	90.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.8	170.8	0	0	0	0	0	110.8	I68 F73 I127 L128 M133 T154 C155 L156	I68-A135 HydrophobicContact CD1-CB 3.29Å; F73-A135 HydrophobicContact CE1-CB 3.77Å; F73-A135 HydrophobicContact CZ-CB 3.87Å; I127-A135 CarbonylContact C-O 3.47Å; I127-A135 WeakPolarHBondContact CA-O 3.45Å; L128-A135 HydrophobicContact CB-CB 4.29Å; L128-A135 PolarHBondContact N-O 3.27Å; L128-A135 PolarHBondContact O-N 2.94Å; M133-A135 HydrophobicContact CE-CB 4.15Å; M133-A135 HydrophobicContact SD-CB 3.67Å; A135-T154 HydrophobicContact CB-CG2 4.36Å; A135-C155 CarbonylContact C-O 3.6Å; A135-C155 VanDerWaalsContact CA-O 3.28Å; A135-C155 WeakPolarHBondContact CA-O 3.36Å; A135-L156 HydrophobicContact CB-CG 4.45Å
136	V	97.8	Very high	89.1	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	116	178.7	-172.3	0	0	0	0	108	I100 I106 L125 E126 I127 V134 W138 T154 C155	I100-V136 HydrophobicContact CD1-CB 4.43Å; I100-V136 HydrophobicContact CD1-CG1 4Å; I100-V136 HydrophobicContact CD1-CG2 3.51Å; I100-V136 HydrophobicContact CG1-CG1 4.46Å; I100-V136 HydrophobicContact CG1-CG2 4.22Å; I100-V136 HydrophobicContact CG2-CG1 3.72Å; I106-V136 HydrophobicContact CD1-CB 4.24Å; I106-V136 HydrophobicContact CD1-CG2 3.83Å; L125-V136 HydrophobicContact CD1-CG1 3.62Å; E126-V136 WeakPolarHBondContact O-CA 3.38Å; I127-V136 HydrophobicContact CG1-CG1 4.41Å; V134-V136 HydrophobicContact CG1-CG2 4.1Å; V136-W138 HydrophobicContact CB-CH2 3.75Å; V136-W138 HydrophobicContact CB-CZ2 4.21Å; V136-W138 HydrophobicContact CB-CZ3 3.91Å; V136-W138 HydrophobicContact CG1-CD2 4.07Å; V136-W138 HydrophobicContact CG1-CE3 4.1Å; V136-W138 HydrophobicContact CG1-CH2 3.46Å; V136-W138 VanDerWaalsContact CG1-CH2 3.46Å; V136-W138 HydrophobicContact CG1-CZ2 3.4Å; V136-W138 HydrophobicContact CG1-CZ3 3.8Å; V136-W138 VanDerWaalsContact O-CZ3 3.31Å; V136-W138 WeakPolarHBondContact O-CZ3 3.34Å; V136-T154 CarbonylContact O-C 3.54Å; V136-T154 VanDerWaalsContact O-CA 3.32Å; V136-T154 WeakPolarHBondContact O-CA 3.44Å; V136-C155 PolarHBondContact N-O 3.39Å; V136-C155 PolarHBondContact O-N 3.33Å
137	K	97.4	Very high	87.5	Confident	33 Å²	33	60.5 Å²	60.5	14%	0.143	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.9	-179.8	178.4	-175.6	-61	-177.7	0	109.3	F73 E126 I153 T154	F73-K137 HydrophobicContact CE1-CB 4.22Å; E126-K137 HydrophobicContact CB-CB 3.99Å; E126-K137 PolarHBondContact N-O 3.11Å; E126-K137 PolarHBondContact O-N 3.48Å; K137-I153 WeakPolarHBondContact CA-O 3.38Å; K137-T154 HydrophobicContact CB-CG2 4.48Å
138	W	97	Very high	86.2	Confident	1 Å²	1	65 Å²	65	0%	0.004	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	135	171.8	-62.6	-95.2	0	0	0	109.8	I100 D101 K102 I106 I115 L125 V136 F140 K152 I153 C155	I100-W138 HydrophobicContact CG2-CZ2 3.96Å; D101-W138 PolarHBondContact O-NE1 2.03Å; K102-W138 VanDerWaalsContact O-CD1 3.3Å; I106-W138 HydrophobicContact CD1-CH2 3.8Å; I106-W138 HydrophobicContact CD1-CZ2 4.45Å; I106-W138 HydrophobicContact CG1-CH2 3.68Å; I106-W138 HydrophobicContact CG1-CZ2 3.91Å; I115-W138 HydrophobicContact CD1-CD2 4.16Å; I115-W138 HydrophobicContact CD1-CE3 3.53Å; I115-W138 HydrophobicContact CD1-CH2 4Å; I115-W138 HydrophobicContact CD1-CZ3 3.45Å; I115-W138 VanDerWaalsContact CD1-CZ3 3.45Å; L125-W138 HydrophobicContact CD1-CG 4.43Å; V136-W138 HydrophobicContact CB-CH2 3.75Å; V136-W138 HydrophobicContact CB-CZ2 4.21Å; V136-W138 HydrophobicContact CB-CZ3 3.91Å; V136-W138 HydrophobicContact CG1-CD2 4.07Å; V136-W138 HydrophobicContact CG1-CE3 4.1Å; V136-W138 HydrophobicContact CG1-CH2 3.46Å; V136-W138 VanDerWaalsContact CG1-CH2 3.46Å; V136-W138 HydrophobicContact CG1-CZ2 3.4Å; V136-W138 HydrophobicContact CG1-CZ3 3.8Å; V136-W138 VanDerWaalsContact O-CZ3 3.31Å; V136-W138 WeakPolarHBondContact O-CZ3 3.34Å; W138-F140 HydrophobicContact CB-CD2 4.16Å; W138-F140 HydrophobicContact CB-CE1 4.47Å; W138-F140 HydrophobicContact CB-CE2 3.4Å; W138-F140 HydrophobicContact CB-CZ 3.58Å; W138-F140 HydrophobicContact CG-CE2 4.22Å; W138-F140 AromaticContact CG-CZ 3.98Å; W138-F140 HydrophobicContact CG-CZ 3.98Å; W138-K152 WeakPolarHBondContact O-CA 3.3Å; W138-I153 PolarHBondContact N-O 2.84Å; W138-I153 PolarHBondContact O-N 2.97Å; W138-C155 HydrophobicContact CH2-CB 3.9Å; W138-C155 HydrophobicContact CZ3-CB 3.52Å
139	S	95.2	Very high	85.5	Confident	16 Å²	16	65.3 Å²	65.3	11%	0.112	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	134.4	163.3	-61.7	0	0	0	0	109.3	S123 D124 A151	S123-S139 WeakPolarHBondContact CA-O 3.31Å; S123-S139 VanDerWaalsContact CB-O 3.32Å; S123-S139 WeakPolarHBondContact CB-O 3.26Å; S123-S139 PolarHBondContact N-O 3.19Å; D124-S139 PolarHBondContact N-O 3.29Å; D124-S139 PolarHBondContact O-N 3.24Å; S139-A151 CarbonylContact C-O 3.59Å; S139-A151 WeakPolarHBondContact CA-O 2.91Å
140	F	93.8	Very high	85.3	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.035	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	150.1	179.3	-56.4	-88	0	0	0	110.5	T103 I115 I117 I120 Y121 P122 W138 T150 A151	T103-F140 WeakPolarHBondContact O-CE1 2.94Å; I115-F140 HydrophobicContact CG2-CE2 4.17Å; I115-F140 HydrophobicContact CG2-CZ 4.16Å; I117-F140 HydrophobicContact CD1-CD2 4.37Å; I117-F140 HydrophobicContact CD1-CE2 4.42Å; I120-F140 HydrophobicContact CB-CB 4.04Å; I120-F140 HydrophobicContact CD1-CB 3.27Å; I120-F140 HydrophobicContact CD1-CD1 4.17Å; I120-F140 HydrophobicContact CD1-CD2 4.05Å; I120-F140 HydrophobicContact CD1-CG 3.61Å; I120-F140 HydrophobicContact CG1-CB 3.79Å; I120-F140 HydrophobicContact CG1-CD1 4.28Å; I120-F140 HydrophobicContact CG1-CG 4.16Å; Y121-F140 CarbonylContact O-C 3.58Å; Y121-F140 WeakPolarHBondContact O-CA 3.43Å; P122-F140 HydrophobicContact CB-CD1 4.43Å; W138-F140 HydrophobicContact CB-CD2 4.16Å; W138-F140 HydrophobicContact CB-CE1 4.47Å; W138-F140 HydrophobicContact CB-CE2 3.4Å; W138-F140 HydrophobicContact CB-CZ 3.58Å; W138-F140 HydrophobicContact CG-CE2 4.22Å; W138-F140 AromaticContact CG-CZ 3.98Å; W138-F140 HydrophobicContact CG-CZ 3.98Å; F140-T150 VanDerWaalsContact O-CA 3.31Å; F140-T150 WeakPolarHBondContact O-CA 3.38Å; F140-A151 HydrophobicContact CB-CB 4.23Å; F140-A151 HydrophobicContact CD2-CB 4.22Å; F140-A151 PolarHBondContact N-O 3.26Å; F140-A151 PolarHBondContact O-N 2.87Å
141	K	91	Very high	85.3	Confident	110 Å²	110	61.7 Å²	61.7	48%	0.478	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	149.7	-179.3	-71.3	171.7	177	159.2	0	111	I120 Y121 S123 T150	I120-K141 CarbonylContact C-O 3.55Å; I120-K141 WeakPolarHBondContact CA-O 3.43Å; Y121-K141 PolarHBondContact N-O 3.23Å; Y121-K141 PolarHBondContact O-N 3.08Å; S123-K141 WeakPolarHBondContact OG-CE 3.36Å; S123-K141 PolarHBondContact OG-NZ 3.22Å; K141-T150 HydrophobicContact CG-CG2 3.92Å
142	S	83.7	Confident	85.4	Confident	24 Å²	24	57.5 Å²	57.5	17%	0.168	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	160.2	164.7	-156.7	0	0	0	0	111.9	E144 F149	S142-E144 VanDerWaalsContact C-N 3.28Å; S142-E144 WeakPolarHBondContact CB-O 3.4Å; S142-E144 PolarHBondContact OG-N 3.49Å; S142-E144 VanDerWaalsContact OG-N 3.17Å; S142-F149 VanDerWaalsContact CB-CD1 3.47Å; S142-F149 PolarHBondContact N-O 3.2Å
143	N	70.8	Confident	85.7	Confident	111 Å²	111	50.7 Å²	50.7	59%	0.594	26%	0.263	S	S	*	.	S	Bend	trans	-73.2	-23.6	160.2	-86	-10.1	0	0	0	112.7	Y121	Y121-N143 HydrophobicContact CD2-CB 4.44Å; Y121-N143 WeakPolarHBondContact CD2-OD1 3.38Å; Y121-N143 HydrophobicContact CE2-CB 3.97Å; Y121-N143 WeakPolarHBondContact CE2-ND2 3.45Å; Y121-N143 WeakPolarHBondContact CE2-OD1 3.38Å; Y121-N143 PolarHBondContact OH-ND2 2.87Å
144	E	67.6	Low	85.8	Confident	146 Å²	146	50 Å²	50	68%	0.682	26%	0.259	S	S	*	.	S	Bend	trans	-76.1	132.9	176	-61.5	-178	176.6	0	0	107.6	S142 D146	S142-E144 VanDerWaalsContact C-N 3.28Å; S142-E144 WeakPolarHBondContact CB-O 3.4Å; S142-E144 PolarHBondContact OG-N 3.49Å; S142-E144 VanDerWaalsContact OG-N 3.17Å; E144-D146 PolarHBondContact O-N 2.92Å
145	D	60.1	Low	85.9	Confident	170 Å²	170	50 Å²	50	91%	0.909	26%	0.259	S	S	*	.	S	Bend	trans	-60.9	11.8	178.9	-73	-44.4	0	0	0	113.9	T147	D145-T147 PolarHBondContact O-N 2.77Å; D145-T147 VanDerWaalsContact O-N 3.12Å
146	D	63.1	Low	85.9	Confident	82 Å²	82	50.1 Å²	50.1	44%	0.439	26%	0.26	S	S	.	.			trans	-71.7	101.2	172.2	-167.8	-7.6	0	0	0	109.9	E144 D148 F149	E144-D146 PolarHBondContact O-N 2.92Å; D146-D148 PolarHBondContact O-N 2.99Å; D146-D148 WeakPolarHBondContact OD1-CB 3.24Å; D146-D148 PolarHBondContact OD1-N 3.4Å; D146-F149 PolarHBondContact O-N 3.35Å
147	T	64.1	Low	85.9	Confident	116 Å²	116	50.1 Å²	50.1	71%	0.712	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-18.9	177.9	52.6	0	0	0	0	113	D145 T150	D145-T147 PolarHBondContact O-N 2.77Å; D145-T147 VanDerWaalsContact O-N 3.12Å; T147-T150 PolarHBondContact O-OG1 2.87Å
148	D	69.1	Low	85.8	Confident	107 Å²	107	51.9 Å²	51.9	57%	0.572	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-20.5	-179.7	-71.7	-18.7	0	0	0	113.4	D146 T150 K169	D146-D148 PolarHBondContact O-N 2.99Å; D146-D148 WeakPolarHBondContact OD1-CB 3.24Å; D146-D148 PolarHBondContact OD1-N 3.4Å; D148-T150 VanDerWaalsContact C-N 3.26Å; D148-T150 PolarHBondContact O-N 2.89Å; D148-K169 PolarHBondContact O-NZ 3.03Å
149	F	82.4	Confident	85.6	Confident	23 Å²	23	53.8 Å²	53.8	10%	0.101	28%	0.282	C	S	.	.			trans	-89.4	64	179.2	-156.9	-92.7	0	0	0	111.7	D119 I120 S142 D146 P171 Q173 I174	D119-F149 HydrophobicContact CB-CE1 4.47Å; I120-F149 HydrophobicContact CG2-CD1 3.64Å; I120-F149 HydrophobicContact CG2-CE1 3.31Å; I120-F149 HydrophobicContact CG2-CZ 4.37Å; S142-F149 VanDerWaalsContact CB-CD1 3.47Å; S142-F149 PolarHBondContact N-O 3.2Å; D146-F149 PolarHBondContact O-N 3.35Å; F149-P171 HydrophobicContact CD1-CG 4.46Å; F149-P171 HydrophobicContact CD2-CB 3.53Å; F149-P171 HydrophobicContact CD2-CG 4.1Å; F149-P171 HydrophobicContact CE2-CB 3.62Å; F149-P171 HydrophobicContact CE2-CG 4.3Å; F149-P171 HydrophobicContact CG-CB 4.13Å; F149-P171 HydrophobicContact CG-CG 4.19Å; F149-P171 HydrophobicContact CZ-CB 4.33Å; F149-Q173 HydrophobicContact CE2-CB 4.05Å; F149-I174 HydrophobicContact CE2-CG1 4.28Å; F149-I174 HydrophobicContact CZ-CG1 3.92Å
150	T	90.3	Very high	85.3	Confident	28 Å²	28	57.5 Å²	57.5	17%	0.172	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	136.4	176.5	42.4	0	0	0	0	111.1	F140 K141 T147 D148 K169 P171	F140-T150 VanDerWaalsContact O-CA 3.31Å; F140-T150 WeakPolarHBondContact O-CA 3.38Å; K141-T150 HydrophobicContact CG-CG2 3.92Å; T147-T150 PolarHBondContact O-OG1 2.87Å; D148-T150 VanDerWaalsContact C-N 3.26Å; D148-T150 PolarHBondContact O-N 2.89Å; T150-K169 WeakPolarHBondContact O-CD 3.44Å; T150-K169 WeakPolarHBondContact O-CG 3.35Å; T150-K169 WeakPolarHBondContact OG1-CE 3.2Å; T150-K169 PolarHBondContact OG1-NZ 3.15Å; T150-P171 VanDerWaalsContact O-CD 3.29Å; T150-P171 WeakPolarHBondContact O-CD 3.2Å; T150-P171 WeakPolarHBondContact O-CG 3.45Å
151	A	93.7	Very high	85.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	140.5	174.2	0	0	0	0	0	110.6	I117 I120 S139 F140 K169	I117-A151 HydrophobicContact CD1-CB 3.94Å; I120-A151 HydrophobicContact CD1-CB 3.69Å; S139-A151 CarbonylContact C-O 3.59Å; S139-A151 WeakPolarHBondContact CA-O 2.91Å; F140-A151 HydrophobicContact CB-CB 4.23Å; F140-A151 HydrophobicContact CD2-CB 4.22Å; F140-A151 PolarHBondContact N-O 3.26Å; F140-A151 PolarHBondContact O-N 2.87Å; A151-K169 CarbonylContact C-O 3.56Å; A151-K169 VanDerWaalsContact CA-O 3.24Å; A151-K169 WeakPolarHBondContact CA-O 3.37Å
152	K	95.5	Very high	85.4	Confident	75 Å²	75	53 Å²	53	33%	0.326	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	122.7	176.3	-69.5	-174.9	-177	-177.4	0	109.7	W138 E168 K169	W138-K152 WeakPolarHBondContact O-CA 3.3Å; K152-E168 HydrophobicContact CB-CB 3.97Å; K152-E168 HydrophobicContact CB-CG 4.44Å; K152-E168 HydrophobicContact CD-CG 4.47Å; K152-E168 WeakPolarHBondContact CD-OE1 3.26Å; K152-E168 IonicContact NZ-OE1 2.92Å; K152-E168 PolarHBondContact NZ-OE1 3.13Å; K152-E168 PolarHBondContact O-N 3.3Å; K152-K169 HydrophobicContact CB-CB 4.3Å; K152-K169 PolarHBondContact N-O 2.69Å; K152-K169 PolarHBondContact O-N 3.2Å
153	I	97.2	Very high	86	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.5	-176.9	-61.7	175.3	0	0	0	109.1	I115 I117 K137 W138 Y166 F167 I170 I181	I115-I153 HydrophobicContact CD1-CB 4.31Å; I115-I153 HydrophobicContact CD1-CG2 3.7Å; I115-I153 HydrophobicContact CG2-CD1 3.66Å; I117-I153 HydrophobicContact CD1-CD1 3.58Å; K137-I153 WeakPolarHBondContact CA-O 3.38Å; W138-I153 PolarHBondContact N-O 2.84Å; W138-I153 PolarHBondContact O-N 2.97Å; I153-Y166 WeakPolarHBondContact CA-O 3.36Å; I153-F167 HydrophobicContact CD1-CD1 4.17Å; I153-F167 HydrophobicContact CD1-CE1 4.44Å; I153-F167 HydrophobicContact CG1-CD1 4.01Å; I153-F167 HydrophobicContact CG2-CD1 4.02Å; I153-F167 HydrophobicContact CG2-CE1 4.25Å; I153-I170 HydrophobicContact CD1-CD1 3.89Å; I153-I170 HydrophobicContact CG1-CD1 3.95Å; I153-I181 HydrophobicContact CD1-CD1 3.76Å
154	T	97.7	Very high	87.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.7	173.6	-55	0	0	0	0	109.4	H66 I68 A135 V136 K137 L156 L165 Y166	H66-T154 PolarHBondContact NE2-OG1 2.89Å; H66-T154 VanDerWaalsContact NE2-OG1 3.09Å; I68-T154 HydrophobicContact CD1-CG2 4.37Å; A135-T154 HydrophobicContact CB-CG2 4.36Å; V136-T154 CarbonylContact O-C 3.54Å; V136-T154 VanDerWaalsContact O-CA 3.32Å; V136-T154 WeakPolarHBondContact O-CA 3.44Å; K137-T154 HydrophobicContact CB-CG2 4.48Å; T154-L156 HydrophobicContact CG2-CD1 4.01Å; T154-L156 HydrophobicContact CG2-CG 4.37Å; T154-L165 CarbonylContact O-C 3.59Å; T154-L165 WeakPolarHBondContact O-CA 3.3Å; T154-Y166 PolarHBondContact N-O 3.3Å; T154-Y166 PolarHBondContact O-N 3.38Å
155	C	98.2	Very high	88.8	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	135.1	165.4	-178.1	0	0	0	0	109.5	I106 A135 V136 W138 S164 L165	I106-C155 HydrophobicContact CD1-CB 4.16Å; A135-C155 CarbonylContact C-O 3.6Å; A135-C155 VanDerWaalsContact CA-O 3.28Å; A135-C155 WeakPolarHBondContact CA-O 3.36Å; V136-C155 PolarHBondContact N-O 3.39Å; V136-C155 PolarHBondContact O-N 3.33Å; W138-C155 HydrophobicContact CH2-CB 3.9Å; W138-C155 HydrophobicContact CZ3-CB 3.52Å; C155-S164 CarbonylContact C-O 3.42Å; C155-S164 VanDerWaalsContact CA-O 3.28Å; C155-S164 WeakPolarHBondContact CA-O 2.9Å; C155-L165 HydrophobicContact CB-CD2 3.64Å
156	L	97.8	Very high	90.6	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.4	173.3	-57	88.9	0	0	0	108.4	P67 I68 V134 A135 T154 Y158 I163 S164	P67-L156 HydrophobicContact CB-CD2 4.29Å; P67-L156 HydrophobicContact CG-CD1 3.75Å; P67-L156 HydrophobicContact CG-CD2 4.05Å; I68-L156 HydrophobicContact CD1-CD2 3.46Å; I68-L156 VanDerWaalsContact CD1-CD2 3.46Å; I68-L156 HydrophobicContact CD1-CG 3.96Å; I68-L156 HydrophobicContact CG1-CD2 3.66Å; V134-L156 CarbonylContact O-C 3.51Å; V134-L156 WeakPolarHBondContact O-CA 3.38Å; A135-L156 HydrophobicContact CB-CG 4.45Å; T154-L156 HydrophobicContact CG2-CD1 4.01Å; T154-L156 HydrophobicContact CG2-CG 4.37Å; L156-Y158 HydrophobicContact CB-CE2 3.84Å; L156-Y158 WeakPolarHBondContact CD2-OH 3.19Å; L156-I163 CarbonylContact O-C 3.5Å; L156-I163 VanDerWaalsContact O-CA 3.26Å; L156-I163 WeakPolarHBondContact O-CA 3.29Å; L156-S164 PolarHBondContact N-O 3.01Å; L156-S164 PolarHBondContact O-N 3.47Å
157	I	97.5	Very high	92.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	121.8	173.6	-60	169.4	0	0	0	106.9	F88 F98 I106 F108 M133 V134 I163	F88-I157 HydrophobicContact CD2-CG2 4.05Å; F88-I157 HydrophobicContact CE1-CG2 4.11Å; F88-I157 HydrophobicContact CE2-CG2 3.6Å; F88-I157 HydrophobicContact CG-CG2 4.47Å; F88-I157 HydrophobicContact CZ-CG2 3.63Å; F98-I157 HydrophobicContact CE1-CD1 4.15Å; F98-I157 HydrophobicContact CE2-CD1 4.45Å; F98-I157 HydrophobicContact CZ-CD1 3.95Å; I106-I157 HydrophobicContact CD1-CD1 3.77Å; I106-I157 HydrophobicContact CG2-CD1 4.23Å; F108-I157 HydrophobicContact CE1-CD1 4.12Å; F108-I157 HydrophobicContact CZ-CD1 3.84Å; M133-I157 CarbonylContact C-O 3.54Å; M133-I157 WeakPolarHBondContact CA-O 3.37Å; M133-I157 VanDerWaalsContact CB-O 3.28Å; M133-I157 WeakPolarHBondContact CB-O 3.29Å; V134-I157 PolarHBondContact N-O 3.13Å; V134-I157 PolarHBondContact O-N 3.43Å; I157-I163 HydrophobicContact CG1-CG1 4.4Å
158	Y	95.6	Very high	93.7	Very high	71 Å²	71	25.8 Å²	25.8	28%	0.278	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	157.2	-176.9	-63	-88	0	0	0	111.7	M133 L156 N160 G161 N162	M133-Y158 HydrophobicContact CB-CD1 3.87Å; M133-Y158 HydrophobicContact CB-CE1 4.26Å; M133-Y158 HydrophobicContact CB-CG 4.45Å; L156-Y158 HydrophobicContact CB-CE2 3.84Å; L156-Y158 WeakPolarHBondContact CD2-OH 3.19Å; Y158-N160 VanDerWaalsContact CB-OD1 3.3Å; Y158-N160 WeakPolarHBondContact CB-OD1 3.2Å; Y158-N160 PolarHBondContact O-N 2.79Å; Y158-N160 VanDerWaalsContact O-N 3.15Å; Y158-G161 PolarHBondContact O-N 3.07Å; Y158-N162 HydrophobicContact CD2-CB 4.08Å; Y158-N162 WeakPolarHBondContact CD2-O 3.38Å; Y158-N162 PolarHBondContact N-O 3.3Å
159	A	92.7	Very high	94.9	Very high	41 Å²	41	24 Å²	24	34%	0.339	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-27.2	178	0	0	0	0	0	114.5	F86 F88 E132 G161	F86-A159 HydrophobicContact CB-CB 3.99Å; F86-A159 HydrophobicContact CD1-CB 4.4Å; F86-A159 VanDerWaalsContact CD2-CA 3.41Å; F86-A159 HydrophobicContact CD2-CB 3.69Å; F86-A159 HydrophobicContact CE2-CB 4.24Å; F86-A159 HydrophobicContact CG-CB 3.76Å; F88-A159 WeakPolarHBondContact CB-O 3.5Å; E132-A159 PolarHBondContact O-N 2.81Å; E132-A159 VanDerWaalsContact O-N 3.08Å; A159-G161 PolarHBondContact O-N 2.93Å
160	N	89.8	Confident	95.4	Very high	93 Å²	93	23.6 Å²	23.6	50%	0.497	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	2.2	175.9	68.1	-1.9	0	0	0	114.2	Y158 N162	Y158-N160 VanDerWaalsContact CB-OD1 3.3Å; Y158-N160 WeakPolarHBondContact CB-OD1 3.2Å; Y158-N160 PolarHBondContact O-N 2.79Å; Y158-N160 VanDerWaalsContact O-N 3.15Å; N160-N162 VanDerWaalsContact C-N 3.33Å; N160-N162 PolarHBondContact ND2-ND2 2.88Å; N160-N162 VanDerWaalsContact ND2-ND2 3.2Å; N160-N162 VanDerWaalsContact OD1-CB 3.24Å; N160-N162 WeakPolarHBondContact OD1-CB 3.42Å; N160-N162 PolarHBondContact OD1-N 2.74Å
161	G	92	Very high	95.3	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.01	11%	0.114	C	C	.	.	S	Bend	trans	85.8	-2.3	-178.5	0	0	0	0	0	114.8	Y158 A159	Y158-G161 PolarHBondContact O-N 3.07Å; A159-G161 PolarHBondContact O-N 2.93Å
162	N	94.5	Very high	94.9	Very high	22 Å²	22	27.6 Å²	27.6	12%	0.118	15%	0.148	C	C	.	.			trans	-66.2	149.3	172.4	-68.1	-8.9	0	0	0	110.6	Y158 N160 Y219 E220 V221	Y158-N162 HydrophobicContact CD2-CB 4.08Å; Y158-N162 WeakPolarHBondContact CD2-O 3.38Å; Y158-N162 PolarHBondContact N-O 3.3Å; N160-N162 VanDerWaalsContact C-N 3.33Å; N160-N162 PolarHBondContact ND2-ND2 2.88Å; N160-N162 VanDerWaalsContact ND2-ND2 3.2Å; N160-N162 VanDerWaalsContact OD1-CB 3.24Å; N160-N162 WeakPolarHBondContact OD1-CB 3.42Å; N160-N162 PolarHBondContact OD1-N 2.74Å; N162-Y219 WeakPolarHBondContact CA-O 3.37Å; N162-E220 WeakPolarHBondContact OD1-CA 3.32Å; N162-V221 PolarHBondContact OD1-N 2.86Å; N162-V221 VanDerWaalsContact OD1-N 3.13Å
163	I	97.4	Very high	94.2	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136.7	177.4	-61.3	175.3	0	0	0	108.7	Y90 V113 L156 I157 I183 Y219	Y90-I163 HydrophobicContact CD2-CD1 3.71Å; Y90-I163 HydrophobicContact CE2-CD1 3.52Å; V113-I163 HydrophobicContact CG2-CD1 4.08Å; L156-I163 CarbonylContact O-C 3.5Å; L156-I163 VanDerWaalsContact O-CA 3.26Å; L156-I163 WeakPolarHBondContact O-CA 3.29Å; I157-I163 HydrophobicContact CG1-CG1 4.4Å; I163-I183 HydrophobicContact CD1-CG2 4.46Å; I163-Y219 HydrophobicContact CB-CD2 4.25Å; I163-Y219 HydrophobicContact CG2-CD2 4.22Å; I163-Y219 PolarHBondContact N-O 2.93Å; I163-Y219 PolarHBondContact O-N 3.04Å
164	S	97.9	Very high	93.5	Very high	8 Å²	8	30.7 Å²	30.7	6%	0.056	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.2	171.9	-63.4	0	0	0	0	111.5	C155 L156 V217	C155-S164 CarbonylContact C-O 3.42Å; C155-S164 VanDerWaalsContact CA-O 3.28Å; C155-S164 WeakPolarHBondContact CA-O 2.9Å; L156-S164 PolarHBondContact N-O 3.01Å; L156-S164 PolarHBondContact O-N 3.47Å; S164-V217 CarbonylContact C-O 3.58Å; S164-V217 WeakPolarHBondContact CA-O 3.4Å
165	L	98.3	Very high	92.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.9	171.8	-62.5	172.1	0	0	0	108.2	V113 T154 C155 F167 I181 V206 V217 Y219	V113-L165 HydrophobicContact CG1-CD2 4.07Å; T154-L165 CarbonylContact O-C 3.59Å; T154-L165 WeakPolarHBondContact O-CA 3.3Å; C155-L165 HydrophobicContact CB-CD2 3.64Å; L165-F167 HydrophobicContact CB-CE1 3.96Å; L165-F167 HydrophobicContact CB-CZ 4.43Å; L165-I181 HydrophobicContact CD1-CG2 3.54Å; L165-V206 HydrophobicContact CD1-CG2 4.48Å; L165-V217 HydrophobicContact CB-CB 4.29Å; L165-V217 PolarHBondContact N-O 2.95Å; L165-V217 PolarHBondContact O-N 3.36Å; L165-Y219 HydrophobicContact CD1-CE2 3.9Å; L165-Y219 HydrophobicContact CG-CE2 4.37Å
166	Y	98.2	Very high	91.8	Very high	12 Å²	12	43.7 Å²	43.7	5%	0.047	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.3	174.8	-179.5	-106	0	0	0	110.2	Q64 H66 P67 I153 T154 E168 L216	Q64-Y166 HydrophobicContact CB-CE2 4.34Å; Q64-Y166 PolarHBondContact O-OH 3.09Å; Q64-Y166 VanDerWaalsContact O-OH 3.07Å; H66-Y166 HydrophobicContact CB-CD1 4.32Å; H66-Y166 HydrophobicContact CB-CE1 3.75Å; H66-Y166 AromaticContact CD2-CD1 3.35Å; H66-Y166 WeakPolarHBondContact CD2-CD1 2.99Å; H66-Y166 AromaticContact CD2-CE1 3.37Å; H66-Y166 WeakPolarHBondContact CD2-CE1 3.44Å; H66-Y166 AromaticContact CG-CD1 3.96Å; H66-Y166 AromaticContact CG-CE1 3.82Å; H66-Y166 PolarHBondContact N-OH 2.76Å; H66-Y166 AromaticContact NE2-CD1 3.98Å; P67-Y166 HydrophobicContact CG-CG 4.3Å; I153-Y166 WeakPolarHBondContact CA-O 3.36Å; T154-Y166 PolarHBondContact N-O 3.3Å; T154-Y166 PolarHBondContact O-N 3.38Å; Y166-E168 HydrophobicContact CD1-CB 4.06Å; Y166-E168 VanDerWaalsContact CE1-CA 3.45Å; Y166-E168 HydrophobicContact CE1-CB 3.65Å; Y166-E168 HydrophobicContact CE1-CG 4.22Å; Y166-E168 PolarHBondContact O-N 2.99Å; Y166-L216 HydrophobicContact CD2-CB 4.35Å; Y166-L216 HydrophobicContact CD2-CD1 4.34Å
167	F	97.2	Very high	91.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	88.3	178	-56.2	-25.9	0	0	0	108.9	I153 L165 I170 I181 V206 I211 K212 S213 E214 T215 V217	I153-F167 HydrophobicContact CD1-CD1 4.17Å; I153-F167 HydrophobicContact CD1-CE1 4.44Å; I153-F167 HydrophobicContact CG1-CD1 4.01Å; I153-F167 HydrophobicContact CG2-CD1 4.02Å; I153-F167 HydrophobicContact CG2-CE1 4.25Å; L165-F167 HydrophobicContact CB-CE1 3.96Å; L165-F167 HydrophobicContact CB-CZ 4.43Å; F167-I170 HydrophobicContact CB-CD1 4.15Å; F167-I170 HydrophobicContact CB-CG1 3.77Å; F167-I170 HydrophobicContact CG-CD1 4.34Å; F167-I170 HydrophobicContact CG-CG1 4.26Å; F167-I181 HydrophobicContact CE1-CD1 3.92Å; F167-I181 HydrophobicContact CE1-CG2 4.1Å; F167-I181 HydrophobicContact CZ-CD1 4.09Å; F167-I181 HydrophobicContact CZ-CG2 4.09Å; F167-V206 HydrophobicContact CE2-CG1 4.12Å; F167-V206 HydrophobicContact CZ-CG1 4.24Å; F167-V206 HydrophobicContact CZ-CG2 4.35Å; F167-I211 HydrophobicContact CD2-CB 4.42Å; F167-I211 HydrophobicContact CD2-CG2 4.07Å; F167-I211 HydrophobicContact CE2-CB 4.06Å; F167-I211 HydrophobicContact CE2-CG1 3.9Å; F167-I211 HydrophobicContact CE2-CG2 3.94Å; F167-I211 HydrophobicContact CZ-CG1 4.24Å; F167-I211 HydrophobicContact CZ-CG2 4.31Å; F167-K212 VanDerWaalsContact CB-O 3.29Å; F167-K212 WeakPolarHBondContact CB-O 3.37Å; F167-S213 CarbonylContact O-C 3.55Å; F167-S213 WeakPolarHBondContact O-CA 3.43Å; F167-E214 PolarHBondContact O-N 3.47Å; F167-T215 HydrophobicContact CD2-CG2 4.34Å; F167-T215 PolarHBondContact N-O 2.92Å; F167-V217 HydrophobicContact CE2-CG2 3.93Å; F167-V217 HydrophobicContact CZ-CG2 4Å
168	E	95.7	Very high	90.4	Very high	58 Å²	58	57.7 Å²	57.7	27%	0.271	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	-49.5	179.8	-177.6	-173.5	139.3	0	0	110.7	H66 K152 Y166	H66-E168 IonicContact CD2-OE2 3.69Å; K152-E168 HydrophobicContact CB-CB 3.97Å; K152-E168 HydrophobicContact CB-CG 4.44Å; K152-E168 HydrophobicContact CD-CG 4.47Å; K152-E168 WeakPolarHBondContact CD-OE1 3.26Å; K152-E168 IonicContact NZ-OE1 2.92Å; K152-E168 PolarHBondContact NZ-OE1 3.13Å; K152-E168 PolarHBondContact O-N 3.3Å; Y166-E168 HydrophobicContact CD1-CB 4.06Å; Y166-E168 VanDerWaalsContact CE1-CA 3.45Å; Y166-E168 HydrophobicContact CE1-CB 3.65Å; Y166-E168 HydrophobicContact CE1-CG 4.22Å; Y166-E168 PolarHBondContact O-N 2.99Å
169	K	93.8	Very high	90.2	Very high	71 Å²	71	55 Å²	55	31%	0.309	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	127.4	178	-171	179.1	177.7	-176.7	0	109.9	D148 T150 A151 K152	D148-K169 PolarHBondContact O-NZ 3.03Å; T150-K169 WeakPolarHBondContact O-CD 3.44Å; T150-K169 WeakPolarHBondContact O-CG 3.35Å; T150-K169 WeakPolarHBondContact OG1-CE 3.2Å; T150-K169 PolarHBondContact OG1-NZ 3.15Å; A151-K169 CarbonylContact C-O 3.56Å; A151-K169 VanDerWaalsContact CA-O 3.24Å; A151-K169 WeakPolarHBondContact CA-O 3.37Å; K152-K169 HydrophobicContact CB-CB 4.3Å; K152-K169 PolarHBondContact N-O 2.69Å; K152-K169 PolarHBondContact O-N 3.2Å
170	I	92.7	Very high	90.3	Very high	14 Å²	14	57 Å²	57	7%	0.072	27%	0.267	C	S	.	.			trans	-130	119.8	172.6	-58.1	-66.2	0	0	0	108.1	I153 F167 S172 I174 I211 S213	I153-I170 HydrophobicContact CD1-CD1 3.89Å; I153-I170 HydrophobicContact CG1-CD1 3.95Å; F167-I170 HydrophobicContact CB-CD1 4.15Å; F167-I170 HydrophobicContact CB-CG1 3.77Å; F167-I170 HydrophobicContact CG-CD1 4.34Å; F167-I170 HydrophobicContact CG-CG1 4.26Å; I170-S172 PolarHBondContact O-N 3.31Å; I170-I174 HydrophobicContact CG2-CD1 3.7Å; I170-I211 HydrophobicContact CD1-CG2 4.15Å; I170-I211 HydrophobicContact CG1-CG2 4.25Å; I170-I211 HydrophobicContact CG2-CG2 4.28Å; I170-S213 PolarHBondContact N-OG 3.05Å; I170-S213 PolarHBondContact O-OG 2.91Å
171	P	89	Confident	90.7	Very high	8 Å²	8	52.6 Å²	52.6	5%	0.052	24%	0.244	C	C	.	.			trans	-57	135.3	175.6	-22.4	27.2	0	0	0	112.3	F149 T150 Q173 I174	F149-P171 HydrophobicContact CD1-CG 4.46Å; F149-P171 HydrophobicContact CD2-CB 3.53Å; F149-P171 HydrophobicContact CD2-CG 4.1Å; F149-P171 HydrophobicContact CE2-CB 3.62Å; F149-P171 HydrophobicContact CE2-CG 4.3Å; F149-P171 HydrophobicContact CG-CB 4.13Å; F149-P171 HydrophobicContact CG-CG 4.19Å; F149-P171 HydrophobicContact CZ-CB 4.33Å; T150-P171 VanDerWaalsContact O-CD 3.29Å; T150-P171 WeakPolarHBondContact O-CD 3.2Å; T150-P171 WeakPolarHBondContact O-CG 3.45Å; P171-Q173 PolarHBondContact O-N 3.29Å; P171-I174 HydrophobicContact CB-CD1 4.05Å; P171-I174 HydrophobicContact CB-CG1 4.07Å; P171-I174 HydrophobicContact CG-CD1 3.95Å; P171-I174 HydrophobicContact CG-CG1 4.35Å; P171-I174 PolarHBondContact O-N 2.86Å
172	S	84.5	Confident	90.9	Very high	104 Å²	104	52.5 Å²	52.5	73%	0.727	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-22.7	-176.5	70.4	0	0	0	0	113.5	I170	I170-S172 PolarHBondContact O-N 3.31Å
173	Q	81.1	Confident	91.1	Very high	126 Å²	126	51.5 Å²	51.5	59%	0.589	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	1.6	-174.6	-49	82.2	-5.3	0	0	113.5	F149 P171 R175	F149-Q173 HydrophobicContact CE2-CB 4.05Å; P171-Q173 PolarHBondContact O-N 3.29Å; Q173-R175 PolarHBondContact O-N 3.42Å
174	I	81.2	Confident	91	Very high	13 Å²	13	52.7 Å²	52.7	7%	0.067	25%	0.245	C	C	.	.			trans	-57.4	133.8	-179.6	-76.1	163.3	0	0	0	111.5	I117 P118 F149 I170 P171 K176 L179	I117-I174 HydrophobicContact CG2-CD1 3.53Å; I117-I174 HydrophobicContact CG2-CG1 4Å; I117-I174 HydrophobicContact CG2-CG2 4.07Å; P118-I174 HydrophobicContact CG-CG2 4.07Å; F149-I174 HydrophobicContact CE2-CG1 4.28Å; F149-I174 HydrophobicContact CZ-CG1 3.92Å; I170-I174 HydrophobicContact CG2-CD1 3.7Å; P171-I174 HydrophobicContact CB-CD1 4.05Å; P171-I174 HydrophobicContact CB-CG1 4.07Å; P171-I174 HydrophobicContact CG-CD1 3.95Å; P171-I174 HydrophobicContact CG-CG1 4.35Å; P171-I174 PolarHBondContact O-N 2.86Å; I174-K176 PolarHBondContact O-N 3.44Å; I174-L179 HydrophobicContact CG2-CB 4.21Å; I174-L179 HydrophobicContact CG2-CD1 4.35Å; I174-L179 HydrophobicContact CG2-CD2 4.05Å; I174-L179 HydrophobicContact CG2-CG 4.45Å
175	R	80.9	Confident	90.9	Very high	147 Å²	147	52.5 Å²	52.5	56%	0.555	24%	0.243	S	C	*	.			trans	-67.4	93	173.4	-66	-177	-178.8	141.2	-7	110.9	P118 D119 Q173 K177 Y178	P118-R175 HydrophobicContact CG-CB 4.13Å; D119-R175 IonicContact OD1-NH1 3.06Å; D119-R175 PolarHBondContact OD1-NH1 2.84Å; D119-R175 VanDerWaalsContact OD1-NH1 3.13Å; D119-R175 WeakPolarHBondContact OD2-CD 3.28Å; D119-R175 IonicContact OD2-CZ 3.57Å; D119-R175 IonicContact OD2-NE 3.88Å; D119-R175 IonicContact OD2-NH1 3.13Å; D119-R175 PolarHBondContact OD2-NH1 2.95Å; Q173-R175 PolarHBondContact O-N 3.42Å; R175-K177 PolarHBondContact O-N 3Å; R175-Y178 HydrophobicContact CB-CD2 4.37Å; R175-Y178 PolarHBondContact O-N 3.36Å; R175-Y178 VanDerWaalsContact O-N 3.13Å
176	K	81	Confident	90.6	Very high	126 Å²	126	56.8 Å²	56.8	55%	0.548	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-27.1	-179	-65.1	-179.5	-178.1	171.6	0	115	I174 Y178 L179 A208	I174-K176 PolarHBondContact O-N 3.44Å; K176-Y178 VanDerWaalsContact C-N 3.28Å; K176-Y178 PolarHBondContact O-N 2.82Å; K176-L179 PolarHBondContact O-N 2.78Å; K176-A208 HydrophobicContact CB-CB 4.31Å
177	K	82.1	Confident	90.1	Very high	169 Å²	169	57 Å²	57	74%	0.735	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-33.6	-179.4	-174.7	178.8	178.2	-175.7	0	113.4	R175	R175-K177 PolarHBondContact O-N 3Å
178	Y	83.8	Confident	89.6	Confident	127 Å²	127	63.3 Å²	63.3	50%	0.498	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-6.2	-176.4	-57.3	-69.9	0	0	0	113.1	R175 K176 Q180	R175-Y178 HydrophobicContact CB-CD2 4.37Å; R175-Y178 PolarHBondContact O-N 3.36Å; R175-Y178 VanDerWaalsContact O-N 3.13Å; K176-Y178 VanDerWaalsContact C-N 3.28Å; K176-Y178 PolarHBondContact O-N 2.82Å; Y178-Q180 PolarHBondContact O-N 3.3Å
179	L	91	Very high	89	Confident	14 Å²	14	61.2 Å²	61.2	7%	0.073	28%	0.282	C	S	.	.			trans	-70.9	114.7	176.8	179	62.2	0	0	0	110	N116 I117 I174 K176 I181 I211	N116-L179 WeakPolarHBondContact O-CA 3.26Å; I117-L179 HydrophobicContact CB-CD1 4.13Å; I117-L179 HydrophobicContact CG1-CD1 3.64Å; I117-L179 HydrophobicContact CG2-CD1 4.11Å; I174-L179 HydrophobicContact CG2-CB 4.21Å; I174-L179 HydrophobicContact CG2-CD1 4.35Å; I174-L179 HydrophobicContact CG2-CD2 4.05Å; I174-L179 HydrophobicContact CG2-CG 4.45Å; K176-L179 PolarHBondContact O-N 2.78Å; L179-I181 HydrophobicContact CD1-CD1 4.2Å; L179-I181 HydrophobicContact CD1-CG1 4.25Å; L179-I211 HydrophobicContact CD1-CD1 4.27Å; L179-I211 HydrophobicContact CD1-CG2 4.32Å; L179-I211 HydrophobicContact CD2-CB 3.79Å; L179-I211 HydrophobicContact CD2-CD1 3.7Å; L179-I211 HydrophobicContact CD2-CG1 4.34Å; L179-I211 HydrophobicContact CD2-CG2 3.78Å; L179-I211 HydrophobicContact CG-CD1 3.65Å; L179-I211 HydrophobicContact CG-CG2 4.4Å
180	Q	94.6	Very high	88.3	Confident	84 Å²	84	64.8 Å²	64.8	39%	0.393	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	117.9	176	-65.4	-166.2	-0.1	0	0	109.9	F114 N116 Y178	F114-Q180 HydrophobicContact CD2-CB 4.3Å; F114-Q180 HydrophobicContact CE2-CB 3.98Å; N116-Q180 HydrophobicContact CB-CB 4.37Å; N116-Q180 WeakPolarHBondContact CB-O 3.25Å; N116-Q180 PolarHBondContact N-O 3.04Å; N116-Q180 PolarHBondContact O-N 2.79Å; Y178-Q180 PolarHBondContact O-N 3.3Å
181	I	97.3	Very high	87.2	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	137.9	174.5	-59.1	-178.4	0	0	0	107.7	F114 I115 I153 L165 F167 L179 V206 I211	F114-I181 VanDerWaalsContact CE2-C 3.43Å; F114-I181 VanDerWaalsContact O-CA 3.31Å; F114-I181 WeakPolarHBondContact O-CA 3.43Å; I115-I181 HydrophobicContact CG1-CG2 4.27Å; I115-I181 HydrophobicContact CG2-CD1 4.29Å; I115-I181 HydrophobicContact CG2-CG1 4.31Å; I153-I181 HydrophobicContact CD1-CD1 3.76Å; L165-I181 HydrophobicContact CD1-CG2 3.54Å; F167-I181 HydrophobicContact CE1-CD1 3.92Å; F167-I181 HydrophobicContact CE1-CG2 4.1Å; F167-I181 HydrophobicContact CZ-CD1 4.09Å; F167-I181 HydrophobicContact CZ-CG2 4.09Å; L179-I181 HydrophobicContact CD1-CD1 4.2Å; L179-I181 HydrophobicContact CD1-CG1 4.25Å; I181-V206 HydrophobicContact CB-CG2 4.44Å; I181-V206 HydrophobicContact CG2-CG2 4.2Å; I181-V206 PolarHBondContact O-N 3.12Å; I181-I211 HydrophobicContact CB-CD1 4.07Å; I181-I211 HydrophobicContact CD1-CD1 4.07Å; I181-I211 HydrophobicContact CD1-CG1 4.46Å; I181-I211 HydrophobicContact CD1-CG2 3.73Å; I181-I211 HydrophobicContact CG1-CD1 4.06Å
182	G	97.7	Very high	86	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.8	-160.4	177.3	0	0	0	0	0	114.3	V113 F114 I204	V113-G182 WeakPolarHBondContact CA-O 3.44Å; F114-G182 VanDerWaalsContact CD1-O 3.31Å; F114-G182 WeakPolarHBondContact CD1-O 3.28Å; F114-G182 WeakPolarHBondContact CE1-O 3.14Å; F114-G182 VanDerWaalsContact CE2-N 3.33Å; F114-G182 PolarHBondContact N-O 2.92Å; F114-G182 PolarHBondContact O-N 3.49Å; G182-I204 CarbonylContact C-O 3.59Å; G182-I204 WeakPolarHBondContact CA-O 3.36Å
183	I	97.6	Very high	85.1	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	147.9	180	65	171.1	0	0	0	111.1	Y56 L112 V113 I163 I204 Y219	Y56-I183 HydrophobicContact CD1-CD1 4.28Å; Y56-I183 HydrophobicContact CD2-CD1 4Å; Y56-I183 HydrophobicContact CE1-CD1 4.39Å; Y56-I183 HydrophobicContact CE2-CD1 4.14Å; Y56-I183 HydrophobicContact CG-CD1 4.06Å; L112-I183 CarbonylContact O-C 3.51Å; L112-I183 WeakPolarHBondContact O-CA 3.37Å; V113-I183 HydrophobicContact CB-CG2 4.45Å; V113-I183 HydrophobicContact CG1-CG2 4.28Å; V113-I183 HydrophobicContact CG2-CG2 4.02Å; I163-I183 HydrophobicContact CD1-CG2 4.46Å; I183-I204 HydrophobicContact CD1-CD1 4.07Å; I183-I204 HydrophobicContact CG1-CB 3.94Å; I183-I204 HydrophobicContact CG1-CD1 4.12Å; I183-I204 HydrophobicContact CG1-CG1 4.36Å; I183-I204 PolarHBondContact N-O 3.48Å; I183-I204 PolarHBondContact O-N 2.96Å; I183-Y219 HydrophobicContact CD1-CD1 3.8Å; I183-Y219 HydrophobicContact CD1-CD2 4.22Å; I183-Y219 HydrophobicContact CD1-CE1 4.25Å; I183-Y219 HydrophobicContact CD1-CG 3.77Å; I183-Y219 HydrophobicContact CG1-CD1 4.2Å; I183-Y219 HydrophobicContact CG1-CE1 4.14Å; I183-Y219 HydrophobicContact CG1-CE2 4.48Å; I183-Y219 HydrophobicContact CG1-CG 4.41Å; I183-Y219 HydrophobicContact CG2-CD2 4.04Å; I183-Y219 HydrophobicContact CG2-CE2 3.88Å
184	T	96.2	Very high	83.8	Confident	26 Å²	26	75.9 Å²	75.9	16%	0.16	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	158	174.7	-171.3	0	0	0	0	111.1	Y90 G111 L112 F114 P202	Y90-T184 WeakPolarHBondContact CE1-O 2.92Å; Y90-T184 PolarHBondContact OH-N 3.31Å; Y90-T184 PolarHBondContact OH-O 2.74Å; G111-T184 WeakPolarHBondContact CA-O 3.32Å; L112-T184 HydrophobicContact CB-CG2 3.81Å; L112-T184 HydrophobicContact CD2-CG2 4.43Å; L112-T184 PolarHBondContact N-O 3Å; L112-T184 PolarHBondContact O-N 3.47Å; F114-T184 HydrophobicContact CD1-CG2 4.14Å; F114-T184 HydrophobicContact CE1-CG2 4.18Å; T184-P202 WeakPolarHBondContact CA-O 3.46Å; T184-P202 WeakPolarHBondContact CB-O 3.31Å; T184-P202 PolarHBondContact OG1-O 2.97Å
185	T	94.8	Very high	82.7	Confident	3 Å²	3	81.1 Å²	81.1	2%	0.018	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	161.4	174	-163.2	0	0	0	0	109.7	Y91 E110 I187 S201 P202	Y91-T185 HydrophobicContact CD1-CG2 3.67Å; Y91-T185 HydrophobicContact CD2-CG2 3.7Å; Y91-T185 HydrophobicContact CE1-CG2 3.69Å; Y91-T185 HydrophobicContact CE2-CG2 3.7Å; Y91-T185 HydrophobicContact CG-CG2 3.68Å; E110-T185 CarbonylContact O-C 3.59Å; E110-T185 VanDerWaalsContact O-CA 3.24Å; E110-T185 WeakPolarHBondContact O-CA 3.46Å; E110-T185 PolarHBondContact O-OG1 2.84Å; E110-T185 VanDerWaalsContact O-OG1 3.06Å; T185-I187 HydrophobicContact CG2-CD1 4.12Å; T185-I187 HydrophobicContact CG2-CG1 4Å; T185-S201 CarbonylContact O-C 3.6Å; T185-S201 WeakPolarHBondContact O-CA 3.38Å; T185-P202 HydrophobicContact CG2-CB 4.25Å; T185-P202 HydrophobicContact CG2-CG 3.99Å; T185-P202 PolarHBondContact N-O 3.01Å; T185-P202 WeakPolarHBondContact O-CD 3.5Å
186	Q	91.6	Very high	81.6	Confident	91 Å²	91	79.4 Å²	79.4	43%	0.425	39%	0.393	S	S	.	.			trans	-106.2	135.3	167.3	-65.7	-178.8	5.9	0	0	108.5	E110 Y188 V199 K200	E110-Q186 PolarHBondContact O-N 2.89Å; Q186-Y188 HydrophobicContact CB-CE2 4.44Å; Q186-Y188 PolarHBondContact OE1-OH 2.01Å; Q186-V199 HydrophobicContact CB-CG1 3.82Å; Q186-V199 HydrophobicContact CG-CG1 4.2Å; Q186-K200 CarbonylContact C-O 3.39Å; Q186-K200 WeakPolarHBondContact CA-O 3.18Å
187	I	88.2	Confident	80.9	Confident	17 Å²	17	76.2 Å²	76.2	9%	0.087	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	117.9	177.7	-61.1	173.2	0	0	0	107.2	I29 Y54 T185 C189 V199 K200 P202	I29-I187 HydrophobicContact CD1-CD1 4.33Å; I29-I187 HydrophobicContact CG2-CD1 3.96Å; I29-I187 HydrophobicContact CG2-CG2 4.01Å; Y54-I187 HydrophobicContact CD1-CD1 4.37Å; Y54-I187 HydrophobicContact CE1-CD1 3.47Å; Y54-I187 VanDerWaalsContact CE1-CD1 3.47Å; T185-I187 HydrophobicContact CG2-CD1 4.12Å; T185-I187 HydrophobicContact CG2-CG1 4Å; I187-C189 PolarHBondContact O-N 3.33Å; I187-V199 CarbonylContact O-C 3.56Å; I187-V199 WeakPolarHBondContact O-CA 3.34Å; I187-K200 HydrophobicContact CB-CB 4.36Å; I187-K200 PolarHBondContact N-O 2.77Å; I187-K200 PolarHBondContact O-N 3.17Å; I187-P202 HydrophobicContact CD1-CG 3.82Å
188	Y	86.3	Confident	80.8	Confident	132 Å²	132	69.9 Å²	69.9	52%	0.518	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	112.7	-179.4	-64.4	-88.2	0	0	0	110	E110 Q186 V199	E110-Y188 HydrophobicContact CG-CE2 4.29Å; E110-Y188 WeakPolarHBondContact OE1-CD2 3.47Å; E110-Y188 WeakPolarHBondContact OE1-CE2 3.4Å; Q186-Y188 HydrophobicContact CB-CE2 4.44Å; Q186-Y188 PolarHBondContact OE1-OH 2.01Å; Y188-V199 HydrophobicContact CD1-CG2 3.6Å; Y188-V199 HydrophobicContact CE1-CG1 4.49Å; Y188-V199 HydrophobicContact CE1-CG2 3.62Å
189	C	84.6	Confident	80.8	Confident	14 Å²	14	67.1 Å²	67.1	10%	0.095	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-83.7	136.7	176.4	-60.6	0	0	0	0	111.1	C30 I187 T191 Q197 G198 K200	C30-C189 WeakPolarHBondContact CA-SG 3.06Å; C30-C189 HydrophobicContact CB-CB 3.63Å; C30-C189 WeakPolarHBondContact CB-SG 3.39Å; C30-C189 WeakPolarHBondContact SG-CA 3.33Å; C30-C189 WeakPolarHBondContact SG-CB 3.4Å; C30-C189 CovalentContact SG-SG 2.01Å; C30-C189 PolarHBondContact SG-SG 3.4Å; I187-C189 PolarHBondContact O-N 3.33Å; C189-T191 PolarHBondContact O-N 3.46Å; C189-Q197 HydrophobicContact CB-CB 3.35Å; C189-G198 VanDerWaalsContact CB-O 3.31Å; C189-G198 WeakPolarHBondContact CB-O 3.31Å; C189-G198 PolarHBondContact N-O 3.18Å; C189-K200 VanDerWaalsContact SG-CG 3.5Å
190	K	78.8	Confident	80.7	Confident	146 Å²	146	67.8 Å²	67.8	64%	0.635	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-63.7	136.7	173.1	-67	175.1	-171.9	158.8	0	109.2	E27 V192 Q197	E27-K190 IonicContact OE1-NZ 2.69Å; K190-V192 PolarHBondContact O-N 3.41Å; K190-Q197 PolarHBondContact O-OE1 2.76Å
191	T	69.8	Low	80.5	Confident	85 Å²	85	66.2 Å²	66.2	52%	0.521	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-69.3	121.6	167.9	-58.1	0	0	0	0	108.7	C189 G193 N195 T196	C189-T191 PolarHBondContact O-N 3.46Å; T191-G193 WeakPolarHBondContact CG2-O 3.46Å; T191-N195 WeakPolarHBondContact CG2-O 3.24Å; T191-T196 HydrophobicContact CG2-CG2 4.15Å
192	V	63.9	Low	80.3	Confident	97 Å²	97	66.2 Å²	66.2	59%	0.588	36%	0.36	S	S	*	.	B	Isolated β-bridge	trans	-107.8	106.9	172.7	-175.9	0	0	0	0	108.1	K190 N195	K190-V192 PolarHBondContact O-N 3.41Å; V192-N195 PolarHBondContact N-O 2.82Å; V192-N195 PolarHBondContact O-N 2.88Å
193	G	64.1	Low	80.1	Confident	68 Å²	68	70.2 Å²	70.2	70%	0.701	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	-131.2	-176.4	0	0	0	0	0	112.7	T191 N195	T191-G193 WeakPolarHBondContact CG2-O 3.46Å; G193-N195 VanDerWaalsContact C-N 3.32Å
194	Y	54.3	Low	80	Confident	235 Å²	235	70.4 Å²	70.4	92%	0.922	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-4.7	176.4	-65.4	-78.5	0	0	0	113.5	T196	Y194-T196 PolarHBondContact O-N 2.8Å
195	N	58.3	Low	80	Confident	123 Å²	123	72.1 Å²	72.1	66%	0.658	39%	0.386	S	S	*	.	B	Isolated β-bridge	trans	-92.6	103.3	-178	-65.3	-26	0	0	0	110	T191 V192 G193 Q197	T191-N195 WeakPolarHBondContact CG2-O 3.24Å; V192-N195 PolarHBondContact N-O 2.82Å; V192-N195 PolarHBondContact O-N 2.88Å; G193-N195 VanDerWaalsContact C-N 3.32Å; N195-Q197 PolarHBondContact O-N 2.77Å; N195-Q197 VanDerWaalsContact O-N 3.17Å
196	T	58.2	Low	80.1	Confident	110 Å²	110	72.3 Å²	72.3	68%	0.675	39%	0.387	S	S	*	.			trans	-70	104.2	165.5	52.2	0	0	0	0	108.4	T191 Y194 G198	T191-T196 HydrophobicContact CG2-CG2 4.15Å; Y194-T196 PolarHBondContact O-N 2.8Å; T196-G198 PolarHBondContact O-N 2.84Å
197	Q	65.1	Low	80.2	Confident	60 Å²	60	69.4 Å²	69.4	28%	0.28	38%	0.376	S	S	.	.			trans	-69.9	-9.9	175	-77.8	177.5	-11.6	0	0	112.4	C189 K190 N195	C189-Q197 HydrophobicContact CB-CB 3.35Å; K190-Q197 PolarHBondContact O-OE1 2.76Å; N195-Q197 PolarHBondContact O-N 2.77Å; N195-Q197 VanDerWaalsContact O-N 3.17Å
198	G	80.5	Confident	80.4	Confident	36 Å²	36	70.2 Å²	70.2	37%	0.371	39%	0.386	S	S	.	.			trans	71.5	-159.5	167.9	0	0	0	0	0	113.2	C189 T196	C189-G198 VanDerWaalsContact CB-O 3.31Å; C189-G198 WeakPolarHBondContact CB-O 3.31Å; C189-G198 PolarHBondContact N-O 3.18Å; T196-G198 PolarHBondContact O-N 2.84Å
199	V	85	Confident	80.7	Confident	69 Å²	69	68.5 Å²	68.5	42%	0.418	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127	174.1	-176.2	0	0	0	0	108	Q186 I187 Y188	Q186-V199 HydrophobicContact CB-CG1 3.82Å; Q186-V199 HydrophobicContact CG-CG1 4.2Å; I187-V199 CarbonylContact O-C 3.56Å; I187-V199 WeakPolarHBondContact O-CA 3.34Å; Y188-V199 HydrophobicContact CD1-CG2 3.6Å; Y188-V199 HydrophobicContact CE1-CG1 4.49Å; Y188-V199 HydrophobicContact CE1-CG2 3.62Å
200	K	88.4	Confident	81.2	Confident	27 Å²	27	68.3 Å²	68.3	12%	0.117	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	142.5	169.3	-56.3	-61.7	-175.2	-171.7	0	109	I29 N33 Q186 I187 C189	I29-K200 HydrophobicContact CD1-CB 4.33Å; I29-K200 HydrophobicContact CG1-CB 4.21Å; I29-K200 HydrophobicContact CG1-CG 4.23Å; N33-K200 PolarHBondContact OD1-NZ 2.79Å; Q186-K200 CarbonylContact C-O 3.39Å; Q186-K200 WeakPolarHBondContact CA-O 3.18Å; I187-K200 HydrophobicContact CB-CB 4.36Å; I187-K200 PolarHBondContact N-O 2.77Å; I187-K200 PolarHBondContact O-N 3.17Å; C189-K200 VanDerWaalsContact SG-CG 3.5Å
201	S	90.2	Very high	82	Confident	51 Å²	51	61.7 Å²	61.7	36%	0.357	35%	0.35	S	S	.	.			trans	-130.3	73.8	-177.5	-58.8	0	0	0	0	112	T185 K203	T185-S201 CarbonylContact O-C 3.6Å; T185-S201 WeakPolarHBondContact O-CA 3.38Å; S201-K203 PolarHBondContact O-N 2.82Å
202	P	91.9	Very high	83.2	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	34%	0.343	C	S	.	.			trans	-48.6	130.2	171	-24.5	32.1	0	0	0	110.6	I29 Y54 Y91 T184 T185 I187	I29-P202 HydrophobicContact CD1-CG 3.46Å; I29-P202 VanDerWaalsContact CD1-CG 3.46Å; Y54-P202 HydrophobicContact CD1-CB 3.92Å; Y54-P202 HydrophobicContact CD1-CG 3.59Å; Y54-P202 HydrophobicContact CE1-CG 4.04Å; Y54-P202 HydrophobicContact CG-CB 4.46Å; Y54-P202 HydrophobicContact CG-CG 4.29Å; Y91-P202 HydrophobicContact CE1-CB 4.44Å; T184-P202 WeakPolarHBondContact CA-O 3.46Å; T184-P202 WeakPolarHBondContact CB-O 3.31Å; T184-P202 PolarHBondContact OG1-O 2.97Å; T185-P202 HydrophobicContact CG2-CB 4.25Å; T185-P202 HydrophobicContact CG2-CG 3.99Å; T185-P202 PolarHBondContact N-O 3.01Å; T185-P202 WeakPolarHBondContact O-CD 3.5Å; I187-P202 HydrophobicContact CD1-CG 3.82Å
203	K	93.9	Very high	84.7	Confident	84 Å²	84	59.3 Å²	59.3	37%	0.365	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	122.3	179.2	-176.1	175.1	-173.3	-174.5	0	109.5	F114 S201 N205	F114-K203 HydrophobicContact CE1-CG 4.19Å; F114-K203 HydrophobicContact CZ-CD 4.29Å; F114-K203 HydrophobicContact CZ-CG 4.13Å; S201-K203 PolarHBondContact O-N 2.82Å; K203-N205 WeakPolarHBondContact CE-OD1 3.5Å
204	I	95.8	Very high	86.2	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	108.6	177.1	-53.6	171.4	0	0	0	107.5	H53 Y56 M58 G182 I183 Y219	H53-I204 HydrophobicContact CB-CD1 3.41Å; H53-I204 VanDerWaalsContact CB-CD1 3.41Å; H53-I204 HydrophobicContact CB-CG1 3.71Å; Y56-I204 HydrophobicContact CD2-CD1 4.43Å; Y56-I204 HydrophobicContact CG-CD1 4.42Å; M58-I204 HydrophobicContact SD-CG2 4.13Å; G182-I204 CarbonylContact C-O 3.59Å; G182-I204 WeakPolarHBondContact CA-O 3.36Å; I183-I204 HydrophobicContact CD1-CD1 4.07Å; I183-I204 HydrophobicContact CG1-CB 3.94Å; I183-I204 HydrophobicContact CG1-CD1 4.12Å; I183-I204 HydrophobicContact CG1-CG1 4.36Å; I183-I204 PolarHBondContact N-O 3.48Å; I183-I204 PolarHBondContact O-N 2.96Å; I204-Y219 HydrophobicContact CB-CE1 4.21Å; I204-Y219 HydrophobicContact CG2-CD1 4.34Å; I204-Y219 HydrophobicContact CG2-CE1 3.58Å
205	N	95.7	Very high	88.3	Confident	62 Å²	62	49.5 Å²	49.5	33%	0.332	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	138.8	175.3	-65.6	-66.7	0	0	0	110.4	F114 K203 P207	F114-N205 WeakPolarHBondContact CZ-OD1 3.2Å; K203-N205 WeakPolarHBondContact CE-OD1 3.5Å; N205-P207 WeakPolarHBondContact O-CD 3.46Å
206	V	96.7	Very high	90.2	Very high	6 Å²	6	44.5 Å²	44.5	4%	0.036	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-67.5	121.8	161.1	-174	0	0	0	0	107.9	I60 L165 F167 I181 A208 W210 I211 V217 Y219	I60-V206 HydrophobicContact CD1-CG1 4.36Å; L165-V206 HydrophobicContact CD1-CG2 4.48Å; F167-V206 HydrophobicContact CE2-CG1 4.12Å; F167-V206 HydrophobicContact CZ-CG1 4.24Å; F167-V206 HydrophobicContact CZ-CG2 4.35Å; I181-V206 HydrophobicContact CB-CG2 4.44Å; I181-V206 HydrophobicContact CG2-CG2 4.2Å; I181-V206 PolarHBondContact O-N 3.12Å; V206-A208 PolarHBondContact O-N 2.84Å; V206-W210 HydrophobicContact CG1-CB 4.23Å; V206-I211 HydrophobicContact CB-CD1 4.23Å; V206-I211 HydrophobicContact CB-CG1 4.08Å; V206-I211 HydrophobicContact CG1-CD1 4.35Å; V206-I211 HydrophobicContact CG1-CG1 3.67Å; V206-V217 HydrophobicContact CG1-CG2 3.85Å; V206-V217 HydrophobicContact CG2-CB 4.43Å; V206-V217 HydrophobicContact CG2-CG1 3.98Å; V206-V217 HydrophobicContact CG2-CG2 4.03Å; V206-Y219 WeakPolarHBondContact CG2-OH 3.2Å
207	P	94.4	Very high	92.1	Very high	31 Å²	31	39.3 Å²	39.3	20%	0.201	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-61.8	131.7	179.2	-19.6	29.7	0	0	0	110.3	N205 K209 W210	N205-P207 WeakPolarHBondContact O-CD 3.46Å; P207-K209 HydrophobicContact CB-CG 4.36Å; P207-K209 PolarHBondContact O-N 2.94Å; P207-W210 WeakPolarHBondContact O-CB 3.41Å; P207-W210 PolarHBondContact O-N 3.36Å
208	A	93.1	Very high	93.7	Very high	34 Å²	34	38.6 Å²	38.6	28%	0.281	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-23	-172.3	0	0	0	0	0	114.7	K176 V206 W210 I211	K176-A208 HydrophobicContact CB-CB 4.31Å; V206-A208 PolarHBondContact O-N 2.84Å; A208-W210 PolarHBondContact O-N 2.85Å; A208-I211 PolarHBondContact O-N 2.96Å
209	K	92.7	Very high	94.4	Very high	96 Å²	96	36.9 Å²	36.9	42%	0.417	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.1	174.6	71.1	180	-175.3	-178.9	0	113.6	Q44 P207 K212	Q44-K209 VanDerWaalsContact NE2-NZ 3.16Å; P207-K209 HydrophobicContact CB-CG 4.36Å; P207-K209 PolarHBondContact O-N 2.94Å; K209-K212 VanDerWaalsContact O-CE 3.26Å; K209-K212 WeakPolarHBondContact O-CE 3.46Å
210	W	95.1	Very high	94.8	Very high	9 Å²	9	34.4 Å²	34.4	3%	0.034	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-14.3	-178.5	-65.7	117.4	0	0	0	113.5	Q44 N45 Q49 I60 R62 V206 P207 A208 K212 T215	Q44-W210 HydrophobicContact CG-CZ2 4.01Å; N45-W210 VanDerWaalsContact O-CH2 3.24Å; N45-W210 WeakPolarHBondContact O-CH2 2.96Å; Q49-W210 HydrophobicContact CB-CH2 4.47Å; Q49-W210 HydrophobicContact CB-CZ2 3.73Å; I60-W210 HydrophobicContact CD1-CB 4.02Å; I60-W210 VanDerWaalsContact CD1-CD1 3.5Å; I60-W210 HydrophobicContact CD1-CD2 4.36Å; I60-W210 HydrophobicContact CD1-CG 3.74Å; I60-W210 HydrophobicContact CG2-CB 3.91Å; I60-W210 HydrophobicContact CG2-CD2 3.76Å; I60-W210 HydrophobicContact CG2-CE3 3.7Å; I60-W210 HydrophobicContact CG2-CG 3.86Å; I60-W210 HydrophobicContact CG2-CZ3 4.45Å; R62-W210 HydrophobicContact CG-CE3 3.79Å; R62-W210 HydrophobicContact CG-CZ3 3.69Å; V206-W210 HydrophobicContact CG1-CB 4.23Å; P207-W210 WeakPolarHBondContact O-CB 3.41Å; P207-W210 PolarHBondContact O-N 3.36Å; A208-W210 PolarHBondContact O-N 2.85Å; W210-K212 VanDerWaalsContact C-N 3.26Å; W210-K212 PolarHBondContact O-N 3.34Å; W210-T215 WeakPolarHBondContact O-CG2 3.31Å; W210-T215 PolarHBondContact O-OG1 3.08Å
211	I	94.9	Very high	94.9	Very high	8 Å²	8	34.3 Å²	34.3	4%	0.041	18%	0.179	C	C	.	.			trans	-78	83.7	178.5	-53.4	170.8	0	0	0	108.6	F167 I170 L179 I181 V206 A208	F167-I211 HydrophobicContact CD2-CB 4.42Å; F167-I211 HydrophobicContact CD2-CG2 4.07Å; F167-I211 HydrophobicContact CE2-CB 4.06Å; F167-I211 HydrophobicContact CE2-CG1 3.9Å; F167-I211 HydrophobicContact CE2-CG2 3.94Å; F167-I211 HydrophobicContact CZ-CG1 4.24Å; F167-I211 HydrophobicContact CZ-CG2 4.31Å; I170-I211 HydrophobicContact CD1-CG2 4.15Å; I170-I211 HydrophobicContact CG1-CG2 4.25Å; I170-I211 HydrophobicContact CG2-CG2 4.28Å; L179-I211 HydrophobicContact CD1-CD1 4.27Å; L179-I211 HydrophobicContact CD1-CG2 4.32Å; L179-I211 HydrophobicContact CD2-CB 3.79Å; L179-I211 HydrophobicContact CD2-CD1 3.7Å; L179-I211 HydrophobicContact CD2-CG1 4.34Å; L179-I211 HydrophobicContact CD2-CG2 3.78Å; L179-I211 HydrophobicContact CG-CD1 3.65Å; L179-I211 HydrophobicContact CG-CG2 4.4Å; I181-I211 HydrophobicContact CB-CD1 4.07Å; I181-I211 HydrophobicContact CD1-CD1 4.07Å; I181-I211 HydrophobicContact CD1-CG1 4.46Å; I181-I211 HydrophobicContact CD1-CG2 3.73Å; I181-I211 HydrophobicContact CG1-CD1 4.06Å; V206-I211 HydrophobicContact CB-CD1 4.23Å; V206-I211 HydrophobicContact CB-CG1 4.08Å; V206-I211 HydrophobicContact CG1-CD1 4.35Å; V206-I211 HydrophobicContact CG1-CG1 3.67Å; A208-I211 PolarHBondContact O-N 2.96Å
212	K	94.5	Very high	94.5	Very high	89 Å²	89	32.9 Å²	32.9	39%	0.387	17%	0.168	S	C	.	.	S	Bend	trans	-138.5	157.8	-179.4	-65.8	-179.8	178.4	175.3	0	108.7	F167 K209 W210 T215	F167-K212 VanDerWaalsContact CB-O 3.29Å; F167-K212 WeakPolarHBondContact CB-O 3.37Å; K209-K212 VanDerWaalsContact O-CE 3.26Å; K209-K212 WeakPolarHBondContact O-CE 3.46Å; W210-K212 VanDerWaalsContact C-N 3.26Å; W210-K212 PolarHBondContact O-N 3.34Å; K212-T215 VanDerWaalsContact O-CB 3.29Å; K212-T215 WeakPolarHBondContact O-CB 3.24Å; K212-T215 PolarHBondContact O-N 3.26Å; K212-T215 PolarHBondContact O-OG1 3.17Å
213	S	95.5	Very high	93.5	Very high	43 Å²	43	33.6 Å²	33.6	30%	0.301	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	151.5	171.8	-50	0	0	0	0	111.8	F167 I170 T215	F167-S213 CarbonylContact O-C 3.55Å; F167-S213 WeakPolarHBondContact O-CA 3.43Å; I170-S213 PolarHBondContact N-OG 3.05Å; I170-S213 PolarHBondContact O-OG 2.91Å; S213-T215 PolarHBondContact O-N 3.22Å; S213-T215 PolarHBondContact O-OG1 3.34Å
214	E	96.9	Very high	92.2	Very high	96 Å²	96	31.7 Å²	31.7	45%	0.449	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	31.3	-179.8	-52.2	172.8	170.1	0	0	113.4	R62 H63 Q64 F167	R62-E214 CarbonylContact C-O 3.52Å; H63-E214 WeakPolarHBondContact CA-O 3.07Å; H63-E214 PolarHBondContact N-O 3.36Å; H63-E214 IonicContact ND1-OE2 3.53Å; H63-E214 PolarHBondContact ND1-OE2 3.44Å; Q64-E214 PolarHBondContact N-O 3.46Å; F167-E214 PolarHBondContact O-N 3.47Å
215	T	97.8	Very high	90.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.1	177.3	-53	0	0	0	0	110.4	I60 R62 F167 W210 K212 S213	I60-T215 HydrophobicContact CG2-CG2 3.66Å; R62-T215 HydrophobicContact CG-CG2 4.29Å; F167-T215 HydrophobicContact CD2-CG2 4.34Å; F167-T215 PolarHBondContact N-O 2.92Å; W210-T215 WeakPolarHBondContact O-CG2 3.31Å; W210-T215 PolarHBondContact O-OG1 3.08Å; K212-T215 VanDerWaalsContact O-CB 3.29Å; K212-T215 WeakPolarHBondContact O-CB 3.24Å; K212-T215 PolarHBondContact O-N 3.26Å; K212-T215 PolarHBondContact O-OG1 3.17Å; S213-T215 PolarHBondContact O-N 3.22Å; S213-T215 PolarHBondContact O-OG1 3.34Å
216	L	98.3	Very high	89.9	Confident	19 Å²	19	33.5 Å²	33.5	10%	0.099	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.1	172.2	-177.3	64.3	0	0	0	109.3	I60 T61 Q64 P67 Y166 E218	I60-L216 CarbonylContact C-O 3.56Å; I60-L216 WeakPolarHBondContact CA-O 3.47Å; T61-L216 PolarHBondContact N-O 3.23Å; T61-L216 PolarHBondContact O-N 3.33Å; Q64-L216 HydrophobicContact CB-CB 4.07Å; Q64-L216 HydrophobicContact CG-CB 3.88Å; P67-L216 HydrophobicContact CG-CD1 4.48Å; Y166-L216 HydrophobicContact CD2-CB 4.35Å; Y166-L216 HydrophobicContact CD2-CD1 4.34Å; L216-E218 HydrophobicContact CD1-CG 4.49Å; L216-E218 HydrophobicContact CD2-CG 4.03Å; L216-E218 HydrophobicContact CG-CG 3.98Å
217	V	98.4	Very high	88.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.9	170.4	-177.9	0	0	0	0	107.9	M58 K59 I60 S164 L165 F167 V206 Y219	M58-V217 HydrophobicContact CG-CG1 3.81Å; M58-V217 HydrophobicContact SD-CG1 4.02Å; K59-V217 CarbonylContact O-C 3.41Å; K59-V217 WeakPolarHBondContact O-CA 3.32Å; I60-V217 HydrophobicContact CG1-CG1 4.26Å; I60-V217 HydrophobicContact CG1-CG2 4.21Å; I60-V217 HydrophobicContact CG2-CG2 4.41Å; S164-V217 CarbonylContact C-O 3.58Å; S164-V217 WeakPolarHBondContact CA-O 3.4Å; L165-V217 HydrophobicContact CB-CB 4.29Å; L165-V217 PolarHBondContact N-O 2.95Å; L165-V217 PolarHBondContact O-N 3.36Å; F167-V217 HydrophobicContact CE2-CG2 3.93Å; F167-V217 HydrophobicContact CZ-CG2 4Å; V206-V217 HydrophobicContact CG1-CG2 3.85Å; V206-V217 HydrophobicContact CG2-CB 4.43Å; V206-V217 HydrophobicContact CG2-CG1 3.98Å; V206-V217 HydrophobicContact CG2-CG2 4.03Å; V217-Y219 HydrophobicContact CG1-CE1 4.32Å; V217-Y219 HydrophobicContact CG1-CE2 3.94Å
218	E	97.8	Very high	88.1	Confident	45 Å²	45	40.7 Å²	40.7	21%	0.21	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123	178.8	-67.1	154.7	84.6	0	0	109.4	M58 K59 L216	M58-E218 CarbonylContact C-O 3.57Å; M58-E218 VanDerWaalsContact CA-O 3.3Å; M58-E218 WeakPolarHBondContact CA-O 3.01Å; K59-E218 HydrophobicContact CB-CB 4.3Å; K59-E218 WeakPolarHBondContact CE-OE2 3.36Å; K59-E218 PolarHBondContact N-O 2.92Å; K59-E218 IonicContact NZ-OE1 2.83Å; K59-E218 PolarHBondContact NZ-OE1 3.11Å; K59-E218 IonicContact NZ-OE2 2.78Å; K59-E218 PolarHBondContact NZ-OE2 3.32Å; K59-E218 PolarHBondContact O-N 2.85Å; L216-E218 HydrophobicContact CD1-CG 4.49Å; L216-E218 HydrophobicContact CD2-CG 4.03Å; L216-E218 HydrophobicContact CG-CG 3.98Å
219	Y	96.5	Very high	87.5	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	107.2	168.1	-59.4	-73.1	0	0	0	108.6	S57 M58 N162 I163 L165 I183 I204 V206 V217	S57-Y219 WeakPolarHBondContact O-CA 3.28Å; M58-Y219 HydrophobicContact CB-CD1 4.05Å; M58-Y219 HydrophobicContact CB-CE1 4.03Å; M58-Y219 HydrophobicContact CG-CD1 4.08Å; M58-Y219 HydrophobicContact CG-CE1 3.71Å; M58-Y219 HydrophobicContact SD-CE1 3.7Å; N162-Y219 WeakPolarHBondContact CA-O 3.37Å; I163-Y219 HydrophobicContact CB-CD2 4.25Å; I163-Y219 HydrophobicContact CG2-CD2 4.22Å; I163-Y219 PolarHBondContact N-O 2.93Å; I163-Y219 PolarHBondContact O-N 3.04Å; L165-Y219 HydrophobicContact CD1-CE2 3.9Å; L165-Y219 HydrophobicContact CG-CE2 4.37Å; I183-Y219 HydrophobicContact CD1-CD1 3.8Å; I183-Y219 HydrophobicContact CD1-CD2 4.22Å; I183-Y219 HydrophobicContact CD1-CE1 4.25Å; I183-Y219 HydrophobicContact CD1-CG 3.77Å; I183-Y219 HydrophobicContact CG1-CD1 4.2Å; I183-Y219 HydrophobicContact CG1-CE1 4.14Å; I183-Y219 HydrophobicContact CG1-CE2 4.48Å; I183-Y219 HydrophobicContact CG1-CG 4.41Å; I183-Y219 HydrophobicContact CG2-CD2 4.04Å; I183-Y219 HydrophobicContact CG2-CE2 3.88Å; I204-Y219 HydrophobicContact CB-CE1 4.21Å; I204-Y219 HydrophobicContact CG2-CD1 4.34Å; I204-Y219 HydrophobicContact CG2-CE1 3.58Å; V206-Y219 WeakPolarHBondContact CG2-OH 3.2Å; V217-Y219 HydrophobicContact CG1-CE1 4.32Å; V217-Y219 HydrophobicContact CG1-CE2 3.94Å
220	E	93	Very high	87.1	Confident	17 Å²	17	42.1 Å²	42.1	8%	0.079	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.7	173.9	-171.7	-171.6	146.5	0	0	109.2	Y56 S57 N162 I222 N258 T262 K266	Y56-E220 CarbonylContact C-O 3.42Å; Y56-E220 VanDerWaalsContact CA-O 3.31Å; Y56-E220 WeakPolarHBondContact CA-O 3.43Å; S57-E220 PolarHBondContact N-O 2.72Å; S57-E220 PolarHBondContact O-N 3.17Å; N162-E220 WeakPolarHBondContact OD1-CA 3.32Å; E220-I222 PolarHBondContact O-N 2.78Å; E220-N258 PolarHBondContact OE1-N 3.3Å; E220-T262 PolarHBondContact OE1-OG1 3.32Å; E220-T262 PolarHBondContact OE2-OG1 3Å; E220-T262 VanDerWaalsContact OE2-OG1 3.11Å; E220-K266 IonicContact OE1-NZ 2.7Å; E220-K266 PolarHBondContact OE1-NZ 3.15Å; E220-K266 WeakPolarHBondContact OE2-CE 2.97Å; E220-K266 IonicContact OE2-NZ 2.97Å; E220-K266 PolarHBondContact OE2-NZ 3.01Å
221	V	89.6	Confident	86.6	Confident	24 Å²	24	45 Å²	45	15%	0.145	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	126.4	174.2	-178.4	0	0	0	0	108.4	Y56 N162 N258	Y56-V221 HydrophobicContact CD1-CG2 4.24Å; Y56-V221 HydrophobicContact CE1-CB 4.37Å; Y56-V221 HydrophobicContact CE1-CG2 3.52Å; N162-V221 PolarHBondContact OD1-N 2.86Å; N162-V221 VanDerWaalsContact OD1-N 3.13Å; V221-N258 PolarHBondContact O-ND2 2.88Å
222	I	82.9	Confident	86.2	Confident	22 Å²	22	47.4 Å²	47.4	11%	0.113	26%	0.259	C	S	.	.			trans	-104.3	122.7	171.7	54.7	173.5	0	0	0	109.1	N55 E220	N55-I222 WeakPolarHBondContact O-CG1 3.41Å; N55-I222 PolarHBondContact O-N 2.87Å; E220-I222 PolarHBondContact O-N 2.78Å
223	G	70.6	Confident	85.9	Confident	16 Å²	16	50 Å²	50	17%	0.165	27%	0.27	C	S	.	.			trans	-64.5	143.6	169.4	0	0	0	0	0	111	A256	G223-A256 VanDerWaalsContact O-CB 3.32Å; G223-A256 WeakPolarHBondContact O-CB 3.39Å
224	T	65.4	Low	85.6	Confident	43 Å²	43	49.4 Å²	49.4	26%	0.264	27%	0.266	S	S	.	.	S	Bend	trans	-83.1	-12.8	175.7	53.6	0	0	0	0	113.2	K25 C226 S227	K25-T224 HydrophobicContact CG-CG2 4.47Å; T224-C226 PolarHBondContact O-N 2.84Å; T224-C226 VanDerWaalsContact O-N 3.14Å; T224-S227 VanDerWaalsContact O-CB 3.28Å; T224-S227 WeakPolarHBondContact O-CB 3.46Å; T224-S227 PolarHBondContact O-N 3.48Å
225	M	68.2	Low	85.1	Confident	104 Å²	104	44.8 Å²	44.8	51%	0.512	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-55	-37.1	-178.4	-73.7	-156	78.7	0	0	112.5	S227 Q228 M243	M225-S227 VanDerWaalsContact C-N 3.34Å; M225-S227 PolarHBondContact O-N 3.01Å; M225-Q228 VanDerWaalsContact O-CG 3.24Å; M225-Q228 WeakPolarHBondContact O-CG 3.45Å; M225-M243 HydrophobicContact CB-CE 3.76Å; M225-M243 HydrophobicContact CB-SD 4.26Å
226	C	76.7	Confident	84.4	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-70.2	-30.4	177.6	-61.3	0	0	0	0	113	T224 Q228 Y229 M243 C245 C254 A256	T224-C226 PolarHBondContact O-N 2.84Å; T224-C226 VanDerWaalsContact O-N 3.14Å; C226-Q228 PolarHBondContact O-N 3.36Å; C226-Q228 VanDerWaalsContact O-N 3.09Å; C226-Y229 WeakPolarHBondContact O-CD2 3.31Å; C226-Y229 PolarHBondContact O-N 3.24Å; C226-M243 VanDerWaalsContact SG-CE 3.53Å; C226-M243 VanDerWaalsContact SG-SD 3.64Å; C226-C245 WeakPolarHBondContact CA-SG 3.46Å; C226-C245 HydrophobicContact CB-CB 3.86Å; C226-C245 WeakPolarHBondContact CB-SG 3.5Å; C226-C245 WeakPolarHBondContact SG-CA 3.36Å; C226-C245 WeakPolarHBondContact SG-CB 3.33Å; C226-C245 CovalentContact SG-SG 2.03Å; C226-C245 PolarHBondContact SG-SG 3.06Å; C226-C254 HydrophobicContact CB-CB 4.49Å; C226-C254 WeakPolarHBondContact O-CB 3.2Å; C226-C254 PolarHBondContact O-SG 2.8Å; C226-A256 HydrophobicContact CB-CB 4.27Å; C226-A256 VanDerWaalsContact SG-CA 3.55Å
227	S	75.4	Confident	83.6	Confident	68 Å²	68	55.9 Å²	55.9	48%	0.476	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-63.8	-18.9	-174.1	-59.1	0	0	0	0	113.7	T224 M225 Y229	T224-S227 VanDerWaalsContact O-CB 3.28Å; T224-S227 WeakPolarHBondContact O-CB 3.46Å; T224-S227 PolarHBondContact O-N 3.48Å; M225-S227 VanDerWaalsContact C-N 3.34Å; M225-S227 PolarHBondContact O-N 3.01Å; S227-Y229 VanDerWaalsContact C-N 3.26Å; S227-Y229 PolarHBondContact O-N 3.47Å
228	Q	76.5	Confident	82.5	Confident	121 Å²	121	59 Å²	59	57%	0.565	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-70.9	-22.2	176.3	78.3	-166.8	-2.1	0	0	112.9	M225 C226 T230	M225-Q228 VanDerWaalsContact O-CG 3.24Å; M225-Q228 WeakPolarHBondContact O-CG 3.45Å; C226-Q228 PolarHBondContact O-N 3.36Å; C226-Q228 VanDerWaalsContact O-N 3.09Å; Q228-T230 PolarHBondContact O-N 3.02Å
229	Y	81.6	Confident	81.3	Confident	42 Å²	42	63.8 Å²	63.8	17%	0.165	33%	0.331	C	S	.	.			trans	-85.4	114.1	-178.9	-58.4	-63.7	0	0	0	110.6	C226 S227 E238 C254	C226-Y229 WeakPolarHBondContact O-CD2 3.31Å; C226-Y229 PolarHBondContact O-N 3.24Å; S227-Y229 VanDerWaalsContact C-N 3.26Å; S227-Y229 PolarHBondContact O-N 3.47Å; Y229-E238 HydrophobicContact CD2-CB 4.36Å; Y229-E238 HydrophobicContact CE2-CB 3.59Å; Y229-E238 HydrophobicContact CE2-CG 3.69Å; Y229-E238 WeakPolarHBondContact OH-CG 3.44Å; Y229-E238 PolarHBondContact OH-OE2 2.69Å; Y229-C254 VanDerWaalsContact O-CB 3.28Å; Y229-C254 WeakPolarHBondContact O-CB 3.29Å
230	T	83	Confident	80.1	Confident	118 Å²	118	66.3 Å²	66.3	72%	0.724	35%	0.346	S	S	*	.			trans	-95.9	-1.7	-177.1	56	0	0	0	0	113.7	Q228 W247	Q228-T230 PolarHBondContact O-N 3.02Å; T230-W247 VanDerWaalsContact O-CH2 3.29Å; T230-W247 WeakPolarHBondContact O-CH2 3.34Å
231	T	85.6	Confident	79	Confident	69 Å²	69	70.1 Å²	70.1	42%	0.423	38%	0.375	S	S	.	.	S	Bend	trans	-123.2	147.8	178.7	76.6	0	0	0	0	111.2	K233 S234 C235	T231-K233 VanDerWaalsContact C-N 3.25Å; T231-K233 PolarHBondContact O-N 2.87Å; T231-S234 PolarHBondContact O-N 3.48Å; T231-S234 PolarHBondContact O-OG 2.91Å; T231-S234 VanDerWaalsContact O-OG 3.1Å; T231-S234 WeakPolarHBondContact OG1-CB 3.16Å; T231-S234 PolarHBondContact OG1-N 3.37Å; T231-S234 PolarHBondContact OG1-OG 2.69Å; T231-C235 VanDerWaalsContact O-CB 3.24Å; T231-C235 WeakPolarHBondContact O-CB 3.48Å; T231-C235 PolarHBondContact O-N 3.06Å
232	T	87.2	Confident	78	Confident	58 Å²	58	74.9 Å²	74.9	36%	0.356	40%	0.399	S	S	.	.	H	α-helix	trans	-52.8	-45.1	175.6	-49.5	0	0	0	0	111.7	C235 Q236 W247	T232-C235 WeakPolarHBondContact O-CB 3.36Å; T232-C235 PolarHBondContact O-N 3.06Å; T232-Q236 HydrophobicContact CG2-CG 4.47Å; T232-Q236 WeakPolarHBondContact O-CB 3.37Å; T232-Q236 VanDerWaalsContact O-CG 3.3Å; T232-Q236 WeakPolarHBondContact O-CG 3.39Å; T232-Q236 PolarHBondContact O-N 2.77Å; T232-W247 HydrophobicContact CG2-CB 3.88Å; T232-W247 HydrophobicContact CG2-CD2 4.4Å; T232-W247 HydrophobicContact CG2-CG 3.73Å; T232-W247 VanDerWaalsContact OG1-CE2 3.25Å; T232-W247 PolarHBondContact OG1-NE1 3.38Å; T232-W247 VanDerWaalsContact OG1-NE1 3.15Å
233	K	87.6	Confident	77.7	Confident	143 Å²	143	74.6 Å²	74.6	62%	0.622	40%	0.398	S	S	*	.	H	α-helix	trans	-63.2	-54	-178	-176.6	175.8	176.4	-179.6	0	111.9	T231 C235 Q236 E237	T231-K233 VanDerWaalsContact C-N 3.25Å; T231-K233 PolarHBondContact O-N 2.87Å; K233-C235 PolarHBondContact O-N 3.09Å; K233-Q236 PolarHBondContact O-N 2.79Å; K233-E237 WeakPolarHBondContact CE-OE1 3.29Å; K233-E237 HydrophobicContact CG-CG 4.5Å; K233-E237 WeakPolarHBondContact CG-OE1 3.4Å; K233-E237 IonicContact NZ-OE1 3.99Å; K233-E237 VanDerWaalsContact O-CG 3.31Å; K233-E237 WeakPolarHBondContact O-CG 3.46Å; K233-E237 PolarHBondContact O-N 2.75Å
234	S	87.8	Confident	78.3	Confident	31 Å²	31	75.7 Å²	75.7	22%	0.217	40%	0.401	C	S	.	.	H	α-helix	trans	-63.8	-32.1	-179.8	63.3	0	0	0	0	112.3	T231	T231-S234 PolarHBondContact O-N 3.48Å; T231-S234 PolarHBondContact O-OG 2.91Å; T231-S234 VanDerWaalsContact O-OG 3.1Å; T231-S234 WeakPolarHBondContact OG1-CB 3.16Å; T231-S234 PolarHBondContact OG1-N 3.37Å; T231-S234 PolarHBondContact OG1-OG 2.69Å
235	C	86.4	Confident	79.2	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-66	-47.3	175.5	-179.7	0	0	0	0	112	T231 T232 K233 C245 I246 W247 C254	T231-C235 VanDerWaalsContact O-CB 3.24Å; T231-C235 WeakPolarHBondContact O-CB 3.48Å; T231-C235 PolarHBondContact O-N 3.06Å; T232-C235 WeakPolarHBondContact O-CB 3.36Å; T232-C235 PolarHBondContact O-N 3.06Å; K233-C235 PolarHBondContact O-N 3.09Å; C235-C245 WeakPolarHBondContact O-CB 3.48Å; C235-I246 PolarHBondContact SG-O 3.26Å; C235-W247 HydrophobicContact CB-CB 4.38Å; C235-W247 HydrophobicContact CB-CE3 3.9Å; C235-W247 PolarHBondContact SG-N 3.28Å; C235-C254 WeakPolarHBondContact CA-SG 3.35Å; C235-C254 HydrophobicContact CB-CB 3.59Å; C235-C254 WeakPolarHBondContact CB-SG 3.26Å; C235-C254 VanDerWaalsContact SG-CA 3.5Å; C235-C254 WeakPolarHBondContact SG-CB 3.44Å; C235-C254 CovalentContact SG-SG 2.01Å; C235-C254 PolarHBondContact SG-SG 2.81Å
236	Q	84	Confident	80	Confident	117 Å²	117	69.4 Å²	69.4	55%	0.547	37%	0.369	S	S	.	.	H	α-helix	trans	-76.3	-23.1	-175.2	-71.6	175.1	-28.5	0	0	113.4	T232 K233 E238	T232-Q236 HydrophobicContact CG2-CG 4.47Å; T232-Q236 WeakPolarHBondContact O-CB 3.37Å; T232-Q236 VanDerWaalsContact O-CG 3.3Å; T232-Q236 WeakPolarHBondContact O-CG 3.39Å; T232-Q236 PolarHBondContact O-N 2.77Å; K233-Q236 PolarHBondContact O-N 2.79Å; Q236-E238 VanDerWaalsContact C-N 3.32Å
237	E	82.4	Confident	80.5	Confident	135 Å²	135	70.1 Å²	70.1	63%	0.631	37%	0.371	S	S	*	.	H	α-helix	trans	-73.2	-23.4	177.3	-75.2	173.7	175.5	0	0	112.7	K233	K233-E237 WeakPolarHBondContact CE-OE1 3.29Å; K233-E237 HydrophobicContact CG-CG 4.5Å; K233-E237 WeakPolarHBondContact CG-OE1 3.4Å; K233-E237 IonicContact NZ-OE1 3.99Å; K233-E237 VanDerWaalsContact O-CG 3.31Å; K233-E237 WeakPolarHBondContact O-CG 3.46Å; K233-E237 PolarHBondContact O-N 2.75Å
238	E	74.7	Confident	81	Confident	65 Å²	65	66.9 Å²	66.9	30%	0.304	35%	0.349	S	S	.	.			trans	-87.7	116.5	-178.2	-165.9	68.9	-136	0	0	112.2	Y229 Q236 C245	Y229-E238 HydrophobicContact CD2-CB 4.36Å; Y229-E238 HydrophobicContact CE2-CB 3.59Å; Y229-E238 HydrophobicContact CE2-CG 3.69Å; Y229-E238 WeakPolarHBondContact OH-CG 3.44Å; Y229-E238 PolarHBondContact OH-OE2 2.69Å; Q236-E238 VanDerWaalsContact C-N 3.32Å; E238-C245 PolarHBondContact O-N 3.29Å
239	K	72	Confident	81.5	Confident	145 Å²	145	64.2 Å²	64.2	63%	0.63	34%	0.338	S	S	*	.	B	Isolated β-bridge	trans	-142.5	124.3	174.4	-176.3	176.5	-178.5	-179.7	0	109.8
240	T	71.6	Confident	81.7	Confident	55 Å²	55	66.4 Å²	66.4	34%	0.337	35%	0.349	S	S	.	.			trans	-101.2	175.7	167.8	69	0	0	0	0	109.7	D242 M243	T240-D242 PolarHBondContact O-N 2.83Å; T240-M243 PolarHBondContact N-O 3.12Å; T240-M243 WeakPolarHBondContact OG1-CB 3.31Å; T240-M243 PolarHBondContact OG1-N 2.79Å; T240-M243 VanDerWaalsContact OG1-N 3.12Å; T240-M243 PolarHBondContact OG1-O 2.97Å
241	S	70.1	Confident	81.6	Confident	96 Å²	96	61.7 Å²	61.7	67%	0.671	32%	0.321	S	S	*	.	S	Bend	trans	-60	-31.5	175.7	54.9	0	0	0	0	112.5
242	D	69.1	Low	81.6	Confident	124 Å²	124	64.1 Å²	64.1	66%	0.663	33%	0.332	S	S	*	.	S	Bend	trans	-112.7	-8.4	-166.7	-51.6	-17.3	0	0	0	112.5	T240	T240-D242 PolarHBondContact O-N 2.83Å
243	M	76.3	Confident	81.4	Confident	16 Å²	16	65.7 Å²	65.7	8%	0.079	33%	0.334	C	S	.	.			trans	-144.4	134.7	-176.1	-174.2	-169	69.4	0	0	111	M225 C226 T240 A256 S257 N258	M225-M243 HydrophobicContact CB-CE 3.76Å; M225-M243 HydrophobicContact CB-SD 4.26Å; C226-M243 VanDerWaalsContact SG-CE 3.53Å; C226-M243 VanDerWaalsContact SG-SD 3.64Å; T240-M243 PolarHBondContact N-O 3.12Å; T240-M243 WeakPolarHBondContact OG1-CB 3.31Å; T240-M243 PolarHBondContact OG1-N 2.79Å; T240-M243 VanDerWaalsContact OG1-N 3.12Å; T240-M243 PolarHBondContact OG1-O 2.97Å; M243-A256 HydrophobicContact CG-CB 3.94Å; M243-A256 HydrophobicContact SD-CB 3.65Å; M243-S257 WeakPolarHBondContact CA-O 3.4Å; M243-N258 WeakPolarHBondContact CG-OD1 3.5Å
244	T	82.3	Confident	81.3	Confident	40 Å²	40	59 Å²	59	25%	0.245	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.1	166.9	-57.7	0	0	0	0	109.3	S257	T244-S257 PolarHBondContact N-O 2.79Å; T244-S257 PolarHBondContact O-N 3.01Å
245	C	84.4	Confident	81.1	Confident	5 Å²	5	58 Å²	58	3%	0.034	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	133.2	173	-67.8	0	0	0	0	110.6	C226 C235 E238 I255	C226-C245 WeakPolarHBondContact CA-SG 3.46Å; C226-C245 HydrophobicContact CB-CB 3.86Å; C226-C245 WeakPolarHBondContact CB-SG 3.5Å; C226-C245 WeakPolarHBondContact SG-CA 3.36Å; C226-C245 WeakPolarHBondContact SG-CB 3.33Å; C226-C245 CovalentContact SG-SG 2.03Å; C226-C245 PolarHBondContact SG-SG 3.06Å; C235-C245 WeakPolarHBondContact O-CB 3.48Å; E238-C245 PolarHBondContact O-N 3.29Å; C245-I255 WeakPolarHBondContact CA-O 3.41Å
246	I	85.2	Confident	80.9	Confident	10 Å²	10	58 Å²	58	5%	0.051	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.6	-178.6	-60.8	163.9	0	0	0	108	C235 C248 I255 K266 V267	C235-I246 PolarHBondContact SG-O 3.26Å; I246-C248 PolarHBondContact O-N 2.89Å; I246-I255 HydrophobicContact CB-CG1 4.04Å; I246-I255 PolarHBondContact N-O 3.28Å; I246-I255 WeakPolarHBondContact O-CG1 3.21Å; I246-I255 PolarHBondContact O-N 3.14Å; I246-K266 HydrophobicContact CD1-CB 3.81Å; I246-K266 HydrophobicContact CD1-CD 4.45Å; I246-V267 HydrophobicContact CD1-CG2 4Å; I246-V267 HydrophobicContact CG1-CG2 4.11Å; I246-V267 HydrophobicContact CG2-CG2 3.76Å
247	W	87.8	Confident	80.6	Confident	15 Å²	15	52.6 Å²	52.6	6%	0.057	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	126	171.8	-176.7	-101.4	0	0	0	109.8	T230 T232 C235 D249 N252 C254	T230-W247 VanDerWaalsContact O-CH2 3.29Å; T230-W247 WeakPolarHBondContact O-CH2 3.34Å; T232-W247 HydrophobicContact CG2-CB 3.88Å; T232-W247 HydrophobicContact CG2-CD2 4.4Å; T232-W247 HydrophobicContact CG2-CG 3.73Å; T232-W247 VanDerWaalsContact OG1-CE2 3.25Å; T232-W247 PolarHBondContact OG1-NE1 3.38Å; T232-W247 VanDerWaalsContact OG1-NE1 3.15Å; C235-W247 HydrophobicContact CB-CB 4.38Å; C235-W247 HydrophobicContact CB-CE3 3.9Å; C235-W247 PolarHBondContact SG-N 3.28Å; W247-D249 PolarHBondContact NE1-OD1 3.13Å; W247-D249 VanDerWaalsContact NE1-OD1 3.15Å; W247-N252 WeakPolarHBondContact CZ2-OD1 3.48Å; W247-C254 HydrophobicContact CE3-CB 4.11Å; W247-C254 HydrophobicContact CZ3-CB 4.37Å
248	C	86.3	Confident	80	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	98.4	-179.1	-160.3	0	0	0	0	111.4	I246 K250 A251 N252 K253 I255 C270	I246-C248 PolarHBondContact O-N 2.89Å; C248-K250 VanDerWaalsContact C-N 3.33Å; C248-K250 PolarHBondContact O-N 3.31Å; C248-A251 HydrophobicContact CB-CB 4.06Å; C248-A251 CarbonylContact O-C 3.49Å; C248-A251 PolarHBondContact O-N 2.87Å; C248-A251 VanDerWaalsContact O-N 3.09Å; C248-N252 WeakPolarHBondContact O-CA 3.35Å; C248-N252 PolarHBondContact O-N 3.33Å; C248-K253 WeakPolarHBondContact CA-O 3.32Å; C248-K253 VanDerWaalsContact CB-O 3.29Å; C248-K253 WeakPolarHBondContact CB-O 3.42Å; C248-K253 PolarHBondContact N-O 3.03Å; C248-K253 PolarHBondContact O-N 3.46Å; C248-I255 HydrophobicContact CB-CD1 4.39Å; C248-I255 HydrophobicContact CB-CG1 4.42Å; C248-I255 HydrophobicContact CB-CG2 4.33Å; C248-C270 HydrophobicContact CB-CB 3.73Å; C248-C270 WeakPolarHBondContact CB-SG 3.23Å; C248-C270 WeakPolarHBondContact SG-CA 3.31Å; C248-C270 WeakPolarHBondContact SG-CB 3.18Å; C248-C270 CovalentContact SG-SG 2.04Å; C248-C270 PolarHBondContact SG-SG 2.87Å
249	D	86.6	Confident	79.7	Confident	64 Å²	64	48.7 Å²	48.7	34%	0.342	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-57.9	-45.9	-176.9	-62.2	-47.4	0	0	0	111.6	W247 A251 N252 C270 H271 V272	W247-D249 PolarHBondContact NE1-OD1 3.13Å; W247-D249 VanDerWaalsContact NE1-OD1 3.15Å; D249-A251 PolarHBondContact O-N 2.95Å; D249-N252 PolarHBondContact O-N 3.02Å; D249-N252 VanDerWaalsContact O-N 3.11Å; D249-C270 PolarHBondContact N-O 2.85Å; D249-H271 IonicContact OD2-CE1 3.66Å; D249-H271 IonicContact OD2-CG 3.79Å; D249-H271 IonicContact OD2-ND1 2.78Å; D249-H271 PolarHBondContact OD2-ND1 3.22Å; D249-V272 HydrophobicContact CB-CG2 4.07Å
250	K	84.6	Confident	79.3	Confident	89 Å²	89	48.5 Å²	48.5	39%	0.387	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-62.3	-27	178.6	-69.2	-179.3	-167.3	150	0	114	I42 C248 D269 C270 H271 V272	I42-K250 HydrophobicContact CG2-CB 3.97Å; I42-K250 HydrophobicContact CG2-CD 4.14Å; I42-K250 VanDerWaalsContact O-CD 3.25Å; I42-K250 WeakPolarHBondContact O-CD 3.37Å; C248-K250 VanDerWaalsContact C-N 3.33Å; C248-K250 PolarHBondContact O-N 3.31Å; K250-D269 WeakPolarHBondContact CD-O 3.45Å; K250-D269 PolarHBondContact NZ-O 3.47Å; K250-C270 PolarHBondContact N-O 2.91Å; K250-C270 VanDerWaalsContact N-O 3.11Å; K250-H271 WeakPolarHBondContact CE-O 3.28Å; K250-H271 PolarHBondContact NZ-O 2.83Å; K250-H271 VanDerWaalsContact NZ-O 3.13Å; K250-V272 HydrophobicContact CG-CG2 4.08Å
251	A	82.4	Confident	78.8	Confident	18 Å²	18	50 Å²	50	15%	0.149	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-99.3	-10.5	175.3	0	0	0	0	0	114	I42 L52 C248 D249 K253	I42-A251 HydrophobicContact CD1-CB 3.59Å; L52-A251 HydrophobicContact CD1-CB 4.26Å; C248-A251 HydrophobicContact CB-CB 4.06Å; C248-A251 CarbonylContact O-C 3.49Å; C248-A251 PolarHBondContact O-N 2.87Å; C248-A251 VanDerWaalsContact O-N 3.09Å; D249-A251 PolarHBondContact O-N 2.95Å; A251-K253 HydrophobicContact CB-CB 4.45Å; A251-K253 WeakPolarHBondContact O-CG 3.46Å; A251-K253 PolarHBondContact O-N 3.48Å
252	N	84.7	Confident	78.6	Confident	120 Å²	120	46.6 Å²	46.6	64%	0.642	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	42.9	-168.4	-166.3	37.1	0	0	0	113.3	W247 C248 D249	W247-N252 WeakPolarHBondContact CZ2-OD1 3.48Å; C248-N252 WeakPolarHBondContact O-CA 3.35Å; C248-N252 PolarHBondContact O-N 3.33Å; D249-N252 PolarHBondContact O-N 3.02Å; D249-N252 VanDerWaalsContact O-N 3.11Å
253	K	84.1	Confident	78.5	Confident	92 Å²	92	41.9 Å²	41.9	40%	0.4	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	152.4	-175.6	-69.2	-175.4	-174	-165.2	0	112.1	R38 C248 A251	R38-K253 VanDerWaalsContact NH2-NZ 3.14Å; C248-K253 WeakPolarHBondContact CA-O 3.32Å; C248-K253 VanDerWaalsContact CB-O 3.29Å; C248-K253 WeakPolarHBondContact CB-O 3.42Å; C248-K253 PolarHBondContact N-O 3.03Å; C248-K253 PolarHBondContact O-N 3.46Å; A251-K253 HydrophobicContact CB-CB 4.45Å; A251-K253 WeakPolarHBondContact O-CG 3.46Å; A251-K253 PolarHBondContact O-N 3.48Å
254	C	84.6	Confident	78.4	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.02	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	129.9	170.5	-169.4	0	0	0	0	110.9	C226 Y229 C235 W247	C226-C254 HydrophobicContact CB-CB 4.49Å; C226-C254 WeakPolarHBondContact O-CB 3.2Å; C226-C254 PolarHBondContact O-SG 2.8Å; Y229-C254 VanDerWaalsContact O-CB 3.28Å; Y229-C254 WeakPolarHBondContact O-CB 3.29Å; C235-C254 WeakPolarHBondContact CA-SG 3.35Å; C235-C254 HydrophobicContact CB-CB 3.59Å; C235-C254 WeakPolarHBondContact CB-SG 3.26Å; C235-C254 VanDerWaalsContact SG-CA 3.5Å; C235-C254 WeakPolarHBondContact SG-CB 3.44Å; C235-C254 CovalentContact SG-SG 2.01Å; C235-C254 PolarHBondContact SG-SG 2.81Å; W247-C254 HydrophobicContact CE3-CB 4.11Å; W247-C254 HydrophobicContact CZ3-CB 4.37Å
255	I	83.3	Confident	78	Confident	9 Å²	9	49.3 Å²	49.3	5%	0.046	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	149.3	-179	64.2	169	0	0	0	111.1	L52 C245 I246 C248 C270	L52-I255 HydrophobicContact CD1-CG2 3.56Å; L52-I255 HydrophobicContact CD2-CG2 4.21Å; C245-I255 WeakPolarHBondContact CA-O 3.41Å; I246-I255 HydrophobicContact CB-CG1 4.04Å; I246-I255 PolarHBondContact N-O 3.28Å; I246-I255 WeakPolarHBondContact O-CG1 3.21Å; I246-I255 PolarHBondContact O-N 3.14Å; C248-I255 HydrophobicContact CB-CD1 4.39Å; C248-I255 HydrophobicContact CB-CG1 4.42Å; C248-I255 HydrophobicContact CB-CG2 4.33Å; I255-C270 VanDerWaalsContact CD1-SG 3.55Å
256	A	82.3	Confident	77.6	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	141.8	173.1	0	0	0	0	0	111.8	G223 C226 M243 K266	G223-A256 VanDerWaalsContact O-CB 3.32Å; G223-A256 WeakPolarHBondContact O-CB 3.39Å; C226-A256 HydrophobicContact CB-CB 4.27Å; C226-A256 VanDerWaalsContact SG-CA 3.55Å; M243-A256 HydrophobicContact CG-CB 3.94Å; M243-A256 HydrophobicContact SD-CB 3.65Å; A256-K266 PolarHBondContact O-NZ 3.2Å
257	S	78.8	Confident	77.3	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	115.8	163.1	175.6	0	0	0	0	107.9	M243 T244 D259 S263	M243-S257 WeakPolarHBondContact CA-O 3.4Å; T244-S257 PolarHBondContact N-O 2.79Å; T244-S257 PolarHBondContact O-N 3.01Å; S257-D259 PolarHBondContact OG-O 2.85Å; S257-D259 VanDerWaalsContact OG-O 3.07Å; S257-S263 VanDerWaalsContact OG-CA 3.3Å; S257-S263 WeakPolarHBondContact OG-CA 3.29Å; S257-S263 WeakPolarHBondContact OG-CB 3.49Å; S257-S263 PolarHBondContact OG-N 2.91Å
258	N	69.2	Low	76.9	Confident	64 Å²	64	55.7 Å²	55.7	34%	0.342	30%	0.295	S	S	.	.			trans	-94.8	-5.6	-178.3	-65.7	-10.5	0	0	0	111.7	E220 V221 M243	E220-N258 PolarHBondContact OE1-N 3.3Å; V221-N258 PolarHBondContact O-ND2 2.88Å; M243-N258 WeakPolarHBondContact CG-OD1 3.5Å
259	D	68.1	Low	76.7	Confident	53 Å²	53	56.6 Å²	56.6	28%	0.283	30%	0.3	S	S	.	.			trans	-122.6	117	176.4	-175.5	-13.4	0	0	0	109.4	S257 S261 T262 S263	S257-D259 PolarHBondContact OG-O 2.85Å; S257-D259 VanDerWaalsContact OG-O 3.07Å; D259-S261 PolarHBondContact O-N 2.92Å; D259-S261 VanDerWaalsContact O-N 3.15Å; D259-S261 WeakPolarHBondContact OD1-CA 3.33Å; D259-S261 VanDerWaalsContact OD1-CB 3.25Å; D259-S261 WeakPolarHBondContact OD1-CB 3.24Å; D259-S261 PolarHBondContact OD1-N 2.81Å; D259-S261 PolarHBondContact OD1-OG 2.88Å; D259-S261 PolarHBondContact OD2-OG 2.78Å; D259-T262 HydrophobicContact CB-CG2 3.99Å; D259-T262 PolarHBondContact O-N 2.8Å; D259-T262 PolarHBondContact O-OG1 2.89Å; D259-S263 PolarHBondContact O-N 3.08Å
260	Q	63.2	Low	76.4	Confident	141 Å²	141	53.6 Å²	53.6	66%	0.659	28%	0.283	S	S	*	.	H	α-helix	trans	-57.8	-29.1	177.8	-68.4	-173.3	31.1	0	0	111.9	S263	Q260-S263 PolarHBondContact O-OG 2.93Å
261	S	60.8	Low	76.2	Confident	86 Å²	86	52.6 Å²	52.6	60%	0.601	28%	0.28	S	S	*	.	H	α-helix	trans	-70.6	-35.8	177.4	79.7	0	0	0	0	112.3	D259	D259-S261 PolarHBondContact O-N 2.92Å; D259-S261 VanDerWaalsContact O-N 3.15Å; D259-S261 WeakPolarHBondContact OD1-CA 3.33Å; D259-S261 VanDerWaalsContact OD1-CB 3.25Å; D259-S261 WeakPolarHBondContact OD1-CB 3.24Å; D259-S261 PolarHBondContact OD1-N 2.81Å; D259-S261 PolarHBondContact OD1-OG 2.88Å; D259-S261 PolarHBondContact OD2-OG 2.78Å
262	T	66.4	Low	75.3	Confident	25 Å²	25	55.9 Å²	55.9	15%	0.153	30%	0.298	C	S	.	.	H	α-helix	trans	-83.1	-18.6	178.8	71.7	0	0	0	0	112.7	E220 D259 K264 S265 K266	E220-T262 PolarHBondContact OE1-OG1 3.32Å; E220-T262 PolarHBondContact OE2-OG1 3Å; E220-T262 VanDerWaalsContact OE2-OG1 3.11Å; D259-T262 HydrophobicContact CB-CG2 3.99Å; D259-T262 PolarHBondContact O-N 2.8Å; D259-T262 PolarHBondContact O-OG1 2.89Å; T262-K264 VanDerWaalsContact C-N 3.33Å; T262-K264 PolarHBondContact O-N 2.9Å; T262-S265 WeakPolarHBondContact O-CB 3.34Å; T262-S265 PolarHBondContact O-N 2.92Å; T262-K266 PolarHBondContact O-N 3.07Å
263	S	67.7	Low	74.1	Confident	25 Å²	25	59 Å²	59	18%	0.175	31%	0.309	C	S	.	.	H	α-helix	trans	-51.6	-47.1	-178.8	70.8	0	0	0	0	113.2	S257 D259 Q260 S265 K266 V267	S257-S263 VanDerWaalsContact OG-CA 3.3Å; S257-S263 WeakPolarHBondContact OG-CA 3.29Å; S257-S263 WeakPolarHBondContact OG-CB 3.49Å; S257-S263 PolarHBondContact OG-N 2.91Å; D259-S263 PolarHBondContact O-N 3.08Å; Q260-S263 PolarHBondContact O-OG 2.93Å; S263-S265 PolarHBondContact O-N 3.13Å; S263-K266 PolarHBondContact O-N 3.06Å; S263-V267 WeakPolarHBondContact O-CB 3.05Å; S263-V267 WeakPolarHBondContact O-CG2 3.2Å; S263-V267 PolarHBondContact O-N 3.12Å
264	K	73.9	Confident	72	Confident	162 Å²	162	60.6 Å²	60.6	70%	0.704	33%	0.326	S	S	*	.	H	α-helix	trans	-64.4	-40.8	177.9	-68.5	-178.6	-179.2	177.1	0	112.7	T262 V267 N268	T262-K264 VanDerWaalsContact C-N 3.33Å; T262-K264 PolarHBondContact O-N 2.9Å; K264-V267 PolarHBondContact O-N 2.93Å; K264-N268 PolarHBondContact O-N 2.9Å; K264-N268 VanDerWaalsContact O-N 3.09Å
265	S	74.3	Confident	69.7	Low	50 Å²	50	65.1 Å²	65.1	35%	0.35	36%	0.358	S	S	.	.	H	α-helix	trans	-64.5	-45	177	-167.9	0	0	0	0	110.5	T262 S263 V267 N268 D269	T262-S265 WeakPolarHBondContact O-CB 3.34Å; T262-S265 PolarHBondContact O-N 2.92Å; S263-S265 PolarHBondContact O-N 3.13Å; S265-V267 PolarHBondContact O-N 3Å; S265-N268 PolarHBondContact O-N 2.8Å; S265-D269 VanDerWaalsContact O-CG 3.24Å; S265-D269 PolarHBondContact O-N 3.38Å
266	K	75.6	Confident	67.3	Low	4 Å²	4	73.2 Å²	73.2	2%	0.017	40%	0.396	C	S	.	.	H	α-helix	trans	-62	-43.4	177.5	-75.9	-179.1	170.2	-175.4	0	112	Y50 E220 I246 A256 T262 S263 N268 D269 C270	Y50-K266 WeakPolarHBondContact OH-CE 3.31Å; E220-K266 IonicContact OE1-NZ 2.7Å; E220-K266 PolarHBondContact OE1-NZ 3.15Å; E220-K266 WeakPolarHBondContact OE2-CE 2.97Å; E220-K266 IonicContact OE2-NZ 2.97Å; E220-K266 PolarHBondContact OE2-NZ 3.01Å; I246-K266 HydrophobicContact CD1-CB 3.81Å; I246-K266 HydrophobicContact CD1-CD 4.45Å; A256-K266 PolarHBondContact O-NZ 3.2Å; T262-K266 PolarHBondContact O-N 3.07Å; S263-K266 PolarHBondContact O-N 3.06Å; K266-N268 VanDerWaalsContact C-N 3.35Å; K266-N268 PolarHBondContact O-N 3.21Å; K266-D269 PolarHBondContact O-N 3.36Å; K266-C270 WeakPolarHBondContact O-CB 3.33Å; K266-C270 PolarHBondContact O-N 2.79Å; K266-C270 PolarHBondContact O-SG 2.99Å
267	V	78.1	Confident	64.9	Low	44 Å²	44	81.6 Å²	81.6	27%	0.267	44%	0.435	S	S	.	.	H	α-helix	trans	-53.6	-52.2	173.1	163.6	0	0	0	0	110.1	I246 S263 K264 S265 D269 C270 H271	I246-V267 HydrophobicContact CD1-CG2 4Å; I246-V267 HydrophobicContact CG1-CG2 4.11Å; I246-V267 HydrophobicContact CG2-CG2 3.76Å; S263-V267 WeakPolarHBondContact O-CB 3.05Å; S263-V267 WeakPolarHBondContact O-CG2 3.2Å; S263-V267 PolarHBondContact O-N 3.12Å; K264-V267 PolarHBondContact O-N 2.93Å; S265-V267 PolarHBondContact O-N 3Å; V267-D269 PolarHBondContact O-N 3.06Å; V267-C270 PolarHBondContact O-N 2.91Å; V267-H271 WeakPolarHBondContact CG1-CD2 3.45Å; V267-H271 WeakPolarHBondContact CG1-NE2 3.09Å; V267-H271 PolarHBondContact O-CD2 2.91Å; V267-H271 PolarHBondContact O-N 2.77Å
268	N	80	Confident	62.6	Low	117 Å²	117	87.7 Å²	87.7	63%	0.626	47%	0.472	S	S	*	.	H	α-helix	trans	-63.4	-41	179.4	-68.1	-7.5	0	0	0	112.8	K264 S265 K266 C270	K264-N268 PolarHBondContact O-N 2.9Å; K264-N268 VanDerWaalsContact O-N 3.09Å; S265-N268 PolarHBondContact O-N 2.8Å; K266-N268 VanDerWaalsContact C-N 3.35Å; K266-N268 PolarHBondContact O-N 3.21Å; N268-C270 PolarHBondContact O-N 2.9Å
269	D	81.4	Confident	61.1	Low	19 Å²	19	92.8 Å²	92.8	10%	0.102	49%	0.494	C	S	.	.	H	α-helix	trans	-63.7	-33.2	177.8	-71.7	-26.9	0	0	0	112	I42 V43 Y48 Y50 K250 S265 K266 V267	I42-D269 WeakPolarHBondContact CG2-O 3.19Å; V43-D269 HydrophobicContact CG1-CB 3.79Å; Y48-D269 VanDerWaalsContact CE1-OD1 3.32Å; Y48-D269 WeakPolarHBondContact CE1-OD1 3.44Å; Y48-D269 PolarHBondContact OH-OD2 3.18Å; Y50-D269 HydrophobicContact CD1-CB 4.03Å; Y50-D269 HydrophobicContact CG-CB 4.45Å; K250-D269 WeakPolarHBondContact CD-O 3.45Å; K250-D269 PolarHBondContact NZ-O 3.47Å; S265-D269 VanDerWaalsContact O-CG 3.24Å; S265-D269 PolarHBondContact O-N 3.38Å; K266-D269 PolarHBondContact O-N 3.36Å; V267-D269 PolarHBondContact O-N 3.06Å
270	C	81.8	Confident	59.3	Low	0 Å²	0	97 Å²	97	0%	0	52%	0.516	C	S	.	.	H	α-helix	trans	-87.1	-30.3	-173.3	-89.7	0	0	0	0	115.3	C248 D249 K250 I255 K266 V267 N268	C248-C270 HydrophobicContact CB-CB 3.73Å; C248-C270 WeakPolarHBondContact CB-SG 3.23Å; C248-C270 WeakPolarHBondContact SG-CA 3.31Å; C248-C270 WeakPolarHBondContact SG-CB 3.18Å; C248-C270 CovalentContact SG-SG 2.04Å; C248-C270 PolarHBondContact SG-SG 2.87Å; D249-C270 PolarHBondContact N-O 2.85Å; K250-C270 PolarHBondContact N-O 2.91Å; K250-C270 VanDerWaalsContact N-O 3.11Å; I255-C270 VanDerWaalsContact CD1-SG 3.55Å; K266-C270 WeakPolarHBondContact O-CB 3.33Å; K266-C270 PolarHBondContact O-N 2.79Å; K266-C270 PolarHBondContact O-SG 2.99Å; V267-C270 PolarHBondContact O-N 2.91Å; N268-C270 PolarHBondContact O-N 2.9Å
271	H	80.7	Confident	58	Low	68 Å²	68	96.8 Å²	96.8	32%	0.315	52%	0.519	S	S	.	.	S	Bend	trans	-74.8	141	179.7	-73.8	-54.9	0	0	0	111.9	D249 K250 V267	D249-H271 IonicContact OD2-CE1 3.66Å; D249-H271 IonicContact OD2-CG 3.79Å; D249-H271 IonicContact OD2-ND1 2.78Å; D249-H271 PolarHBondContact OD2-ND1 3.22Å; K250-H271 WeakPolarHBondContact CE-O 3.28Å; K250-H271 PolarHBondContact NZ-O 2.83Å; K250-H271 VanDerWaalsContact NZ-O 3.13Å; V267-H271 WeakPolarHBondContact CG1-CD2 3.45Å; V267-H271 WeakPolarHBondContact CG1-NE2 3.09Å; V267-H271 PolarHBondContact O-CD2 2.91Å; V267-H271 PolarHBondContact O-N 2.77Å
272	V	63	Low	56.9	Low	87 Å²	87	97.2 Å²	97.2	53%	0.527	52%	0.522	S	S	.	.			trans	-76.1	121.5	163.7	-179	0	0	0	0	106.1	D249 K250 T274	D249-V272 HydrophobicContact CB-CG2 4.07Å; K250-V272 HydrophobicContact CG-CG2 4.08Å; V272-T274 PolarHBondContact O-N 2.73Å
273	E	59	Low	55.5	Low	187 Å²	187	101.4 Å²	101.4	87%	0.874	55%	0.548	S	S	*	.			trans	-57.9	104.6	169.4	-73.8	-176.7	179.4	0	0	107.3	S275	E273-S275 PolarHBondContact O-N 3.17Å; E273-S275 VanDerWaalsContact O-N 3.11Å
274	T	41.1	Very low	54	Low	124 Å²	124	105.8 Å²	105.8	76%	0.761	58%	0.576	S	S	*	*			trans	-72.5	105.4	166.7	-53.6	0	0	0	0	103.9	V272 Q276	V272-T274 PolarHBondContact O-N 2.73Å; T274-Q276 VanDerWaalsContact C-N 3.31Å; T274-Q276 PolarHBondContact O-N 2.9Å
275	S	34.4	Very low	52.5	Low	98 Å²	98	102.6 Å²	102.6	69%	0.685	58%	0.58	S	S	*	*			trans	-52.4	107.2	161.9	47.9	0	0	0	0	105.5	E273 E277	E273-S275 PolarHBondContact O-N 3.17Å; E273-S275 VanDerWaalsContact O-N 3.11Å; S275-E277 PolarHBondContact O-N 2.78Å
276	Q	34.4	Very low	50.8	Low	179 Å²	179	106.3 Å²	106.3	84%	0.836	61%	0.606	S	S	*	*			trans	-60.8	93	159.2	-76.9	-173.2	-52.9	0	0	104.7	T274 T278	T274-Q276 VanDerWaalsContact C-N 3.31Å; T274-Q276 PolarHBondContact O-N 2.9Å; Q276-T278 VanDerWaalsContact C-N 3.3Å; Q276-T278 PolarHBondContact O-N 3.35Å
277	E	32.2	Very low	49.3	Very low	177 Å²	177	113.9 Å²	113.9	83%	0.827	64%	0.644	S	S	*	*			trans	-47.9	113.8	147	-86	-176.5	154.6	0	0	104.4	S275 E279	S275-E277 PolarHBondContact O-N 2.78Å; E277-E279 VanDerWaalsContact C-N 3.27Å; E277-E279 PolarHBondContact O-N 2.62Å
278	T	30.1	Very low	47.6	Very low	132 Å²	132	121 Å²	121	81%	0.81	67%	0.672	S	S	*	*			trans	-58	100.9	173.6	-20.4	0	0	0	0	104.1	Q276 D280	Q276-T278 VanDerWaalsContact C-N 3.3Å; Q276-T278 PolarHBondContact O-N 3.35Å; T278-D280 PolarHBondContact O-N 2.9Å
279	E	36.2	Very low	45.7	Very low	171 Å²	171	127.2 Å²	127.2	80%	0.799	69%	0.686	S	S	*	*			trans	-60.7	99.4	165.5	-97	-171	158.3	0	0	105.6	E277 L281	E277-E279 VanDerWaalsContact C-N 3.27Å; E277-E279 PolarHBondContact O-N 2.62Å; E279-L281 PolarHBondContact O-N 3.47Å
280	D	31.2	Very low	43.8	Very low	140 Å²	140	132 Å²	132	75%	0.749	72%	0.717	S	S	*	*			trans	-67.3	79.8	174.1	-150.1	-17.5	0	0	0	107.3	T278 S282	T278-D280 PolarHBondContact O-N 2.9Å; D280-S282 PolarHBondContact O-N 3.47Å; D280-S282 PolarHBondContact OD1-OG 3.19Å
281	L	35.7	Very low	42	Very low	137 Å²	137	141.4 Å²	141.4	72%	0.717	76%	0.76	S	S	*	*			trans	-87.5	65.8	169.5	-116.3	104.7	0	0	0	109.2	E279 T283	E279-L281 PolarHBondContact O-N 3.47Å; L281-T283 VanDerWaalsContact C-N 3.35Å; L281-T283 PolarHBondContact O-N 2.85Å
282	S	38.5	Very low	40.1	Very low	96 Å²	96	143.8 Å²	143.8	67%	0.671	78%	0.78	S	S	*	*			trans	-87	77.2	162.5	37.8	0	0	0	0	109.4	D280	D280-S282 PolarHBondContact O-N 3.47Å; D280-S282 PolarHBondContact OD1-OG 3.19Å
283	T	35.4	Very low	39.3	Very low	113 Å²	113	145.7 Å²	145.7	69%	0.693	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-103.4	127.9	165.9	-43.9	0	0	0	0	109.2	L281	L281-T283 VanDerWaalsContact C-N 3.35Å; L281-T283 PolarHBondContact O-N 2.85Å
284	P	38	Very low	38.5	Very low	117 Å²	117	141 Å²	141	76%	0.76	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-76.3	136.9	-163.4	-10.6	26.9	0	0	0	113.1	S286	P284-S286 PolarHBondContact O-N 2.93Å
285	A	41.5	Very low	38.8	Very low	95 Å²	95	141.8 Å²	141.8	79%	0.785	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-61.1	127.3	168.6	0	0	0	0	0	111.1	I287	A285-I287 PolarHBondContact O-N 3.4Å
286	S	38.8	Very low	39.8	Very low	128 Å²	128	147.5 Å²	147.5	90%	0.895	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-58.2	125	172.1	-73.1	0	0	0	0	111.7	P284	P284-S286 PolarHBondContact O-N 2.93Å
287	I	44.4	Very low	40	Very low	162 Å²	162	146 Å²	146	83%	0.831	81%	0.809	S	S	*	*			trans	-112.3	114.5	162.6	-63.8	176.3	0	0	0	107.7	A285	A285-I287 PolarHBondContact O-N 3.4Å
288	K	41.2	Very low	40.4	Very low	194 Å²	194	144.3 Å²	144.3	84%	0.843	81%	0.808	S	S	*	*			trans	-55.5	133.7	167.1	-88.1	176.2	170.7	176.9	0	110.3
289	R	41.6	Very low	41	Very low	247 Å²	247	145 Å²	145	93%	0.932	81%	0.807	S	S	*	*			trans	-144.9	112.6	145	-134	174.7	-170.2	152.6	1.7	110.2
290	T	40.3	Very low	41.3	Very low	120 Å²	120	143.5 Å²	143.5	74%	0.736	81%	0.808	S	S	*	*			trans	-67.6	133.8	166.6	-33.9	0	0	0	0	108.7
291	E	44.9	Very low	41.9	Very low	197 Å²	197	143.7 Å²	143.7	92%	0.921	81%	0.812	S	S	*	*			trans	-170.8	154.4	135.8	-108.2	169.3	-170.6	0	0	111.6
292	T	39.6	Very low	42.3	Very low	118 Å²	118	144.1 Å²	144.1	72%	0.724	82%	0.818	S	S	*	*			trans	-112.8	143.7	-150.2	-53.4	0	0	0	0	110.4
293	T	46.8	Very low	42.6	Very low	127 Å²	127	147.6 Å²	147.6	78%	0.779	83%	0.828	S	S	*	*			trans	175.3	113.8	147.4	25.5	0	0	0	0	107
294	S	42	Very low	43.2	Very low	89 Å²	89	150.2 Å²	150.2	62%	0.622	84%	0.839	S	S	*	*				47	128.7	83.1	104	0	0	0	0	111.8
295	D	47.9	Very low	43.6	Very low	141 Å²	141	153 Å²	153	75%	0.754	85%	0.845	S	S	*	*			cis	-159.2	162.4	28.5	-79.4	-62.7	0	0	0	110.8
296	V	54.1	Low	43.8	Very low	218 Å²	218	158.3 Å²	158.3	100%	1.321	85%	0.851	S	S	*	*			trans	74.2	0	165.7	-161.6	0	0	0	0	118.7

Retrieved 296 of 296 residues in 57.3 ms (Link to these results)

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