A0A5K4F0H4_SCHMA Loading...

WD_REPEATS_REGION domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0H4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 359 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.3	Very low	70.3	Confident	216 Å²	216	101.8 Å²	101.8	100%	1.064	51%	0.509	S	S	*	.				0	-34.6	0	-77.1	-179.2	-175	0	0	114.1	N3	M1-N3 PolarHBondContact O-N 3.15Å
2	N	54.6	Low	72.4	Confident	130 Å²	130	93.3 Å²	93.3	70%	0.695	47%	0.466	S	S	*	.	H	α-helix	trans	-66.7	-32.5	-177.7	-78.5	0.2	0	0	0	115.5	N4 R5 I6	N2-N4 PolarHBondContact O-N 3.11Å; N2-R5 PolarHBondContact O-N 3.06Å; N2-I6 PolarHBondContact O-N 3Å
3	N	63.6	Low	74.2	Confident	96 Å²	96	89.3 Å²	89.3	51%	0.513	45%	0.447	S	S	.	.	H	α-helix	trans	-68.3	-37.9	-173.6	-152.3	15.9	0	0	0	113.1	M1 R5 I6 I7	M1-N3 PolarHBondContact O-N 3.15Å; N3-R5 VanDerWaalsContact C-N 3.33Å; N3-R5 PolarHBondContact O-N 3.38Å; N3-I6 PolarHBondContact O-N 3Å; N3-I7 WeakPolarHBondContact O-CG1 3.46Å; N3-I7 PolarHBondContact O-N 2.98Å
4	N	61.7	Low	75.8	Confident	124 Å²	124	83.7 Å²	83.7	66%	0.663	42%	0.42	S	S	*	.	H	α-helix	trans	-66.4	-34.6	-178.4	-66	6	0	0	0	112.5	N2 I7 A8	N2-N4 PolarHBondContact O-N 3.11Å; N4-I7 PolarHBondContact O-N 3.21Å; N4-A8 PolarHBondContact O-N 3.48Å; N4-A8 VanDerWaalsContact O-N 3.09Å
5	R	65.4	Low	77.1	Confident	188 Å²	188	79.8 Å²	79.8	71%	0.709	40%	0.404	S	S	*	.	H	α-helix	trans	-65.9	-44.1	174.7	-72.1	-173.1	178.1	177.2	-0.3	111	N2 N3 I7 A8 H9	N2-R5 PolarHBondContact O-N 3.06Å; N3-R5 VanDerWaalsContact C-N 3.33Å; N3-R5 PolarHBondContact O-N 3.38Å; R5-I7 VanDerWaalsContact C-N 3.32Å; R5-I7 PolarHBondContact O-N 2.58Å; R5-A8 PolarHBondContact O-N 3.08Å; R5-H9 PolarHBondContact O-CD2 3.19Å; R5-H9 PolarHBondContact O-N 3.28Å
6	I	72.9	Confident	78.2	Confident	80 Å²	80	76.1 Å²	76.1	41%	0.41	39%	0.387	S	S	.	.	H	α-helix	trans	-59.6	-46.4	177.2	-63.6	169.8	0	0	0	109.8	N2 N3 A8 H9 T10 I30	N2-I6 PolarHBondContact O-N 3Å; N3-I6 PolarHBondContact O-N 3Å; I6-A8 VanDerWaalsContact C-N 3.32Å; I6-A8 PolarHBondContact O-N 3.41Å; I6-H9 CarbonylContact O-C 3.57Å; I6-H9 PolarHBondContact O-N 2.82Å; I6-T10 PolarHBondContact O-N 2.93Å; I6-T10 PolarHBondContact O-OG1 3.41Å; I6-I30 HydrophobicContact CG2-CD1 3.98Å
7	I	75.3	Confident	79	Confident	32 Å²	32	73.1 Å²	73.1	16%	0.164	37%	0.373	C	S	.	.	H	α-helix	trans	-58.8	-41.7	178.6	-66.3	164.6	0	0	0	111.7	N3 N4 R5 H9 T10 P340 Y357	N3-I7 WeakPolarHBondContact O-CG1 3.46Å; N3-I7 PolarHBondContact O-N 2.98Å; N4-I7 PolarHBondContact O-N 3.21Å; R5-I7 VanDerWaalsContact C-N 3.32Å; R5-I7 PolarHBondContact O-N 2.58Å; I7-H9 PolarHBondContact O-N 3Å; I7-T10 PolarHBondContact O-N 3.13Å; I7-P340 HydrophobicContact CG2-CB 4.01Å; I7-Y357 HydrophobicContact CG2-CD2 4.3Å
8	A	72	Confident	79.6	Confident	58 Å²	58	69.1 Å²	69.1	48%	0.479	35%	0.353	S	S	.	.	H	α-helix	trans	-66.3	-21.4	178.2	0	0	0	0	0	114	N4 R5 I6	N4-A8 PolarHBondContact O-N 3.48Å; N4-A8 VanDerWaalsContact O-N 3.09Å; R5-A8 PolarHBondContact O-N 3.08Å; I6-A8 VanDerWaalsContact C-N 3.32Å; I6-A8 PolarHBondContact O-N 3.41Å
9	H	82.4	Confident	80	Confident	126 Å²	126	70.2 Å²	70.2	58%	0.583	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	5.7	178.3	-68.7	-70.6	0	0	0	113.4	R5 I6 I7 N29	R5-H9 PolarHBondContact O-CD2 3.19Å; R5-H9 PolarHBondContact O-N 3.28Å; I6-H9 CarbonylContact O-C 3.57Å; I6-H9 PolarHBondContact O-N 2.82Å; I7-H9 PolarHBondContact O-N 3Å; H9-N29 PolarHBondContact O-ND2 3.24Å
10	T	89.1	Confident	80.1	Confident	3 Å²	3	70.2 Å²	70.2	2%	0.018	37%	0.37	C	S	.	.			trans	-76.1	132.1	173.9	-59.9	0	0	0	0	109.1	I6 I7 T28 N29 I30 Y357	I6-T10 PolarHBondContact O-N 2.93Å; I6-T10 PolarHBondContact O-OG1 3.41Å; I7-T10 PolarHBondContact O-N 3.13Å; T10-T28 HydrophobicContact CG2-CG2 3.94Å; T10-N29 WeakPolarHBondContact CA-OD1 3.22Å; T10-I30 HydrophobicContact CG2-CD1 4.15Å; T10-I30 HydrophobicContact CG2-CG1 4.31Å; T10-I30 WeakPolarHBondContact OG1-CD1 3.5Å; T10-Y357 VanDerWaalsContact CB-CD2 3.47Å; T10-Y357 HydrophobicContact CG2-CD2 3.46Å; T10-Y357 VanDerWaalsContact CG2-CD2 3.46Å; T10-Y357 HydrophobicContact CG2-CE2 3.48Å; T10-Y357 VanDerWaalsContact CG2-CE2 3.48Å; T10-Y357 HydrophobicContact CG2-CG 4.16Å
11	F	93.6	Very high	80.2	Confident	67 Å²	67	72.1 Å²	72.1	29%	0.294	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-118.8	140.9	173.8	-52.5	-32.2	0	0	0	109.6	L13 T28 N29 G337 C338	F11-L13 HydrophobicContact CB-CD2 4.33Å; F11-T28 WeakPolarHBondContact O-CA 3.31Å; F11-N29 HydrophobicContact CB-CB 4.33Å; F11-N29 HydrophobicContact CD2-CB 4.35Å; F11-N29 WeakPolarHBondContact CD2-ND2 3.22Å; F11-N29 PolarHBondContact N-OD1 3.09Å; F11-N29 PolarHBondContact O-N 3.08Å; F11-G337 WeakPolarHBondContact CA-O 3.49Å; F11-C338 HydrophobicContact CD1-CB 4.01Å; F11-C338 HydrophobicContact CE1-CB 4.11Å
12	I	96.1	Very high	82.2	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	118.1	165.3	-57.6	-46.2	0	0	0	108	F26 T28 L34 A310 G337 I342 Y357	I12-F26 HydrophobicContact CD1-CB 4.02Å; I12-F26 HydrophobicContact CG2-CB 4.27Å; I12-F26 HydrophobicContact CG2-CD1 3.75Å; I12-F26 HydrophobicContact CG2-CG 4.46Å; I12-T28 HydrophobicContact CD1-CG2 3.89Å; I12-L34 HydrophobicContact CD1-CD1 4.24Å; I12-A310 HydrophobicContact CG2-CB 4.04Å; I12-G337 PolarHBondContact N-O 3.18Å; I12-I342 HydrophobicContact CD1-CD1 4.1Å; I12-I342 HydrophobicContact CD1-CG1 4.26Å; I12-I342 HydrophobicContact CG1-CD1 4.1Å; I12-I342 HydrophobicContact CG1-CG1 3.71Å; I12-Y357 HydrophobicContact CD1-CD1 4.48Å; I12-Y357 HydrophobicContact CD1-CE1 3.74Å; I12-Y357 HydrophobicContact CG1-CE1 4.07Å
13	L	96.1	Very high	83.8	Confident	41 Å²	41	62.9 Å²	62.9	22%	0.215	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-30.3	-178.9	-62.9	177.6	0	0	0	112	F11 G27 N29 N62 I63 Y64 L309	F11-L13 HydrophobicContact CB-CD2 4.33Å; L13-G27 PolarHBondContact N-O 3.02Å; L13-N29 HydrophobicContact CD1-CB 3.95Å; L13-N29 HydrophobicContact CG-CB 4.42Å; L13-N62 HydrophobicContact CD1-CB 3.68Å; L13-I63 WeakPolarHBondContact CB-O 3.36Å; L13-Y64 HydrophobicContact CD1-CD1 4.1Å; L13-Y64 HydrophobicContact CD1-CE1 4.24Å; L13-L309 HydrophobicContact CD2-CD1 4.09Å
14	S	96.4	Very high	85.1	Confident	11 Å²	11	58.3 Å²	58.3	8%	0.077	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	157.2	-179.5	54.4	0	0	0	0	111.1	F26 G27 I63 Y64	S14-F26 WeakPolarHBondContact O-CA 3.39Å; S14-G27 PolarHBondContact N-O 3.31Å; S14-G27 PolarHBondContact O-N 3.09Å; S14-I63 PolarHBondContact OG-O 2.76Å; S14-Y64 WeakPolarHBondContact CB-O 3.46Å
15	S	95.6	Very high	86.8	Confident	25 Å²	25	52.4 Å²	52.4	18%	0.175	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.2	176.6	57.4	0	0	0	0	109.9	L25 F334	S15-L25 CarbonylContact C-O 3.59Å; S15-L25 VanDerWaalsContact CA-O 3.26Å; S15-L25 WeakPolarHBondContact CA-O 3.23Å; S15-F334 VanDerWaalsContact CB-CE2 3.41Å; S15-F334 VanDerWaalsContact OG-CE2 3.31Å; S15-F334 WeakPolarHBondContact OG-CE2 3.37Å; S15-F334 WeakPolarHBondContact OG-CZ 3.33Å
16	V	94.7	Very high	88.3	Confident	21 Å²	21	43.4 Å²	43.4	13%	0.127	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	141.2	168.6	72.4	0	0	0	0	109.7	L25 L66 F68	V16-L25 HydrophobicContact CG1-CB 3.9Å; V16-L25 HydrophobicContact CG1-CD2 4.47Å; V16-L25 PolarHBondContact N-O 3.01Å; V16-L25 PolarHBondContact O-N 3.34Å; V16-L66 HydrophobicContact CB-CB 3.95Å; V16-L66 HydrophobicContact CG1-CB 3.7Å; V16-L66 HydrophobicContact CG1-CD1 4.33Å; V16-F68 HydrophobicContact CB-CD2 4.25Å; V16-F68 HydrophobicContact CG1-CD2 3.62Å; V16-F68 HydrophobicContact CG1-CE2 3.74Å; V16-F68 HydrophobicContact CG2-CB 4.46Å; V16-F68 HydrophobicContact CG2-CD2 3.68Å
17	T	91.1	Very high	89.4	Confident	24 Å²	24	39.6 Å²	39.6	15%	0.147	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	138	175.3	-60.9	0	0	0	0	109.8	R21 L24 F68	T17-R21 HydrophobicContact CG2-CB 4.14Å; T17-R21 HydrophobicContact CG2-CG 4.11Å; T17-L24 HydrophobicContact CG2-CD2 4.01Å; T17-L24 WeakPolarHBondContact OG1-CD2 3.13Å; T17-F68 VanDerWaalsContact O-CD2 3.3Å; T17-F68 WeakPolarHBondContact O-CD2 3.35Å
18	S	90.8	Very high	90.4	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.014	20%	0.202	C	C	.	.			trans	-57.4	152.1	173.9	55.5	0	0	0	0	112.3	C20 R21 K22 Y23 F68	S18-C20 PolarHBondContact O-N 2.98Å; S18-C20 VanDerWaalsContact O-N 3.15Å; S18-R21 WeakPolarHBondContact O-CA 3.35Å; S18-R21 PolarHBondContact O-N 3.08Å; S18-K22 PolarHBondContact OG-N 3.29Å; S18-Y23 PolarHBondContact N-O 2.97Å; S18-Y23 WeakPolarHBondContact OG-CA 3.36Å; S18-Y23 PolarHBondContact OG-N 3.35Å; S18-Y23 PolarHBondContact OG-O 3.01Å; S18-F68 VanDerWaalsContact CA-CE2 3.46Å
19	P	86.3	Confident	91.5	Very high	90 Å²	90	36.9 Å²	36.9	58%	0.584	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-33.3	-179.6	-27.7	35.4	0	0	0	114	R21 F68	P19-R21 PolarHBondContact O-N 3.22Å; P19-F68 HydrophobicContact CG-CB 4.45Å; P19-F68 HydrophobicContact CG-CD1 4Å; P19-F68 HydrophobicContact CG-CG 4.29Å
20	C	83	Confident	92	Very high	70 Å²	70	33.3 Å²	33.3	47%	0.473	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-1.6	175.4	62.4	0	0	0	0	114	S18 K22	S18-C20 PolarHBondContact O-N 2.98Å; S18-C20 VanDerWaalsContact O-N 3.15Å; C20-K22 PolarHBondContact O-N 3.48Å; C20-K22 VanDerWaalsContact O-N 3.15Å
21	R	81.6	Confident	92.2	Very high	111 Å²	111	37.7 Å²	37.7	42%	0.419	19%	0.193	S	C	.	.	S	Bend	trans	53.1	28.7	-176.9	-58.3	-174	175.6	-152.1	-2	114.8	T17 S18 P19 L38 N315	T17-R21 HydrophobicContact CG2-CB 4.14Å; T17-R21 HydrophobicContact CG2-CG 4.11Å; S18-R21 WeakPolarHBondContact O-CA 3.35Å; S18-R21 PolarHBondContact O-N 3.08Å; P19-R21 PolarHBondContact O-N 3.22Å; R21-L38 VanDerWaalsContact O-CD1 3.22Å; R21-L38 WeakPolarHBondContact O-CD1 3.33Å; R21-N315 PolarHBondContact NH1-OD1 2.74Å
22	K	83.1	Confident	92.2	Very high	113 Å²	113	37.4 Å²	37.4	49%	0.491	19%	0.191	S	C	.	.	S	Bend	trans	-101.4	-23.9	176.9	-68	-174.4	178.2	-175.4	0	113.6	S18 C20 L38	S18-K22 PolarHBondContact OG-N 3.29Å; C20-K22 PolarHBondContact O-N 3.48Å; C20-K22 VanDerWaalsContact O-N 3.15Å; K22-L38 WeakPolarHBondContact O-CB 3.27Å; K22-L38 WeakPolarHBondContact O-CG 3.43Å; K22-L38 PolarHBondContact O-N 2.65Å
23	Y	88.9	Confident	92.2	Very high	38 Å²	38	37.4 Å²	37.4	15%	0.149	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.9	-178.3	-56.1	-81	0	0	0	111.5	S18 Y36 W86 P89 F93	S18-Y23 PolarHBondContact N-O 2.97Å; S18-Y23 WeakPolarHBondContact OG-CA 3.36Å; S18-Y23 PolarHBondContact OG-N 3.35Å; S18-Y23 PolarHBondContact OG-O 3.01Å; Y23-Y36 CarbonylContact C-O 3.56Å; Y23-Y36 WeakPolarHBondContact CA-O 3.33Å; Y23-W86 HydrophobicContact CD2-CH2 4.08Å; Y23-W86 AromaticContact CD2-CZ2 3.74Å; Y23-W86 HydrophobicContact CD2-CZ2 3.74Å; Y23-W86 HydrophobicContact CE2-CZ2 4.42Å; Y23-W86 HydrophobicContact CG-CH2 4.05Å; Y23-W86 HydrophobicContact CG-CZ2 4.19Å; Y23-P89 HydrophobicContact CE1-CG 4.42Å; Y23-P89 WeakPolarHBondContact OH-CG 3.14Å; Y23-F93 HydrophobicContact CD1-CD1 4.48Å; Y23-F93 AromaticContact CD1-CE1 3.56Å; Y23-F93 HydrophobicContact CD1-CE1 3.56Å; Y23-F93 HydrophobicContact CD1-CZ 4.16Å; Y23-F93 AromaticContact CE1-CE1 3.37Å; Y23-F93 HydrophobicContact CE1-CE1 3.37Å; Y23-F93 AromaticContact CE1-CZ 3.75Å; Y23-F93 HydrophobicContact CE1-CZ 3.75Å; Y23-F93 HydrophobicContact CE2-CE1 4.33Å; Y23-F93 HydrophobicContact CG-CE1 4.15Å; Y23-F93 AromaticContact CZ-CE1 3.79Å
24	L	92	Very high	92.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.2	174.9	-57.7	-177.8	0	0	0	109.3	T17 F26 I35 Y36 L38 F314 F334	T17-L24 HydrophobicContact CG2-CD2 4.01Å; T17-L24 WeakPolarHBondContact OG1-CD2 3.13Å; L24-F26 HydrophobicContact CB-CE2 3.65Å; L24-F26 HydrophobicContact CB-CZ 4.06Å; L24-F26 HydrophobicContact CD1-CE2 4.35Å; L24-F26 HydrophobicContact CD1-CZ 4.21Å; L24-I35 WeakPolarHBondContact O-CA 3.42Å; L24-Y36 PolarHBondContact N-O 3.15Å; L24-Y36 PolarHBondContact O-N 2.54Å; L24-L38 HydrophobicContact CD1-CD2 3.72Å; L24-L38 HydrophobicContact CD1-CG 4.46Å; L24-L38 HydrophobicContact CD2-CD1 4.39Å; L24-L38 HydrophobicContact CG-CD1 4.42Å; L24-L38 HydrophobicContact CG-CD2 4Å; L24-L38 HydrophobicContact CG-CG 4.2Å; L24-F314 HydrophobicContact CD2-CB 4.01Å; L24-F334 HydrophobicContact CD1-CD1 3.7Å; L24-F334 HydrophobicContact CD1-CE1 4.26Å; L24-F334 HydrophobicContact CD1-CG 4.38Å; L24-F334 HydrophobicContact CD2-CD1 3.97Å; L24-F334 HydrophobicContact CD2-CE1 3.75Å; L24-F334 HydrophobicContact CG-CD1 4.42Å
25	L	95.7	Very high	92.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134.9	177.8	-75.3	68.4	0	0	0	109.4	S15 V16 I33 L34 I35 L66 F68 V73 W86 L94	S15-L25 CarbonylContact C-O 3.59Å; S15-L25 VanDerWaalsContact CA-O 3.26Å; S15-L25 WeakPolarHBondContact CA-O 3.23Å; V16-L25 HydrophobicContact CG1-CB 3.9Å; V16-L25 HydrophobicContact CG1-CD2 4.47Å; V16-L25 PolarHBondContact N-O 3.01Å; V16-L25 PolarHBondContact O-N 3.34Å; L25-I33 HydrophobicContact CB-CG2 4.29Å; L25-I33 HydrophobicContact CD2-CG2 4.37Å; L25-I33 HydrophobicContact CG-CG2 4.39Å; L25-L34 CarbonylContact C-O 3.51Å; L25-L34 VanDerWaalsContact CA-O 3.32Å; L25-L34 WeakPolarHBondContact CA-O 3.42Å; L25-I35 HydrophobicContact CD1-CG2 4.16Å; L25-I35 HydrophobicContact CG-CG1 4.18Å; L25-I35 HydrophobicContact CG-CG2 4.44Å; L25-L66 HydrophobicContact CB-CD1 4.36Å; L25-F68 HydrophobicContact CD1-CE2 3.99Å; L25-F68 HydrophobicContact CD1-CZ 4.09Å; L25-F68 HydrophobicContact CD2-CE2 3.95Å; L25-F68 HydrophobicContact CD2-CZ 3.94Å; L25-F68 HydrophobicContact CG-CE2 4.48Å; L25-V73 HydrophobicContact CD2-CG1 4.02Å; L25-V73 HydrophobicContact CD2-CG2 4.04Å; L25-W86 HydrophobicContact CD1-CH2 4.12Å; L25-W86 HydrophobicContact CD1-CZ3 3.99Å; L25-W86 HydrophobicContact CD2-CZ3 4.14Å; L25-L94 HydrophobicContact CD2-CD1 4.33Å
26	F	96.8	Very high	91.9	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.6	179.7	-61	-83	0	0	0	111.5	I12 S14 L24 I33 L34 Y36 F334 I342 L355	I12-F26 HydrophobicContact CD1-CB 4.02Å; I12-F26 HydrophobicContact CG2-CB 4.27Å; I12-F26 HydrophobicContact CG2-CD1 3.75Å; I12-F26 HydrophobicContact CG2-CG 4.46Å; S14-F26 WeakPolarHBondContact O-CA 3.39Å; L24-F26 HydrophobicContact CB-CE2 3.65Å; L24-F26 HydrophobicContact CB-CZ 4.06Å; L24-F26 HydrophobicContact CD1-CE2 4.35Å; L24-F26 HydrophobicContact CD1-CZ 4.21Å; F26-I33 CarbonylContact O-C 3.43Å; F26-I33 VanDerWaalsContact O-CA 3.27Å; F26-I33 WeakPolarHBondContact O-CA 3.36Å; F26-L34 HydrophobicContact CB-CB 4.32Å; F26-L34 PolarHBondContact N-O 2.9Å; F26-L34 PolarHBondContact O-N 3.39Å; F26-Y36 AromaticContact CD2-CD2 3.63Å; F26-Y36 HydrophobicContact CD2-CD2 3.63Å; F26-Y36 AromaticContact CD2-CE2 3.68Å; F26-Y36 HydrophobicContact CD2-CE2 3.68Å; F26-Y36 AromaticContact CE2-CD2 3.69Å; F26-Y36 HydrophobicContact CE2-CD2 3.69Å; F26-Y36 HydrophobicContact CE2-CE2 4.01Å; F26-F334 HydrophobicContact CD1-CE2 4.39Å; F26-F334 AromaticContact CE1-CD2 3.37Å; F26-F334 HydrophobicContact CE1-CD2 3.37Å; F26-F334 AromaticContact CE1-CE2 3.4Å; F26-F334 HydrophobicContact CE1-CE2 3.4Å; F26-F334 VanDerWaalsContact CE1-CE2 3.4Å; F26-F334 AromaticContact CE1-CG 3.97Å; F26-F334 HydrophobicContact CE1-CG 3.97Å; F26-F334 AromaticContact CE1-CZ 3.98Å; F26-F334 HydrophobicContact CE1-CZ 3.98Å; F26-F334 HydrophobicContact CZ-CB 4.25Å; F26-F334 HydrophobicContact CZ-CD1 4.18Å; F26-F334 AromaticContact CZ-CD2 3.7Å; F26-F334 HydrophobicContact CZ-CD2 3.7Å; F26-F334 HydrophobicContact CZ-CE1 4.4Å; F26-F334 AromaticContact CZ-CE2 3.99Å; F26-F334 HydrophobicContact CZ-CE2 3.99Å; F26-F334 AromaticContact CZ-CG 3.79Å; F26-F334 HydrophobicContact CZ-CG 3.79Å; F26-F334 HydrophobicContact CZ-CZ 4.28Å; F26-I342 HydrophobicContact CB-CD1 4.36Å; F26-I342 HydrophobicContact CD1-CD1 3.95Å; F26-I342 HydrophobicContact CD1-CG1 4.3Å; F26-I342 HydrophobicContact CD2-CD1 3.55Å; F26-I342 HydrophobicContact CE1-CD1 4.04Å; F26-I342 HydrophobicContact CE1-CG1 4.17Å; F26-I342 HydrophobicContact CE1-CG2 4.16Å; F26-I342 HydrophobicContact CE2-CD1 3.68Å; F26-I342 HydrophobicContact CG-CD1 3.68Å; F26-I342 HydrophobicContact CZ-CD1 3.93Å; F26-I342 HydrophobicContact CZ-CG1 4.3Å; F26-I342 HydrophobicContact CZ-CG2 3.94Å; F26-L355 HydrophobicContact CE2-CD1 4.19Å
27	G	97.1	Very high	91.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	133.1	175.3	0	0	0	0	0	110.6	L13 S14	L13-G27 PolarHBondContact N-O 3.02Å; S14-G27 PolarHBondContact N-O 3.31Å; S14-G27 PolarHBondContact O-N 3.09Å
28	T	96.2	Very high	90.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	165.3	-174.4	65.1	0	0	0	0	113.3	T10 F11 I12 I30 K32 L34 I63	T10-T28 HydrophobicContact CG2-CG2 3.94Å; F11-T28 WeakPolarHBondContact O-CA 3.31Å; I12-T28 HydrophobicContact CD1-CG2 3.89Å; T28-I30 PolarHBondContact O-N 2.59Å; T28-I30 WeakPolarHBondContact OG1-CG1 3.09Å; T28-I30 PolarHBondContact OG1-N 2.83Å; T28-K32 WeakPolarHBondContact CB-O 3.33Å; T28-K32 WeakPolarHBondContact CG2-O 3.34Å; T28-K32 PolarHBondContact N-O 2.97Å; T28-K32 WeakPolarHBondContact OG1-CA 3.38Å; T28-K32 WeakPolarHBondContact OG1-CB 3.18Å; T28-K32 PolarHBondContact OG1-N 3.42Å; T28-K32 PolarHBondContact OG1-O 3.05Å; T28-L34 HydrophobicContact CG2-CD1 4Å; T28-L34 HydrophobicContact CG2-CG 4.05Å; T28-I63 PolarHBondContact O-N 2.69Å
29	N	94.7	Very high	89.6	Confident	33 Å²	33	35 Å²	35	18%	0.176	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-0.4	168	69.3	-31.7	0	0	0	114.4	H9 T10 F11 L13 N62	H9-N29 PolarHBondContact O-ND2 3.24Å; T10-N29 WeakPolarHBondContact CA-OD1 3.22Å; F11-N29 HydrophobicContact CB-CB 4.33Å; F11-N29 HydrophobicContact CD2-CB 4.35Å; F11-N29 WeakPolarHBondContact CD2-ND2 3.22Å; F11-N29 PolarHBondContact N-OD1 3.09Å; F11-N29 PolarHBondContact O-N 3.08Å; L13-N29 HydrophobicContact CD1-CB 3.95Å; L13-N29 HydrophobicContact CG-CB 4.42Å; N29-N62 WeakPolarHBondContact CA-OD1 3.39Å; N29-N62 PolarHBondContact O-OD1 3.17Å
30	I	92.6	Very high	88.3	Confident	50 Å²	50	33.9 Å²	33.9	26%	0.256	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	34.1	-177.6	58.6	167.1	0	0	0	112.2	I6 T10 T28 K32	I6-I30 HydrophobicContact CG2-CD1 3.98Å; T10-I30 HydrophobicContact CG2-CD1 4.15Å; T10-I30 HydrophobicContact CG2-CG1 4.31Å; T10-I30 WeakPolarHBondContact OG1-CD1 3.5Å; T28-I30 PolarHBondContact O-N 2.59Å; T28-I30 WeakPolarHBondContact OG1-CG1 3.09Å; T28-I30 PolarHBondContact OG1-N 2.83Å; I30-K32 HydrophobicContact CD1-CD 3.85Å; I30-K32 HydrophobicContact CG1-CB 4.4Å; I30-K32 HydrophobicContact CG1-CD 4.19Å; I30-K32 HydrophobicContact CG1-CG 4.4Å; I30-K32 PolarHBondContact O-N 2.8Å; I30-K32 VanDerWaalsContact O-N 3.15Å
31	Q	93.5	Very high	87.4	Confident	96 Å²	96	30.9 Å²	30.9	45%	0.449	15%	0.152	S	C	.	.	S	Bend	trans	61.6	19.6	176.4	-32.5	-177.5	13	0	0	114.1	V57 A60 G61	Q31-V57 PolarHBondContact O-N 3.44Å; Q31-A60 WeakPolarHBondContact CB-O 3.49Å; Q31-A60 WeakPolarHBondContact CG-O 3.17Å; Q31-A60 PolarHBondContact OE1-O 3.44Å; Q31-G61 VanDerWaalsContact CA-O 3.27Å; Q31-G61 WeakPolarHBondContact CA-O 3.41Å; Q31-G61 VanDerWaalsContact CG-O 3.32Å; Q31-G61 WeakPolarHBondContact CG-O 3.48Å; Q31-G61 PolarHBondContact N-O 3.36Å
32	K	94.9	Very high	86	Confident	61 Å²	61	30.2 Å²	30.2	27%	0.265	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137.7	-176.3	-70.7	176.5	-176.6	-178.5	0	112.5	T28 I30 L34 I54 I55 N56 I63	T28-K32 WeakPolarHBondContact CB-O 3.33Å; T28-K32 WeakPolarHBondContact CG2-O 3.34Å; T28-K32 PolarHBondContact N-O 2.97Å; T28-K32 WeakPolarHBondContact OG1-CA 3.38Å; T28-K32 WeakPolarHBondContact OG1-CB 3.18Å; T28-K32 PolarHBondContact OG1-N 3.42Å; T28-K32 PolarHBondContact OG1-O 3.05Å; I30-K32 HydrophobicContact CD1-CD 3.85Å; I30-K32 HydrophobicContact CG1-CB 4.4Å; I30-K32 HydrophobicContact CG1-CD 4.19Å; I30-K32 HydrophobicContact CG1-CG 4.4Å; I30-K32 PolarHBondContact O-N 2.8Å; I30-K32 VanDerWaalsContact O-N 3.15Å; K32-L34 HydrophobicContact CB-CD2 4.46Å; K32-I54 HydrophobicContact CB-CG2 4.3Å; K32-I54 HydrophobicContact CD-CG2 3.81Å; K32-I54 HydrophobicContact CG-CG2 4.12Å; K32-I55 WeakPolarHBondContact CA-O 3.23Å; K32-N56 WeakPolarHBondContact CE-OD1 3.44Å; K32-N56 WeakPolarHBondContact CG-OD1 3.21Å; K32-I63 WeakPolarHBondContact O-CD1 3.26Å
33	I	96.4	Very high	84.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	124.8	162.4	-57.5	167.8	0	0	0	107.9	L25 F26 I35 I54 I55 V57 I63 L66 C75 Y84 L94	L25-I33 HydrophobicContact CB-CG2 4.29Å; L25-I33 HydrophobicContact CD2-CG2 4.37Å; L25-I33 HydrophobicContact CG-CG2 4.39Å; F26-I33 CarbonylContact O-C 3.43Å; F26-I33 VanDerWaalsContact O-CA 3.27Å; F26-I33 WeakPolarHBondContact O-CA 3.36Å; I33-I35 HydrophobicContact CG2-CG1 4.21Å; I33-I54 WeakPolarHBondContact O-CA 3.34Å; I33-I55 HydrophobicContact CB-CB 4.36Å; I33-I55 PolarHBondContact N-O 2.65Å; I33-I55 PolarHBondContact O-N 3.36Å; I33-V57 HydrophobicContact CD1-CG2 3.53Å; I33-V57 HydrophobicContact CG1-CG2 3.61Å; I33-I63 HydrophobicContact CG1-CD1 3.6Å; I33-L66 HydrophobicContact CD1-CD2 4.28Å; I33-L66 HydrophobicContact CG1-CD2 4.45Å; I33-C75 WeakPolarHBondContact CD1-SG 3.35Å; I33-Y84 HydrophobicContact CD1-CD2 4.44Å; I33-Y84 HydrophobicContact CD1-CE2 4.19Å; I33-L94 HydrophobicContact CD1-CD1 4.12Å; I33-L94 HydrophobicContact CG2-CD1 4.38Å
34	L	95.2	Very high	82.5	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	128.4	174.2	-49.3	177.2	0	0	0	108.6	I12 L25 F26 T28 K32 Y36 P51 I54 Y357	I12-L34 HydrophobicContact CD1-CD1 4.24Å; L25-L34 CarbonylContact C-O 3.51Å; L25-L34 VanDerWaalsContact CA-O 3.32Å; L25-L34 WeakPolarHBondContact CA-O 3.42Å; F26-L34 HydrophobicContact CB-CB 4.32Å; F26-L34 PolarHBondContact N-O 2.9Å; F26-L34 PolarHBondContact O-N 3.39Å; T28-L34 HydrophobicContact CG2-CD1 4Å; T28-L34 HydrophobicContact CG2-CG 4.05Å; K32-L34 HydrophobicContact CB-CD2 4.46Å; L34-Y36 HydrophobicContact CB-CD2 4.38Å; L34-Y36 HydrophobicContact CB-CE2 3.6Å; L34-Y36 HydrophobicContact CD1-CE2 4.37Å; L34-P51 HydrophobicContact CB-CB 4.5Å; L34-I54 HydrophobicContact CD2-CD1 4.39Å; L34-I54 HydrophobicContact CD2-CG1 4.01Å; L34-I54 HydrophobicContact CD2-CG2 4.1Å; L34-Y357 HydrophobicContact CD1-CD1 3.55Å; L34-Y357 HydrophobicContact CD1-CE1 4.26Å; L34-Y357 HydrophobicContact CD1-CG 4.09Å
35	I	94.5	Very high	80.8	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.6	179.6	-47.2	-171.7	0	0	0	108.7	L24 L25 I33 P51 E52 C53 I55 F93 L94	L24-I35 WeakPolarHBondContact O-CA 3.42Å; L25-I35 HydrophobicContact CD1-CG2 4.16Å; L25-I35 HydrophobicContact CG-CG1 4.18Å; L25-I35 HydrophobicContact CG-CG2 4.44Å; I33-I35 HydrophobicContact CG2-CG1 4.21Å; I35-P51 CarbonylContact O-C 3.39Å; I35-P51 WeakPolarHBondContact O-CA 3.34Å; I35-E52 PolarHBondContact O-N 3.24Å; I35-C53 HydrophobicContact CB-CB 4.09Å; I35-C53 HydrophobicContact CD1-CB 4.15Å; I35-C53 HydrophobicContact CG1-CB 4.27Å; I35-C53 PolarHBondContact N-O 2.94Å; I35-C53 PolarHBondContact O-N 2.83Å; I35-I55 HydrophobicContact CD1-CG1 4.36Å; I35-F93 HydrophobicContact CD1-CB 3.58Å; I35-F93 HydrophobicContact CD1-CG 4.09Å; I35-F93 HydrophobicContact CG2-CD1 4.11Å; I35-F93 HydrophobicContact CG2-CE1 4.31Å; I35-F93 HydrophobicContact CG2-CG 4.28Å; I35-L94 HydrophobicContact CD1-CD1 3.86Å; I35-L94 HydrophobicContact CD1-CG 3.95Å
36	Y	91.1	Very high	79.5	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.9	176.6	-61.8	-95.8	0	0	0	110	Y23 L24 F26 L34 K50 P51 I342 L355 H356	Y23-Y36 CarbonylContact C-O 3.56Å; Y23-Y36 WeakPolarHBondContact CA-O 3.33Å; L24-Y36 PolarHBondContact N-O 3.15Å; L24-Y36 PolarHBondContact O-N 2.54Å; F26-Y36 AromaticContact CD2-CD2 3.63Å; F26-Y36 HydrophobicContact CD2-CD2 3.63Å; F26-Y36 AromaticContact CD2-CE2 3.68Å; F26-Y36 HydrophobicContact CD2-CE2 3.68Å; F26-Y36 AromaticContact CE2-CD2 3.69Å; F26-Y36 HydrophobicContact CE2-CD2 3.69Å; F26-Y36 HydrophobicContact CE2-CE2 4.01Å; L34-Y36 HydrophobicContact CB-CD2 4.38Å; L34-Y36 HydrophobicContact CB-CE2 3.6Å; L34-Y36 HydrophobicContact CD1-CE2 4.37Å; Y36-K50 WeakPolarHBondContact CD1-O 3.45Å; Y36-P51 HydrophobicContact CE1-CB 4.04Å; Y36-P51 HydrophobicContact CE1-CG 4.5Å; Y36-P51 VanDerWaalsContact CE1-N 3.25Å; Y36-P51 HydrophobicContact CE2-CB 4.4Å; Y36-I342 HydrophobicContact CE2-CD1 3.98Å; Y36-L355 HydrophobicContact CD1-CB 4Å; Y36-L355 HydrophobicContact CD1-CD1 3.98Å; Y36-L355 HydrophobicContact CD1-CD2 4.01Å; Y36-L355 HydrophobicContact CD1-CG 4.23Å; Y36-L355 HydrophobicContact CD2-CD1 4.15Å; Y36-L355 HydrophobicContact CE1-CB 3.58Å; Y36-L355 HydrophobicContact CE1-CD1 4.33Å; Y36-L355 HydrophobicContact CE1-CD2 4.38Å; Y36-L355 HydrophobicContact CE1-CG 4.33Å; Y36-L355 HydrophobicContact CE2-CB 4.5Å; Y36-L355 HydrophobicContact CE2-CD1 4.47Å; Y36-L355 HydrophobicContact CG-CD1 3.88Å; Y36-H356 PolarHBondContact OH-O 3.02Å
37	S	86.7	Confident	78.4	Confident	8 Å²	8	43.5 Å²	43.5	6%	0.056	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	132.7	167.7	171.9	0	0	0	0	109.5	C39 S40 E52	S37-C39 VanDerWaalsContact C-N 3.32Å; S37-C39 PolarHBondContact OG-N 3.1Å; S37-S40 WeakPolarHBondContact CB-OG 3.47Å; S37-S40 PolarHBondContact OG-OG 3.07Å; S37-E52 WeakPolarHBondContact CB-OE1 3.37Å; S37-E52 WeakPolarHBondContact CB-OE2 3.44Å
38	L	73.8	Confident	77.7	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.016	28%	0.278	C	S	.	.	S	Bend	trans	-73.4	-25.9	174.5	-67.7	170.5	0	0	0	112.3	R21 K22 L24 S40 L41 F314	R21-L38 VanDerWaalsContact O-CD1 3.22Å; R21-L38 WeakPolarHBondContact O-CD1 3.33Å; K22-L38 WeakPolarHBondContact O-CB 3.27Å; K22-L38 WeakPolarHBondContact O-CG 3.43Å; K22-L38 PolarHBondContact O-N 2.65Å; L24-L38 HydrophobicContact CD1-CD2 3.72Å; L24-L38 HydrophobicContact CD1-CG 4.46Å; L24-L38 HydrophobicContact CD2-CD1 4.39Å; L24-L38 HydrophobicContact CG-CD1 4.42Å; L24-L38 HydrophobicContact CG-CD2 4Å; L24-L38 HydrophobicContact CG-CG 4.2Å; L38-S40 VanDerWaalsContact C-N 3.29Å; L38-S40 PolarHBondContact O-N 3.03Å; L38-L41 HydrophobicContact CB-CD1 4.49Å; L38-L41 HydrophobicContact CD2-CD1 3.66Å; L38-L41 WeakPolarHBondContact O-CB 3.21Å; L38-L41 PolarHBondContact O-N 3.04Å; L38-F314 HydrophobicContact CD1-CB 4.08Å; L38-F314 HydrophobicContact CD1-CD2 3.88Å; L38-F314 HydrophobicContact CD1-CG 4.36Å; L38-F314 HydrophobicContact CD2-CD2 3.41Å; L38-F314 VanDerWaalsContact CD2-CD2 3.41Å; L38-F314 HydrophobicContact CD2-CE2 3.67Å; L38-F314 HydrophobicContact CD2-CG 4.05Å; L38-F314 HydrophobicContact CD2-CZ 4.49Å; L38-F314 HydrophobicContact CG-CD2 4.29Å
39	C	66.8	Low	77.2	Confident	55 Å²	55	48.8 Å²	48.8	37%	0.372	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-24.5	178.7	-63.6	0	0	0	0	112.6	S37 L41	S37-C39 VanDerWaalsContact C-N 3.32Å; S37-C39 PolarHBondContact OG-N 3.1Å; C39-L41 PolarHBondContact O-N 3.46Å
40	S	60.7	Low	76.9	Confident	68 Å²	68	52.7 Å²	52.7	48%	0.476	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-0.8	-179.2	-53.8	0	0	0	0	112.6	S37 L38 S42 E52	S37-S40 WeakPolarHBondContact CB-OG 3.47Å; S37-S40 PolarHBondContact OG-OG 3.07Å; L38-S40 VanDerWaalsContact C-N 3.29Å; L38-S40 PolarHBondContact O-N 3.03Å; S40-S42 VanDerWaalsContact C-N 3.34Å; S40-S42 PolarHBondContact O-N 2.88Å; S40-E52 PolarHBondContact OG-OE1 3.5Å
41	L	63.4	Low	76.8	Confident	6 Å²	6	50.5 Å²	50.5	3%	0.031	29%	0.286	C	S	.	.			trans	-88.3	66.3	-179.4	-63.6	177.5	0	0	0	110.2	L38 C39 I47 L344 L355	L38-L41 HydrophobicContact CB-CD1 4.49Å; L38-L41 HydrophobicContact CD2-CD1 3.66Å; L38-L41 WeakPolarHBondContact O-CB 3.21Å; L38-L41 PolarHBondContact O-N 3.04Å; C39-L41 PolarHBondContact O-N 3.46Å; L41-I47 HydrophobicContact CB-CG2 3.48Å; L41-I47 VanDerWaalsContact CB-CG2 3.48Å; L41-I47 HydrophobicContact CD1-CG2 3.84Å; L41-I47 HydrophobicContact CD2-CG2 3.49Å; L41-I47 VanDerWaalsContact CD2-CG2 3.49Å; L41-I47 HydrophobicContact CG-CG2 3.74Å; L41-L344 HydrophobicContact CD1-CD1 4.29Å; L41-L355 HydrophobicContact CD1-CD2 4.43Å; L41-L355 HydrophobicContact CD2-CD2 3.51Å
42	S	52.1	Low	76.6	Confident	98 Å²	98	48.8 Å²	48.8	69%	0.685	28%	0.278	S	S	*	.			trans	-117.3	96.5	178	65.6	0	0	0	0	110.1	S40	S40-S42 VanDerWaalsContact C-N 3.34Å; S40-S42 PolarHBondContact O-N 2.88Å
43	C	47.4	Very low	76.5	Confident	79 Å²	79	46.6 Å²	46.6	53%	0.534	27%	0.27	S	S	.	.			trans	-140.8	136.9	164.2	-83.7	0	0	0	0	109.7	A45 Q46	C43-A45 PolarHBondContact O-N 2.87Å; C43-Q46 WeakPolarHBondContact CB-O 2.98Å
44	D	50.8	Low	76.4	Confident	165 Å²	165	49 Å²	49	88%	0.882	28%	0.283	S	S	*	.	S	Bend	trans	-59.3	122.1	174.6	-77.5	-42.4	0	0	0	109.4	Q46	D44-Q46 PolarHBondContact O-N 2.81Å
45	A	56.2	Low	76.3	Confident	71 Å²	71	50.2 Å²	50.2	59%	0.587	29%	0.289	S	S	*	.	S	Bend	trans	81.1	-38.3	178.6	0	0	0	0	0	119	C43	C43-A45 PolarHBondContact O-N 2.87Å
46	Q	68.4	Low	76.3	Confident	113 Å²	113	55.4 Å²	55.4	53%	0.528	32%	0.317	S	S	.	.	S	Bend	trans	-139.9	137.2	177.6	-72.8	-175.5	-14	0	0	112.2	C43 D44 E48 L352	C43-Q46 WeakPolarHBondContact CB-O 2.98Å; D44-Q46 PolarHBondContact O-N 2.81Å; Q46-E48 PolarHBondContact O-N 2.91Å; Q46-L352 CarbonylContact C-O 3.55Å; Q46-L352 WeakPolarHBondContact CA-O 3.12Å
47	I	75	Confident	76.5	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	103.9	177.5	-60.8	176.5	0	0	0	109.8	L41 L323 L344 L352 G353 M354	L41-I47 HydrophobicContact CB-CG2 3.48Å; L41-I47 VanDerWaalsContact CB-CG2 3.48Å; L41-I47 HydrophobicContact CD1-CG2 3.84Å; L41-I47 HydrophobicContact CD2-CG2 3.49Å; L41-I47 VanDerWaalsContact CD2-CG2 3.49Å; L41-I47 HydrophobicContact CG-CG2 3.74Å; I47-L323 HydrophobicContact CD1-CD1 3.55Å; I47-L323 HydrophobicContact CG1-CD1 3.67Å; I47-L344 HydrophobicContact CB-CD1 3.82Å; I47-L344 HydrophobicContact CD1-CD1 4.21Å; I47-L344 HydrophobicContact CG2-CD1 3.32Å; I47-L352 HydrophobicContact CD1-CB 4.2Å; I47-L352 PolarHBondContact N-O 3.1Å; I47-G353 CarbonylContact O-C 3.52Å; I47-G353 WeakPolarHBondContact O-CA 3.03Å; I47-M354 PolarHBondContact O-N 3.11Å
48	E	82.3	Confident	76.5	Confident	103 Å²	103	61.9 Å²	61.9	48%	0.481	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.5	167.1	-68.2	-166.6	165.3	0	0	110.8	Q46 M354	Q46-E48 PolarHBondContact O-N 2.91Å; E48-M354 WeakPolarHBondContact CA-O 3.5Å
49	G	83.8	Confident	76.9	Confident	9 Å²	9	70.3 Å²	70.3	9%	0.093	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	148.9	-176.5	0	0	0	0	0	113.4	M354 L355 H356	G49-M354 PolarHBondContact N-O 3.07Å; G49-L355 CarbonylContact O-C 3.57Å; G49-L355 WeakPolarHBondContact O-CA 3.23Å; G49-H356 PolarHBondContact O-N 2.86Å
50	K	88.4	Confident	77.8	Confident	115 Å²	115	67.9 Å²	67.9	50%	0.5	36%	0.361	S	S	.	.			trans	-120.3	156.1	172	-62.7	-167	-177.9	-170.5	0	109.5	Y36 E52 S358 R359	Y36-K50 WeakPolarHBondContact CD1-O 3.45Å; K50-E52 PolarHBondContact O-N 3.07Å; K50-S358 WeakPolarHBondContact CD-O 3.21Å; K50-R359 WeakPolarHBondContact CD-OXT 3.3Å; K50-R359 WeakPolarHBondContact CE-OXT 3.32Å; K50-R359 PolarHBondContact NZ-O 3.36Å; K50-R359 PolarHBondContact NZ-OXT 3.25Å
51	P	90.5	Very high	79.1	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.019	35%	0.351	C	S	.	.			trans	-67.1	124.9	-176.8	25.7	-34.9	0	0	0	110	L34 I35 Y36 C53 I54 H356 R359	L34-P51 HydrophobicContact CB-CB 4.5Å; I35-P51 CarbonylContact O-C 3.39Å; I35-P51 WeakPolarHBondContact O-CA 3.34Å; Y36-P51 HydrophobicContact CE1-CB 4.04Å; Y36-P51 HydrophobicContact CE1-CG 4.5Å; Y36-P51 VanDerWaalsContact CE1-N 3.25Å; Y36-P51 HydrophobicContact CE2-CB 4.4Å; P51-C53 PolarHBondContact O-N 2.86Å; P51-I54 HydrophobicContact CB-CD1 4.42Å; P51-I54 HydrophobicContact CB-CG1 3.82Å; P51-I54 HydrophobicContact CG-CD1 3.66Å; P51-I54 HydrophobicContact CG-CG1 3.62Å; P51-H356 WeakPolarHBondContact CD-O 3.49Å; P51-R359 HydrophobicContact CG-CG 4.21Å; P51-R359 VanDerWaalsContact O-CG 3.31Å; P51-R359 WeakPolarHBondContact O-CG 3.25Å; P51-R359 PolarHBondContact O-NE 3.25Å
52	E	90.4	Very high	80.6	Confident	61 Å²	61	68 Å²	68	29%	0.285	36%	0.363	S	S	.	.	S	Bend	trans	-62.8	-33.6	170.4	-70.6	-157.4	162.1	0	0	110.9	I35 S37 S40 K50 F93 R359	I35-E52 PolarHBondContact O-N 3.24Å; S37-E52 WeakPolarHBondContact CB-OE1 3.37Å; S37-E52 WeakPolarHBondContact CB-OE2 3.44Å; S40-E52 PolarHBondContact OG-OE1 3.5Å; K50-E52 PolarHBondContact O-N 3.07Å; E52-F93 HydrophobicContact CB-CE2 4.27Å; E52-F93 HydrophobicContact CB-CZ 4.42Å; E52-F93 VanDerWaalsContact OE2-CZ 3.26Å; E52-F93 WeakPolarHBondContact OE2-CZ 3.42Å; E52-R359 PolarHBondContact O-NH2 3.4Å
53	C	92.4	Very high	82.7	Confident	15 Å²	15	63.4 Å²	63.4	10%	0.101	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	142.9	175.7	-163.6	0	0	0	0	111.5	I35 P51 I55 F93	I35-C53 HydrophobicContact CB-CB 4.09Å; I35-C53 HydrophobicContact CD1-CB 4.15Å; I35-C53 HydrophobicContact CG1-CB 4.27Å; I35-C53 PolarHBondContact N-O 2.94Å; I35-C53 PolarHBondContact O-N 2.83Å; P51-C53 PolarHBondContact O-N 2.86Å; C53-I55 VanDerWaalsContact SG-CD1 3.52Å; C53-F93 HydrophobicContact CB-CD2 3.73Å; C53-F93 HydrophobicContact CB-CE2 4.2Å
54	I	93.9	Very high	85.1	Confident	50 Å²	50	62.8 Å²	62.8	26%	0.256	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	115.8	172.3	-58.1	177.9	0	0	0	106.8	K32 I33 L34 P51	K32-I54 HydrophobicContact CB-CG2 4.3Å; K32-I54 HydrophobicContact CD-CG2 3.81Å; K32-I54 HydrophobicContact CG-CG2 4.12Å; I33-I54 WeakPolarHBondContact O-CA 3.34Å; L34-I54 HydrophobicContact CD2-CD1 4.39Å; L34-I54 HydrophobicContact CD2-CG1 4.01Å; L34-I54 HydrophobicContact CD2-CG2 4.1Å; P51-I54 HydrophobicContact CB-CD1 4.42Å; P51-I54 HydrophobicContact CB-CG1 3.82Å; P51-I54 HydrophobicContact CG-CD1 3.66Å; P51-I54 HydrophobicContact CG-CG1 3.62Å
55	I	94.6	Very high	87.3	Confident	30 Å²	30	55.2 Å²	55.2	15%	0.154	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.7	178.6	-58.1	-62.7	0	0	0	108.9	K32 I33 I35 C53 Y84 L94	K32-I55 WeakPolarHBondContact CA-O 3.23Å; I33-I55 HydrophobicContact CB-CB 4.36Å; I33-I55 PolarHBondContact N-O 2.65Å; I33-I55 PolarHBondContact O-N 3.36Å; I35-I55 HydrophobicContact CD1-CG1 4.36Å; C53-I55 VanDerWaalsContact SG-CD1 3.52Å; I55-Y84 HydrophobicContact CG2-CE1 4.06Å; I55-L94 HydrophobicContact CG1-CB 4.32Å; I55-L94 HydrophobicContact CG1-CD1 4.21Å
56	N	94.6	Very high	89.3	Confident	109 Å²	109	52.4 Å²	52.4	58%	0.583	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	117.6	168.8	-62.5	-49.7	0	0	0	108.6	K32 K58	K32-N56 WeakPolarHBondContact CE-OD1 3.44Å; K32-N56 WeakPolarHBondContact CG-OD1 3.21Å; N56-K58 PolarHBondContact O-N 3.45Å
57	V	94.5	Very high	90.7	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	23%	0.232	C	C	.	.			trans	-83.1	108.6	-178.6	-175.8	0	0	0	0	109.3	Q31 I33 Y59 A60 I63 V82 Y84	Q31-V57 PolarHBondContact O-N 3.44Å; I33-V57 HydrophobicContact CD1-CG2 3.53Å; I33-V57 HydrophobicContact CG1-CG2 3.61Å; V57-Y59 PolarHBondContact O-N 2.83Å; V57-A60 HydrophobicContact CB-CB 3.88Å; V57-A60 HydrophobicContact CG1-CB 3.46Å; V57-A60 VanDerWaalsContact CG1-CB 3.46Å; V57-A60 PolarHBondContact O-N 2.84Å; V57-I63 HydrophobicContact CB-CD1 4.23Å; V57-I63 HydrophobicContact CG2-CD1 3.59Å; V57-V82 HydrophobicContact CG1-CB 3.82Å; V57-V82 HydrophobicContact CG1-CG1 4.08Å; V57-V82 HydrophobicContact CG1-CG2 3.57Å; V57-Y84 WeakPolarHBondContact CA-OH 3.38Å; V57-Y84 HydrophobicContact CG1-CE2 4.23Å; V57-Y84 HydrophobicContact CG2-CE2 4.22Å
58	K	86.9	Confident	91.7	Very high	144 Å²	144	48.8 Å²	48.8	63%	0.626	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	137.4	179.2	-66.9	-175	177.8	-179.8	0	110.4	N56 A60	N56-K58 PolarHBondContact O-N 3.45Å; K58-A60 PolarHBondContact O-N 2.81Å
59	Y	82.8	Confident	92.3	Very high	180 Å²	180	44 Å²	44	71%	0.706	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.8	-9.6	177.2	-44.1	-71.4	0	0	0	116.4	V57	V57-Y59 PolarHBondContact O-N 2.83Å
60	A	84.5	Confident	92.7	Very high	4 Å²	4	47.1 Å²	47.1	3%	0.033	23%	0.226	C	C	.	.			trans	-78.5	144.5	175.1	0	0	0	0	0	110.6	Q31 V57 K58	Q31-A60 WeakPolarHBondContact CB-O 3.49Å; Q31-A60 WeakPolarHBondContact CG-O 3.17Å; Q31-A60 PolarHBondContact OE1-O 3.44Å; V57-A60 HydrophobicContact CB-CB 3.88Å; V57-A60 HydrophobicContact CG1-CB 3.46Å; V57-A60 VanDerWaalsContact CG1-CB 3.46Å; V57-A60 PolarHBondContact O-N 2.84Å; K58-A60 PolarHBondContact O-N 2.81Å
61	G	87.9	Confident	92.9	Very high	27 Å²	27	46.4 Å²	46.4	28%	0.278	23%	0.228	S	C	.	.	S	Bend	trans	-89.8	-108.6	162	0	0	0	0	0	109.3	Q31 S77	Q31-G61 VanDerWaalsContact CA-O 3.27Å; Q31-G61 WeakPolarHBondContact CA-O 3.41Å; Q31-G61 VanDerWaalsContact CG-O 3.32Å; Q31-G61 WeakPolarHBondContact CG-O 3.48Å; Q31-G61 PolarHBondContact N-O 3.36Å; G61-S77 PolarHBondContact N-OG 2.99Å
62	N	95.1	Very high	93.2	Very high	51 Å²	51	48.2 Å²	48.2	27%	0.273	23%	0.234	S	C	.	.	S	Bend	trans	-70.9	139.1	171.4	-65.6	-18.5	0	0	0	110.6	L13 N29 Y64 S77	L13-N62 HydrophobicContact CD1-CB 3.68Å; N29-N62 WeakPolarHBondContact CA-OD1 3.39Å; N29-N62 PolarHBondContact O-OD1 3.17Å; N62-Y64 HydrophobicContact CB-CD1 4.31Å; N62-Y64 HydrophobicContact CB-CD2 3.98Å; N62-Y64 HydrophobicContact CB-CE1 3.85Å; N62-Y64 HydrophobicContact CB-CE2 3.46Å; N62-Y64 VanDerWaalsContact CB-CE2 3.46Å; N62-Y64 HydrophobicContact CB-CG 4.37Å; N62-Y64 VanDerWaalsContact CB-CZ 3.41Å; N62-Y64 PolarHBondContact ND2-OH 2.93Å; N62-Y64 PolarHBondContact O-N 2.85Å; N62-S77 WeakPolarHBondContact O-CA 3.48Å; N62-S77 WeakPolarHBondContact O-CB 3.21Å; N62-S77 PolarHBondContact O-OG 2.94Å
63	I	97.1	Very high	93.5	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	22%	0.221	C	C	.	.			trans	-96.1	85.7	173.6	-52.6	179.8	0	0	0	108.5	L13 S14 T28 K32 I33 V57 L66 C75	L13-I63 WeakPolarHBondContact CB-O 3.36Å; S14-I63 PolarHBondContact OG-O 2.76Å; T28-I63 PolarHBondContact O-N 2.69Å; K32-I63 WeakPolarHBondContact O-CD1 3.26Å; I33-I63 HydrophobicContact CG1-CD1 3.6Å; V57-I63 HydrophobicContact CB-CD1 4.23Å; V57-I63 HydrophobicContact CG2-CD1 3.59Å; I63-L66 HydrophobicContact CG2-CD2 4Å; I63-L66 HydrophobicContact CG2-CG 4.06Å; I63-C75 HydrophobicContact CG2-CB 4.43Å
64	Y	97.1	Very high	93.8	Very high	65 Å²	65	44.6 Å²	44.6	26%	0.255	22%	0.216	S	C	.	.			trans	-75.6	-25.2	-174.4	-66.3	-72	0	0	0	113.6	L13 S14 N62 G76 V78 E113 V114	L13-Y64 HydrophobicContact CD1-CD1 4.1Å; L13-Y64 HydrophobicContact CD1-CE1 4.24Å; S14-Y64 WeakPolarHBondContact CB-O 3.46Å; N62-Y64 HydrophobicContact CB-CD1 4.31Å; N62-Y64 HydrophobicContact CB-CD2 3.98Å; N62-Y64 HydrophobicContact CB-CE1 3.85Å; N62-Y64 HydrophobicContact CB-CE2 3.46Å; N62-Y64 VanDerWaalsContact CB-CE2 3.46Å; N62-Y64 HydrophobicContact CB-CG 4.37Å; N62-Y64 VanDerWaalsContact CB-CZ 3.41Å; N62-Y64 PolarHBondContact ND2-OH 2.93Å; N62-Y64 PolarHBondContact O-N 2.85Å; Y64-G76 PolarHBondContact N-O 3.42Å; Y64-V78 HydrophobicContact CE2-CG2 4.13Å; Y64-E113 HydrophobicContact CD2-CB 4.02Å; Y64-E113 HydrophobicContact CD2-CG 4.3Å; Y64-E113 HydrophobicContact CE2-CB 3.89Å; Y64-E113 HydrophobicContact CE2-CG 3.65Å; Y64-V114 VanDerWaalsContact CB-O 3.27Å; Y64-V114 WeakPolarHBondContact CB-O 3.45Å
65	A	97.6	Very high	94	Very high	6 Å²	6	42.3 Å²	42.3	5%	0.05	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	141.3	-178.4	0	0	0	0	0	111.6	G76 L117	A65-G76 PolarHBondContact O-N 2.7Å; A65-L117 HydrophobicContact CB-CB 4.04Å; A65-L117 HydrophobicContact CB-CD1 3.9Å; A65-L117 HydrophobicContact CB-CG 3.78Å
66	L	97.8	Very high	94.1	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.068	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.7	169.7	-75.6	174.2	0	0	0	108.9	V16 L25 I33 I63 V73 F74 C75	V16-L66 HydrophobicContact CB-CB 3.95Å; V16-L66 HydrophobicContact CG1-CB 3.7Å; V16-L66 HydrophobicContact CG1-CD1 4.33Å; L25-L66 HydrophobicContact CB-CD1 4.36Å; I33-L66 HydrophobicContact CD1-CD2 4.28Å; I33-L66 HydrophobicContact CG1-CD2 4.45Å; I63-L66 HydrophobicContact CG2-CD2 4Å; I63-L66 HydrophobicContact CG2-CG 4.06Å; L66-V73 HydrophobicContact CD2-CG1 4.2Å; L66-F74 WeakPolarHBondContact CA-O 3.47Å; L66-C75 HydrophobicContact CD2-CB 4.16Å
67	C	97.1	Very high	94.2	Very high	14 Å²	14	35.7 Å²	35.7	10%	0.095	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	136.7	176.4	-173.1	0	0	0	0	110.4	V73 F74 L117 Y119	C67-V73 WeakPolarHBondContact O-CA 3.48Å; C67-F74 HydrophobicContact CB-CB 4.47Å; C67-F74 PolarHBondContact N-O 3.04Å; C67-F74 VanDerWaalsContact N-O 3.09Å; C67-F74 WeakPolarHBondContact O-CD2 3.36Å; C67-F74 PolarHBondContact O-N 3.17Å; C67-L117 HydrophobicContact CB-CB 3.55Å; C67-Y119 PolarHBondContact SG-N 2.84Å
68	F	96.2	Very high	94.2	Very high	23 Å²	23	38.3 Å²	38.3	10%	0.101	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	136.9	166.7	-91.5	-83.2	0	0	0	109.5	V16 T17 S18 P19 L25 Y72 V73 W86 Y119	V16-F68 HydrophobicContact CB-CD2 4.25Å; V16-F68 HydrophobicContact CG1-CD2 3.62Å; V16-F68 HydrophobicContact CG1-CE2 3.74Å; V16-F68 HydrophobicContact CG2-CB 4.46Å; V16-F68 HydrophobicContact CG2-CD2 3.68Å; T17-F68 VanDerWaalsContact O-CD2 3.3Å; T17-F68 WeakPolarHBondContact O-CD2 3.35Å; S18-F68 VanDerWaalsContact CA-CE2 3.46Å; P19-F68 HydrophobicContact CG-CB 4.45Å; P19-F68 HydrophobicContact CG-CD1 4Å; P19-F68 HydrophobicContact CG-CG 4.29Å; L25-F68 HydrophobicContact CD1-CE2 3.99Å; L25-F68 HydrophobicContact CD1-CZ 4.09Å; L25-F68 HydrophobicContact CD2-CE2 3.95Å; L25-F68 HydrophobicContact CD2-CZ 3.94Å; L25-F68 HydrophobicContact CG-CE2 4.48Å; F68-Y72 WeakPolarHBondContact CA-O 3.5Å; F68-V73 HydrophobicContact CD1-CG2 3.6Å; F68-V73 HydrophobicContact CD2-CG2 4.33Å; F68-V73 HydrophobicContact CE1-CG2 3.18Å; F68-V73 HydrophobicContact CE2-CG2 3.96Å; F68-V73 HydrophobicContact CG-CG2 4.17Å; F68-V73 HydrophobicContact CZ-CG2 3.37Å; F68-W86 HydrophobicContact CE1-CB 4.08Å; F68-W86 AromaticContact CE1-CD2 3.64Å; F68-W86 HydrophobicContact CE1-CD2 3.64Å; F68-W86 AromaticContact CE1-CE3 3.78Å; F68-W86 HydrophobicContact CE1-CE3 3.78Å; F68-W86 AromaticContact CE1-CG 3.77Å; F68-W86 HydrophobicContact CE1-CG 3.77Å; F68-W86 HydrophobicContact CE1-CZ3 4.48Å; F68-W86 AromaticContact CZ-CD2 3.89Å; F68-W86 HydrophobicContact CZ-CD2 3.89Å; F68-W86 AromaticContact CZ-CE3 3.65Å; F68-W86 HydrophobicContact CZ-CE3 3.65Å; F68-W86 HydrophobicContact CZ-CG 4.49Å; F68-W86 HydrophobicContact CZ-CH2 4.35Å; F68-W86 AromaticContact CZ-CZ3 3.92Å; F68-W86 HydrophobicContact CZ-CZ3 3.92Å; F68-Y119 WeakPolarHBondContact O-CB 3.38Å
69	G	94.5	Very high	94.4	Very high	2 Å²	2	31.6 Å²	31.6	2%	0.021	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	126	168.4	0	0	0	0	0	110.8	D71 Y72	G69-D71 PolarHBondContact O-N 3.11Å; G69-Y72 PolarHBondContact N-O 2.52Å; G69-Y72 WeakPolarHBondContact O-CB 3.16Å; G69-Y72 PolarHBondContact O-N 3.05Å
70	K	92.5	Very high	95	Very high	76 Å²	76	23.5 Å²	23.5	33%	0.33	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	-127	-169.1	-64.7	177.5	150.4	170.1	0	110.6	Y72 Y119 D124 I140 D141	K70-Y72 VanDerWaalsContact C-N 3.29Å; K70-Y72 HydrophobicContact CB-CD2 4.44Å; K70-Y72 PolarHBondContact O-N 3.33Å; K70-Y119 WeakPolarHBondContact CG-OH 3.16Å; K70-D124 WeakPolarHBondContact CD-OD1 3.42Å; K70-D124 VanDerWaalsContact CE-CG 3.47Å; K70-D124 WeakPolarHBondContact CE-OD1 3.35Å; K70-D124 IonicContact NZ-OD1 3.94Å; K70-D124 PolarHBondContact NZ-OD1 2.92Å; K70-D124 IonicContact NZ-OD2 2.67Å; K70-D124 PolarHBondContact NZ-OD2 3.2Å; K70-I140 HydrophobicContact CD-CB 4.34Å; K70-I140 HydrophobicContact CD-CD1 4.47Å; K70-I140 HydrophobicContact CD-CG2 3.74Å; K70-D141 IonicContact NZ-OD1 2.91Å; K70-D141 PolarHBondContact NZ-OD1 3.01Å; K70-D141 IonicContact NZ-OD2 2.91Å; K70-D141 PolarHBondContact NZ-OD2 2.77Å
71	D	93.2	Very high	95.6	Very high	100 Å²	100	23.4 Å²	23.4	54%	0.535	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	17.1	177.6	-60.5	-30.1	0	0	0	112.5	G69 K85 W86	G69-D71 PolarHBondContact O-N 3.11Å; D71-K85 CarbonylContact O-C 3.53Å; D71-K85 WeakPolarHBondContact O-CA 3.47Å; D71-W86 WeakPolarHBondContact O-CB 3.3Å; D71-W86 PolarHBondContact O-N 2.92Å
72	Y	96.6	Very high	96	Very high	40 Å²	40	22.1 Å²	22.1	16%	0.157	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	149.4	-173.2	-57.2	-76.2	0	0	0	113.1	F68 G69 K70 F74 V83 Y84 K85 H97 I140 F144	F68-Y72 WeakPolarHBondContact CA-O 3.5Å; G69-Y72 PolarHBondContact N-O 2.52Å; G69-Y72 WeakPolarHBondContact O-CB 3.16Å; G69-Y72 PolarHBondContact O-N 3.05Å; K70-Y72 VanDerWaalsContact C-N 3.29Å; K70-Y72 HydrophobicContact CB-CD2 4.44Å; K70-Y72 PolarHBondContact O-N 3.33Å; Y72-F74 HydrophobicContact CD2-CZ 4.47Å; Y72-F74 HydrophobicContact CG-CZ 4.34Å; Y72-V83 HydrophobicContact CD1-CG1 3.8Å; Y72-V83 HydrophobicContact CG-CG1 4.14Å; Y72-Y84 CarbonylContact C-O 3.59Å; Y72-Y84 WeakPolarHBondContact CA-O 3.25Å; Y72-K85 HydrophobicContact CD1-CB 4.31Å; Y72-K85 HydrophobicContact CE1-CB 4.26Å; Y72-K85 HydrophobicContact CE1-CG 4.43Å; Y72-H97 HydrophobicContact CE1-CB 4.45Å; Y72-H97 AromaticContact CE1-CD2 3.62Å; Y72-H97 AromaticContact CE1-CG 3.89Å; Y72-H97 AromaticContact CE1-NE2 3.98Å; Y72-I140 HydrophobicContact CD2-CG2 3.95Å; Y72-I140 HydrophobicContact CE2-CG2 3.93Å; Y72-F144 HydrophobicContact CD1-CZ 4.1Å; Y72-F144 HydrophobicContact CD2-CE1 4.28Å; Y72-F144 HydrophobicContact CD2-CZ 4.06Å; Y72-F144 HydrophobicContact CE1-CZ 4.02Å; Y72-F144 HydrophobicContact CE2-CE1 4.47Å; Y72-F144 AromaticContact CE2-CZ 3.97Å; Y72-F144 HydrophobicContact CE2-CZ 3.97Å; Y72-F144 HydrophobicContact CG-CE1 4.48Å; Y72-F144 HydrophobicContact CG-CZ 4.13Å; Y72-F144 AromaticContact CZ-CZ 3.96Å
73	V	97.1	Very high	96.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.4	165.6	-179.8	0	0	0	0	108.4	L25 L66 C67 F68 Y84 W86 L94	L25-V73 HydrophobicContact CD2-CG1 4.02Å; L25-V73 HydrophobicContact CD2-CG2 4.04Å; L66-V73 HydrophobicContact CD2-CG1 4.2Å; C67-V73 WeakPolarHBondContact O-CA 3.48Å; F68-V73 HydrophobicContact CD1-CG2 3.6Å; F68-V73 HydrophobicContact CD2-CG2 4.33Å; F68-V73 HydrophobicContact CE1-CG2 3.18Å; F68-V73 HydrophobicContact CE2-CG2 3.96Å; F68-V73 HydrophobicContact CG-CG2 4.17Å; F68-V73 HydrophobicContact CZ-CG2 3.37Å; V73-Y84 PolarHBondContact N-O 3.02Å; V73-Y84 PolarHBondContact O-N 3.34Å; V73-W86 HydrophobicContact CG2-CE3 4.16Å; V73-L94 HydrophobicContact CB-CD2 3.96Å; V73-L94 HydrophobicContact CG2-CD2 3.7Å
74	F	97.6	Very high	96.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130.3	179.5	-57.6	-79.1	0	0	0	109.9	L66 C67 Y72 I81 V83 L117 L126 I140 F144	L66-F74 WeakPolarHBondContact CA-O 3.47Å; C67-F74 HydrophobicContact CB-CB 4.47Å; C67-F74 PolarHBondContact N-O 3.04Å; C67-F74 VanDerWaalsContact N-O 3.09Å; C67-F74 WeakPolarHBondContact O-CD2 3.36Å; C67-F74 PolarHBondContact O-N 3.17Å; Y72-F74 HydrophobicContact CD2-CZ 4.47Å; Y72-F74 HydrophobicContact CG-CZ 4.34Å; F74-I81 HydrophobicContact CB-CG2 4.03Å; F74-I81 HydrophobicContact CD1-CG2 4.17Å; F74-V83 HydrophobicContact CD1-CG1 4.08Å; F74-V83 HydrophobicContact CD1-CG2 3.95Å; F74-V83 HydrophobicContact CE1-CG1 3.81Å; F74-V83 HydrophobicContact CE1-CG2 4.1Å; F74-L117 HydrophobicContact CB-CD1 3.83Å; F74-L126 HydrophobicContact CB-CD1 4.35Å; F74-L126 HydrophobicContact CB-CD2 4.36Å; F74-L126 HydrophobicContact CD1-CD1 4.41Å; F74-L126 HydrophobicContact CD1-CD2 3.46Å; F74-L126 VanDerWaalsContact CD1-CD2 3.46Å; F74-L126 HydrophobicContact CD2-CD1 3.75Å; F74-L126 HydrophobicContact CD2-CD2 4.31Å; F74-L126 HydrophobicContact CE1-CD2 3.73Å; F74-L126 HydrophobicContact CE2-CD1 4.13Å; F74-L126 HydrophobicContact CG-CD1 3.9Å; F74-L126 HydrophobicContact CG-CD2 3.78Å; F74-L126 HydrophobicContact CG-CG 4.49Å; F74-L126 HydrophobicContact CZ-CD2 4.26Å; F74-I140 HydrophobicContact CE2-CD1 4.22Å; F74-I140 HydrophobicContact CZ-CD1 3.93Å; F74-I140 HydrophobicContact CZ-CG1 4.26Å; F74-F144 AromaticContact CE1-CD1 3.81Å; F74-F144 HydrophobicContact CE1-CD1 3.81Å; F74-F144 AromaticContact CE1-CE1 3.5Å; F74-F144 HydrophobicContact CE1-CE1 3.5Å; F74-F144 VanDerWaalsContact CE1-CE1 3.5Å; F74-F144 HydrophobicContact CE1-CZ 4.4Å; F74-F144 HydrophobicContact CZ-CD1 4.37Å; F74-F144 AromaticContact CZ-CE1 3.79Å; F74-F144 HydrophobicContact CZ-CE1 3.79Å
75	C	97.9	Very high	96	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.014	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	105.3	-176.5	-49.8	0	0	0	0	109.7	I33 I63 L66 I81 V82	I33-C75 WeakPolarHBondContact CD1-SG 3.35Å; I63-C75 HydrophobicContact CG2-CB 4.43Å; L66-C75 HydrophobicContact CD2-CB 4.16Å; C75-I81 CarbonylContact O-C 3.55Å; C75-I81 WeakPolarHBondContact O-CA 3.45Å; C75-V82 HydrophobicContact CB-CB 4.26Å; C75-V82 PolarHBondContact N-O 3.47Å; C75-V82 PolarHBondContact O-N 3.18Å
76	G	97.4	Very high	95.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	128	179.2	0	0	0	0	0	111.5	Y64 A65	Y64-G76 PolarHBondContact N-O 3.42Å; A65-G76 PolarHBondContact O-N 2.7Å
77	S	96.5	Very high	95.7	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.007	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	-164.4	175	-160.7	0	0	0	0	110.8	G61 N62 G79 L80 V114	G61-S77 PolarHBondContact N-OG 2.99Å; N62-S77 WeakPolarHBondContact O-CA 3.48Å; N62-S77 WeakPolarHBondContact O-CB 3.21Å; N62-S77 PolarHBondContact O-OG 2.94Å; S77-G79 PolarHBondContact O-N 2.84Å; S77-G79 VanDerWaalsContact O-N 3.11Å; S77-L80 PolarHBondContact N-O 3.35Å; S77-V114 WeakPolarHBondContact O-CB 3.23Å; S77-V114 WeakPolarHBondContact O-CG2 3.11Å; S77-V114 PolarHBondContact O-N 2.85Å
78	V	94	Very high	95.1	Very high	55 Å²	55	26.5 Å²	26.5	33%	0.333	13%	0.133	S	C	.	.	B	Isolated β-bridge	trans	-68.1	107.3	177.7	-169.1	0	0	0	0	109.4	Y64 L80 V111 E113	Y64-V78 HydrophobicContact CE2-CG2 4.13Å; V78-L80 VanDerWaalsContact C-N 3.26Å; V78-L80 PolarHBondContact O-N 2.82Å; V78-V111 HydrophobicContact CG1-CB 4.29Å; V78-V111 HydrophobicContact CG1-CG1 4.02Å; V78-E113 HydrophobicContact CG1-CG 4.38Å; V78-E113 HydrophobicContact CG2-CG 3.98Å
79	G	92.2	Very high	94.5	Very high	4 Å²	4	28.3 Å²	28.3	4%	0.041	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	6.1	174.4	0	0	0	0	0	117.3	S77 L102 S112	S77-G79 PolarHBondContact O-N 2.84Å; S77-G79 VanDerWaalsContact O-N 3.11Å; G79-L102 PolarHBondContact O-N 3.01Å; G79-S112 WeakPolarHBondContact CA-O 3.19Å; G79-S112 PolarHBondContact N-O 3.3Å
80	L	94.9	Very high	94	Very high	10 Å²	10	34.4 Å²	34.4	5%	0.052	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	156.4	-175.1	60.6	84.6	0	0	0	112.7	S77 V78 V82 T99 V100	S77-L80 PolarHBondContact N-O 3.35Å; V78-L80 VanDerWaalsContact C-N 3.26Å; V78-L80 PolarHBondContact O-N 2.82Å; L80-V82 HydrophobicContact CD1-CG2 3.43Å; L80-V82 VanDerWaalsContact CD1-CG2 3.43Å; L80-T99 HydrophobicContact CB-CG2 4.23Å; L80-T99 HydrophobicContact CD1-CG2 4.45Å; L80-T99 HydrophobicContact CD2-CG2 4.45Å; L80-V100 CarbonylContact C-O 3.54Å; L80-V100 WeakPolarHBondContact CA-O 3.36Å
81	I	96.6	Very high	93.7	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	117.3	168.2	-58.5	165.3	0	0	0	107	F74 C75 V83 T99 V100 L102 V114 L117 L126 A128 F138	F74-I81 HydrophobicContact CB-CG2 4.03Å; F74-I81 HydrophobicContact CD1-CG2 4.17Å; C75-I81 CarbonylContact O-C 3.55Å; C75-I81 WeakPolarHBondContact O-CA 3.45Å; I81-V83 HydrophobicContact CG2-CG2 4.43Å; I81-T99 WeakPolarHBondContact O-CA 3.5Å; I81-V100 HydrophobicContact CB-CB 4.38Å; I81-V100 PolarHBondContact N-O 3.41Å; I81-V100 PolarHBondContact O-N 2.86Å; I81-L102 HydrophobicContact CD1-CD1 4.15Å; I81-L102 HydrophobicContact CG1-CD1 3.94Å; I81-V114 HydrophobicContact CG1-CG1 4.34Å; I81-V114 HydrophobicContact CG1-CG2 4.1Å; I81-L117 HydrophobicContact CD1-CD2 3.88Å; I81-L117 HydrophobicContact CG1-CD2 4.27Å; I81-L126 HydrophobicContact CD1-CD2 4.37Å; I81-A128 HydrophobicContact CD1-CB 3.74Å; I81-F138 HydrophobicContact CD1-CE2 4Å
82	V	97	Very high	93.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	128.7	170.6	-171.1	0	0	0	0	108.7	V57 C75 L80 Y84 Y96 T99	V57-V82 HydrophobicContact CG1-CB 3.82Å; V57-V82 HydrophobicContact CG1-CG1 4.08Å; V57-V82 HydrophobicContact CG1-CG2 3.57Å; C75-V82 HydrophobicContact CB-CB 4.26Å; C75-V82 PolarHBondContact N-O 3.47Å; C75-V82 PolarHBondContact O-N 3.18Å; L80-V82 HydrophobicContact CD1-CG2 3.43Å; L80-V82 VanDerWaalsContact CD1-CG2 3.43Å; V82-Y84 HydrophobicContact CB-CE2 4.1Å; V82-Y84 HydrophobicContact CG1-CD2 4.17Å; V82-Y84 HydrophobicContact CG1-CE2 3.46Å; V82-Y84 VanDerWaalsContact CG1-CE2 3.46Å; V82-Y96 HydrophobicContact CG1-CD2 4.12Å; V82-Y96 HydrophobicContact CG1-CE2 4.04Å; V82-T99 HydrophobicContact CG2-CG2 4.42Å
83	V	96.8	Very high	93.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.8	-178.4	-169.8	0	0	0	0	109.2	Y72 F74 I81 H97 D98 V100 F144	Y72-V83 HydrophobicContact CD1-CG1 3.8Å; Y72-V83 HydrophobicContact CG-CG1 4.14Å; F74-V83 HydrophobicContact CD1-CG1 4.08Å; F74-V83 HydrophobicContact CD1-CG2 3.95Å; F74-V83 HydrophobicContact CE1-CG1 3.81Å; F74-V83 HydrophobicContact CE1-CG2 4.1Å; I81-V83 HydrophobicContact CG2-CG2 4.43Å; V83-H97 HydrophobicContact CG1-CB 4.33Å; V83-H97 WeakPolarHBondContact O-CB 3.28Å; V83-H97 PolarHBondContact O-N 2.94Å; V83-D98 HydrophobicContact CB-CB 4.35Å; V83-D98 PolarHBondContact N-O 3.38Å; V83-D98 PolarHBondContact O-N 3.21Å; V83-V100 HydrophobicContact CG2-CG2 4.32Å; V83-F144 HydrophobicContact CG1-CE1 4.06Å; V83-F144 HydrophobicContact CG1-CE2 3.99Å; V83-F144 HydrophobicContact CG1-CZ 3.65Å; V83-F144 HydrophobicContact CG2-CD2 4.4Å; V83-F144 HydrophobicContact CG2-CE2 4.5Å; V83-F144 HydrophobicContact CG2-CG 4.44Å
84	Y	96.6	Very high	93.2	Very high	10 Å²	10	30.7 Å²	30.7	4%	0.039	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.5	170.8	-67.6	-87.9	0	0	0	109.9	I33 I55 V57 Y72 V73 V82 L94 K95 Y96	I33-Y84 HydrophobicContact CD1-CD2 4.44Å; I33-Y84 HydrophobicContact CD1-CE2 4.19Å; I55-Y84 HydrophobicContact CG2-CE1 4.06Å; V57-Y84 WeakPolarHBondContact CA-OH 3.38Å; V57-Y84 HydrophobicContact CG1-CE2 4.23Å; V57-Y84 HydrophobicContact CG2-CE2 4.22Å; Y72-Y84 CarbonylContact C-O 3.59Å; Y72-Y84 WeakPolarHBondContact CA-O 3.25Å; V73-Y84 PolarHBondContact N-O 3.02Å; V73-Y84 PolarHBondContact O-N 3.34Å; V82-Y84 HydrophobicContact CB-CE2 4.1Å; V82-Y84 HydrophobicContact CG1-CD2 4.17Å; V82-Y84 HydrophobicContact CG1-CE2 3.46Å; V82-Y84 VanDerWaalsContact CG1-CE2 3.46Å; Y84-L94 HydrophobicContact CD1-CB 3.89Å; Y84-L94 HydrophobicContact CG-CB 4.09Å; Y84-L94 HydrophobicContact CG-CD1 4.37Å; Y84-K95 CarbonylContact C-O 3.52Å; Y84-K95 WeakPolarHBondContact CA-O 3.41Å; Y84-Y96 HydrophobicContact CE1-CD2 4.49Å
85	K	95.6	Very high	93.1	Very high	93 Å²	93	35.2 Å²	35.2	40%	0.404	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	125.1	164	-172.8	169.5	-176.1	170	0	108.9	D71 Y72 T87 L94 K95	D71-K85 CarbonylContact O-C 3.53Å; D71-K85 WeakPolarHBondContact O-CA 3.47Å; Y72-K85 HydrophobicContact CD1-CB 4.31Å; Y72-K85 HydrophobicContact CE1-CB 4.26Å; Y72-K85 HydrophobicContact CE1-CG 4.43Å; K85-T87 HydrophobicContact CG-CG2 4.48Å; K85-L94 WeakPolarHBondContact O-CA 3.39Å; K85-K95 PolarHBondContact N-O 2.74Å; K85-K95 PolarHBondContact O-N 2.93Å
86	W	95.5	Very high	92.9	Very high	49 Å²	49	40.9 Å²	40.9	19%	0.186	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	126.9	170.3	-177.3	-111.6	0	0	0	109.6	Y23 L25 F68 D71 V73 F93 L94	Y23-W86 HydrophobicContact CD2-CH2 4.08Å; Y23-W86 AromaticContact CD2-CZ2 3.74Å; Y23-W86 HydrophobicContact CD2-CZ2 3.74Å; Y23-W86 HydrophobicContact CE2-CZ2 4.42Å; Y23-W86 HydrophobicContact CG-CH2 4.05Å; Y23-W86 HydrophobicContact CG-CZ2 4.19Å; L25-W86 HydrophobicContact CD1-CH2 4.12Å; L25-W86 HydrophobicContact CD1-CZ3 3.99Å; L25-W86 HydrophobicContact CD2-CZ3 4.14Å; F68-W86 HydrophobicContact CE1-CB 4.08Å; F68-W86 AromaticContact CE1-CD2 3.64Å; F68-W86 HydrophobicContact CE1-CD2 3.64Å; F68-W86 AromaticContact CE1-CE3 3.78Å; F68-W86 HydrophobicContact CE1-CE3 3.78Å; F68-W86 AromaticContact CE1-CG 3.77Å; F68-W86 HydrophobicContact CE1-CG 3.77Å; F68-W86 HydrophobicContact CE1-CZ3 4.48Å; F68-W86 AromaticContact CZ-CD2 3.89Å; F68-W86 HydrophobicContact CZ-CD2 3.89Å; F68-W86 AromaticContact CZ-CE3 3.65Å; F68-W86 HydrophobicContact CZ-CE3 3.65Å; F68-W86 HydrophobicContact CZ-CG 4.49Å; F68-W86 HydrophobicContact CZ-CH2 4.35Å; F68-W86 AromaticContact CZ-CZ3 3.92Å; F68-W86 HydrophobicContact CZ-CZ3 3.92Å; D71-W86 WeakPolarHBondContact O-CB 3.3Å; D71-W86 PolarHBondContact O-N 2.92Å; V73-W86 HydrophobicContact CG2-CE3 4.16Å; W86-F93 AromaticContact CH2-CD1 3.69Å; W86-F93 HydrophobicContact CH2-CD1 3.69Å; W86-F93 HydrophobicContact CH2-CE1 4.4Å; W86-F93 HydrophobicContact CZ2-CD1 4.33Å; W86-F93 HydrophobicContact CZ3-CB 4.23Å; W86-F93 HydrophobicContact CZ3-CD1 4.14Å; W86-L94 HydrophobicContact CE3-CD2 3.63Å; W86-L94 HydrophobicContact CE3-CG 4.47Å; W86-L94 HydrophobicContact CZ3-CD2 4.17Å
87	T	93.5	Very high	92.8	Very high	22 Å²	22	44.8 Å²	44.8	14%	0.135	24%	0.237	C	C	.	.			trans	-129.5	177.6	-179.1	66.6	0	0	0	0	110.5	K85 D91 F93 K95	K85-T87 HydrophobicContact CG-CG2 4.48Å; T87-D91 HydrophobicContact CG2-CB 4.49Å; T87-D91 WeakPolarHBondContact OG1-CB 3.16Å; T87-F93 PolarHBondContact N-O 3.35Å; T87-F93 WeakPolarHBondContact OG1-CA 3.38Å; T87-F93 PolarHBondContact OG1-N 2.76Å; T87-F93 PolarHBondContact OG1-O 3.35Å; T87-K95 HydrophobicContact CG2-CB 4.28Å; T87-K95 HydrophobicContact CG2-CD 3.96Å; T87-K95 HydrophobicContact CG2-CG 3.93Å
88	T	85.9	Confident	92.7	Very high	69 Å²	69	47.5 Å²	47.5	42%	0.423	25%	0.251	S	S	.	.			trans	-69.5	161.9	174.3	59.1	0	0	0	0	111.5	T90 D91 G92 F93	T88-T90 PolarHBondContact O-N 2.77Å; T88-T90 PolarHBondContact OG1-OG1 2.96Å; T88-D91 PolarHBondContact O-N 2.88Å; T88-D91 PolarHBondContact OG1-OD2 3.19Å; T88-G92 PolarHBondContact O-N 3.07Å; T88-F93 PolarHBondContact O-N 2.77Å
89	P	83	Confident	92.8	Very high	60 Å²	60	45.8 Å²	45.8	39%	0.39	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-55.2	-37	173.3	-26.4	34	0	0	0	113.3	Y23 D91 G92 F93	Y23-P89 HydrophobicContact CE1-CG 4.42Å; Y23-P89 WeakPolarHBondContact OH-CG 3.14Å; P89-D91 PolarHBondContact O-N 2.76Å; P89-G92 PolarHBondContact O-N 2.91Å; P89-F93 HydrophobicContact CB-CE1 3.87Å; P89-F93 HydrophobicContact CB-CE2 3.96Å; P89-F93 HydrophobicContact CB-CZ 3.49Å; P89-F93 VanDerWaalsContact CB-CZ 3.49Å; P89-F93 HydrophobicContact CG-CD1 4.46Å; P89-F93 HydrophobicContact CG-CE1 3.65Å; P89-F93 HydrophobicContact CG-CZ 3.74Å
90	T	84.2	Confident	92.8	Very high	131 Å²	131	46.5 Å²	46.5	80%	0.804	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-65.4	-23.6	178.7	55.7	0	0	0	0	112.8	T88	T88-T90 PolarHBondContact O-N 2.77Å; T88-T90 PolarHBondContact OG1-OG1 2.96Å
91	D	86.7	Confident	92.7	Very high	82 Å²	82	52.3 Å²	52.3	44%	0.439	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-96.8	5.5	179.8	-88.9	-49.7	0	0	0	113.8	T87 T88 P89 K95	T87-D91 HydrophobicContact CG2-CB 4.49Å; T87-D91 WeakPolarHBondContact OG1-CB 3.16Å; T88-D91 PolarHBondContact O-N 2.88Å; T88-D91 PolarHBondContact OG1-OD2 3.19Å; P89-D91 PolarHBondContact O-N 2.76Å; D91-K95 VanDerWaalsContact CG-NZ 3.3Å; D91-K95 VanDerWaalsContact O-CE 3.26Å; D91-K95 WeakPolarHBondContact O-CE 3.43Å; D91-K95 IonicContact OD1-NZ 3.9Å; D91-K95 PolarHBondContact OD1-NZ 2.87Å; D91-K95 IonicContact OD2-NZ 3.01Å
92	G	88.1	Confident	92.4	Very high	33 Å²	33	53 Å²	53	34%	0.34	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	15.3	178.6	0	0	0	0	0	115.3	T88 P89 L94	T88-G92 PolarHBondContact O-N 3.07Å; P89-G92 PolarHBondContact O-N 2.91Å; G92-L94 PolarHBondContact O-N 3.1Å
93	F	92.4	Very high	91.4	Very high	10 Å²	10	57.6 Å²	57.6	4%	0.044	30%	0.303	C	S	.	.	S	Bend	trans	65.4	-47.8	-179.7	-66.1	-84.5	0	0	0	117.3	Y23 I35 E52 C53 W86 T87 T88 P89	Y23-F93 HydrophobicContact CD1-CD1 4.48Å; Y23-F93 AromaticContact CD1-CE1 3.56Å; Y23-F93 HydrophobicContact CD1-CE1 3.56Å; Y23-F93 HydrophobicContact CD1-CZ 4.16Å; Y23-F93 AromaticContact CE1-CE1 3.37Å; Y23-F93 HydrophobicContact CE1-CE1 3.37Å; Y23-F93 AromaticContact CE1-CZ 3.75Å; Y23-F93 HydrophobicContact CE1-CZ 3.75Å; Y23-F93 HydrophobicContact CE2-CE1 4.33Å; Y23-F93 HydrophobicContact CG-CE1 4.15Å; Y23-F93 AromaticContact CZ-CE1 3.79Å; I35-F93 HydrophobicContact CD1-CB 3.58Å; I35-F93 HydrophobicContact CD1-CG 4.09Å; I35-F93 HydrophobicContact CG2-CD1 4.11Å; I35-F93 HydrophobicContact CG2-CE1 4.31Å; I35-F93 HydrophobicContact CG2-CG 4.28Å; E52-F93 HydrophobicContact CB-CE2 4.27Å; E52-F93 HydrophobicContact CB-CZ 4.42Å; E52-F93 VanDerWaalsContact OE2-CZ 3.26Å; E52-F93 WeakPolarHBondContact OE2-CZ 3.42Å; C53-F93 HydrophobicContact CB-CD2 3.73Å; C53-F93 HydrophobicContact CB-CE2 4.2Å; W86-F93 AromaticContact CH2-CD1 3.69Å; W86-F93 HydrophobicContact CH2-CD1 3.69Å; W86-F93 HydrophobicContact CH2-CE1 4.4Å; W86-F93 HydrophobicContact CZ2-CD1 4.33Å; W86-F93 HydrophobicContact CZ3-CB 4.23Å; W86-F93 HydrophobicContact CZ3-CD1 4.14Å; T87-F93 PolarHBondContact N-O 3.35Å; T87-F93 WeakPolarHBondContact OG1-CA 3.38Å; T87-F93 PolarHBondContact OG1-N 2.76Å; T87-F93 PolarHBondContact OG1-O 3.35Å; T88-F93 PolarHBondContact O-N 2.77Å; P89-F93 HydrophobicContact CB-CE1 3.87Å; P89-F93 HydrophobicContact CB-CE2 3.96Å; P89-F93 HydrophobicContact CB-CZ 3.49Å; P89-F93 VanDerWaalsContact CB-CZ 3.49Å; P89-F93 HydrophobicContact CG-CD1 4.46Å; P89-F93 HydrophobicContact CG-CE1 3.65Å; P89-F93 HydrophobicContact CG-CZ 3.74Å
94	L	94.9	Very high	90	Very high	13 Å²	13	59 Å²	59	7%	0.068	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	116	-175	-66.8	-178.4	0	0	0	110	L25 I33 I35 I55 V73 Y84 K85 W86 G92	L25-L94 HydrophobicContact CD2-CD1 4.33Å; I33-L94 HydrophobicContact CD1-CD1 4.12Å; I33-L94 HydrophobicContact CG2-CD1 4.38Å; I35-L94 HydrophobicContact CD1-CD1 3.86Å; I35-L94 HydrophobicContact CD1-CG 3.95Å; I55-L94 HydrophobicContact CG1-CB 4.32Å; I55-L94 HydrophobicContact CG1-CD1 4.21Å; V73-L94 HydrophobicContact CB-CD2 3.96Å; V73-L94 HydrophobicContact CG2-CD2 3.7Å; Y84-L94 HydrophobicContact CD1-CB 3.89Å; Y84-L94 HydrophobicContact CG-CB 4.09Å; Y84-L94 HydrophobicContact CG-CD1 4.37Å; K85-L94 WeakPolarHBondContact O-CA 3.39Å; W86-L94 HydrophobicContact CE3-CD2 3.63Å; W86-L94 HydrophobicContact CE3-CG 4.47Å; W86-L94 HydrophobicContact CZ3-CD2 4.17Å; G92-L94 PolarHBondContact O-N 3.1Å
95	K	94.9	Very high	88.2	Confident	95 Å²	95	61.4 Å²	61.4	41%	0.413	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.3	169.9	-69	-175.9	-177	167.1	0	108.9	Y84 K85 T87 D91 H97	Y84-K95 CarbonylContact C-O 3.52Å; Y84-K95 WeakPolarHBondContact CA-O 3.41Å; K85-K95 PolarHBondContact N-O 2.74Å; K85-K95 PolarHBondContact O-N 2.93Å; T87-K95 HydrophobicContact CG2-CB 4.28Å; T87-K95 HydrophobicContact CG2-CD 3.96Å; T87-K95 HydrophobicContact CG2-CG 3.93Å; D91-K95 VanDerWaalsContact CG-NZ 3.3Å; D91-K95 VanDerWaalsContact O-CE 3.26Å; D91-K95 WeakPolarHBondContact O-CE 3.43Å; D91-K95 IonicContact OD1-NZ 3.9Å; D91-K95 PolarHBondContact OD1-NZ 2.87Å; D91-K95 IonicContact OD2-NZ 3.01Å; K95-H97 PolarHBondContact O-N 3.08Å
96	Y	95	Very high	86.4	Confident	120 Å²	120	61.2 Å²	61.2	47%	0.471	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	133.1	176	173.1	-94.3	0	0	0	110.1	V82 Y84 D98 T99	V82-Y96 HydrophobicContact CG1-CD2 4.12Å; V82-Y96 HydrophobicContact CG1-CE2 4.04Å; Y84-Y96 HydrophobicContact CE1-CD2 4.49Å; Y96-D98 WeakPolarHBondContact CE2-O 3.35Å; Y96-T99 WeakPolarHBondContact CE2-OG1 3.47Å; Y96-T99 PolarHBondContact OH-N 2.68Å; Y96-T99 PolarHBondContact OH-OG1 3.21Å
97	H	94.7	Very high	84.3	Confident	83 Å²	83	67.1 Å²	67.1	38%	0.384	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	-55.9	178.5	-173.9	-75	0	0	0	111.6	Y72 V83 K95 F144	Y72-H97 HydrophobicContact CE1-CB 4.45Å; Y72-H97 AromaticContact CE1-CD2 3.62Å; Y72-H97 AromaticContact CE1-CG 3.89Å; Y72-H97 AromaticContact CE1-NE2 3.98Å; V83-H97 HydrophobicContact CG1-CB 4.33Å; V83-H97 WeakPolarHBondContact O-CB 3.28Å; V83-H97 PolarHBondContact O-N 2.94Å; K95-H97 PolarHBondContact O-N 3.08Å; H97-F144 AromaticContact CE1-CE2 3.61Å; H97-F144 AromaticContact ND1-CE2 3.51Å
98	D	94.8	Very high	82.6	Confident	58 Å²	58	76.3 Å²	76.3	31%	0.31	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	172.9	-175.3	-157.1	1.8	0	0	0	112.8	V83 Y96 F144	V83-D98 HydrophobicContact CB-CB 4.35Å; V83-D98 PolarHBondContact N-O 3.38Å; V83-D98 PolarHBondContact O-N 3.21Å; Y96-D98 WeakPolarHBondContact CE2-O 3.35Å; D98-F144 HydrophobicContact CB-CD2 4.37Å
99	T	94.6	Very high	81.3	Confident	18 Å²	18	75.1 Å²	75.1	11%	0.11	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	112.6	170.9	-58.3	0	0	0	0	110	L80 I81 V82 Y96	L80-T99 HydrophobicContact CB-CG2 4.23Å; L80-T99 HydrophobicContact CD1-CG2 4.45Å; L80-T99 HydrophobicContact CD2-CG2 4.45Å; I81-T99 WeakPolarHBondContact O-CA 3.5Å; V82-T99 HydrophobicContact CG2-CG2 4.42Å; Y96-T99 WeakPolarHBondContact CE2-OG1 3.47Å; Y96-T99 PolarHBondContact OH-N 2.68Å; Y96-T99 PolarHBondContact OH-OG1 3.21Å
100	V	93.9	Very high	80.7	Confident	20 Å²	20	78.3 Å²	78.3	12%	0.121	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	114.6	178.2	-176.5	0	0	0	0	108.3	L80 I81 V83 F138 F144	L80-V100 CarbonylContact C-O 3.54Å; L80-V100 WeakPolarHBondContact CA-O 3.36Å; I81-V100 HydrophobicContact CB-CB 4.38Å; I81-V100 PolarHBondContact N-O 3.41Å; I81-V100 PolarHBondContact O-N 2.86Å; V83-V100 HydrophobicContact CG2-CG2 4.32Å; V100-F138 HydrophobicContact CG1-CD1 4.24Å; V100-F138 HydrophobicContact CG1-CE1 3.73Å; V100-F138 HydrophobicContact CG1-CZ 4.24Å; V100-F144 HydrophobicContact CG2-CB 3.64Å; V100-F144 HydrophobicContact CG2-CG 4.39Å
101	H	91.9	Very high	80.6	Confident	132 Å²	132	76.2 Å²	76.2	61%	0.611	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	130.6	173.6	-71.5	-78	0	0	0	110.5
102	L	89.9	Confident	80.8	Confident	14 Å²	14	72.8 Å²	72.8	7%	0.073	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-96.1	130.8	178.6	-68.9	141.7	0	0	0	109.5	G79 I81 V114 L130 H136 F138	G79-L102 PolarHBondContact O-N 3.01Å; I81-L102 HydrophobicContact CD1-CD1 4.15Å; I81-L102 HydrophobicContact CG1-CD1 3.94Å; L102-V114 HydrophobicContact CD1-CG2 3.07Å; L102-L130 HydrophobicContact CB-CD2 4.38Å; L102-L130 HydrophobicContact CD2-CD1 4.37Å; L102-L130 HydrophobicContact CD2-CD2 4.41Å; L102-H136 HydrophobicContact CD2-CB 3.81Å; L102-F138 HydrophobicContact CD2-CE2 4.13Å; L102-F138 HydrophobicContact CD2-CZ 3.58Å
103	T	76.9	Confident	81.1	Confident	97 Å²	97	74.7 Å²	74.7	60%	0.595	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-88.5	129.2	172.3	55.9	0	0	0	0	109.4	K149	T103-K149 PolarHBondContact O-NZ 3.33Å
104	S	66.7	Low	81.3	Confident	31 Å²	31	74.2 Å²	74.2	22%	0.217	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-61.3	150	169.6	-178.1	0	0	0	0	109.5	N106 A109	S104-N106 PolarHBondContact O-N 3.24Å; S104-N106 PolarHBondContact OG-N 2.75Å; S104-A109 WeakPolarHBondContact OG-CB 3.17Å
105	G	58.8	Low	81.4	Confident	59 Å²	59	74.8 Å²	74.8	61%	0.608	40%	0.399	S	S	*	.	S	Bend	trans	-65.1	-13	173.5	0	0	0	0	0	113.5	K149	G105-K149 VanDerWaalsContact CA-NZ 3.3Å
106	N	58.1	Low	81.5	Confident	89 Å²	89	70.6 Å²	70.6	48%	0.476	38%	0.383	S	S	.	.	S	Bend	trans	-124.4	123.8	-173.6	-176	-6.6	0	0	0	110.8	S104 Y108 A109	S104-N106 PolarHBondContact O-N 3.24Å; S104-N106 PolarHBondContact OG-N 2.75Å; N106-Y108 PolarHBondContact O-N 3.22Å; N106-Y108 VanDerWaalsContact O-N 3.15Å; N106-Y108 PolarHBondContact OD1-N 3.11Å; N106-Y108 VanDerWaalsContact OD1-N 3.11Å; N106-A109 HydrophobicContact CB-CB 3.67Å; N106-A109 PolarHBondContact O-N 3.09Å
107	L	51.8	Low	81.6	Confident	173 Å²	173	65.7 Å²	65.7	91%	0.906	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-23.9	179.4	-75	158.5	0	0	0	113.4
108	Y	57	Low	81.7	Confident	215 Å²	215	62.2 Å²	62.2	84%	0.843	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-2.1	179.4	-60.7	-79.2	0	0	0	113.5	N106	N106-Y108 PolarHBondContact O-N 3.22Å; N106-Y108 VanDerWaalsContact O-N 3.15Å; N106-Y108 PolarHBondContact OD1-N 3.11Å; N106-Y108 VanDerWaalsContact OD1-N 3.11Å
109	A	58.4	Low	81.7	Confident	44 Å²	44	61.3 Å²	61.3	36%	0.364	34%	0.342	S	S	.	.	S	Bend	trans	-81.6	148	-178.9	0	0	0	0	0	111.7	S104 N106	S104-A109 WeakPolarHBondContact OG-CB 3.17Å; N106-A109 HydrophobicContact CB-CB 3.67Å; N106-A109 PolarHBondContact O-N 3.09Å
110	T	70.6	Confident	81.6	Confident	127 Å²	127	60.6 Å²	60.6	78%	0.779	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-55.7	151	163.7	49.4	0	0	0	0	110.1	S112	T110-S112 PolarHBondContact O-N 2.78Å
111	V	83.1	Confident	81.5	Confident	87 Å²	87	63.8 Å²	63.8	53%	0.527	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-57	121.1	171.6	-178.7	0	0	0	0	108.9	V78	V78-V111 HydrophobicContact CG1-CB 4.29Å; V78-V111 HydrophobicContact CG1-CG1 4.02Å
112	S	90.2	Very high	81.4	Confident	11 Å²	11	64.2 Å²	64.2	8%	0.077	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-82.1	146	-175.9	-178	0	0	0	0	111.9	G79 T110 G131 D132	G79-S112 WeakPolarHBondContact CA-O 3.19Å; G79-S112 PolarHBondContact N-O 3.3Å; T110-S112 PolarHBondContact O-N 2.78Å; S112-G131 VanDerWaalsContact OG-CA 3.3Å; S112-G131 WeakPolarHBondContact OG-CA 3.5Å; S112-G131 PolarHBondContact OG-N 3.42Å; S112-D132 PolarHBondContact OG-N 2.89Å
113	E	93.9	Very high	81.3	Confident	72 Å²	72	65.4 Å²	65.4	34%	0.336	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-74.5	141.1	175.2	-55.4	89.5	166	0	0	112.2	Y64 V78 T115 L130 G131	Y64-E113 HydrophobicContact CD2-CB 4.02Å; Y64-E113 HydrophobicContact CD2-CG 4.3Å; Y64-E113 HydrophobicContact CE2-CB 3.89Å; Y64-E113 HydrophobicContact CE2-CG 3.65Å; V78-E113 HydrophobicContact CG1-CG 4.38Å; V78-E113 HydrophobicContact CG2-CG 3.98Å; E113-T115 HydrophobicContact CB-CG2 4.29Å; E113-T115 PolarHBondContact O-N 3.01Å; E113-L130 CarbonylContact O-C 3.51Å; E113-L130 VanDerWaalsContact O-CA 3.25Å; E113-L130 WeakPolarHBondContact O-CA 3.22Å; E113-G131 PolarHBondContact O-N 3.29Å
114	V	96.9	Very high	82	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	95.2	166.1	-177.7	0	0	0	0	108.4	Y64 S77 I81 L102 L117 A128 A129	Y64-V114 VanDerWaalsContact CB-O 3.27Å; Y64-V114 WeakPolarHBondContact CB-O 3.45Å; S77-V114 WeakPolarHBondContact O-CB 3.23Å; S77-V114 WeakPolarHBondContact O-CG2 3.11Å; S77-V114 PolarHBondContact O-N 2.85Å; I81-V114 HydrophobicContact CG1-CG1 4.34Å; I81-V114 HydrophobicContact CG1-CG2 4.1Å; L102-V114 HydrophobicContact CD1-CG2 3.07Å; V114-L117 HydrophobicContact CG1-CD1 4.48Å; V114-L117 HydrophobicContact CG1-CD2 3.89Å; V114-L117 HydrophobicContact CG1-CG 3.92Å; V114-A128 HydrophobicContact CG1-CB 4.24Å; V114-A129 CarbonylContact C-O 3.57Å; V114-A129 WeakPolarHBondContact CA-O 3.28Å
115	T	96.9	Very high	83.2	Confident	25 Å²	25	60.9 Å²	60.9	15%	0.153	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-22.8	-173.2	49.5	0	0	0	0	113.2	E113 A129 T156 I157	E113-T115 HydrophobicContact CB-CG2 4.29Å; E113-T115 PolarHBondContact O-N 3.01Å; T115-A129 PolarHBondContact N-O 2.86Å; T115-A129 PolarHBondContact OG1-O 3.04Å; T115-A129 VanDerWaalsContact OG1-O 3.14Å; T115-T156 HydrophobicContact CG2-CG2 4.14Å; T115-I157 WeakPolarHBondContact CB-O 3.36Å; T115-I157 PolarHBondContact OG1-O 3.09Å
116	G	97.1	Very high	85	Confident	8 Å²	8	58.2 Å²	58.2	8%	0.082	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	145.2	-179.8	0	0	0	0	0	112.4	A129 I160	G116-A129 PolarHBondContact N-O 2.74Å; G116-A129 PolarHBondContact O-N 3.14Å; G116-I160 VanDerWaalsContact C-CG2 3.5Å
117	L	98.1	Very high	86.8	Confident	16 Å²	16	54 Å²	54	8%	0.084	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	137.1	174.8	-73.4	168.4	0	0	0	109.2	A65 C67 F74 I81 V114 L126 L127 A128	A65-L117 HydrophobicContact CB-CB 4.04Å; A65-L117 HydrophobicContact CB-CD1 3.9Å; A65-L117 HydrophobicContact CB-CG 3.78Å; C67-L117 HydrophobicContact CB-CB 3.55Å; F74-L117 HydrophobicContact CB-CD1 3.83Å; I81-L117 HydrophobicContact CD1-CD2 3.88Å; I81-L117 HydrophobicContact CG1-CD2 4.27Å; V114-L117 HydrophobicContact CG1-CD1 4.48Å; V114-L117 HydrophobicContact CG1-CD2 3.89Å; V114-L117 HydrophobicContact CG1-CG 3.92Å; L117-L126 HydrophobicContact CD2-CD1 4.25Å; L117-L126 HydrophobicContact CD2-CD2 4.39Å; L117-L126 HydrophobicContact CD2-CG 4.42Å; L117-L127 WeakPolarHBondContact CA-O 3.22Å; L117-A128 HydrophobicContact CD2-CB 3.77Å
118	C	96.3	Very high	88.9	Confident	11 Å²	11	45.7 Å²	45.7	7%	0.074	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	125.1	176.5	178	0	0	0	0	109.8	L127 I160 S162	C118-L127 HydrophobicContact CB-CB 4.31Å; C118-L127 HydrophobicContact CB-CD1 4.37Å; C118-L127 PolarHBondContact N-O 3.41Å; C118-L127 WeakPolarHBondContact O-CB 3.27Å; C118-L127 PolarHBondContact O-N 2.99Å; C118-I160 HydrophobicContact CB-CG1 4.09Å; C118-I160 HydrophobicContact CB-CG2 4.02Å; C118-S162 PolarHBondContact SG-N 2.86Å
119	Y	95.5	Very high	90.8	Very high	38 Å²	38	35.5 Å²	35.5	15%	0.149	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	125	171.7	172	-119.4	0	0	0	109.4	C67 F68 K70 T121 D124 I140	C67-Y119 PolarHBondContact SG-N 2.84Å; F68-Y119 WeakPolarHBondContact O-CB 3.38Å; K70-Y119 WeakPolarHBondContact CG-OH 3.16Å; Y119-T121 HydrophobicContact CD1-CG2 4.07Å; Y119-T121 HydrophobicContact CE1-CG2 3.69Å; Y119-D124 PolarHBondContact OH-OD1 2.7Å; Y119-D124 VanDerWaalsContact OH-OD1 3.05Å; Y119-I140 HydrophobicContact CD2-CD1 3.45Å; Y119-I140 VanDerWaalsContact CD2-CD1 3.45Å; Y119-I140 HydrophobicContact CE2-CD1 3.24Å; Y119-I140 HydrophobicContact CE2-CG1 4.43Å; Y119-I140 HydrophobicContact CG-CD1 4.49Å
120	H	92.6	Very high	92.6	Very high	3 Å²	3	33.4 Å²	33.4	1%	0.014	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.6	175.9	-176	-87.5	0	0	0	109.7	S123 D124 T125 S162 A165 H182	H120-S123 VanDerWaalsContact ND1-CB 3.32Å; H120-S123 WeakPolarHBondContact ND1-CB 3.32Å; H120-S123 PolarHBondContact ND1-N 2.95Å; H120-S123 VanDerWaalsContact ND1-N 3.18Å; H120-S123 PolarHBondContact ND1-OG 3.27Å; H120-D124 WeakPolarHBondContact O-CA 3.28Å; H120-D124 PolarHBondContact O-N 2.86Å; H120-D124 VanDerWaalsContact O-N 3.1Å; H120-T125 PolarHBondContact N-O 2.98Å; H120-T125 PolarHBondContact O-N 3.3Å; H120-S162 PolarHBondContact CD2-OG 2.81Å; H120-A165 PolarHBondContact CE1-O 2.86Å; H120-A165 VanDerWaalsContact NE2-C 3.27Å; H120-A165 PolarHBondContact NE2-O 3.04Å; H120-H182 AromaticContact CD2-CD2 3.52Å; H120-H182 AromaticContact CD2-NE2 3.22Å; H120-H182 PolarHBondContact CD2-NE2 2.86Å; H120-H182 AromaticContact CE1-CD2 3.74Å; H120-H182 AromaticContact CG-CD2 3.87Å; H120-H182 AromaticContact CG-NE2 3.4Å; H120-H182 AromaticContact ND1-NE2 3.96Å; H120-H182 AromaticContact NE2-CD2 3.43Å; H120-H182 PolarHBondContact NE2-CD2 2.93Å; H120-H182 AromaticContact NE2-NE2 3.68Å
121	T	90.6	Very high	93.7	Very high	88 Å²	88	28 Å²	28	54%	0.54	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-48.6	-170	50.9	0	0	0	0	113.1	Y119 S123 D124	Y119-T121 HydrophobicContact CD1-CG2 4.07Å; Y119-T121 HydrophobicContact CE1-CG2 3.69Å; T121-S123 VanDerWaalsContact C-N 3.29Å; T121-S123 PolarHBondContact O-N 2.78Å; T121-D124 PolarHBondContact O-N 2.86Å
122	E	89.4	Confident	94.2	Very high	141 Å²	141	26.2 Å²	26.2	66%	0.659	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-29.6	-173.6	-63.5	-58.4	131.1	0	0	113.1	A165	E122-A165 HydrophobicContact CG-CB 4.14Å
123	S	88.3	Confident	94.4	Very high	38 Å²	38	25.7 Å²	25.7	27%	0.266	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	1.4	179.9	74.3	0	0	0	0	113	H120 T121 T125	H120-S123 VanDerWaalsContact ND1-CB 3.32Å; H120-S123 WeakPolarHBondContact ND1-CB 3.32Å; H120-S123 PolarHBondContact ND1-N 2.95Å; H120-S123 VanDerWaalsContact ND1-N 3.18Å; H120-S123 PolarHBondContact ND1-OG 3.27Å; T121-S123 VanDerWaalsContact C-N 3.29Å; T121-S123 PolarHBondContact O-N 2.78Å; S123-T125 PolarHBondContact O-N 2.9Å; S123-T125 VanDerWaalsContact O-N 3.16Å; S123-T125 PolarHBondContact O-OG1 2.68Å; S123-T125 WeakPolarHBondContact OG-CB 3.42Å; S123-T125 PolarHBondContact OG-OG1 2.93Å
124	D	91.1	Very high	94.3	Very high	32 Å²	32	22.9 Å²	22.9	17%	0.171	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	41.6	48.1	-173.8	-174.5	44.7	0	0	0	112.9	K70 Y119 H120 T121	K70-D124 WeakPolarHBondContact CD-OD1 3.42Å; K70-D124 VanDerWaalsContact CE-CG 3.47Å; K70-D124 WeakPolarHBondContact CE-OD1 3.35Å; K70-D124 IonicContact NZ-OD1 3.94Å; K70-D124 PolarHBondContact NZ-OD1 2.92Å; K70-D124 IonicContact NZ-OD2 2.67Å; K70-D124 PolarHBondContact NZ-OD2 3.2Å; Y119-D124 PolarHBondContact OH-OD1 2.7Å; Y119-D124 VanDerWaalsContact OH-OD1 3.05Å; H120-D124 WeakPolarHBondContact O-CA 3.28Å; H120-D124 PolarHBondContact O-N 2.86Å; H120-D124 VanDerWaalsContact O-N 3.1Å; T121-D124 PolarHBondContact O-N 2.86Å
125	T	92.5	Very high	94.2	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.2	-172.6	-61.3	0	0	0	0	109.6	H120 S123 L127 K147	H120-T125 PolarHBondContact N-O 2.98Å; H120-T125 PolarHBondContact O-N 3.3Å; S123-T125 PolarHBondContact O-N 2.9Å; S123-T125 VanDerWaalsContact O-N 3.16Å; S123-T125 PolarHBondContact O-OG1 2.68Å; S123-T125 WeakPolarHBondContact OG-CB 3.42Å; S123-T125 PolarHBondContact OG-OG1 2.93Å; T125-L127 HydrophobicContact CG2-CD2 4.22Å; T125-K147 HydrophobicContact CG2-CD 4.43Å; T125-K147 PolarHBondContact OG1-NZ 3.42Å
126	L	96.2	Very high	94	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.016	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	130.5	166.5	179.5	71.4	0	0	0	109.1	F74 I81 L117 T137 F138 I140	F74-L126 HydrophobicContact CB-CD1 4.35Å; F74-L126 HydrophobicContact CB-CD2 4.36Å; F74-L126 HydrophobicContact CD1-CD1 4.41Å; F74-L126 HydrophobicContact CD1-CD2 3.46Å; F74-L126 VanDerWaalsContact CD1-CD2 3.46Å; F74-L126 HydrophobicContact CD2-CD1 3.75Å; F74-L126 HydrophobicContact CD2-CD2 4.31Å; F74-L126 HydrophobicContact CE1-CD2 3.73Å; F74-L126 HydrophobicContact CE2-CD1 4.13Å; F74-L126 HydrophobicContact CG-CD1 3.9Å; F74-L126 HydrophobicContact CG-CD2 3.78Å; F74-L126 HydrophobicContact CG-CG 4.49Å; F74-L126 HydrophobicContact CZ-CD2 4.26Å; I81-L126 HydrophobicContact CD1-CD2 4.37Å; L117-L126 HydrophobicContact CD2-CD1 4.25Å; L117-L126 HydrophobicContact CD2-CD2 4.39Å; L117-L126 HydrophobicContact CD2-CG 4.42Å; L126-T137 CarbonylContact O-C 3.56Å; L126-T137 VanDerWaalsContact O-CA 3.28Å; L126-T137 WeakPolarHBondContact O-CA 3Å; L126-F138 HydrophobicContact CB-CB 4.33Å; L126-F138 HydrophobicContact CD2-CD2 4.37Å; L126-F138 PolarHBondContact N-O 3.16Å; L126-F138 VanDerWaalsContact N-O 3.07Å; L126-F138 PolarHBondContact O-N 3.26Å; L126-I140 HydrophobicContact CB-CG1 4.47Å
127	L	95.8	Very high	93.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.8	172.9	-56.4	170.5	0	0	0	109.2	L117 C118 T125 T137 I160 F168	L117-L127 WeakPolarHBondContact CA-O 3.22Å; C118-L127 HydrophobicContact CB-CB 4.31Å; C118-L127 HydrophobicContact CB-CD1 4.37Å; C118-L127 PolarHBondContact N-O 3.41Å; C118-L127 WeakPolarHBondContact O-CB 3.27Å; C118-L127 PolarHBondContact O-N 2.99Å; T125-L127 HydrophobicContact CG2-CD2 4.22Å; L127-T137 HydrophobicContact CD2-CG2 3.4Å; L127-T137 VanDerWaalsContact CD2-CG2 3.4Å; L127-I160 HydrophobicContact CB-CD1 3.66Å; L127-I160 HydrophobicContact CD1-CD1 4.06Å; L127-I160 HydrophobicContact CG-CD1 4.47Å; L127-F168 HydrophobicContact CD1-CB 3.83Å; L127-F168 HydrophobicContact CD1-CD1 3.87Å; L127-F168 HydrophobicContact CD1-CD2 3.94Å; L127-F168 HydrophobicContact CD1-CE1 4.36Å; L127-F168 HydrophobicContact CD1-CE2 4.44Å; L127-F168 HydrophobicContact CD1-CG 3.61Å
128	A	96.9	Very high	93.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.6	173.3	0	0	0	0	0	109.3	I81 V114 L117 L130 I135 H136 F138	I81-A128 HydrophobicContact CD1-CB 3.74Å; V114-A128 HydrophobicContact CG1-CB 4.24Å; L117-A128 HydrophobicContact CD2-CB 3.77Å; A128-L130 HydrophobicContact CB-CD1 4.41Å; A128-L130 WeakPolarHBondContact O-CD1 3.38Å; A128-I135 CarbonylContact O-C 3.48Å; A128-I135 VanDerWaalsContact O-CA 3.26Å; A128-I135 WeakPolarHBondContact O-CA 3.3Å; A128-H136 HydrophobicContact CB-CB 4.45Å; A128-H136 PolarHBondContact N-O 2.64Å; A128-H136 PolarHBondContact O-N 3.45Å; A128-F138 HydrophobicContact CB-CE2 4.01Å
129	A	96.7	Very high	93.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	137.5	173.2	0	0	0	0	0	109.8	V114 T115 G116 I157 I160	V114-A129 CarbonylContact C-O 3.57Å; V114-A129 WeakPolarHBondContact CA-O 3.28Å; T115-A129 PolarHBondContact N-O 2.86Å; T115-A129 PolarHBondContact OG1-O 3.04Å; T115-A129 VanDerWaalsContact OG1-O 3.14Å; G116-A129 PolarHBondContact N-O 2.74Å; G116-A129 PolarHBondContact O-N 3.14Å; A129-I157 HydrophobicContact CB-CB 3.9Å; A129-I157 HydrophobicContact CB-CD1 4.27Å; A129-I157 HydrophobicContact CB-CG2 3.58Å; A129-I160 HydrophobicContact CB-CB 3.99Å; A129-I160 HydrophobicContact CB-CD1 4.26Å; A129-I160 HydrophobicContact CB-CG2 3.85Å
130	L	95.9	Very high	93.3	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	158.3	-174.2	-72.6	85	0	0	0	113.3	L102 E113 A128 D132 G133 T134 H136 I157	L102-L130 HydrophobicContact CB-CD2 4.38Å; L102-L130 HydrophobicContact CD2-CD1 4.37Å; L102-L130 HydrophobicContact CD2-CD2 4.41Å; E113-L130 CarbonylContact O-C 3.51Å; E113-L130 VanDerWaalsContact O-CA 3.25Å; E113-L130 WeakPolarHBondContact O-CA 3.22Å; A128-L130 HydrophobicContact CB-CD1 4.41Å; A128-L130 WeakPolarHBondContact O-CD1 3.38Å; L130-D132 WeakPolarHBondContact CB-OD1 3.45Å; L130-D132 PolarHBondContact O-N 3.45Å; L130-G133 PolarHBondContact O-N 2.81Å; L130-T134 PolarHBondContact N-O 2.94Å; L130-H136 HydrophobicContact CD1-CB 4.3Å; L130-I157 PolarHBondContact O-N 3.42Å
131	G	94.8	Very high	93	Very high	13 Å²	13	29.1 Å²	29.1	13%	0.134	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.6	170	0	0	0	0	0	115.5	S112 E113 G133 T156	S112-G131 VanDerWaalsContact OG-CA 3.3Å; S112-G131 WeakPolarHBondContact OG-CA 3.5Å; S112-G131 PolarHBondContact OG-N 3.42Å; E113-G131 PolarHBondContact O-N 3.29Å; G131-G133 VanDerWaalsContact C-N 3.31Å; G131-T156 WeakPolarHBondContact O-CA 3.36Å; G131-T156 PolarHBondContact O-N 3.34Å; G131-T156 PolarHBondContact O-OG1 3.16Å
132	D	92.7	Very high	92.7	Very high	49 Å²	49	28 Å²	28	26%	0.262	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	5.2	176.6	70.7	-1.1	0	0	0	114	S112 L130 T134	S112-D132 PolarHBondContact OG-N 2.89Å; L130-D132 WeakPolarHBondContact CB-OD1 3.45Å; L130-D132 PolarHBondContact O-N 3.45Å; D132-T134 VanDerWaalsContact C-N 3.31Å; D132-T134 VanDerWaalsContact OD1-CB 3.27Å; D132-T134 WeakPolarHBondContact OD1-CB 3.27Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.5Å; D132-T134 PolarHBondContact OD1-N 3.02Å; D132-T134 PolarHBondContact OD1-OG1 3.05Å
133	G	93.5	Very high	92.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.144	C	C	.	.	S	Bend	trans	83.4	4.3	-178.6	0	0	0	0	0	114.4	L130 G131 G152 H153 S155	L130-G133 PolarHBondContact O-N 2.81Å; G131-G133 VanDerWaalsContact C-N 3.31Å; G133-G152 PolarHBondContact O-N 3.18Å; G133-G152 VanDerWaalsContact O-N 3.13Å; G133-H153 PolarHBondContact O-N 3.17Å; G133-S155 WeakPolarHBondContact CA-O 3.19Å
134	T	93.1	Very high	92.8	Very high	14 Å²	14	22.1 Å²	22.1	9%	0.086	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	154.9	177.6	69.6	0	0	0	0	112.8	L130 D132 H136 L150	L130-T134 PolarHBondContact N-O 2.94Å; D132-T134 VanDerWaalsContact C-N 3.31Å; D132-T134 VanDerWaalsContact OD1-CB 3.27Å; D132-T134 WeakPolarHBondContact OD1-CB 3.27Å; D132-T134 WeakPolarHBondContact OD1-CG2 3.5Å; D132-T134 PolarHBondContact OD1-N 3.02Å; D132-T134 PolarHBondContact OD1-OG1 3.05Å; T134-H136 PolarHBondContact OG1-CD2 3.26Å; T134-H136 PolarHBondContact OG1-NE2 3.47Å; T134-L150 CarbonylContact C-O 3.46Å; T134-L150 WeakPolarHBondContact CA-O 3.33Å; T134-L150 WeakPolarHBondContact CB-O 3.39Å
135	I	94	Very high	92.8	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118.7	172	-50.5	-179	0	0	0	107.9	A128 L150 I157 I160 F168 T170	A128-I135 CarbonylContact O-C 3.48Å; A128-I135 VanDerWaalsContact O-CA 3.26Å; A128-I135 WeakPolarHBondContact O-CA 3.3Å; I135-L150 HydrophobicContact CB-CB 4.14Å; I135-L150 HydrophobicContact CB-CD2 4.02Å; I135-L150 HydrophobicContact CD1-CD2 3.72Å; I135-L150 HydrophobicContact CG1-CD2 4.05Å; I135-L150 PolarHBondContact N-O 3.07Å; I135-L150 WeakPolarHBondContact O-CB 3.24Å; I135-L150 PolarHBondContact O-N 3.09Å; I135-I157 HydrophobicContact CD1-CD1 3.87Å; I135-I157 HydrophobicContact CG1-CD1 3.37Å; I135-I160 HydrophobicContact CD1-CD1 4.35Å; I135-I160 HydrophobicContact CG2-CD1 3.97Å; I135-F168 HydrophobicContact CD1-CE2 3.68Å; I135-F168 HydrophobicContact CD1-CZ 4.41Å; I135-T170 HydrophobicContact CD1-CG2 3.54Å
136	H	93.6	Very high	92.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	141.2	174.4	-72.8	-128.8	0	0	0	109.3	L102 A128 L130 T134 F138 E146 K149	L102-H136 HydrophobicContact CD2-CB 3.81Å; A128-H136 HydrophobicContact CB-CB 4.45Å; A128-H136 PolarHBondContact N-O 2.64Å; A128-H136 PolarHBondContact O-N 3.45Å; L130-H136 HydrophobicContact CD1-CB 4.3Å; T134-H136 PolarHBondContact OG1-CD2 3.26Å; T134-H136 PolarHBondContact OG1-NE2 3.47Å; H136-F138 HydrophobicContact CB-CE2 3.59Å; H136-F138 HydrophobicContact CB-CZ 3.67Å; H136-E146 IonicContact CE1-OE1 2.7Å; H136-E146 PolarHBondContact CE1-OE1 2.88Å; H136-E146 IonicContact CG-OE1 3.3Å; H136-E146 IonicContact ND1-OE1 3.2Å; H136-E146 PolarHBondContact ND1-OE1 2.92Å; H136-K149 PolarHBondContact CE1-NZ 3.48Å; H136-K149 WeakPolarHBondContact NE2-CD 3.41Å; H136-K149 WeakPolarHBondContact NE2-CE 3.3Å; H136-K149 PolarHBondContact NE2-NZ 3.11Å
137	T	93.3	Very high	92.3	Very high	11 Å²	11	34.7 Å²	34.7	7%	0.067	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	141.7	-179.3	70.1	0	0	0	0	109.8	L126 L127 K147 L148	L126-T137 CarbonylContact O-C 3.56Å; L126-T137 VanDerWaalsContact O-CA 3.28Å; L126-T137 WeakPolarHBondContact O-CA 3Å; L127-T137 HydrophobicContact CD2-CG2 3.4Å; L127-T137 VanDerWaalsContact CD2-CG2 3.4Å; T137-K147 WeakPolarHBondContact O-CB 3.41Å; T137-K147 PolarHBondContact O-N 3.13Å; T137-K147 WeakPolarHBondContact OG1-CB 3.47Å; T137-L148 PolarHBondContact N-O 3.34Å; T137-L148 WeakPolarHBondContact OG1-CB 3.33Å; T137-L148 PolarHBondContact OG1-N 3.37Å; T137-L148 VanDerWaalsContact OG1-N 3.07Å; T137-L148 PolarHBondContact OG1-O 2.97Å; T137-L148 VanDerWaalsContact OG1-O 3.11Å
138	F	94.4	Very high	92	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.018	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	141.2	-173.5	-56.4	-88.5	0	0	0	111.9	I81 V100 L102 L126 A128 H136 F144 K145 E146	I81-F138 HydrophobicContact CD1-CE2 4Å; V100-F138 HydrophobicContact CG1-CD1 4.24Å; V100-F138 HydrophobicContact CG1-CE1 3.73Å; V100-F138 HydrophobicContact CG1-CZ 4.24Å; L102-F138 HydrophobicContact CD2-CE2 4.13Å; L102-F138 HydrophobicContact CD2-CZ 3.58Å; L126-F138 HydrophobicContact CB-CB 4.33Å; L126-F138 HydrophobicContact CD2-CD2 4.37Å; L126-F138 PolarHBondContact N-O 3.16Å; L126-F138 VanDerWaalsContact N-O 3.07Å; L126-F138 PolarHBondContact O-N 3.26Å; A128-F138 HydrophobicContact CB-CE2 4.01Å; H136-F138 HydrophobicContact CB-CE2 3.59Å; H136-F138 HydrophobicContact CB-CZ 3.67Å; F138-F144 VanDerWaalsContact CD1-O 3.29Å; F138-F144 WeakPolarHBondContact CD1-O 3.3Å; F138-K145 WeakPolarHBondContact CA-O 3.44Å; F138-E146 HydrophobicContact CD1-CB 4.04Å; F138-E146 HydrophobicContact CE1-CB 3.78Å; F138-E146 HydrophobicContact CE1-CG 4.09Å
139	F	91.4	Very high	91.7	Very high	87 Å²	87	40.3 Å²	40.3	38%	0.382	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	124.5	168.2	-70	-68.7	0	0	0	110.2	C142 F144 K145 K147	F139-C142 HydrophobicContact CB-CB 3.81Å; F139-C142 HydrophobicContact CG-CB 4.5Å; F139-F144 WeakPolarHBondContact O-CA 3.47Å; F139-F144 PolarHBondContact O-N 3.31Å; F139-F144 VanDerWaalsContact O-N 3.09Å; F139-K145 PolarHBondContact N-O 3.21Å; F139-K147 HydrophobicContact CD1-CD 4.15Å; F139-K147 HydrophobicContact CD2-CB 3.75Å; F139-K147 HydrophobicContact CD2-CD 4.39Å; F139-K147 HydrophobicContact CD2-CG 4.16Å; F139-K147 HydrophobicContact CE1-CD 3.62Å; F139-K147 HydrophobicContact CE1-CG 4.19Å; F139-K147 HydrophobicContact CE2-CB 3.57Å; F139-K147 HydrophobicContact CE2-CD 3.9Å; F139-K147 HydrophobicContact CE2-CG 3.51Å; F139-K147 HydrophobicContact CG-CB 4.39Å; F139-K147 HydrophobicContact CZ-CB 4.09Å; F139-K147 HydrophobicContact CZ-CD 3.49Å; F139-K147 VanDerWaalsContact CZ-CD 3.49Å; F139-K147 HydrophobicContact CZ-CG 3.54Å
140	I	91.5	Very high	91.3	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-49.4	178.6	-63.5	-175.7	0	0	0	111	K70 Y72 F74 Y119 L126 C142 G143 F144	K70-I140 HydrophobicContact CD-CB 4.34Å; K70-I140 HydrophobicContact CD-CD1 4.47Å; K70-I140 HydrophobicContact CD-CG2 3.74Å; Y72-I140 HydrophobicContact CD2-CG2 3.95Å; Y72-I140 HydrophobicContact CE2-CG2 3.93Å; F74-I140 HydrophobicContact CE2-CD1 4.22Å; F74-I140 HydrophobicContact CZ-CD1 3.93Å; F74-I140 HydrophobicContact CZ-CG1 4.26Å; Y119-I140 HydrophobicContact CD2-CD1 3.45Å; Y119-I140 VanDerWaalsContact CD2-CD1 3.45Å; Y119-I140 HydrophobicContact CE2-CD1 3.24Å; Y119-I140 HydrophobicContact CE2-CG1 4.43Å; Y119-I140 HydrophobicContact CG-CD1 4.49Å; L126-I140 HydrophobicContact CB-CG1 4.47Å; I140-C142 PolarHBondContact O-N 3.35Å; I140-G143 PolarHBondContact O-N 3.02Å; I140-F144 HydrophobicContact CB-CE1 4.4Å; I140-F144 HydrophobicContact CG1-CE1 4.5Å; I140-F144 HydrophobicContact CG2-CE1 3.87Å
141	D	88	Confident	91	Very high	126 Å²	126	44.9 Å²	44.9	67%	0.674	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.4	-175.4	-70.8	-19.6	0	0	0	114.6	K70	K70-D141 IonicContact NZ-OD1 2.91Å; K70-D141 PolarHBondContact NZ-OD1 3.01Å; K70-D141 IonicContact NZ-OD2 2.91Å; K70-D141 PolarHBondContact NZ-OD2 2.77Å
142	C	84.4	Confident	90.7	Very high	64 Å²	64	44.8 Å²	44.8	43%	0.432	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	33.8	179.2	-154.5	0	0	0	0	112.4	F139 I140 K145	F139-C142 HydrophobicContact CB-CB 3.81Å; F139-C142 HydrophobicContact CG-CB 4.5Å; I140-C142 PolarHBondContact O-N 3.35Å; C142-K145 VanDerWaalsContact O-CG 3.28Å; C142-K145 WeakPolarHBondContact O-CG 3.45Å
143	G	87.3	Confident	90.8	Very high	48 Å²	48	43.2 Å²	43.2	50%	0.495	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	42.4	179.8	0	0	0	0	0	112.9	I140 K145	I140-G143 PolarHBondContact O-N 3.02Å; G143-K145 PolarHBondContact O-N 2.9Å; G143-K145 VanDerWaalsContact O-N 3.11Å
144	F	91.5	Very high	90.8	Very high	7 Å²	7	52.8 Å²	52.8	3%	0.031	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	30.1	177.4	-46	-72.6	0	0	0	114.5	Y72 F74 V83 H97 D98 V100 F138 F139 I140	Y72-F144 HydrophobicContact CD1-CZ 4.1Å; Y72-F144 HydrophobicContact CD2-CE1 4.28Å; Y72-F144 HydrophobicContact CD2-CZ 4.06Å; Y72-F144 HydrophobicContact CE1-CZ 4.02Å; Y72-F144 HydrophobicContact CE2-CE1 4.47Å; Y72-F144 AromaticContact CE2-CZ 3.97Å; Y72-F144 HydrophobicContact CE2-CZ 3.97Å; Y72-F144 HydrophobicContact CG-CE1 4.48Å; Y72-F144 HydrophobicContact CG-CZ 4.13Å; Y72-F144 AromaticContact CZ-CZ 3.96Å; F74-F144 AromaticContact CE1-CD1 3.81Å; F74-F144 HydrophobicContact CE1-CD1 3.81Å; F74-F144 AromaticContact CE1-CE1 3.5Å; F74-F144 HydrophobicContact CE1-CE1 3.5Å; F74-F144 VanDerWaalsContact CE1-CE1 3.5Å; F74-F144 HydrophobicContact CE1-CZ 4.4Å; F74-F144 HydrophobicContact CZ-CD1 4.37Å; F74-F144 AromaticContact CZ-CE1 3.79Å; F74-F144 HydrophobicContact CZ-CE1 3.79Å; V83-F144 HydrophobicContact CG1-CE1 4.06Å; V83-F144 HydrophobicContact CG1-CE2 3.99Å; V83-F144 HydrophobicContact CG1-CZ 3.65Å; V83-F144 HydrophobicContact CG2-CD2 4.4Å; V83-F144 HydrophobicContact CG2-CE2 4.5Å; V83-F144 HydrophobicContact CG2-CG 4.44Å; H97-F144 AromaticContact CE1-CE2 3.61Å; H97-F144 AromaticContact ND1-CE2 3.51Å; D98-F144 HydrophobicContact CB-CD2 4.37Å; V100-F144 HydrophobicContact CG2-CB 3.64Å; V100-F144 HydrophobicContact CG2-CG 4.39Å; F138-F144 VanDerWaalsContact CD1-O 3.29Å; F138-F144 WeakPolarHBondContact CD1-O 3.3Å; F139-F144 WeakPolarHBondContact O-CA 3.47Å; F139-F144 PolarHBondContact O-N 3.31Å; F139-F144 VanDerWaalsContact O-N 3.09Å; I140-F144 HydrophobicContact CB-CE1 4.4Å; I140-F144 HydrophobicContact CG1-CE1 4.5Å; I140-F144 HydrophobicContact CG2-CE1 3.87Å
145	K	90.7	Very high	91	Very high	134 Å²	134	54.1 Å²	54.1	58%	0.583	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	137.3	175.2	-77.6	178.6	-174.1	178.8	0	111	F138 F139 C142 G143 K147	F138-K145 WeakPolarHBondContact CA-O 3.44Å; F139-K145 PolarHBondContact N-O 3.21Å; C142-K145 VanDerWaalsContact O-CG 3.28Å; C142-K145 WeakPolarHBondContact O-CG 3.45Å; G143-K145 PolarHBondContact O-N 2.9Å; G143-K145 VanDerWaalsContact O-N 3.11Å; K145-K147 PolarHBondContact O-N 2.82Å
146	E	91	Very high	91.1	Very high	89 Å²	89	55.6 Å²	55.6	42%	0.416	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	122.1	172.4	-171	171.4	-82.8	0	0	109.5	H136 F138	H136-E146 IonicContact CE1-OE1 2.7Å; H136-E146 PolarHBondContact CE1-OE1 2.88Å; H136-E146 IonicContact CG-OE1 3.3Å; H136-E146 IonicContact ND1-OE1 3.2Å; H136-E146 PolarHBondContact ND1-OE1 2.92Å; F138-E146 HydrophobicContact CD1-CB 4.04Å; F138-E146 HydrophobicContact CE1-CB 3.78Å; F138-E146 HydrophobicContact CE1-CG 4.09Å
147	K	88.8	Confident	91.3	Very high	77 Å²	77	55.6 Å²	55.6	34%	0.335	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-53.8	177.2	174.5	177.7	-177.4	177.8	0	109.5	T125 T137 F139 K145	T125-K147 HydrophobicContact CG2-CD 4.43Å; T125-K147 PolarHBondContact OG1-NZ 3.42Å; T137-K147 WeakPolarHBondContact O-CB 3.41Å; T137-K147 PolarHBondContact O-N 3.13Å; T137-K147 WeakPolarHBondContact OG1-CB 3.47Å; F139-K147 HydrophobicContact CD1-CD 4.15Å; F139-K147 HydrophobicContact CD2-CB 3.75Å; F139-K147 HydrophobicContact CD2-CD 4.39Å; F139-K147 HydrophobicContact CD2-CG 4.16Å; F139-K147 HydrophobicContact CE1-CD 3.62Å; F139-K147 HydrophobicContact CE1-CG 4.19Å; F139-K147 HydrophobicContact CE2-CB 3.57Å; F139-K147 HydrophobicContact CE2-CD 3.9Å; F139-K147 HydrophobicContact CE2-CG 3.51Å; F139-K147 HydrophobicContact CG-CB 4.39Å; F139-K147 HydrophobicContact CZ-CB 4.09Å; F139-K147 HydrophobicContact CZ-CD 3.49Å; F139-K147 VanDerWaalsContact CZ-CD 3.49Å; F139-K147 HydrophobicContact CZ-CG 3.54Å; K145-K147 PolarHBondContact O-N 2.82Å
148	L	89.3	Confident	91.5	Very high	54 Å²	54	59 Å²	59	28%	0.283	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	151.9	-175.8	-67.4	169.6	0	0	0	111.4	T137 I185 Y190	T137-L148 PolarHBondContact N-O 3.34Å; T137-L148 WeakPolarHBondContact OG1-CB 3.33Å; T137-L148 PolarHBondContact OG1-N 3.37Å; T137-L148 VanDerWaalsContact OG1-N 3.07Å; T137-L148 PolarHBondContact OG1-O 2.97Å; T137-L148 VanDerWaalsContact OG1-O 3.11Å; L148-I185 HydrophobicContact CD1-CG2 3.12Å; L148-Y190 HydrophobicContact CD1-CE1 4.49Å; L148-Y190 WeakPolarHBondContact CD2-OH 3.36Å
149	K	89.3	Confident	91.6	Very high	64 Å²	64	62.3 Å²	62.3	28%	0.278	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.1	170.1	177.4	174.7	-174.9	138.8	0	109.9	T103 G105 H136	T103-K149 PolarHBondContact O-NZ 3.33Å; G105-K149 VanDerWaalsContact CA-NZ 3.3Å; H136-K149 PolarHBondContact CE1-NZ 3.48Å; H136-K149 WeakPolarHBondContact NE2-CD 3.41Å; H136-K149 WeakPolarHBondContact NE2-CE 3.3Å; H136-K149 PolarHBondContact NE2-NZ 3.11Å
150	L	89	Confident	91.9	Very high	11 Å²	11	58.7 Å²	58.7	6%	0.058	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.3	-178.5	172	79.2	0	0	0	109.8	T134 I135 G152 W180 Y190	T134-L150 CarbonylContact C-O 3.46Å; T134-L150 WeakPolarHBondContact CA-O 3.33Å; T134-L150 WeakPolarHBondContact CB-O 3.39Å; I135-L150 HydrophobicContact CB-CB 4.14Å; I135-L150 HydrophobicContact CB-CD2 4.02Å; I135-L150 HydrophobicContact CD1-CD2 3.72Å; I135-L150 HydrophobicContact CG1-CD2 4.05Å; I135-L150 PolarHBondContact N-O 3.07Å; I135-L150 WeakPolarHBondContact O-CB 3.24Å; I135-L150 PolarHBondContact O-N 3.09Å; L150-G152 PolarHBondContact O-N 3.3Å; L150-W180 HydrophobicContact CD1-CZ3 4.26Å; L150-W180 HydrophobicContact CD2-CD2 4.16Å; L150-W180 HydrophobicContact CD2-CE3 3.97Å; L150-W180 HydrophobicContact CD2-CH2 4.18Å; L150-W180 HydrophobicContact CD2-CZ2 4.33Å; L150-W180 HydrophobicContact CD2-CZ3 3.98Å; L150-Y190 HydrophobicContact CD1-CD1 3.72Å; L150-Y190 HydrophobicContact CD1-CD2 3.67Å; L150-Y190 HydrophobicContact CD1-CG 3.17Å
151	A	89.4	Confident	92.1	Very high	86 Å²	86	59.7 Å²	59.7	71%	0.711	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	86.8	161.3	0	0	0	0	0	109
152	G	88.7	Confident	92.4	Very high	12 Å²	12	55.9 Å²	55.9	12%	0.124	30%	0.303	C	S	.	.			trans	-83.2	-38.7	-171.2	0	0	0	0	0	113.1	G133 L150 W180	G133-G152 PolarHBondContact O-N 3.18Å; G133-G152 VanDerWaalsContact O-N 3.13Å; L150-G152 PolarHBondContact O-N 3.3Å; G152-W180 VanDerWaalsContact CA-CH2 3.49Å; G152-W180 WeakPolarHBondContact O-CH2 3.27Å; G152-W180 WeakPolarHBondContact O-CZ2 3.42Å
153	H	94.6	Very high	92.9	Very high	16 Å²	16	53 Å²	53	7%	0.074	28%	0.283	C	S	.	.			trans	-135.1	165.9	-173.9	-76	-85.8	0	0	0	111.5	G133 S155 I157 T170 S172 D174 T176 C178	G133-H153 PolarHBondContact O-N 3.17Å; H153-S155 VanDerWaalsContact C-N 3.33Å; H153-S155 WeakPolarHBondContact CB-O 3.27Å; H153-I157 HydrophobicContact CB-CG1 4.02Å; H153-T170 WeakPolarHBondContact NE2-CB 3.43Å; H153-T170 PolarHBondContact NE2-OG1 3.23Å; H153-S172 VanDerWaalsContact CG-CB 3.45Å; H153-S172 WeakPolarHBondContact ND1-CB 3.28Å; H153-D174 WeakPolarHBondContact CB-OD2 3.24Å; H153-D174 IonicContact CG-OD2 3.42Å; H153-D174 IonicContact ND1-OD1 3.08Å; H153-D174 PolarHBondContact ND1-OD1 2.82Å; H153-D174 IonicContact ND1-OD2 2.78Å; H153-D174 PolarHBondContact ND1-OD2 3.03Å; H153-D174 VanDerWaalsContact ND1-OD2 3.08Å; H153-T176 PolarHBondContact CE1-OG1 3.17Å; H153-T176 PolarHBondContact ND1-OG1 3.16Å; H153-C178 PolarHBondContact CE1-SG 2.85Å
154	K	94.5	Very high	93.1	Very high	201 Å²	201	52.2 Å²	52.2	87%	0.874	28%	0.276	S	S	*	.	S	Bend	trans	-85.9	-7.5	177.5	-64.3	-177.7	-179.6	-178.8	0	113.5	D174	K154-D174 HydrophobicContact CB-CB 4.13Å; K154-D174 PolarHBondContact N-OD2 2.85Å
155	S	95.6	Very high	93	Very high	41 Å²	41	53.8 Å²	53.8	29%	0.287	29%	0.29	S	S	.	.	S	Bend	trans	-156.8	179.2	-176.1	-166.1	0	0	0	0	109.9	G133 H153 I157 S172 E173	G133-S155 WeakPolarHBondContact CA-O 3.19Å; H153-S155 VanDerWaalsContact C-N 3.33Å; H153-S155 WeakPolarHBondContact CB-O 3.27Å; S155-I157 PolarHBondContact O-N 2.78Å; S155-S172 PolarHBondContact O-OG 3.17Å; S155-E173 WeakPolarHBondContact OG-CB 3.42Å; S155-E173 WeakPolarHBondContact OG-CG 3.48Å
156	T	96.3	Very high	93	Very high	31 Å²	31	51.2 Å²	51.2	19%	0.19	28%	0.28	C	S	.	.			trans	-37.8	127.5	179.6	-59.7	0	0	0	0	113	T115 G131 Y158 S172 E173	T115-T156 HydrophobicContact CG2-CG2 4.14Å; G131-T156 WeakPolarHBondContact O-CA 3.36Å; G131-T156 PolarHBondContact O-N 3.34Å; G131-T156 PolarHBondContact O-OG1 3.16Å; T156-Y158 HydrophobicContact CG2-CD1 4.03Å; T156-Y158 HydrophobicContact CG2-CD2 4.39Å; T156-Y158 HydrophobicContact CG2-CE1 3.79Å; T156-Y158 HydrophobicContact CG2-CE2 4.21Å; T156-Y158 HydrophobicContact CG2-CG 4.33Å; T156-S172 CarbonylContact O-C 3.34Å; T156-S172 WeakPolarHBondContact O-CA 3.34Å; T156-S172 WeakPolarHBondContact O-CB 3.32Å; T156-S172 PolarHBondContact O-OG 2.93Å; T156-E173 PolarHBondContact O-N 2.82Å
157	I	97.9	Very high	93.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.7	166.9	-59.3	170.8	0	0	0	106.8	T115 A129 L130 I135 H153 S155 K159 T170 S171	T115-I157 WeakPolarHBondContact CB-O 3.36Å; T115-I157 PolarHBondContact OG1-O 3.09Å; A129-I157 HydrophobicContact CB-CB 3.9Å; A129-I157 HydrophobicContact CB-CD1 4.27Å; A129-I157 HydrophobicContact CB-CG2 3.58Å; L130-I157 PolarHBondContact O-N 3.42Å; I135-I157 HydrophobicContact CD1-CD1 3.87Å; I135-I157 HydrophobicContact CG1-CD1 3.37Å; H153-I157 HydrophobicContact CB-CG1 4.02Å; S155-I157 PolarHBondContact O-N 2.78Å; I157-K159 WeakPolarHBondContact CG2-O 3.27Å; I157-T170 HydrophobicContact CG2-CG2 4Å; I157-S171 CarbonylContact C-O 3.58Å; I157-S171 WeakPolarHBondContact CA-O 3.3Å
158	Y	97.8	Very high	93.4	Very high	82 Å²	82	44.7 Å²	44.7	32%	0.322	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-28.4	178.9	-74.2	-70.9	0	0	0	113.5	T156 S171 E173 W212 L213	T156-Y158 HydrophobicContact CG2-CD1 4.03Å; T156-Y158 HydrophobicContact CG2-CD2 4.39Å; T156-Y158 HydrophobicContact CG2-CE1 3.79Å; T156-Y158 HydrophobicContact CG2-CE2 4.21Å; T156-Y158 HydrophobicContact CG2-CG 4.33Å; Y158-S171 PolarHBondContact N-O 2.95Å; Y158-E173 HydrophobicContact CD2-CB 4.46Å; Y158-E173 HydrophobicContact CE2-CB 3.68Å; Y158-E173 HydrophobicContact CE2-CG 4.45Å; Y158-E173 WeakPolarHBondContact CE2-OE2 3.17Å; Y158-E173 PolarHBondContact OH-OE2 3.46Å; Y158-W212 HydrophobicContact CE2-CB 4.5Å; Y158-L213 VanDerWaalsContact CD2-O 3.23Å; Y158-L213 WeakPolarHBondContact CD2-O 3.48Å
159	K	97.6	Very high	93.8	Very high	74 Å²	74	42.1 Å²	42.1	32%	0.322	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	141.1	-177.1	-154.5	75.7	172.9	-171.8	0	110.3	I157 T170 S171 L216	I157-K159 WeakPolarHBondContact CG2-O 3.27Å; K159-T170 VanDerWaalsContact O-CA 3.24Å; K159-T170 WeakPolarHBondContact O-CA 3.29Å; K159-S171 VanDerWaalsContact CB-OG 3.3Å; K159-S171 WeakPolarHBondContact CB-OG 3.44Å; K159-S171 PolarHBondContact N-O 3.13Å; K159-S171 PolarHBondContact O-N 3.38Å; K159-L216 HydrophobicContact CB-CB 4Å; K159-L216 HydrophobicContact CG-CB 4.07Å; K159-L216 WeakPolarHBondContact CG-O 3.1Å
160	I	97.5	Very high	94.2	Very high	11 Å²	11	39 Å²	39	6%	0.056	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	136.2	170.6	-172.7	165.4	0	0	0	108.1	G116 C118 L127 A129 I135 F168 G169 T170	G116-I160 VanDerWaalsContact C-CG2 3.5Å; C118-I160 HydrophobicContact CB-CG1 4.09Å; C118-I160 HydrophobicContact CB-CG2 4.02Å; L127-I160 HydrophobicContact CB-CD1 3.66Å; L127-I160 HydrophobicContact CD1-CD1 4.06Å; L127-I160 HydrophobicContact CG-CD1 4.47Å; A129-I160 HydrophobicContact CB-CB 3.99Å; A129-I160 HydrophobicContact CB-CD1 4.26Å; A129-I160 HydrophobicContact CB-CG2 3.85Å; I135-I160 HydrophobicContact CD1-CD1 4.35Å; I135-I160 HydrophobicContact CG2-CD1 3.97Å; I160-F168 HydrophobicContact CD1-CD2 3.98Å; I160-F168 HydrophobicContact CD1-CE2 4.24Å; I160-F168 HydrophobicContact CG1-CD2 4.13Å; I160-G169 VanDerWaalsContact CA-O 3.3Å; I160-G169 WeakPolarHBondContact CA-O 3.39Å; I160-T170 HydrophobicContact CB-CG2 4.02Å; I160-T170 HydrophobicContact CD1-CG2 3.99Å; I160-T170 HydrophobicContact CG1-CG2 3.79Å
161	C	95.4	Very high	94.6	Very high	25 Å²	25	38.5 Å²	38.5	17%	0.169	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	154.1	178.7	59	0	0	0	0	111.3	F168 G169	C161-F168 CarbonylContact O-C 3.57Å; C161-F168 VanDerWaalsContact O-CA 3.22Å; C161-F168 WeakPolarHBondContact O-CA 3.47Å; C161-F168 VanDerWaalsContact O-CB 3.27Å; C161-F168 WeakPolarHBondContact O-CB 3.4Å; C161-G169 PolarHBondContact N-O 3.02Å; C161-G169 PolarHBondContact O-N 3.05Å
162	S	94.1	Very high	95.1	Very high	47 Å²	47	34.4 Å²	34.4	33%	0.329	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	143	173.1	-161.2	0	0	0	0	109.7	C118 H120	C118-S162 PolarHBondContact SG-N 2.86Å; H120-S162 PolarHBondContact CD2-OG 2.81Å
163	V	94.6	Very high	95.5	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	98.4	179.3	-176	0	0	0	0	107.3	E167 F179 C218 E223	V163-E167 CarbonylContact C-O 3.56Å; V163-E167 HydrophobicContact CB-CB 4.04Å; V163-E167 HydrophobicContact CG1-CB 4.44Å; V163-E167 PolarHBondContact N-O 2.77Å; V163-E167 CarbonylContact O-C 3.55Å; V163-E167 WeakPolarHBondContact O-CA 3.34Å; V163-E167 WeakPolarHBondContact O-CB 3.5Å; V163-E167 PolarHBondContact O-N 2.87Å; V163-E167 VanDerWaalsContact O-N 3.13Å; V163-F179 HydrophobicContact CB-CD1 4.43Å; V163-F179 HydrophobicContact CG1-CD1 4.2Å; V163-F179 HydrophobicContact CG1-CE1 4.1Å; V163-F179 HydrophobicContact CG2-CD1 3.99Å; V163-F179 HydrophobicContact CG2-CE1 3.82Å; V163-C218 HydrophobicContact CG2-CB 4.14Å; V163-C218 VanDerWaalsContact CG2-SG 3.6Å; V163-E223 HydrophobicContact CG1-CB 4.12Å; V163-E223 HydrophobicContact CG1-CG 4.38Å
164	G	91.3	Very high	95.7	Very high	33 Å²	33	37.3 Å²	37.3	34%	0.34	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	-152.8	-175.6	0	0	0	0	0	113.9	E223	G164-E223 WeakPolarHBondContact CA-OE1 3.32Å
165	A	89.9	Confident	95.9	Very high	39 Å²	39	27.8 Å²	27.8	32%	0.322	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-12.6	-176.5	0	0	0	0	0	114.4	H120 E122	H120-A165 PolarHBondContact CE1-O 2.86Å; H120-A165 VanDerWaalsContact NE2-C 3.27Å; H120-A165 PolarHBondContact NE2-O 3.04Å; E122-A165 HydrophobicContact CG-CB 4.14Å
166	H	90.3	Very high	96	Very high	80 Å²	80	26.5 Å²	26.5	37%	0.37	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.7	-9.3	-167.6	-58.9	-45.2	0	0	0	114.7	H182 R183	H166-H182 WeakPolarHBondContact O-CB 3.42Å; H166-H182 PolarHBondContact O-CD2 2.96Å; H166-H182 VanDerWaalsContact O-CD2 3.23Å; H166-H182 PolarHBondContact O-N 3.2Å; H166-R183 PolarHBondContact CD2-NH1 3.04Å; H166-R183 PolarHBondContact CD2-NH2 3.47Å; H166-R183 PolarHBondContact NE2-NH1 2.89Å
167	E	93.4	Very high	96.1	Very high	27 Å²	27	25 Å²	25	13%	0.126	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	163.2	-179.6	-64	-171	111.2	0	0	112	V163 W180 D181 S193 R239	V163-E167 CarbonylContact C-O 3.56Å; V163-E167 HydrophobicContact CB-CB 4.04Å; V163-E167 HydrophobicContact CG1-CB 4.44Å; V163-E167 PolarHBondContact N-O 2.77Å; V163-E167 CarbonylContact O-C 3.55Å; V163-E167 WeakPolarHBondContact O-CA 3.34Å; V163-E167 WeakPolarHBondContact O-CB 3.5Å; V163-E167 PolarHBondContact O-N 2.87Å; V163-E167 VanDerWaalsContact O-N 3.13Å; E167-W180 CarbonylContact C-O 3.54Å; E167-W180 WeakPolarHBondContact CA-O 3.39Å; E167-W180 WeakPolarHBondContact CB-O 3.09Å; E167-D181 HydrophobicContact CG-CB 4.24Å; E167-S193 WeakPolarHBondContact OE1-CB 3.35Å; E167-S193 PolarHBondContact OE1-OG 3.42Å; E167-R239 VanDerWaalsContact CD-NH2 3.35Å; E167-R239 IonicContact OE1-NH2 2.66Å; E167-R239 PolarHBondContact OE1-NH2 2.92Å; E167-R239 IonicContact OE2-CZ 3.17Å; E167-R239 IonicContact OE2-NH1 2.68Å; E167-R239 PolarHBondContact OE2-NH1 3.22Å; E167-R239 IonicContact OE2-NH2 2.73Å; E167-R239 PolarHBondContact OE2-NH2 3.43Å
168	F	95.1	Very high	96.1	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.009	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	156.5	164.1	64.6	-84	0	0	0	109.1	L127 I135 I160 C161 T170 F179 W180 H182 I185	L127-F168 HydrophobicContact CD1-CB 3.83Å; L127-F168 HydrophobicContact CD1-CD1 3.87Å; L127-F168 HydrophobicContact CD1-CD2 3.94Å; L127-F168 HydrophobicContact CD1-CE1 4.36Å; L127-F168 HydrophobicContact CD1-CE2 4.44Å; L127-F168 HydrophobicContact CD1-CG 3.61Å; I135-F168 HydrophobicContact CD1-CE2 3.68Å; I135-F168 HydrophobicContact CD1-CZ 4.41Å; I160-F168 HydrophobicContact CD1-CD2 3.98Å; I160-F168 HydrophobicContact CD1-CE2 4.24Å; I160-F168 HydrophobicContact CG1-CD2 4.13Å; C161-F168 CarbonylContact O-C 3.57Å; C161-F168 VanDerWaalsContact O-CA 3.22Å; C161-F168 WeakPolarHBondContact O-CA 3.47Å; C161-F168 VanDerWaalsContact O-CB 3.27Å; C161-F168 WeakPolarHBondContact O-CB 3.4Å; F168-T170 HydrophobicContact CD2-CG2 4.33Å; F168-T170 HydrophobicContact CE2-CG2 4.39Å; F168-F179 WeakPolarHBondContact O-CA 3.32Å; F168-W180 HydrophobicContact CD1-CB 3.84Å; F168-W180 HydrophobicContact CD2-CB 4.17Å; F168-W180 AromaticContact CD2-CD1 3.5Å; F168-W180 VanDerWaalsContact CD2-CD1 3.5Å; F168-W180 HydrophobicContact CD2-CG 4.09Å; F168-W180 HydrophobicContact CE1-CB 3.4Å; F168-W180 HydrophobicContact CE1-CG 4.1Å; F168-W180 HydrophobicContact CE2-CB 3.73Å; F168-W180 AromaticContact CE2-CD1 3.16Å; F168-W180 HydrophobicContact CE2-CD2 4.36Å; F168-W180 AromaticContact CE2-CG 3.49Å; F168-W180 HydrophobicContact CE2-CG 3.49Å; F168-W180 VanDerWaalsContact CE2-CG 3.49Å; F168-W180 AromaticContact CE2-NE1 3.86Å; F168-W180 HydrophobicContact CG-CB 4.23Å; F168-W180 HydrophobicContact CZ-CB 3.34Å; F168-W180 AromaticContact CZ-CD1 3.72Å; F168-W180 HydrophobicContact CZ-CD2 4.34Å; F168-W180 AromaticContact CZ-CG 3.52Å; F168-W180 HydrophobicContact CZ-CG 3.52Å; F168-W180 PolarHBondContact N-O 3.09Å; F168-W180 PolarHBondContact O-N 3.23Å; F168-H182 AromaticContact CD1-CD2 3.92Å; F168-H182 AromaticContact CD1-CE1 3.28Å; F168-H182 WeakPolarHBondContact CD1-CE1 3.34Å; F168-H182 AromaticContact CD1-ND1 3.85Å; F168-H182 AromaticContact CD1-NE2 3.32Å; F168-H182 VanDerWaalsContact CD1-NE2 3.32Å; F168-H182 WeakPolarHBondContact CD1-NE2 2.99Å; F168-H182 AromaticContact CE1-CE1 3.62Å; F168-H182 AromaticContact CE1-ND1 3.84Å; F168-I185 HydrophobicContact CE1-CD1 4.17Å
169	G	96.9	Very high	96	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	149.4	179.5	0	0	0	0	0	111.3	I160 C161 C178	I160-G169 VanDerWaalsContact CA-O 3.3Å; I160-G169 WeakPolarHBondContact CA-O 3.39Å; C161-G169 PolarHBondContact N-O 3.02Å; C161-G169 PolarHBondContact O-N 3.05Å; G169-C178 CarbonylContact C-O 3.51Å; G169-C178 WeakPolarHBondContact CA-O 3.36Å
170	T	98.2	Very high	95.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	145.7	173.7	49.7	0	0	0	0	112.6	I135 H153 I157 K159 I160 F168 V177 C178 W180	I135-T170 HydrophobicContact CD1-CG2 3.54Å; H153-T170 WeakPolarHBondContact NE2-CB 3.43Å; H153-T170 PolarHBondContact NE2-OG1 3.23Å; I157-T170 HydrophobicContact CG2-CG2 4Å; K159-T170 VanDerWaalsContact O-CA 3.24Å; K159-T170 WeakPolarHBondContact O-CA 3.29Å; I160-T170 HydrophobicContact CB-CG2 4.02Å; I160-T170 HydrophobicContact CD1-CG2 3.99Å; I160-T170 HydrophobicContact CG1-CG2 3.79Å; F168-T170 HydrophobicContact CD2-CG2 4.33Å; F168-T170 HydrophobicContact CE2-CG2 4.39Å; T170-V177 CarbonylContact O-C 3.57Å; T170-V177 WeakPolarHBondContact O-CA 3.41Å; T170-C178 PolarHBondContact N-O 2.95Å; T170-C178 PolarHBondContact O-N 3.15Å; T170-C178 PolarHBondContact OG1-O 3.33Å; T170-W180 PolarHBondContact OG1-NE1 2.84Å
171	S	98.5	Very high	95.5	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	140	169.7	66.4	0	0	0	0	111	I157 Y158 K159 L213	I157-S171 CarbonylContact C-O 3.58Å; I157-S171 WeakPolarHBondContact CA-O 3.3Å; Y158-S171 PolarHBondContact N-O 2.95Å; K159-S171 VanDerWaalsContact CB-OG 3.3Å; K159-S171 WeakPolarHBondContact CB-OG 3.44Å; K159-S171 PolarHBondContact N-O 3.13Å; K159-S171 PolarHBondContact O-N 3.38Å; S171-L213 PolarHBondContact OG-O 3.18Å
172	S	98.6	Very high	95	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	158	-171.6	174.9	0	0	0	0	114.3	H153 S155 T156 D174 G175 T176 L213	H153-S172 VanDerWaalsContact CG-CB 3.45Å; H153-S172 WeakPolarHBondContact ND1-CB 3.28Å; S155-S172 PolarHBondContact O-OG 3.17Å; T156-S172 CarbonylContact O-C 3.34Å; T156-S172 WeakPolarHBondContact O-CA 3.34Å; T156-S172 WeakPolarHBondContact O-CB 3.32Å; T156-S172 PolarHBondContact O-OG 2.93Å; S172-D174 WeakPolarHBondContact CB-OD1 3.27Å; S172-D174 PolarHBondContact O-N 2.91Å; S172-D174 PolarHBondContact OG-N 3.41Å; S172-D174 VanDerWaalsContact OG-N 3.08Å; S172-D174 PolarHBondContact OG-OD1 3.18Å; S172-G175 PolarHBondContact O-N 3.02Å; S172-T176 PolarHBondContact N-O 3.44Å; S172-L213 PolarHBondContact O-N 2.92Å
173	E	98.4	Very high	94.4	Very high	58 Å²	58	24.1 Å²	24.1	27%	0.271	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-28.9	163.6	-176.5	68.4	-150.2	0	0	112.4	S155 T156 Y158 G175 W212	S155-E173 WeakPolarHBondContact OG-CB 3.42Å; S155-E173 WeakPolarHBondContact OG-CG 3.48Å; T156-E173 PolarHBondContact O-N 2.82Å; Y158-E173 HydrophobicContact CD2-CB 4.46Å; Y158-E173 HydrophobicContact CE2-CB 3.68Å; Y158-E173 HydrophobicContact CE2-CG 4.45Å; Y158-E173 WeakPolarHBondContact CE2-OE2 3.17Å; Y158-E173 PolarHBondContact OH-OE2 3.46Å; E173-G175 PolarHBondContact O-N 2.69Å; E173-G175 VanDerWaalsContact O-N 3.09Å; E173-W212 HydrophobicContact CB-CB 4.42Å; E173-W212 HydrophobicContact CG-CB 4.3Å; E173-W212 WeakPolarHBondContact O-CA 3.39Å; E173-W212 WeakPolarHBondContact OE1-CB 3.37Å; E173-W212 VanDerWaalsContact OE2-CB 3.23Å; E173-W212 WeakPolarHBondContact OE2-CB 3.31Å
174	D	98	Very high	93.5	Very high	31 Å²	31	28.8 Å²	28.8	17%	0.166	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-4.3	176.4	74.6	13	0	0	0	114.3	H153 K154 S172 T176	H153-D174 WeakPolarHBondContact CB-OD2 3.24Å; H153-D174 IonicContact CG-OD2 3.42Å; H153-D174 IonicContact ND1-OD1 3.08Å; H153-D174 PolarHBondContact ND1-OD1 2.82Å; H153-D174 IonicContact ND1-OD2 2.78Å; H153-D174 PolarHBondContact ND1-OD2 3.03Å; H153-D174 VanDerWaalsContact ND1-OD2 3.08Å; K154-D174 HydrophobicContact CB-CB 4.13Å; K154-D174 PolarHBondContact N-OD2 2.85Å; S172-D174 WeakPolarHBondContact CB-OD1 3.27Å; S172-D174 PolarHBondContact O-N 2.91Å; S172-D174 PolarHBondContact OG-N 3.41Å; S172-D174 VanDerWaalsContact OG-N 3.08Å; S172-D174 PolarHBondContact OG-OD1 3.18Å; D174-T176 WeakPolarHBondContact OD1-CB 3.44Å; D174-T176 WeakPolarHBondContact OD1-CG2 3.4Å; D174-T176 PolarHBondContact OD1-N 2.94Å; D174-T176 PolarHBondContact OD1-OG1 3.25Å; D174-T176 PolarHBondContact OD2-OG1 3.02Å
175	G	98.3	Very high	92.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.144	C	C	.	.	S	Bend	trans	82.3	14.4	176.6	0	0	0	0	0	115.3	S172 E173 Y199 S211	S172-G175 PolarHBondContact O-N 3.02Å; E173-G175 PolarHBondContact O-N 2.69Å; E173-G175 VanDerWaalsContact O-N 3.09Å; G175-Y199 WeakPolarHBondContact O-CD1 3.22Å; G175-Y199 WeakPolarHBondContact O-CE1 3.33Å; G175-S211 WeakPolarHBondContact CA-O 3.38Å
176	T	98.5	Very high	90.7	Very high	14 Å²	14	37.1 Å²	37.1	9%	0.086	17%	0.168	C	C	.	.			trans	-108.5	144.7	178.2	69	0	0	0	0	112.3	H153 S172 D174 V195 F196 K197	H153-T176 PolarHBondContact CE1-OG1 3.17Å; H153-T176 PolarHBondContact ND1-OG1 3.16Å; S172-T176 PolarHBondContact N-O 3.44Å; D174-T176 WeakPolarHBondContact OD1-CB 3.44Å; D174-T176 WeakPolarHBondContact OD1-CG2 3.4Å; D174-T176 PolarHBondContact OD1-N 2.94Å; D174-T176 PolarHBondContact OD1-OG1 3.25Å; D174-T176 PolarHBondContact OD2-OG1 3.02Å; T176-V195 HydrophobicContact CG2-CG1 4.29Å; T176-F196 WeakPolarHBondContact CA-O 3.18Å; T176-K197 HydrophobicContact CG2-CG 4.13Å
177	V	98.5	Very high	89	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	123.8	159.4	179.8	0	0	0	0	107.5	T170 F179 V195 F196 L213 L216 F226 T228	T170-V177 CarbonylContact O-C 3.57Å; T170-V177 WeakPolarHBondContact O-CA 3.41Å; V177-F179 HydrophobicContact CG1-CD2 4.35Å; V177-F179 HydrophobicContact CG1-CE2 3.76Å; V177-F179 HydrophobicContact CG1-CZ 4.22Å; V177-V195 CarbonylContact O-C 3.5Å; V177-V195 WeakPolarHBondContact O-CA 3.14Å; V177-F196 HydrophobicContact CB-CB 4.25Å; V177-F196 PolarHBondContact N-O 2.75Å; V177-F196 PolarHBondContact O-N 3.43Å; V177-L213 HydrophobicContact CG2-CD1 3.6Å; V177-L216 HydrophobicContact CG1-CD1 3.79Å; V177-L216 HydrophobicContact CG1-CD2 4.12Å; V177-F226 HydrophobicContact CB-CE2 4.32Å; V177-F226 HydrophobicContact CG1-CD2 4.42Å; V177-F226 HydrophobicContact CG1-CE2 4.09Å; V177-F226 HydrophobicContact CG2-CE2 4.16Å; V177-T228 HydrophobicContact CG2-CG2 3.94Å; V177-T228 WeakPolarHBondContact CG2-OG1 3.4Å
178	C	97.4	Very high	87.4	Confident	7 Å²	7	41.4 Å²	41.4	5%	0.047	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.7	178.4	-68.2	0	0	0	0	110	H153 G169 T170 W180 A192 S194	H153-C178 PolarHBondContact CE1-SG 2.85Å; G169-C178 CarbonylContact C-O 3.51Å; G169-C178 WeakPolarHBondContact CA-O 3.36Å; T170-C178 PolarHBondContact N-O 2.95Å; T170-C178 PolarHBondContact O-N 3.15Å; T170-C178 PolarHBondContact OG1-O 3.33Å; C178-W180 HydrophobicContact CB-CD2 4.47Å; C178-W180 VanDerWaalsContact CB-CE2 3.49Å; C178-W180 HydrophobicContact CB-CH2 4.19Å; C178-W180 HydrophobicContact CB-CZ2 3.32Å; C178-W180 PolarHBondContact O-NE1 2.94Å; C178-A192 HydrophobicContact CB-CB 3.95Å; C178-S194 WeakPolarHBondContact CA-O 3.31Å
179	F	96.1	Very high	85.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	145.9	169	-68.2	-91.4	0	0	0	109.6	V163 F168 V177 A192 S193 S194 F196 F226 R239	V163-F179 HydrophobicContact CB-CD1 4.43Å; V163-F179 HydrophobicContact CG1-CD1 4.2Å; V163-F179 HydrophobicContact CG1-CE1 4.1Å; V163-F179 HydrophobicContact CG2-CD1 3.99Å; V163-F179 HydrophobicContact CG2-CE1 3.82Å; F168-F179 WeakPolarHBondContact O-CA 3.32Å; V177-F179 HydrophobicContact CG1-CD2 4.35Å; V177-F179 HydrophobicContact CG1-CE2 3.76Å; V177-F179 HydrophobicContact CG1-CZ 4.22Å; F179-A192 CarbonylContact O-C 3.57Å; F179-A192 WeakPolarHBondContact O-CA 3.37Å; F179-A192 WeakPolarHBondContact O-CB 3.39Å; F179-S193 WeakPolarHBondContact CB-OG 3.05Å; F179-S193 PolarHBondContact O-N 2.79Å; F179-S193 PolarHBondContact O-OG 2.92Å; F179-S194 PolarHBondContact N-O 3.4Å; F179-F196 HydrophobicContact CD2-CD2 4.04Å; F179-F196 AromaticContact CD2-CE2 3.74Å; F179-F196 HydrophobicContact CD2-CE2 3.74Å; F179-F196 AromaticContact CE2-CD2 3.8Å; F179-F196 HydrophobicContact CE2-CD2 3.8Å; F179-F196 AromaticContact CE2-CE2 3.61Å; F179-F196 HydrophobicContact CE2-CE2 3.61Å; F179-F226 HydrophobicContact CE2-CD1 4.04Å; F179-F226 AromaticContact CE2-CE1 3.97Å; F179-F226 HydrophobicContact CE2-CE1 3.97Å; F179-F226 HydrophobicContact CE2-CG 4.43Å; F179-F226 HydrophobicContact CE2-CZ 4.33Å; F179-F226 HydrophobicContact CZ-CB 4.22Å; F179-F226 AromaticContact CZ-CD1 3.74Å; F179-F226 HydrophobicContact CZ-CD1 3.74Å; F179-F226 HydrophobicContact CZ-CD2 4.47Å; F179-F226 HydrophobicContact CZ-CE1 4.16Å; F179-F226 AromaticContact CZ-CG 3.9Å; F179-F226 HydrophobicContact CZ-CG 3.9Å; F179-R239 HydrophobicContact CE2-CG 4.09Å; F179-R239 HydrophobicContact CZ-CG 4.07Å
180	W	93.9	Very high	84.5	Confident	14 Å²	14	50.8 Å²	50.8	5%	0.053	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	128.9	-169.7	-48.1	90.6	0	0	0	109.8	L150 G152 E167 F168 T170 C178 A192	L150-W180 HydrophobicContact CD1-CZ3 4.26Å; L150-W180 HydrophobicContact CD2-CD2 4.16Å; L150-W180 HydrophobicContact CD2-CE3 3.97Å; L150-W180 HydrophobicContact CD2-CH2 4.18Å; L150-W180 HydrophobicContact CD2-CZ2 4.33Å; L150-W180 HydrophobicContact CD2-CZ3 3.98Å; G152-W180 VanDerWaalsContact CA-CH2 3.49Å; G152-W180 WeakPolarHBondContact O-CH2 3.27Å; G152-W180 WeakPolarHBondContact O-CZ2 3.42Å; E167-W180 CarbonylContact C-O 3.54Å; E167-W180 WeakPolarHBondContact CA-O 3.39Å; E167-W180 WeakPolarHBondContact CB-O 3.09Å; F168-W180 HydrophobicContact CD1-CB 3.84Å; F168-W180 HydrophobicContact CD2-CB 4.17Å; F168-W180 AromaticContact CD2-CD1 3.5Å; F168-W180 VanDerWaalsContact CD2-CD1 3.5Å; F168-W180 HydrophobicContact CD2-CG 4.09Å; F168-W180 HydrophobicContact CE1-CB 3.4Å; F168-W180 HydrophobicContact CE1-CG 4.1Å; F168-W180 HydrophobicContact CE2-CB 3.73Å; F168-W180 AromaticContact CE2-CD1 3.16Å; F168-W180 HydrophobicContact CE2-CD2 4.36Å; F168-W180 AromaticContact CE2-CG 3.49Å; F168-W180 HydrophobicContact CE2-CG 3.49Å; F168-W180 VanDerWaalsContact CE2-CG 3.49Å; F168-W180 AromaticContact CE2-NE1 3.86Å; F168-W180 HydrophobicContact CG-CB 4.23Å; F168-W180 HydrophobicContact CZ-CB 3.34Å; F168-W180 AromaticContact CZ-CD1 3.72Å; F168-W180 HydrophobicContact CZ-CD2 4.34Å; F168-W180 AromaticContact CZ-CG 3.52Å; F168-W180 HydrophobicContact CZ-CG 3.52Å; F168-W180 PolarHBondContact N-O 3.09Å; F168-W180 PolarHBondContact O-N 3.23Å; T170-W180 PolarHBondContact OG1-NE1 2.84Å; C178-W180 HydrophobicContact CB-CD2 4.47Å; C178-W180 VanDerWaalsContact CB-CE2 3.49Å; C178-W180 HydrophobicContact CB-CH2 4.19Å; C178-W180 HydrophobicContact CB-CZ2 3.32Å; C178-W180 PolarHBondContact O-NE1 2.94Å; W180-A192 HydrophobicContact CD2-CB 4.35Å; W180-A192 HydrophobicContact CE3-CB 4.04Å; W180-A192 HydrophobicContact CH2-CB 4.06Å; W180-A192 HydrophobicContact CZ2-CB 4.4Å; W180-A192 HydrophobicContact CZ3-CB 3.89Å
181	D	90.2	Very high	83.8	Confident	30 Å²	30	59.2 Å²	59.2	16%	0.16	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	120.1	174.6	-171.7	-40.7	0	0	0	110.8	E167 R183 V184 I185	E167-D181 HydrophobicContact CG-CB 4.24Å; D181-R183 PolarHBondContact O-N 3.09Å; D181-R183 VanDerWaalsContact O-N 3.09Å; D181-R183 WeakPolarHBondContact OD1-CB 3.38Å; D181-R183 WeakPolarHBondContact OD1-CG 3.4Å; D181-R183 IonicContact OD1-CZ 3.37Å; D181-R183 PolarHBondContact OD1-N 2.87Å; D181-R183 IonicContact OD1-NE 3.17Å; D181-R183 PolarHBondContact OD1-NE 3.39Å; D181-R183 IonicContact OD1-NH2 2.69Å; D181-R183 IonicContact OD2-CZ 2.65Å; D181-R183 IonicContact OD2-NE 3.73Å; D181-R183 PolarHBondContact OD2-NE 3.27Å; D181-R183 IonicContact OD2-NH2 3.19Å; D181-R183 PolarHBondContact OD2-NH2 2.82Å; D181-V184 HydrophobicContact CB-CG2 4.18Å; D181-V184 PolarHBondContact O-N 2.92Å; D181-I185 WeakPolarHBondContact O-CG1 3.26Å
182	H	84.1	Confident	83.4	Confident	30 Å²	30	60.4 Å²	60.4	14%	0.139	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-25	-180	-75.6	-70.8	0	0	0	114.7	H120 H166 F168	H120-H182 AromaticContact CD2-CD2 3.52Å; H120-H182 AromaticContact CD2-NE2 3.22Å; H120-H182 PolarHBondContact CD2-NE2 2.86Å; H120-H182 AromaticContact CE1-CD2 3.74Å; H120-H182 AromaticContact CG-CD2 3.87Å; H120-H182 AromaticContact CG-NE2 3.4Å; H120-H182 AromaticContact ND1-NE2 3.96Å; H120-H182 AromaticContact NE2-CD2 3.43Å; H120-H182 PolarHBondContact NE2-CD2 2.93Å; H120-H182 AromaticContact NE2-NE2 3.68Å; H166-H182 WeakPolarHBondContact O-CB 3.42Å; H166-H182 PolarHBondContact O-CD2 2.96Å; H166-H182 VanDerWaalsContact O-CD2 3.23Å; H166-H182 PolarHBondContact O-N 3.2Å; F168-H182 AromaticContact CD1-CD2 3.92Å; F168-H182 AromaticContact CD1-CE1 3.28Å; F168-H182 WeakPolarHBondContact CD1-CE1 3.34Å; F168-H182 AromaticContact CD1-ND1 3.85Å; F168-H182 AromaticContact CD1-NE2 3.32Å; F168-H182 VanDerWaalsContact CD1-NE2 3.32Å; F168-H182 WeakPolarHBondContact CD1-NE2 2.99Å; F168-H182 AromaticContact CE1-CE1 3.62Å; F168-H182 AromaticContact CE1-ND1 3.84Å
183	R	81.7	Confident	83.1	Confident	139 Å²	139	63.1 Å²	63.1	53%	0.525	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-31.8	-173.8	-60.6	170.8	-78.2	-167.2	-3.7	112.3	H166 D181 I185	H166-R183 PolarHBondContact CD2-NH1 3.04Å; H166-R183 PolarHBondContact CD2-NH2 3.47Å; H166-R183 PolarHBondContact NE2-NH1 2.89Å; D181-R183 PolarHBondContact O-N 3.09Å; D181-R183 VanDerWaalsContact O-N 3.09Å; D181-R183 WeakPolarHBondContact OD1-CB 3.38Å; D181-R183 WeakPolarHBondContact OD1-CG 3.4Å; D181-R183 IonicContact OD1-CZ 3.37Å; D181-R183 PolarHBondContact OD1-N 2.87Å; D181-R183 IonicContact OD1-NE 3.17Å; D181-R183 PolarHBondContact OD1-NE 3.39Å; D181-R183 IonicContact OD1-NH2 2.69Å; D181-R183 IonicContact OD2-CZ 2.65Å; D181-R183 IonicContact OD2-NE 3.73Å; D181-R183 PolarHBondContact OD2-NE 3.27Å; D181-R183 IonicContact OD2-NH2 3.19Å; D181-R183 PolarHBondContact OD2-NH2 2.82Å; R183-I185 VanDerWaalsContact C-N 3.31Å
184	V	75.8	Confident	82.9	Confident	100 Å²	100	62.5 Å²	62.5	61%	0.606	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-82.5	-13.8	-174.3	-173.6	0	0	0	0	112.2	D181 R186	D181-V184 HydrophobicContact CB-CG2 4.18Å; D181-V184 PolarHBondContact O-N 2.92Å; V184-R186 PolarHBondContact O-N 3.24Å
185	I	66.1	Low	82.8	Confident	28 Å²	28	64.4 Å²	64.4	14%	0.144	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-59	-1.9	-177.2	-69.4	-175.5	0	0	0	114.4	L148 F168 D181 R183 Y190	L148-I185 HydrophobicContact CD1-CG2 3.12Å; F168-I185 HydrophobicContact CE1-CD1 4.17Å; D181-I185 WeakPolarHBondContact O-CG1 3.26Å; R183-I185 VanDerWaalsContact C-N 3.31Å; I185-Y190 HydrophobicContact CB-CD1 4.29Å; I185-Y190 HydrophobicContact CB-CE1 3.97Å; I185-Y190 HydrophobicContact CG1-CD1 4.18Å; I185-Y190 HydrophobicContact CG1-CE1 4.32Å; I185-Y190 HydrophobicContact CG2-CD1 4.22Å; I185-Y190 HydrophobicContact CG2-CE1 3.55Å; I185-Y190 WeakPolarHBondContact O-CE1 3.24Å; I185-Y190 PolarHBondContact O-OH 2.92Å
186	R	56.5	Low	82.8	Confident	219 Å²	219	65 Å²	65	83%	0.826	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-81.4	-18.3	-172.1	-66.3	-174.4	-178	-95.6	2.2	116.1	V184	V184-R186 PolarHBondContact O-N 3.24Å
187	N	54.9	Low	82.8	Confident	149 Å²	149	68.8 Å²	68.8	80%	0.797	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-108.9	13	-167.7	-68.6	-3.6	0	0	0	115.4	D189	N187-D189 PolarHBondContact O-N 2.94Å; N187-D189 VanDerWaalsContact O-N 3.08Å
188	G	59.6	Low	82.8	Confident	48 Å²	48	68.9 Å²	68.9	50%	0.495	35%	0.35	S	S	.	.	S	Bend	trans	77.8	-19.1	176.1	0	0	0	0	0	115.9	Y190	G188-Y190 WeakPolarHBondContact O-CD2 3Å
189	D	59.9	Low	82.8	Confident	128 Å²	128	71.9 Å²	71.9	68%	0.684	36%	0.361	S	S	*	.			trans	-93.2	93.8	171.2	-80.8	-25.8	0	0	0	111.1	N187 K191	N187-D189 PolarHBondContact O-N 2.94Å; N187-D189 VanDerWaalsContact O-N 3.08Å; D189-K191 PolarHBondContact O-N 2.87Å
190	Y	71.7	Confident	82.9	Confident	71 Å²	71	77.5 Å²	77.5	28%	0.278	39%	0.39	S	S	.	.			trans	-90	89.1	-178.7	-54.1	-78.8	0	0	0	112	L148 L150 I185 G188	L148-Y190 HydrophobicContact CD1-CE1 4.49Å; L148-Y190 WeakPolarHBondContact CD2-OH 3.36Å; L150-Y190 HydrophobicContact CD1-CD1 3.72Å; L150-Y190 HydrophobicContact CD1-CD2 3.67Å; L150-Y190 HydrophobicContact CD1-CG 3.17Å; I185-Y190 HydrophobicContact CB-CD1 4.29Å; I185-Y190 HydrophobicContact CB-CE1 3.97Å; I185-Y190 HydrophobicContact CG1-CD1 4.18Å; I185-Y190 HydrophobicContact CG1-CE1 4.32Å; I185-Y190 HydrophobicContact CG2-CD1 4.22Å; I185-Y190 HydrophobicContact CG2-CE1 3.55Å; I185-Y190 WeakPolarHBondContact O-CE1 3.24Å; I185-Y190 PolarHBondContact O-OH 2.92Å; G188-Y190 WeakPolarHBondContact O-CD2 3Å
191	K	83	Confident	83.1	Confident	178 Å²	178	78.8 Å²	78.8	77%	0.774	40%	0.398	S	S	*	.			trans	-95.3	130.6	171.4	-68.3	-178.5	-178.8	174.5	0	109.9	D189 S193	D189-K191 PolarHBondContact O-N 2.87Å; K191-S193 PolarHBondContact O-N 2.89Å
192	A	91.1	Very high	83.3	Confident	25 Å²	25	82.5 Å²	82.5	21%	0.207	43%	0.426	C	S	.	.			trans	-55.2	134.6	167.7	0	0	0	0	0	109.7	C178 F179 W180 S194 V195	C178-A192 HydrophobicContact CB-CB 3.95Å; F179-A192 CarbonylContact O-C 3.57Å; F179-A192 WeakPolarHBondContact O-CA 3.37Å; F179-A192 WeakPolarHBondContact O-CB 3.39Å; W180-A192 HydrophobicContact CD2-CB 4.35Å; W180-A192 HydrophobicContact CE3-CB 4.04Å; W180-A192 HydrophobicContact CH2-CB 4.06Å; W180-A192 HydrophobicContact CZ2-CB 4.4Å; W180-A192 HydrophobicContact CZ3-CB 3.89Å; A192-S194 PolarHBondContact O-N 2.89Å; A192-V195 HydrophobicContact CB-CG2 3.58Å
193	S	91	Very high	83.8	Confident	57 Å²	57	86.8 Å²	86.8	40%	0.399	45%	0.447	S	S	.	.	S	Bend	trans	-64.3	-30.9	176.3	60.8	0	0	0	0	111.1	E167 F179 K191	E167-S193 WeakPolarHBondContact OE1-CB 3.35Å; E167-S193 PolarHBondContact OE1-OG 3.42Å; F179-S193 WeakPolarHBondContact CB-OG 3.05Å; F179-S193 PolarHBondContact O-N 2.79Å; F179-S193 PolarHBondContact O-OG 2.92Å; K191-S193 PolarHBondContact O-N 2.89Å
194	S	94.5	Very high	84.5	Confident	44 Å²	44	80.2 Å²	80.2	31%	0.308	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	144.9	174	-65.3	0	0	0	0	110.3	C178 F179 A192	C178-S194 WeakPolarHBondContact CA-O 3.31Å; F179-S194 PolarHBondContact N-O 3.4Å; A192-S194 PolarHBondContact O-N 2.89Å
195	V	97.1	Very high	85.5	Confident	71 Å²	71	77.4 Å²	77.4	43%	0.43	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	124.1	177.9	-176.6	0	0	0	0	109.5	T176 V177 A192 K197	T176-V195 HydrophobicContact CG2-CG1 4.29Å; V177-V195 CarbonylContact O-C 3.5Å; V177-V195 WeakPolarHBondContact O-CA 3.14Å; A192-V195 HydrophobicContact CB-CG2 3.58Å; V195-K197 HydrophobicContact CG1-CG 4.35Å
196	F	98.4	Very high	86.9	Confident	13 Å²	13	76.9 Å²	76.9	6%	0.057	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	141.7	176.2	-58.8	-96.2	0	0	0	109.8	T176 V177 F179 F226 W237 R239	T176-F196 WeakPolarHBondContact CA-O 3.18Å; V177-F196 HydrophobicContact CB-CB 4.25Å; V177-F196 PolarHBondContact N-O 2.75Å; V177-F196 PolarHBondContact O-N 3.43Å; F179-F196 HydrophobicContact CD2-CD2 4.04Å; F179-F196 AromaticContact CD2-CE2 3.74Å; F179-F196 HydrophobicContact CD2-CE2 3.74Å; F179-F196 AromaticContact CE2-CD2 3.8Å; F179-F196 HydrophobicContact CE2-CD2 3.8Å; F179-F196 AromaticContact CE2-CE2 3.61Å; F179-F196 HydrophobicContact CE2-CE2 3.61Å; F196-F226 HydrophobicContact CB-CZ 4.07Å; F196-F226 HydrophobicContact CD1-CE1 4.2Å; F196-F226 AromaticContact CD1-CZ 3.9Å; F196-F226 HydrophobicContact CD1-CZ 3.9Å; F196-F226 AromaticContact CD2-CE1 3.98Å; F196-F226 HydrophobicContact CD2-CE1 3.98Å; F196-F226 AromaticContact CD2-CZ 3.72Å; F196-F226 HydrophobicContact CD2-CZ 3.72Å; F196-F226 HydrophobicContact CE1-CE1 4.12Å; F196-F226 HydrophobicContact CE1-CZ 4.29Å; F196-F226 AromaticContact CE2-CE1 3.93Å; F196-F226 HydrophobicContact CE2-CE1 3.93Å; F196-F226 HydrophobicContact CE2-CZ 4.17Å; F196-F226 HydrophobicContact CG-CE1 4.15Å; F196-F226 AromaticContact CG-CZ 3.61Å; F196-F226 HydrophobicContact CG-CZ 3.61Å; F196-F226 HydrophobicContact CZ-CE1 4.03Å; F196-F226 HydrophobicContact CZ-CZ 4.45Å; F196-W237 HydrophobicContact CB-CE3 4.49Å; F196-W237 HydrophobicContact CB-CZ3 4.37Å; F196-W237 HydrophobicContact CD1-CD2 4.48Å; F196-W237 AromaticContact CD1-CE3 3.5Å; F196-W237 HydrophobicContact CD1-CE3 3.5Å; F196-W237 AromaticContact CD1-CZ3 3.69Å; F196-W237 HydrophobicContact CD1-CZ3 3.69Å; F196-W237 HydrophobicContact CE1-CE3 4.15Å; F196-W237 HydrophobicContact CG-CE3 4.33Å; F196-W237 HydrophobicContact CG-CZ3 4.49Å; F196-R239 HydrophobicContact CE2-CG 4.23Å; F196-R239 HydrophobicContact CZ-CB 4.01Å; F196-R239 HydrophobicContact CZ-CG 4.05Å
197	K	98.1	Very high	88.7	Confident	94 Å²	94	72 Å²	72	41%	0.409	40%	0.399	S	S	.	.			trans	-129.6	74.8	-174.8	-62	-178.1	179.9	175.7	0	110.4	T176 V195 Y199 L200	T176-K197 HydrophobicContact CG2-CG 4.13Å; V195-K197 HydrophobicContact CG1-CG 4.35Å; K197-Y199 HydrophobicContact CB-CD1 4.18Å; K197-Y199 HydrophobicContact CB-CE1 3.68Å; K197-Y199 HydrophobicContact CD-CE1 4.37Å; K197-Y199 HydrophobicContact CG-CE1 4.04Å; K197-Y199 PolarHBondContact O-N 3.15Å; K197-Y199 VanDerWaalsContact O-N 3.1Å; K197-L200 HydrophobicContact CB-CB 4.46Å; K197-L200 HydrophobicContact CB-CD1 3.77Å; K197-L200 HydrophobicContact CB-CG 3.98Å; K197-L200 HydrophobicContact CD-CD1 3.67Å; K197-L200 HydrophobicContact CG-CD1 4.37Å; K197-L200 WeakPolarHBondContact O-CB 3.49Å; K197-L200 PolarHBondContact O-N 3.22Å
198	P	98.3	Very high	90.6	Very high	1 Å²	1	75 Å²	75	1%	0.006	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-53.3	-33.8	-176.2	-27.6	35.7	0	0	0	113.9	L200 N201 L204 L213 T228 P232 W237	P198-L200 PolarHBondContact O-N 2.85Å; P198-L200 VanDerWaalsContact O-N 3.15Å; P198-N201 PolarHBondContact O-N 3.25Å; P198-N201 VanDerWaalsContact O-N 3.07Å; P198-L204 HydrophobicContact CB-CD1 4.09Å; P198-L213 HydrophobicContact CB-CD2 4.47Å; P198-L213 HydrophobicContact CG-CD1 4.08Å; P198-L213 HydrophobicContact CG-CD2 4.19Å; P198-T228 HydrophobicContact CG-CG2 3.87Å; P198-P232 HydrophobicContact CB-CB 3.84Å; P198-P232 HydrophobicContact CB-CG 4.14Å; P198-W237 HydrophobicContact CB-CZ2 3.9Å; P198-W237 HydrophobicContact CG-CH2 4.49Å; P198-W237 HydrophobicContact CG-CZ2 3.79Å
199	Y	97.5	Very high	92.4	Very high	70 Å²	70	74.5 Å²	74.5	28%	0.275	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-64.6	-16	179.8	71.2	-89.5	0	0	0	114.8	G175 K197 S205	G175-Y199 WeakPolarHBondContact O-CD1 3.22Å; G175-Y199 WeakPolarHBondContact O-CE1 3.33Å; K197-Y199 HydrophobicContact CB-CD1 4.18Å; K197-Y199 HydrophobicContact CB-CE1 3.68Å; K197-Y199 HydrophobicContact CD-CE1 4.37Å; K197-Y199 HydrophobicContact CG-CE1 4.04Å; K197-Y199 PolarHBondContact O-N 3.15Å; K197-Y199 VanDerWaalsContact O-N 3.1Å; Y199-S205 VanDerWaalsContact O-CB 3.31Å; Y199-S205 WeakPolarHBondContact O-CB 2.9Å; Y199-S205 PolarHBondContact O-OG 3.26Å
200	L	97.7	Very high	94.1	Very high	119 Å²	119	69.7 Å²	69.7	62%	0.623	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-83.9	-18.9	174.9	-66.1	-178.9	0	0	0	112.9	K197 P198	K197-L200 HydrophobicContact CB-CB 4.46Å; K197-L200 HydrophobicContact CB-CD1 3.77Å; K197-L200 HydrophobicContact CB-CG 3.98Å; K197-L200 HydrophobicContact CD-CD1 3.67Å; K197-L200 HydrophobicContact CG-CD1 4.37Å; K197-L200 WeakPolarHBondContact O-CB 3.49Å; K197-L200 PolarHBondContact O-N 3.22Å; P198-L200 PolarHBondContact O-N 2.85Å; P198-L200 VanDerWaalsContact O-N 3.15Å
201	N	97.1	Very high	95.4	Very high	40 Å²	40	68.3 Å²	68.3	21%	0.214	37%	0.373	C	S	.	.	S	Bend	trans	-80	122.3	174.1	-177.9	-18	0	0	0	109.1	P198 E203 L204 S205 N244	P198-N201 PolarHBondContact O-N 3.25Å; P198-N201 VanDerWaalsContact O-N 3.07Å; N201-E203 PolarHBondContact O-N 3.4Å; N201-E203 PolarHBondContact OD1-N 3.38Å; N201-L204 HydrophobicContact CB-CB 4.23Å; N201-L204 HydrophobicContact CB-CD1 4.01Å; N201-L204 HydrophobicContact CB-CG 4.07Å; N201-L204 PolarHBondContact O-N 2.66Å; N201-L204 VanDerWaalsContact O-N 3.11Å; N201-S205 VanDerWaalsContact O-CB 3.23Å; N201-S205 WeakPolarHBondContact O-CB 3.41Å; N201-S205 PolarHBondContact O-N 2.73Å; N201-N244 PolarHBondContact ND2-OD1 3.48Å
202	S	96	Very high	96.1	Very high	108 Å²	108	62 Å²	62	76%	0.755	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.6	179.7	50.5	0	0	0	0	114.4
203	E	94.5	Very high	96.5	Very high	121 Å²	121	60.9 Å²	60.9	57%	0.565	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-27	179.1	-59.8	-179.4	160.3	0	0	112.4	N201 R233 I247	N201-E203 PolarHBondContact O-N 3.4Å; N201-E203 PolarHBondContact OD1-N 3.38Å; E203-R233 WeakPolarHBondContact O-CD 3.31Å; E203-I247 HydrophobicContact CB-CD1 3.75Å
204	L	96.5	Very high	96.8	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-30.9	-179.9	-57.6	179.9	0	0	0	112.3	P198 N201 R206 P232 R233 W237 N244 I247	P198-L204 HydrophobicContact CB-CD1 4.09Å; N201-L204 HydrophobicContact CB-CB 4.23Å; N201-L204 HydrophobicContact CB-CD1 4.01Å; N201-L204 HydrophobicContact CB-CG 4.07Å; N201-L204 PolarHBondContact O-N 2.66Å; N201-L204 VanDerWaalsContact O-N 3.11Å; L204-R206 PolarHBondContact O-N 2.68Å; L204-P232 HydrophobicContact CB-CB 4.41Å; L204-P232 CarbonylContact O-C 3.42Å; L204-P232 WeakPolarHBondContact O-CA 3.44Å; L204-R233 HydrophobicContact CD2-CB 4.09Å; L204-R233 PolarHBondContact O-N 3.23Å; L204-W237 HydrophobicContact CD1-CH2 4.31Å; L204-W237 HydrophobicContact CD1-CZ2 3.45Å; L204-W237 VanDerWaalsContact CD1-CZ2 3.45Å; L204-N244 HydrophobicContact CD1-CB 4.19Å; L204-I247 HydrophobicContact CD2-CD1 3.89Å; L204-I247 HydrophobicContact CD2-CG1 3.73Å; L204-I247 HydrophobicContact CD2-CG2 4.37Å
205	S	96.4	Very high	97	Very high	42 Å²	42	56.9 Å²	56.9	29%	0.294	31%	0.306	S	S	.	.			trans	-66	129.5	-173.3	-164.9	0	0	0	0	111.4	Y199 N201	Y199-S205 VanDerWaalsContact O-CB 3.31Å; Y199-S205 WeakPolarHBondContact O-CB 2.9Å; Y199-S205 PolarHBondContact O-OG 3.26Å; N201-S205 VanDerWaalsContact O-CB 3.23Å; N201-S205 WeakPolarHBondContact O-CB 3.41Å; N201-S205 PolarHBondContact O-N 2.73Å
206	R	95.4	Very high	97	Very high	17 Å²	17	53.7 Å²	53.7	6%	0.064	29%	0.286	C	S	.	.			trans	-130.3	85.1	176.5	-65.6	-177.8	-68	176.1	3.3	108.7	L204 K208 L209 G210 G230 G231 P232 R233 W257	L204-R206 PolarHBondContact O-N 2.68Å; R206-K208 PolarHBondContact O-N 2.66Å; R206-L209 HydrophobicContact CB-CB 4.33Å; R206-L209 HydrophobicContact CB-CD1 4.35Å; R206-L209 HydrophobicContact CB-CG 4.43Å; R206-L209 PolarHBondContact O-N 2.91Å; R206-G210 PolarHBondContact O-N 3.23Å; R206-G230 PolarHBondContact NH2-O 2.67Å; R206-G231 PolarHBondContact NE-O 3.05Å; R206-G231 PolarHBondContact NH2-O 2.84Å; R206-P232 PolarHBondContact NH2-O 2.88Å; R206-R233 HydrophobicContact CG-CG 4.21Å; R206-W257 PolarHBondContact NH1-O 3.4Å
207	P	94.7	Very high	96.9	Very high	115 Å²	115	53.8 Å²	53.8	75%	0.747	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-30.3	-172.2	-29.3	35.7	0	0	0	114.8	L209	P207-L209 VanDerWaalsContact C-N 3.31Å; P207-L209 PolarHBondContact O-N 3.05Å
208	K	95.2	Very high	96.8	Very high	212 Å²	212	50.4 Å²	50.4	92%	0.922	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-30.8	176.1	-66.9	-176.7	-178.8	176.2	0	113.5	R206	R206-K208 PolarHBondContact O-N 2.66Å
209	L	95.6	Very high	96.6	Very high	39 Å²	39	51.4 Å²	51.4	20%	0.204	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-34.2	178	-62.7	-178.7	0	0	0	110.8	R206 P207 W212	R206-L209 HydrophobicContact CB-CB 4.33Å; R206-L209 HydrophobicContact CB-CD1 4.35Å; R206-L209 HydrophobicContact CB-CG 4.43Å; R206-L209 PolarHBondContact O-N 2.91Å; P207-L209 VanDerWaalsContact C-N 3.31Å; P207-L209 PolarHBondContact O-N 3.05Å; L209-W212 PolarHBondContact O-NE1 3.34Å
210	G	97	Very high	96.1	Very high	27 Å²	27	53.4 Å²	53.4	28%	0.278	29%	0.293	S	S	.	.			trans	105	-169.7	179.9	0	0	0	0	0	112.7	R206 G231	R206-G210 PolarHBondContact O-N 3.23Å; G210-G231 CarbonylContact O-C 3.56Å; G210-G231 WeakPolarHBondContact O-CA 3.45Å
211	S	98	Very high	95.7	Very high	42 Å²	42	56.4 Å²	56.4	29%	0.294	30%	0.301	S	S	.	.	S	Bend	trans	-97.3	-14.2	-173.4	53.8	0	0	0	0	114.8	G175 P232	G175-S211 WeakPolarHBondContact CA-O 3.38Å; S211-P232 WeakPolarHBondContact O-CD 3.45Å
212	W	98.4	Very high	95.4	Very high	45 Å²	45	58.6 Å²	58.6	17%	0.17	31%	0.31	C	S	.	.			trans	-59.1	142.3	-170.1	47.5	-86.3	0	0	0	114.1	Y158 E173 L209 T214 G230 G231 P232 Y258	Y158-W212 HydrophobicContact CE2-CB 4.5Å; E173-W212 HydrophobicContact CB-CB 4.42Å; E173-W212 HydrophobicContact CG-CB 4.3Å; E173-W212 WeakPolarHBondContact O-CA 3.39Å; E173-W212 WeakPolarHBondContact OE1-CB 3.37Å; E173-W212 VanDerWaalsContact OE2-CB 3.23Å; E173-W212 WeakPolarHBondContact OE2-CB 3.31Å; L209-W212 PolarHBondContact O-NE1 3.34Å; W212-T214 HydrophobicContact CE3-CG2 3.4Å; W212-T214 VanDerWaalsContact CE3-CG2 3.4Å; W212-T214 HydrophobicContact CZ3-CG2 3.32Å; W212-G230 CarbonylContact O-C 3.55Å; W212-G230 WeakPolarHBondContact O-CA 3.48Å; W212-G231 PolarHBondContact O-N 3.1Å; W212-P232 WeakPolarHBondContact O-CD 3.47Å; W212-Y258 AromaticContact CH2-CD1 3.9Å; W212-Y258 HydrophobicContact CH2-CD1 3.9Å; W212-Y258 AromaticContact CH2-CD2 3.47Å; W212-Y258 HydrophobicContact CH2-CD2 3.47Å; W212-Y258 VanDerWaalsContact CH2-CD2 3.47Å; W212-Y258 AromaticContact CH2-CE1 3.94Å; W212-Y258 HydrophobicContact CH2-CE1 3.94Å; W212-Y258 AromaticContact CH2-CE2 3.54Å; W212-Y258 HydrophobicContact CH2-CE2 3.54Å; W212-Y258 AromaticContact CH2-CG 3.66Å; W212-Y258 HydrophobicContact CH2-CG 3.66Å; W212-Y258 AromaticContact CH2-CZ 3.78Å; W212-Y258 HydrophobicContact CZ2-CD1 4.46Å; W212-Y258 AromaticContact CZ3-CD2 3.83Å; W212-Y258 HydrophobicContact CZ3-CD2 3.83Å; W212-Y258 AromaticContact CZ3-CE2 3.97Å; W212-Y258 HydrophobicContact CZ3-CE2 3.97Å; W212-Y258 HydrophobicContact CZ3-CG 4.37Å
213	L	98.7	Very high	95.2	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	112.8	-178.6	-61.5	174.7	0	0	0	110.8	Y158 S171 S172 V177 P198 G229 P232	Y158-L213 VanDerWaalsContact CD2-O 3.23Å; Y158-L213 WeakPolarHBondContact CD2-O 3.48Å; S171-L213 PolarHBondContact OG-O 3.18Å; S172-L213 PolarHBondContact O-N 2.92Å; V177-L213 HydrophobicContact CG2-CD1 3.6Å; P198-L213 HydrophobicContact CB-CD2 4.47Å; P198-L213 HydrophobicContact CG-CD1 4.08Å; P198-L213 HydrophobicContact CG-CD2 4.19Å; L213-G229 CarbonylContact C-O 3.18Å; L213-G229 WeakPolarHBondContact CA-O 3.44Å; L213-P232 HydrophobicContact CD2-CB 4.38Å; L213-P232 HydrophobicContact CD2-CG 3.96Å
214	T	97.8	Very high	95.2	Very high	17 Å²	17	54 Å²	54	10%	0.104	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-26.3	-175.7	50.2	0	0	0	0	113.7	W212 G229 S259	W212-T214 HydrophobicContact CE3-CG2 3.4Å; W212-T214 VanDerWaalsContact CE3-CG2 3.4Å; W212-T214 HydrophobicContact CZ3-CG2 3.32Å; T214-G229 PolarHBondContact N-O 3.2Å; T214-G229 PolarHBondContact OG1-O 3.34Å; T214-S259 PolarHBondContact OG1-O 2.91Å
215	T	97.6	Very high	95.2	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.3	-171.3	-169.1	0	0	0	0	111.5	T228 G229 L234 A262	T215-T228 VanDerWaalsContact O-CA 3.3Å; T215-T228 WeakPolarHBondContact O-CA 3.27Å; T215-T228 PolarHBondContact O-OG1 2.9Å; T215-G229 PolarHBondContact N-O 2.94Å; T215-G229 PolarHBondContact O-N 2.84Å; T215-L234 HydrophobicContact CG2-CD1 4.09Å; T215-A262 HydrophobicContact CG2-CB 4Å; T215-A262 PolarHBondContact OG1-N 2.93Å
216	L	98.3	Very high	95.3	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	128.9	169	177.1	63.6	0	0	0	107.9	K159 V177 F226 V227	K159-L216 HydrophobicContact CB-CB 4Å; K159-L216 HydrophobicContact CG-CB 4.07Å; K159-L216 WeakPolarHBondContact CG-O 3.1Å; V177-L216 HydrophobicContact CG1-CD1 3.79Å; V177-L216 HydrophobicContact CG1-CD2 4.12Å; L216-F226 HydrophobicContact CD1-CB 4.18Å; L216-F226 HydrophobicContact CD1-CD2 3.69Å; L216-F226 HydrophobicContact CD1-CG 4.27Å; L216-V227 WeakPolarHBondContact CA-O 3.37Å
217	S	97.1	Very high	95.4	Very high	16 Å²	16	54.6 Å²	54.6	11%	0.112	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	136.6	168.6	167.7	0	0	0	0	108.3	F226 V227 A262 I263 F264	S217-F226 CarbonylContact O-C 3.57Å; S217-F226 VanDerWaalsContact O-CA 3.24Å; S217-F226 WeakPolarHBondContact O-CA 3.42Å; S217-F226 WeakPolarHBondContact O-CB 3.45Å; S217-V227 PolarHBondContact N-O 3.05Å; S217-V227 PolarHBondContact O-N 3.06Å; S217-A262 WeakPolarHBondContact CB-O 2.95Å; S217-I263 WeakPolarHBondContact OG-CA 3.36Å; S217-F264 VanDerWaalsContact O-CE2 3.31Å; S217-F264 WeakPolarHBondContact O-CE2 3.41Å; S217-F264 WeakPolarHBondContact OG-CD2 3.35Å; S217-F264 PolarHBondContact OG-N 2.87Å; S217-F264 VanDerWaalsContact OG-N 3.09Å
218	C	96	Very high	95.6	Very high	23 Å²	23	49.1 Å²	49.1	16%	0.155	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.1	178.3	-64.9	0	0	0	0	108.5	V163 F264	V163-C218 HydrophobicContact CG2-CB 4.14Å; V163-C218 VanDerWaalsContact CG2-SG 3.6Å; C218-F264 VanDerWaalsContact C-CD2 3.45Å
219	K	93.5	Very high	95.7	Very high	21 Å²	21	39 Å²	39	9%	0.091	20%	0.195	C	C	.	.			trans	-70.5	133.5	-178.7	-169.4	174.1	171.8	-168.7	0	109.4	E222 W225 F264 S271	K219-E222 HydrophobicContact CB-CB 4.33Å; K219-E222 HydrophobicContact CD-CB 3.97Å; K219-E222 HydrophobicContact CD-CG 4.48Å; K219-E222 VanDerWaalsContact CE-CD 3.49Å; K219-E222 WeakPolarHBondContact CE-OE1 3.33Å; K219-E222 HydrophobicContact CG-CB 4.15Å; K219-E222 IonicContact NZ-OE1 3.91Å; K219-E222 PolarHBondContact NZ-OE1 2.85Å; K219-E222 IonicContact NZ-OE2 2.79Å; K219-E222 PolarHBondContact NZ-OE2 3.34Å; K219-W225 HydrophobicContact CB-CB 3.89Å; K219-W225 HydrophobicContact CD-CB 4.29Å; K219-W225 PolarHBondContact N-O 2.89Å; K219-F264 HydrophobicContact CB-CD1 4.13Å; K219-F264 HydrophobicContact CB-CD2 3.92Å; K219-F264 HydrophobicContact CB-CE1 4.2Å; K219-F264 HydrophobicContact CB-CE2 4Å; K219-F264 HydrophobicContact CB-CG 3.99Å; K219-F264 HydrophobicContact CB-CZ 4.14Å; K219-F264 HydrophobicContact CD-CD1 4.36Å; K219-F264 HydrophobicContact CD-CE1 4.4Å; K219-F264 HydrophobicContact CG-CD1 4.12Å; K219-F264 HydrophobicContact CG-CE1 4.46Å; K219-F264 HydrophobicContact CG-CG 4.21Å; K219-F264 VanDerWaalsContact N-CD2 3.34Å; K219-S271 VanDerWaalsContact CE-OG 3.23Å; K219-S271 WeakPolarHBondContact CE-OG 3.44Å
220	Q	87.4	Confident	95.8	Very high	112 Å²	112	37.2 Å²	37.2	52%	0.523	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	137.2	-179.8	-160.6	177.8	-1.9	0	0	109.6	E222	Q220-E222 PolarHBondContact O-N 3.23Å
221	F	87.8	Confident	95.8	Very high	182 Å²	182	35.9 Å²	35.9	80%	0.798	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	-8.5	-178.4	-47.4	-67.2	0	0	0	116.8
222	E	91.8	Very high	95.8	Very high	86 Å²	86	34 Å²	34	40%	0.402	16%	0.158	S	C	.	.			trans	-121.8	72.3	173.9	-70.5	-179.6	-128.7	0	0	109.9	K219 Q220 D224 W225	K219-E222 HydrophobicContact CB-CB 4.33Å; K219-E222 HydrophobicContact CD-CB 3.97Å; K219-E222 HydrophobicContact CD-CG 4.48Å; K219-E222 VanDerWaalsContact CE-CD 3.49Å; K219-E222 WeakPolarHBondContact CE-OE1 3.33Å; K219-E222 HydrophobicContact CG-CB 4.15Å; K219-E222 IonicContact NZ-OE1 3.91Å; K219-E222 PolarHBondContact NZ-OE1 2.85Å; K219-E222 IonicContact NZ-OE2 2.79Å; K219-E222 PolarHBondContact NZ-OE2 3.34Å; Q220-E222 PolarHBondContact O-N 3.23Å; E222-D224 PolarHBondContact O-N 2.8Å; E222-W225 PolarHBondContact O-N 3.09Å
223	E	90.9	Very high	95.7	Very high	82 Å²	82	34 Å²	34	38%	0.383	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-14.9	-171.2	-62	170.3	-159.8	0	0	114.4	V163 G164 W225 R239	V163-E223 HydrophobicContact CG1-CB 4.12Å; V163-E223 HydrophobicContact CG1-CG 4.38Å; G164-E223 WeakPolarHBondContact CA-OE1 3.32Å; E223-W225 VanDerWaalsContact C-N 3.29Å; E223-R239 WeakPolarHBondContact O-CD 3.44Å; E223-R239 PolarHBondContact O-NH1 3.03Å
224	D	95	Very high	95.7	Very high	51 Å²	51	34 Å²	34	27%	0.273	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-14.2	176.5	-82	-39.1	0	0	0	113.4	E222 S238 R239 R240	E222-D224 PolarHBondContact O-N 2.8Å; D224-S238 CarbonylContact O-C 3.51Å; D224-S238 WeakPolarHBondContact O-CA 3.32Å; D224-R239 WeakPolarHBondContact O-CG 3.45Å; D224-R239 PolarHBondContact O-N 3.48Å; D224-R240 IonicContact OD2-CZ 2.87Å; D224-R240 IonicContact OD2-NE 3.61Å; D224-R240 PolarHBondContact OD2-NE 3.29Å; D224-R240 VanDerWaalsContact OD2-NE 3.17Å; D224-R240 IonicContact OD2-NH2 3.72Å; D224-R240 PolarHBondContact OD2-NH2 3.47Å
225	W	96.7	Very high	95.7	Very high	72 Å²	72	33.2 Å²	33.2	27%	0.273	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.8	-176.1	-65.2	98	0	0	0	112.1	K219 E222 E223 L236 W237 V245 F264	K219-W225 HydrophobicContact CB-CB 3.89Å; K219-W225 HydrophobicContact CD-CB 4.29Å; K219-W225 PolarHBondContact N-O 2.89Å; E222-W225 PolarHBondContact O-N 3.09Å; E223-W225 VanDerWaalsContact C-N 3.29Å; W225-L236 HydrophobicContact CE3-CD1 3.85Å; W225-L236 HydrophobicContact CE3-CD2 4.01Å; W225-L236 HydrophobicContact CE3-CG 3.86Å; W225-L236 HydrophobicContact CZ3-CD1 4.49Å; W225-L236 HydrophobicContact CZ3-CD2 3.89Å; W225-L236 HydrophobicContact CZ3-CG 4Å; W225-W237 WeakPolarHBondContact CA-O 3.39Å; W225-V245 HydrophobicContact CH2-CG1 4.32Å; W225-V245 HydrophobicContact CH2-CG2 3.93Å; W225-V245 HydrophobicContact CZ3-CB 3.98Å; W225-V245 HydrophobicContact CZ3-CG1 4.16Å; W225-V245 HydrophobicContact CZ3-CG2 3.55Å; W225-F264 HydrophobicContact CB-CZ 4.48Å
226	F	98	Very high	95.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	155.2	172.1	73.7	-83.1	0	0	0	111.8	V177 F179 F196 L216 S217 T228 W237 R239	V177-F226 HydrophobicContact CB-CE2 4.32Å; V177-F226 HydrophobicContact CG1-CD2 4.42Å; V177-F226 HydrophobicContact CG1-CE2 4.09Å; V177-F226 HydrophobicContact CG2-CE2 4.16Å; F179-F226 HydrophobicContact CE2-CD1 4.04Å; F179-F226 AromaticContact CE2-CE1 3.97Å; F179-F226 HydrophobicContact CE2-CE1 3.97Å; F179-F226 HydrophobicContact CE2-CG 4.43Å; F179-F226 HydrophobicContact CE2-CZ 4.33Å; F179-F226 HydrophobicContact CZ-CB 4.22Å; F179-F226 AromaticContact CZ-CD1 3.74Å; F179-F226 HydrophobicContact CZ-CD1 3.74Å; F179-F226 HydrophobicContact CZ-CD2 4.47Å; F179-F226 HydrophobicContact CZ-CE1 4.16Å; F179-F226 AromaticContact CZ-CG 3.9Å; F179-F226 HydrophobicContact CZ-CG 3.9Å; F196-F226 HydrophobicContact CB-CZ 4.07Å; F196-F226 HydrophobicContact CD1-CE1 4.2Å; F196-F226 AromaticContact CD1-CZ 3.9Å; F196-F226 HydrophobicContact CD1-CZ 3.9Å; F196-F226 AromaticContact CD2-CE1 3.98Å; F196-F226 HydrophobicContact CD2-CE1 3.98Å; F196-F226 AromaticContact CD2-CZ 3.72Å; F196-F226 HydrophobicContact CD2-CZ 3.72Å; F196-F226 HydrophobicContact CE1-CE1 4.12Å; F196-F226 HydrophobicContact CE1-CZ 4.29Å; F196-F226 AromaticContact CE2-CE1 3.93Å; F196-F226 HydrophobicContact CE2-CE1 3.93Å; F196-F226 HydrophobicContact CE2-CZ 4.17Å; F196-F226 HydrophobicContact CG-CE1 4.15Å; F196-F226 AromaticContact CG-CZ 3.61Å; F196-F226 HydrophobicContact CG-CZ 3.61Å; F196-F226 HydrophobicContact CZ-CE1 4.03Å; F196-F226 HydrophobicContact CZ-CZ 4.45Å; L216-F226 HydrophobicContact CD1-CB 4.18Å; L216-F226 HydrophobicContact CD1-CD2 3.69Å; L216-F226 HydrophobicContact CD1-CG 4.27Å; S217-F226 CarbonylContact O-C 3.57Å; S217-F226 VanDerWaalsContact O-CA 3.24Å; S217-F226 WeakPolarHBondContact O-CA 3.42Å; S217-F226 WeakPolarHBondContact O-CB 3.45Å; F226-T228 HydrophobicContact CD2-CG2 4.31Å; F226-T228 HydrophobicContact CE2-CG2 3.81Å; F226-W237 HydrophobicContact CD1-CB 3.72Å; F226-W237 HydrophobicContact CD2-CB 4.18Å; F226-W237 HydrophobicContact CD2-CG 4.47Å; F226-W237 HydrophobicContact CE1-CB 3.28Å; F226-W237 HydrophobicContact CE1-CG 4.02Å; F226-W237 HydrophobicContact CE2-CB 3.76Å; F226-W237 AromaticContact CE2-CD1 3.96Å; F226-W237 HydrophobicContact CE2-CD2 4.33Å; F226-W237 AromaticContact CE2-CG 3.74Å; F226-W237 HydrophobicContact CE2-CG 3.74Å; F226-W237 HydrophobicContact CG-CB 4.17Å; F226-W237 HydrophobicContact CZ-CB 3.29Å; F226-W237 AromaticContact CZ-CD2 3.86Å; F226-W237 HydrophobicContact CZ-CD2 3.86Å; F226-W237 HydrophobicContact CZ-CE3 4.18Å; F226-W237 AromaticContact CZ-CG 3.49Å; F226-W237 HydrophobicContact CZ-CG 3.49Å; F226-W237 VanDerWaalsContact CZ-CG 3.49Å; F226-W237 PolarHBondContact N-O 3.39Å; F226-W237 PolarHBondContact O-N 2.9Å; F226-R239 HydrophobicContact CD1-CG 3.52Å; F226-R239 HydrophobicContact CE1-CG 3.64Å
227	V	98.4	Very high	95.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.2	172.4	65.6	0	0	0	0	108.9	L216 S217 L234 S235 L248 A262 F264 I273	L216-V227 WeakPolarHBondContact CA-O 3.37Å; S217-V227 PolarHBondContact N-O 3.05Å; S217-V227 PolarHBondContact O-N 3.06Å; V227-L234 HydrophobicContact CG2-CD1 3.68Å; V227-L234 HydrophobicContact CG2-CG 4.14Å; V227-S235 WeakPolarHBondContact CA-O 3.23Å; V227-S235 WeakPolarHBondContact CG2-O 3.47Å; V227-L248 HydrophobicContact CG2-CD1 3.85Å; V227-A262 HydrophobicContact CG1-CB 4.08Å; V227-F264 HydrophobicContact CB-CE2 4.19Å; V227-F264 HydrophobicContact CB-CZ 4.21Å; V227-F264 HydrophobicContact CG1-CD2 4.35Å; V227-F264 HydrophobicContact CG1-CE2 3.89Å; V227-F264 HydrophobicContact CG1-CZ 4.32Å; V227-I273 HydrophobicContact CB-CG2 4.5Å; V227-I273 HydrophobicContact CG1-CG2 4.28Å; V227-I273 HydrophobicContact CG2-CG2 4.09Å
228	T	98.6	Very high	95.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.4	177.6	-170.4	0	0	0	0	111	V177 P198 T215 F226 L234 S235	V177-T228 HydrophobicContact CG2-CG2 3.94Å; V177-T228 WeakPolarHBondContact CG2-OG1 3.4Å; P198-T228 HydrophobicContact CG-CG2 3.87Å; T215-T228 VanDerWaalsContact O-CA 3.3Å; T215-T228 WeakPolarHBondContact O-CA 3.27Å; T215-T228 PolarHBondContact O-OG1 2.9Å; F226-T228 HydrophobicContact CD2-CG2 4.31Å; F226-T228 HydrophobicContact CE2-CG2 3.81Å; T228-L234 WeakPolarHBondContact O-CA 3.43Å; T228-S235 PolarHBondContact N-O 3.45Å; T228-S235 VanDerWaalsContact N-O 3.16Å; T228-S235 PolarHBondContact O-N 2.75Å
229	G	98	Very high	95.7	Very high	0 Å²	0	34 Å²	34	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173	-179.4	175.8	0	0	0	0	0	112.9	L213 T214 T215 S259	L213-G229 CarbonylContact C-O 3.18Å; L213-G229 WeakPolarHBondContact CA-O 3.44Å; T214-G229 PolarHBondContact N-O 3.2Å; T214-G229 PolarHBondContact OG1-O 3.34Å; T215-G229 PolarHBondContact N-O 2.94Å; T215-G229 PolarHBondContact O-N 2.84Å; G229-S259 WeakPolarHBondContact CA-OG 3.47Å
230	G	97.3	Very high	95.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.4	-118.3	-176.7	0	0	0	0	0	108.7	R206 W212 P232 Y258 S259	R206-G230 PolarHBondContact NH2-O 2.67Å; W212-G230 CarbonylContact O-C 3.55Å; W212-G230 WeakPolarHBondContact O-CA 3.48Å; G230-P232 CarbonylContact C-O 3.57Å; G230-P232 PolarHBondContact N-O 2.96Å; G230-P232 VanDerWaalsContact O-O 3.05Å; G230-Y258 WeakPolarHBondContact O-CB 3.14Å; G230-S259 PolarHBondContact N-OG 2.91Å
231	G	97.2	Very high	96.1	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-53.7	-57.1	166.9	0	0	0	0	0	111.9	R206 G210 W212	R206-G231 PolarHBondContact NE-O 3.05Å; R206-G231 PolarHBondContact NH2-O 2.84Å; G210-G231 CarbonylContact O-C 3.56Å; G210-G231 WeakPolarHBondContact O-CA 3.45Å; W212-G231 PolarHBondContact O-N 3.1Å
232	P	97.2	Very high	96.5	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	17%	0.168	C	C	.	.	S	Bend	trans	-63.8	152.8	167	-23.2	35.5	0	0	0	112.8	P198 L204 R206 S211 W212 L213 G230	P198-P232 HydrophobicContact CB-CB 3.84Å; P198-P232 HydrophobicContact CB-CG 4.14Å; L204-P232 HydrophobicContact CB-CB 4.41Å; L204-P232 CarbonylContact O-C 3.42Å; L204-P232 WeakPolarHBondContact O-CA 3.44Å; R206-P232 PolarHBondContact NH2-O 2.88Å; S211-P232 WeakPolarHBondContact O-CD 3.45Å; W212-P232 WeakPolarHBondContact O-CD 3.47Å; L213-P232 HydrophobicContact CD2-CB 4.38Å; L213-P232 HydrophobicContact CD2-CG 3.96Å; G230-P232 CarbonylContact C-O 3.57Å; G230-P232 PolarHBondContact N-O 2.96Å; G230-P232 VanDerWaalsContact O-O 3.05Å
233	R	96.8	Very high	96.7	Very high	47 Å²	47	37.7 Å²	37.7	18%	0.177	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-57.9	139.8	178.1	-64.5	-172.7	-176.6	-82.1	-0.6	110.7	E203 L204 R206 S235 I247 H249 D255	E203-R233 WeakPolarHBondContact O-CD 3.31Å; L204-R233 HydrophobicContact CD2-CB 4.09Å; L204-R233 PolarHBondContact O-N 3.23Å; R206-R233 HydrophobicContact CG-CG 4.21Å; R233-S235 PolarHBondContact O-N 2.98Å; R233-S235 PolarHBondContact O-OG 3.23Å; R233-I247 HydrophobicContact CB-CG2 3.88Å; R233-I247 HydrophobicContact CG-CG2 4.49Å; R233-H249 PolarHBondContact NH1-CD2 2.87Å; R233-H249 PolarHBondContact NH1-CE1 3.41Å; R233-H249 VanDerWaalsContact NH1-CG 3.3Å; R233-H249 PolarHBondContact NH1-ND1 3.12Å; R233-H249 PolarHBondContact NH1-NE2 3.39Å; R233-D255 IonicContact CZ-OD1 3.62Å; R233-D255 IonicContact NH1-OD1 3.36Å; R233-D255 IonicContact NH2-OD1 3.34Å; R233-D255 PolarHBondContact NH2-OD1 3.06Å
234	L	97.9	Very high	97	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-56.8	131.1	171.7	-178.2	73.4	0	0	0	108.5	T215 V227 T228 L248 W257 A262 S275	T215-L234 HydrophobicContact CG2-CD1 4.09Å; V227-L234 HydrophobicContact CG2-CD1 3.68Å; V227-L234 HydrophobicContact CG2-CG 4.14Å; T228-L234 WeakPolarHBondContact O-CA 3.43Å; L234-L248 HydrophobicContact CB-CB 4.28Å; L234-L248 HydrophobicContact CD2-CB 3.79Å; L234-L248 HydrophobicContact CD2-CD1 4.07Å; L234-L248 HydrophobicContact CG-CB 3.92Å; L234-L248 HydrophobicContact CG-CD1 4.12Å; L234-L248 HydrophobicContact CG-CG 4.45Å; L234-L248 PolarHBondContact O-N 2.81Å; L234-W257 HydrophobicContact CB-CZ3 4.48Å; L234-W257 HydrophobicContact CD2-CH2 4.38Å; L234-A262 HydrophobicContact CD1-CB 3.93Å; L234-S275 VanDerWaalsContact CD2-CB 3.45Å
235	S	98	Very high	97.1	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	147.1	-174.2	43.2	0	0	0	0	111.9	V227 T228 R233 W237 S246	V227-S235 WeakPolarHBondContact CA-O 3.23Å; V227-S235 WeakPolarHBondContact CG2-O 3.47Å; T228-S235 PolarHBondContact N-O 3.45Å; T228-S235 VanDerWaalsContact N-O 3.16Å; T228-S235 PolarHBondContact O-N 2.75Å; R233-S235 PolarHBondContact O-N 2.98Å; R233-S235 PolarHBondContact O-OG 3.23Å; S235-W237 PolarHBondContact OG-NE1 3.01Å; S235-S246 VanDerWaalsContact CA-O 3.27Å; S235-S246 WeakPolarHBondContact CA-O 3.26Å; S235-S246 VanDerWaalsContact CB-O 3.27Å; S235-S246 WeakPolarHBondContact CB-O 3.18Å
236	L	98.2	Very high	97.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	138.6	170.3	177.7	63.1	0	0	0	109.4	W225 N244 V245 S246 F264 I273 H287	W225-L236 HydrophobicContact CE3-CD1 3.85Å; W225-L236 HydrophobicContact CE3-CD2 4.01Å; W225-L236 HydrophobicContact CE3-CG 3.86Å; W225-L236 HydrophobicContact CZ3-CD1 4.49Å; W225-L236 HydrophobicContact CZ3-CD2 3.89Å; W225-L236 HydrophobicContact CZ3-CG 4Å; L236-N244 CarbonylContact O-C 3.59Å; L236-N244 VanDerWaalsContact O-CA 3.28Å; L236-N244 WeakPolarHBondContact O-CA 3.25Å; L236-V245 PolarHBondContact O-N 2.89Å; L236-S246 WeakPolarHBondContact CB-OG 3.37Å; L236-S246 PolarHBondContact N-O 3.42Å; L236-F264 HydrophobicContact CD1-CE1 3.91Å; L236-F264 HydrophobicContact CD1-CZ 3.54Å; L236-I273 HydrophobicContact CB-CD1 4.29Å; L236-I273 HydrophobicContact CD1-CD1 4.01Å; L236-I273 HydrophobicContact CD2-CD1 4.36Å; L236-I273 HydrophobicContact CG-CD1 4.45Å; L236-H287 HydrophobicContact CD2-CB 3.67Å; L236-H287 WeakPolarHBondContact CD2-O 3.49Å
237	W	98.2	Very high	97	Very high	13 Å²	13	35.4 Å²	35.4	5%	0.049	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	145.4	-177.1	-71.3	71.2	0	0	0	111.6	F196 P198 L204 W225 F226 S235 N244	F196-W237 HydrophobicContact CB-CE3 4.49Å; F196-W237 HydrophobicContact CB-CZ3 4.37Å; F196-W237 HydrophobicContact CD1-CD2 4.48Å; F196-W237 AromaticContact CD1-CE3 3.5Å; F196-W237 HydrophobicContact CD1-CE3 3.5Å; F196-W237 AromaticContact CD1-CZ3 3.69Å; F196-W237 HydrophobicContact CD1-CZ3 3.69Å; F196-W237 HydrophobicContact CE1-CE3 4.15Å; F196-W237 HydrophobicContact CG-CE3 4.33Å; F196-W237 HydrophobicContact CG-CZ3 4.49Å; P198-W237 HydrophobicContact CB-CZ2 3.9Å; P198-W237 HydrophobicContact CG-CH2 4.49Å; P198-W237 HydrophobicContact CG-CZ2 3.79Å; L204-W237 HydrophobicContact CD1-CH2 4.31Å; L204-W237 HydrophobicContact CD1-CZ2 3.45Å; L204-W237 VanDerWaalsContact CD1-CZ2 3.45Å; W225-W237 WeakPolarHBondContact CA-O 3.39Å; F226-W237 HydrophobicContact CD1-CB 3.72Å; F226-W237 HydrophobicContact CD2-CB 4.18Å; F226-W237 HydrophobicContact CD2-CG 4.47Å; F226-W237 HydrophobicContact CE1-CB 3.28Å; F226-W237 HydrophobicContact CE1-CG 4.02Å; F226-W237 HydrophobicContact CE2-CB 3.76Å; F226-W237 AromaticContact CE2-CD1 3.96Å; F226-W237 HydrophobicContact CE2-CD2 4.33Å; F226-W237 AromaticContact CE2-CG 3.74Å; F226-W237 HydrophobicContact CE2-CG 3.74Å; F226-W237 HydrophobicContact CG-CB 4.17Å; F226-W237 HydrophobicContact CZ-CB 3.29Å; F226-W237 AromaticContact CZ-CD2 3.86Å; F226-W237 HydrophobicContact CZ-CD2 3.86Å; F226-W237 HydrophobicContact CZ-CE3 4.18Å; F226-W237 AromaticContact CZ-CG 3.49Å; F226-W237 HydrophobicContact CZ-CG 3.49Å; F226-W237 VanDerWaalsContact CZ-CG 3.49Å; F226-W237 PolarHBondContact N-O 3.39Å; F226-W237 PolarHBondContact O-N 2.9Å; S235-W237 PolarHBondContact OG-NE1 3.01Å; W237-N244 HydrophobicContact CD2-CB 3.95Å; W237-N244 HydrophobicContact CE3-CB 4.45Å; W237-N244 VanDerWaalsContact CE3-N 3.3Å; W237-N244 HydrophobicContact CG-CB 4.29Å; W237-N244 HydrophobicContact CH2-CB 4.49Å; W237-N244 HydrophobicContact CZ2-CB 4Å
238	S	96.9	Very high	96.9	Very high	16 Å²	16	35.4 Å²	35.4	11%	0.112	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.2	163.9	173.2	0	0	0	0	108.8	D224 R240 A241 G242 R243	D224-S238 CarbonylContact O-C 3.51Å; D224-S238 WeakPolarHBondContact O-CA 3.32Å; S238-R240 VanDerWaalsContact C-N 3.34Å; S238-A241 PolarHBondContact O-N 3.45Å; S238-A241 PolarHBondContact OG-N 3.36Å; S238-G242 PolarHBondContact O-N 2.9Å; S238-R243 PolarHBondContact N-O 2.94Å
239	R	96	Very high	96.4	Very high	31 Å²	31	37.1 Å²	37.1	12%	0.117	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-45.7	177.8	-66.1	172.5	68.8	-159.1	-3.2	110.9	E167 F179 F196 E223 D224 F226 A241 G242	E167-R239 VanDerWaalsContact CD-NH2 3.35Å; E167-R239 IonicContact OE1-NH2 2.66Å; E167-R239 PolarHBondContact OE1-NH2 2.92Å; E167-R239 IonicContact OE2-CZ 3.17Å; E167-R239 IonicContact OE2-NH1 2.68Å; E167-R239 PolarHBondContact OE2-NH1 3.22Å; E167-R239 IonicContact OE2-NH2 2.73Å; E167-R239 PolarHBondContact OE2-NH2 3.43Å; F179-R239 HydrophobicContact CE2-CG 4.09Å; F179-R239 HydrophobicContact CZ-CG 4.07Å; F196-R239 HydrophobicContact CE2-CG 4.23Å; F196-R239 HydrophobicContact CZ-CB 4.01Å; F196-R239 HydrophobicContact CZ-CG 4.05Å; E223-R239 WeakPolarHBondContact O-CD 3.44Å; E223-R239 PolarHBondContact O-NH1 3.03Å; D224-R239 WeakPolarHBondContact O-CG 3.45Å; D224-R239 PolarHBondContact O-N 3.48Å; F226-R239 HydrophobicContact CD1-CG 3.52Å; F226-R239 HydrophobicContact CE1-CG 3.64Å; R239-A241 VanDerWaalsContact C-N 3.34Å; R239-A241 PolarHBondContact O-N 3.06Å; R239-G242 PolarHBondContact O-N 3.48Å; R239-G242 VanDerWaalsContact O-N 3.16Å
240	R	95.3	Very high	95.5	Very high	201 Å²	201	37.5 Å²	37.5	76%	0.758	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-42.1	176.9	-172.3	179.6	-59.5	-176.6	-1.2	112.7	D224 S238 G242	D224-R240 IonicContact OD2-CZ 2.87Å; D224-R240 IonicContact OD2-NE 3.61Å; D224-R240 PolarHBondContact OD2-NE 3.29Å; D224-R240 VanDerWaalsContact OD2-NE 3.17Å; D224-R240 IonicContact OD2-NH2 3.72Å; D224-R240 PolarHBondContact OD2-NH2 3.47Å; S238-R240 VanDerWaalsContact C-N 3.34Å; R240-G242 VanDerWaalsContact C-N 3.33Å
241	A	95.1	Very high	94.4	Very high	57 Å²	57	46.6 Å²	46.6	47%	0.471	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-16.1	179.3	0	0	0	0	0	113.5	S238 R239 R243	S238-A241 PolarHBondContact O-N 3.45Å; S238-A241 PolarHBondContact OG-N 3.36Å; R239-A241 VanDerWaalsContact C-N 3.34Å; R239-A241 PolarHBondContact O-N 3.06Å; A241-R243 VanDerWaalsContact C-N 3.26Å; A241-R243 HydrophobicContact CB-CG 4.12Å; A241-R243 PolarHBondContact O-N 3.39Å
242	G	95.2	Very high	93.2	Very high	48 Å²	48	54.4 Å²	54.4	50%	0.495	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	12.7	-179.9	0	0	0	0	0	114.8	S238 R239 R240	S238-G242 PolarHBondContact O-N 2.9Å; R239-G242 PolarHBondContact O-N 3.48Å; R239-G242 VanDerWaalsContact O-N 3.16Å; R240-G242 VanDerWaalsContact C-N 3.33Å
243	R	95.7	Very high	91.9	Very high	171 Å²	171	56.4 Å²	56.4	65%	0.645	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	161.2	-172.9	67.6	179.8	-173.5	-156	1.5	113	S238 A241	S238-R243 PolarHBondContact N-O 2.94Å; A241-R243 VanDerWaalsContact C-N 3.26Å; A241-R243 HydrophobicContact CB-CG 4.12Å; A241-R243 PolarHBondContact O-N 3.39Å
244	N	97.1	Very high	90.9	Very high	23 Å²	23	57.3 Å²	57.3	12%	0.123	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	145.8	167.2	63.4	-66.8	0	0	0	110.1	N201 L204 L236 W237	N201-N244 PolarHBondContact ND2-OD1 3.48Å; L204-N244 HydrophobicContact CD1-CB 4.19Å; L236-N244 CarbonylContact O-C 3.59Å; L236-N244 VanDerWaalsContact O-CA 3.28Å; L236-N244 WeakPolarHBondContact O-CA 3.25Å; W237-N244 HydrophobicContact CD2-CB 3.95Å; W237-N244 HydrophobicContact CE3-CB 4.45Å; W237-N244 VanDerWaalsContact CE3-N 3.3Å; W237-N244 HydrophobicContact CG-CB 4.29Å; W237-N244 HydrophobicContact CH2-CB 4.49Å; W237-N244 HydrophobicContact CZ2-CB 4Å
245	V	96.9	Very high	90.2	Very high	75 Å²	75	62.1 Å²	62.1	46%	0.455	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-42	178.1	175.4	0	0	0	0	110.3	W225 L236	W225-V245 HydrophobicContact CH2-CG1 4.32Å; W225-V245 HydrophobicContact CH2-CG2 3.93Å; W225-V245 HydrophobicContact CZ3-CB 3.98Å; W225-V245 HydrophobicContact CZ3-CG1 4.16Å; W225-V245 HydrophobicContact CZ3-CG2 3.55Å; L236-V245 PolarHBondContact O-N 2.89Å
246	S	96.7	Very high	89.8	Confident	8 Å²	8	66.1 Å²	66.1	6%	0.056	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	153.1	178.7	54.8	0	0	0	0	111.4	S235 L236 H287 V288	S235-S246 VanDerWaalsContact CA-O 3.27Å; S235-S246 WeakPolarHBondContact CA-O 3.26Å; S235-S246 VanDerWaalsContact CB-O 3.27Å; S235-S246 WeakPolarHBondContact CB-O 3.18Å; L236-S246 WeakPolarHBondContact CB-OG 3.37Å; L236-S246 PolarHBondContact N-O 3.42Å; S246-H287 WeakPolarHBondContact CB-O 3.34Å; S246-H287 PolarHBondContact OG-O 3.26Å; S246-V288 VanDerWaalsContact CB-C 3.44Å; S246-V288 WeakPolarHBondContact CB-O 3.32Å
247	I	96.5	Very high	89.6	Confident	51 Å²	51	66.4 Å²	66.4	26%	0.262	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.7	174.3	-55.2	-178.1	0	0	0	106.9	E203 L204 R233 H249	E203-I247 HydrophobicContact CB-CD1 3.75Å; L204-I247 HydrophobicContact CD2-CD1 3.89Å; L204-I247 HydrophobicContact CD2-CG1 3.73Å; L204-I247 HydrophobicContact CD2-CG2 4.37Å; R233-I247 HydrophobicContact CB-CG2 3.88Å; R233-I247 HydrophobicContact CG-CG2 4.49Å; I247-H249 HydrophobicContact CG2-CB 4.11Å
248	L	96	Very high	89.5	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.354	C	S	.	.			trans	-104	78.6	-176.7	-50.2	-175.6	0	0	0	108.4	V227 L234 I273 W285	V227-L248 HydrophobicContact CG2-CD1 3.85Å; L234-L248 HydrophobicContact CB-CB 4.28Å; L234-L248 HydrophobicContact CD2-CB 3.79Å; L234-L248 HydrophobicContact CD2-CD1 4.07Å; L234-L248 HydrophobicContact CG-CB 3.92Å; L234-L248 HydrophobicContact CG-CD1 4.12Å; L234-L248 HydrophobicContact CG-CG 4.45Å; L234-L248 PolarHBondContact O-N 2.81Å; L248-I273 HydrophobicContact CD1-CB 4.17Å; L248-I273 HydrophobicContact CD1-CD1 3.66Å; L248-I273 HydrophobicContact CD1-CG2 3.76Å; L248-W285 HydrophobicContact CB-CD2 3.89Å; L248-W285 HydrophobicContact CB-CE3 4.26Å; L248-W285 HydrophobicContact CB-CG 4.1Å; L248-W285 HydrophobicContact CD1-CB 4.34Å; L248-W285 HydrophobicContact CD1-CG 4.18Å; L248-W285 HydrophobicContact CD2-CB 4.05Å; L248-W285 HydrophobicContact CD2-CD2 4.46Å; L248-W285 HydrophobicContact CD2-CG 4.23Å; L248-W285 HydrophobicContact CG-CG 4.4Å
249	H	89.3	Confident	89.5	Confident	37 Å²	37	67.3 Å²	67.3	17%	0.171	35%	0.349	C	S	.	.			trans	-132	126.2	-176.7	-174.5	63.9	0	0	0	110.7	R233 I247 E251 W285	R233-H249 PolarHBondContact NH1-CD2 2.87Å; R233-H249 PolarHBondContact NH1-CE1 3.41Å; R233-H249 VanDerWaalsContact NH1-CG 3.3Å; R233-H249 PolarHBondContact NH1-ND1 3.12Å; R233-H249 PolarHBondContact NH1-NE2 3.39Å; I247-H249 HydrophobicContact CG2-CB 4.11Å; H249-E251 PolarHBondContact O-N 2.84Å; H249-W285 VanDerWaalsContact C-CH2 3.49Å
250	P	78.9	Confident	89.5	Confident	7 Å²	7	68 Å²	68	5%	0.045	35%	0.354	C	S	.	.			trans	-69.7	128.7	175.5	-16.4	28.3	0	0	0	109.5	D252 L253 Y283 W285	P250-D252 PolarHBondContact O-N 3.18Å; P250-L253 HydrophobicContact CB-CB 4.21Å; P250-L253 HydrophobicContact CB-CD1 3.9Å; P250-L253 HydrophobicContact CB-CG 3.81Å; P250-L253 HydrophobicContact CG-CD1 3.39Å; P250-L253 HydrophobicContact CG-CG 3.9Å; P250-L253 PolarHBondContact O-N 3.09Å; P250-Y283 HydrophobicContact CB-CE1 4.17Å; P250-Y283 HydrophobicContact CG-CD1 3.82Å; P250-Y283 HydrophobicContact CG-CD2 4.39Å; P250-Y283 HydrophobicContact CG-CE1 3.57Å; P250-Y283 HydrophobicContact CG-CE2 4.17Å; P250-Y283 HydrophobicContact CG-CG 4.23Å; P250-W285 HydrophobicContact CB-CH2 4.15Å; P250-W285 HydrophobicContact CG-CH2 3.48Å; P250-W285 VanDerWaalsContact CG-CH2 3.48Å; P250-W285 HydrophobicContact CG-CZ2 3.75Å; P250-W285 VanDerWaalsContact N-CH2 3.33Å
251	E	72.7	Confident	89.6	Confident	191 Å²	191	58.6 Å²	58.6	89%	0.893	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-33.7	179.8	-63	-173.5	164	0	0	112.5	H249 L253	H249-E251 PolarHBondContact O-N 2.84Å; E251-L253 VanDerWaalsContact C-N 3.3Å; E251-L253 PolarHBondContact O-N 2.92Å
252	D	73.1	Confident	89.7	Confident	165 Å²	165	55.9 Å²	55.9	88%	0.882	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-1	-176	-62.1	-43.2	0	0	0	114.5	P250	P250-D252 PolarHBondContact O-N 3.18Å
253	L	69.6	Low	89.7	Confident	42 Å²	42	54.6 Å²	54.6	22%	0.22	28%	0.277	C	S	.	.	S	Bend	trans	-89.5	153.6	-176.3	-86.8	-173.7	0	0	0	113.6	P250 E251 D255 W257 L281 Y283	P250-L253 HydrophobicContact CB-CB 4.21Å; P250-L253 HydrophobicContact CB-CD1 3.9Å; P250-L253 HydrophobicContact CB-CG 3.81Å; P250-L253 HydrophobicContact CG-CD1 3.39Å; P250-L253 HydrophobicContact CG-CG 3.9Å; P250-L253 PolarHBondContact O-N 3.09Å; E251-L253 VanDerWaalsContact C-N 3.3Å; E251-L253 PolarHBondContact O-N 2.92Å; L253-D255 PolarHBondContact O-N 2.89Å; L253-W257 HydrophobicContact CD1-CB 3.64Å; L253-W257 HydrophobicContact CD1-CD2 3.78Å; L253-W257 HydrophobicContact CD1-CE3 4.29Å; L253-W257 HydrophobicContact CD1-CG 3.46Å; L253-W257 VanDerWaalsContact CD1-CG 3.46Å; L253-L281 HydrophobicContact CD2-CD1 4.28Å; L253-Y283 HydrophobicContact CD1-CE2 4.08Å; L253-Y283 VanDerWaalsContact CD1-OH 3.27Å; L253-Y283 WeakPolarHBondContact CD1-OH 3.3Å; L253-Y283 WeakPolarHBondContact CD2-OH 3.23Å; L253-Y283 WeakPolarHBondContact CG-OH 3.15Å
254	S	76.6	Confident	89.7	Confident	66 Å²	66	47.5 Å²	47.5	46%	0.462	25%	0.251	S	S	.	.			trans	-55	134.4	162.5	179.7	0	0	0	0	110.5	T256 W257	S254-T256 WeakPolarHBondContact CB-OG1 3.41Å; S254-T256 PolarHBondContact O-N 2.93Å; S254-T256 WeakPolarHBondContact OG-CB 3.33Å; S254-T256 WeakPolarHBondContact OG-CG2 3.43Å; S254-T256 PolarHBondContact OG-N 2.92Å; S254-T256 PolarHBondContact OG-OG1 2.87Å; S254-W257 PolarHBondContact O-N 2.81Å
255	D	82.5	Confident	89.3	Confident	103 Å²	103	46.5 Å²	46.5	55%	0.551	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-10.7	169.3	-89.9	-35.6	0	0	0	113.5	R233 L253	R233-D255 IonicContact CZ-OD1 3.62Å; R233-D255 IonicContact NH1-OD1 3.36Å; R233-D255 IonicContact NH2-OD1 3.34Å; R233-D255 PolarHBondContact NH2-OD1 3.06Å; L253-D255 PolarHBondContact O-N 2.89Å
256	T	89.4	Confident	88.7	Confident	83 Å²	83	46.6 Å²	46.6	51%	0.509	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.3	175	67.5	0	0	0	0	114.4	S254 N278	S254-T256 WeakPolarHBondContact CB-OG1 3.41Å; S254-T256 PolarHBondContact O-N 2.93Å; S254-T256 WeakPolarHBondContact OG-CB 3.33Å; S254-T256 WeakPolarHBondContact OG-CG2 3.43Å; S254-T256 PolarHBondContact OG-N 2.92Å; S254-T256 PolarHBondContact OG-OG1 2.87Å; T256-N278 PolarHBondContact O-ND2 2.85Å; T256-N278 VanDerWaalsContact O-ND2 3.1Å
257	W	94	Very high	87.6	Confident	6 Å²	6	46.9 Å²	46.9	2%	0.023	25%	0.245	C	C	.	.			trans	-71.8	136.5	177.1	-177.9	88.7	0	0	0	111.3	R206 L234 L253 S254 N278 S279 Y283	R206-W257 PolarHBondContact NH1-O 3.4Å; L234-W257 HydrophobicContact CB-CZ3 4.48Å; L234-W257 HydrophobicContact CD2-CH2 4.38Å; L253-W257 HydrophobicContact CD1-CB 3.64Å; L253-W257 HydrophobicContact CD1-CD2 3.78Å; L253-W257 HydrophobicContact CD1-CE3 4.29Å; L253-W257 HydrophobicContact CD1-CG 3.46Å; L253-W257 VanDerWaalsContact CD1-CG 3.46Å; S254-W257 PolarHBondContact O-N 2.81Å; W257-N278 VanDerWaalsContact CA-OD1 3.3Å; W257-N278 WeakPolarHBondContact CA-OD1 3.47Å; W257-N278 VanDerWaalsContact CD1-OD1 3.29Å; W257-S279 PolarHBondContact NE1-OG 3.49Å; W257-S279 VanDerWaalsContact NE1-OG 3.13Å; W257-Y283 AromaticContact CE2-CE2 3.87Å; W257-Y283 HydrophobicContact CH2-CD2 4.42Å; W257-Y283 AromaticContact CZ2-CD2 3.87Å; W257-Y283 HydrophobicContact CZ2-CD2 3.87Å; W257-Y283 AromaticContact CZ2-CE2 3.89Å; W257-Y283 HydrophobicContact CZ2-CE2 3.89Å; W257-Y283 AromaticContact NE1-CE2 3.86Å
258	Y	95.4	Very high	86.3	Confident	48 Å²	48	50.5 Å²	50.5	19%	0.188	27%	0.265	C	S	.	.			trans	-137.5	144.7	173.7	56.1	-98.8	0	0	0	111	W212 G230 Q260 G277 N278	W212-Y258 AromaticContact CH2-CD1 3.9Å; W212-Y258 HydrophobicContact CH2-CD1 3.9Å; W212-Y258 AromaticContact CH2-CD2 3.47Å; W212-Y258 HydrophobicContact CH2-CD2 3.47Å; W212-Y258 VanDerWaalsContact CH2-CD2 3.47Å; W212-Y258 AromaticContact CH2-CE1 3.94Å; W212-Y258 HydrophobicContact CH2-CE1 3.94Å; W212-Y258 AromaticContact CH2-CE2 3.54Å; W212-Y258 HydrophobicContact CH2-CE2 3.54Å; W212-Y258 AromaticContact CH2-CG 3.66Å; W212-Y258 HydrophobicContact CH2-CG 3.66Å; W212-Y258 AromaticContact CH2-CZ 3.78Å; W212-Y258 HydrophobicContact CZ2-CD1 4.46Å; W212-Y258 AromaticContact CZ3-CD2 3.83Å; W212-Y258 HydrophobicContact CZ3-CD2 3.83Å; W212-Y258 AromaticContact CZ3-CE2 3.97Å; W212-Y258 HydrophobicContact CZ3-CE2 3.97Å; W212-Y258 HydrophobicContact CZ3-CG 4.37Å; G230-Y258 WeakPolarHBondContact O-CB 3.14Å; Y258-Q260 HydrophobicContact CD2-CG 3.86Å; Y258-Q260 HydrophobicContact CE2-CG 3.63Å; Y258-G277 WeakPolarHBondContact O-CA 3.17Å; Y258-N278 HydrophobicContact CD1-CB 4.26Å; Y258-N278 WeakPolarHBondContact CD1-ND2 3.38Å; Y258-N278 HydrophobicContact CD2-CB 4.22Å; Y258-N278 HydrophobicContact CE1-CB 3.78Å; Y258-N278 VanDerWaalsContact CE1-CG 3.5Å; Y258-N278 WeakPolarHBondContact CE1-ND2 3.49Å; Y258-N278 HydrophobicContact CE2-CB 3.71Å; Y258-N278 HydrophobicContact CG-CB 4.47Å; Y258-N278 VanDerWaalsContact CZ-CB 3.47Å; Y258-N278 PolarHBondContact N-OD1 2.88Å; Y258-N278 PolarHBondContact O-N 2.8Å; Y258-N278 PolarHBondContact O-OD1 3.04Å
259	S	96.8	Very high	85.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	142.4	173.7	54.2	0	0	0	0	110.4	T214 G229 G230	T214-S259 PolarHBondContact OG1-O 2.91Å; G229-S259 WeakPolarHBondContact CA-OG 3.47Å; G230-S259 PolarHBondContact N-OG 2.91Å
260	Q	97	Very high	84.8	Confident	47 Å²	47	62 Å²	62	22%	0.22	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	-23.6	169.1	-64.4	-171.6	-88.7	0	0	110.6	Y258 G276 G277 H307 L309	Y258-Q260 HydrophobicContact CD2-CG 3.86Å; Y258-Q260 HydrophobicContact CE2-CG 3.63Å; Q260-G276 PolarHBondContact N-O 2.89Å; Q260-G277 PolarHBondContact OE1-O 3Å; Q260-H307 PolarHBondContact OE1-ND1 2.8Å; Q260-L309 HydrophobicContact CB-CD2 4.16Å; Q260-L309 VanDerWaalsContact CD-CD2 3.45Å; Q260-L309 HydrophobicContact CG-CD2 4.42Å; Q260-L309 VanDerWaalsContact NE2-CD2 3.34Å
261	T	97.1	Very high	85.2	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.012	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	145.5	174.1	-172.7	0	0	0	0	110.6	S275 G276 I308 V311	T261-S275 WeakPolarHBondContact O-CA 3.27Å; T261-G276 PolarHBondContact N-O 3.5Å; T261-G276 VanDerWaalsContact N-O 3.09Å; T261-G276 PolarHBondContact O-N 3.09Å; T261-I308 HydrophobicContact CG2-CG2 3.93Å; T261-V311 HydrophobicContact CG2-CB 4.25Å; T261-V311 HydrophobicContact CG2-CG2 3.7Å
262	A	97.3	Very high	86.2	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	143.5	171.1	0	0	0	0	0	109.4	T215 S217 V227 L234 V274	T215-A262 HydrophobicContact CG2-CB 4Å; T215-A262 PolarHBondContact OG1-N 2.93Å; S217-A262 WeakPolarHBondContact CB-O 2.95Å; V227-A262 HydrophobicContact CG1-CB 4.08Å; L234-A262 HydrophobicContact CD1-CB 3.93Å; A262-V274 CarbonylContact C-O 3.51Å; A262-V274 WeakPolarHBondContact CA-O 3.48Å
263	I	95.7	Very high	87.2	Confident	20 Å²	20	48.5 Å²	48.5	10%	0.103	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	150.2	177.5	63.7	171.7	0	0	0	110.7	S217 I273 V274 V311 T313 F333	S217-I263 WeakPolarHBondContact OG-CA 3.36Å; I263-I273 WeakPolarHBondContact O-CA 3.25Å; I263-V274 HydrophobicContact CG1-CB 4.03Å; I263-V274 PolarHBondContact N-O 2.6Å; I263-V274 PolarHBondContact O-N 2.74Å; I263-V311 HydrophobicContact CD1-CG1 3.8Å; I263-V311 HydrophobicContact CG1-CG1 4.26Å; I263-V311 WeakPolarHBondContact CG2-O 3.47Å; I263-T313 HydrophobicContact CD1-CG2 4.09Å; I263-F333 HydrophobicContact CD1-CD1 4.5Å
264	F	94.5	Very high	88.5	Confident	22 Å²	22	46.5 Å²	46.5	10%	0.096	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	150.1	160.7	-77.3	-79.7	0	0	0	110	S217 C218 K219 W225 V227 L236 I273 H287	S217-F264 VanDerWaalsContact O-CE2 3.31Å; S217-F264 WeakPolarHBondContact O-CE2 3.41Å; S217-F264 WeakPolarHBondContact OG-CD2 3.35Å; S217-F264 PolarHBondContact OG-N 2.87Å; S217-F264 VanDerWaalsContact OG-N 3.09Å; C218-F264 VanDerWaalsContact C-CD2 3.45Å; K219-F264 HydrophobicContact CB-CD1 4.13Å; K219-F264 HydrophobicContact CB-CD2 3.92Å; K219-F264 HydrophobicContact CB-CE1 4.2Å; K219-F264 HydrophobicContact CB-CE2 4Å; K219-F264 HydrophobicContact CB-CG 3.99Å; K219-F264 HydrophobicContact CB-CZ 4.14Å; K219-F264 HydrophobicContact CD-CD1 4.36Å; K219-F264 HydrophobicContact CD-CE1 4.4Å; K219-F264 HydrophobicContact CG-CD1 4.12Å; K219-F264 HydrophobicContact CG-CE1 4.46Å; K219-F264 HydrophobicContact CG-CG 4.21Å; K219-F264 VanDerWaalsContact N-CD2 3.34Å; W225-F264 HydrophobicContact CB-CZ 4.48Å; V227-F264 HydrophobicContact CB-CE2 4.19Å; V227-F264 HydrophobicContact CB-CZ 4.21Å; V227-F264 HydrophobicContact CG1-CD2 4.35Å; V227-F264 HydrophobicContact CG1-CE2 3.89Å; V227-F264 HydrophobicContact CG1-CZ 4.32Å; L236-F264 HydrophobicContact CD1-CE1 3.91Å; L236-F264 HydrophobicContact CD1-CZ 3.54Å; F264-I273 HydrophobicContact CD1-CG1 3.8Å; F264-I273 HydrophobicContact CE1-CD1 3.85Å; F264-I273 HydrophobicContact CE1-CG1 3.64Å; F264-I273 HydrophobicContact CZ-CD1 4.36Å; F264-I273 HydrophobicContact CZ-CG1 4.41Å; F264-H287 AromaticContact CE1-CE1 3.87Å
265	C	89.4	Confident	89.4	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.02	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	96.6	-172.5	168.7	0	0	0	0	107.9	M267 R272 V274 F333	C265-M267 WeakPolarHBondContact SG-CE 3.28Å; C265-M267 WeakPolarHBondContact SG-CG 3.44Å; C265-R272 PolarHBondContact N-O 2.91Å; C265-R272 PolarHBondContact O-N 2.9Å; C265-V274 HydrophobicContact CB-CG2 4.14Å; C265-F333 HydrophobicContact CB-CE1 4.22Å; C265-F333 WeakPolarHBondContact SG-CE1 3.37Å; C265-F333 WeakPolarHBondContact SG-CZ 3.36Å
266	D	83.7	Confident	90.1	Very high	76 Å²	76	38.5 Å²	38.5	41%	0.406	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	117.3	178.3	-59.4	-39.9	0	0	0	109.7	S271	D266-S271 WeakPolarHBondContact OD1-CB 3.32Å; D266-S271 PolarHBondContact OD1-OG 3.33Å
267	M	73.4	Confident	90.4	Very high	14 Å²	14	34.5 Å²	34.5	7%	0.069	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	123.4	-172.6	-61.8	-66.1	-171.2	0	0	110.1	C265 N269 D270 T313 C331 F333 N347	C265-M267 WeakPolarHBondContact SG-CE 3.28Å; C265-M267 WeakPolarHBondContact SG-CG 3.44Å; M267-N269 PolarHBondContact O-N 2.82Å; M267-D270 PolarHBondContact N-O 2.89Å; M267-D270 CarbonylContact O-C 3.45Å; M267-D270 WeakPolarHBondContact O-CA 3.38Å; M267-D270 PolarHBondContact O-N 2.97Å; M267-T313 HydrophobicContact CE-CG2 4.32Å; M267-C331 HydrophobicContact CE-CB 3.43Å; M267-C331 VanDerWaalsContact CE-CB 3.43Å; M267-C331 HydrophobicContact SD-CB 3.67Å; M267-F333 HydrophobicContact CE-CE1 4.06Å; M267-F333 HydrophobicContact CE-CZ 4.01Å; M267-N347 VanDerWaalsContact CE-CG 3.43Å; M267-N347 VanDerWaalsContact CE-ND2 3.29Å; M267-N347 WeakPolarHBondContact CE-ND2 2.9Å; M267-N347 VanDerWaalsContact CE-OD1 3.26Å; M267-N347 WeakPolarHBondContact CE-OD1 3.36Å; M267-N347 PolarHBondContact SD-ND2 3Å
268	D	70.1	Confident	90.4	Very high	128 Å²	128	36 Å²	36	68%	0.684	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	37.4	172.8	-55.7	-43.3	0	0	0	114.9	D270	D268-D270 VanDerWaalsContact C-N 3.25Å; D268-D270 PolarHBondContact O-N 2.94Å
269	N	72.2	Confident	90.3	Very high	176 Å²	176	34.8 Å²	34.8	94%	0.941	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.3	-2.1	-171.6	-54	-43.6	0	0	0	116.6	M267	M267-N269 PolarHBondContact O-N 2.82Å
270	D	81.3	Confident	90.2	Very high	101 Å²	101	35.7 Å²	35.7	54%	0.54	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119	171.3	-76.3	-23.7	0	0	0	111.2	M267 D268	M267-D270 PolarHBondContact N-O 2.89Å; M267-D270 CarbonylContact O-C 3.45Å; M267-D270 WeakPolarHBondContact O-CA 3.38Å; M267-D270 PolarHBondContact O-N 2.97Å; D268-D270 VanDerWaalsContact C-N 3.25Å; D268-D270 PolarHBondContact O-N 2.94Å
271	S	88	Confident	90	Very high	20 Å²	20	35.3 Å²	35.3	14%	0.14	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	124.1	174.4	-173.2	0	0	0	0	109.9	K219 D266 H287	K219-S271 VanDerWaalsContact CE-OG 3.23Å; K219-S271 WeakPolarHBondContact CE-OG 3.44Å; D266-S271 WeakPolarHBondContact OD1-CB 3.32Å; D266-S271 PolarHBondContact OD1-OG 3.33Å; S271-H287 WeakPolarHBondContact CB-NE2 3.38Å; S271-H287 PolarHBondContact O-CE1 2.82Å; S271-H287 PolarHBondContact O-NE2 3.17Å; S271-H287 PolarHBondContact OG-CE1 3.37Å; S271-H287 PolarHBondContact OG-NE2 3.15Å; S271-H287 VanDerWaalsContact OG-NE2 3.12Å
272	R	92.6	Very high	89.9	Confident	61 Å²	61	35.2 Å²	35.2	23%	0.23	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	164	179.2	-59.8	-178.1	-172.7	-173.4	1.6	110.5	C265 W285 L292	C265-R272 PolarHBondContact N-O 2.91Å; C265-R272 PolarHBondContact O-N 2.9Å; R272-W285 WeakPolarHBondContact CA-O 3.16Å; R272-L292 HydrophobicContact CG-CD1 4.11Å
273	I	95.2	Very high	89.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.6	174.5	-59.5	163.3	0	0	0	108	V227 L236 L248 I263 F264 M284 W285	V227-I273 HydrophobicContact CB-CG2 4.5Å; V227-I273 HydrophobicContact CG1-CG2 4.28Å; V227-I273 HydrophobicContact CG2-CG2 4.09Å; L236-I273 HydrophobicContact CB-CD1 4.29Å; L236-I273 HydrophobicContact CD1-CD1 4.01Å; L236-I273 HydrophobicContact CD2-CD1 4.36Å; L236-I273 HydrophobicContact CG-CD1 4.45Å; L248-I273 HydrophobicContact CD1-CB 4.17Å; L248-I273 HydrophobicContact CD1-CD1 3.66Å; L248-I273 HydrophobicContact CD1-CG2 3.76Å; I263-I273 WeakPolarHBondContact O-CA 3.25Å; F264-I273 HydrophobicContact CD1-CG1 3.8Å; F264-I273 HydrophobicContact CE1-CD1 3.85Å; F264-I273 HydrophobicContact CE1-CG1 3.64Å; F264-I273 HydrophobicContact CZ-CD1 4.36Å; F264-I273 HydrophobicContact CZ-CG1 4.41Å; I273-M284 CarbonylContact O-C 3.51Å; I273-M284 WeakPolarHBondContact O-CA 3.49Å; I273-W285 HydrophobicContact CB-CB 4.22Å; I273-W285 PolarHBondContact N-O 2.91Å; I273-W285 VanDerWaalsContact O-CD1 3.32Å; I273-W285 PolarHBondContact O-N 3.39Å
274	V	95.5	Very high	89.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	132.4	176.2	-176.6	0	0	0	0	108.5	A262 I263 C265 L282 Y283 M284 V311 F333	A262-V274 CarbonylContact C-O 3.51Å; A262-V274 WeakPolarHBondContact CA-O 3.48Å; I263-V274 HydrophobicContact CG1-CB 4.03Å; I263-V274 PolarHBondContact N-O 2.6Å; I263-V274 PolarHBondContact O-N 2.74Å; C265-V274 HydrophobicContact CB-CG2 4.14Å; V274-L282 HydrophobicContact CG1-CD1 3.67Å; V274-L282 HydrophobicContact CG1-CD2 3.89Å; V274-L282 HydrophobicContact CG1-CG 3.84Å; V274-Y283 CarbonylContact C-O 3.53Å; V274-Y283 WeakPolarHBondContact CA-O 3.32Å; V274-M284 HydrophobicContact CG2-CE 4.01Å; V274-M284 HydrophobicContact CG2-CG 4.21Å; V274-V311 HydrophobicContact CG1-CG1 3.97Å; V274-F333 HydrophobicContact CG2-CE1 3.78Å; V274-F333 HydrophobicContact CG2-CE2 4.24Å; V274-F333 HydrophobicContact CG2-CZ 3.64Å
275	S	96.6	Very high	89.7	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	145.2	-177.7	68.7	0	0	0	0	113	L234 T261 Y283 W285	L234-S275 VanDerWaalsContact CD2-CB 3.45Å; T261-S275 WeakPolarHBondContact O-CA 3.27Å; S275-Y283 PolarHBondContact N-O 3.04Å; S275-Y283 PolarHBondContact O-N 2.61Å; S275-W285 PolarHBondContact OG-NE1 3.37Å
276	G	96	Very high	89.9	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	164.7	171.2	0	0	0	0	0	110.9	Q260 T261	Q260-G276 PolarHBondContact N-O 2.89Å; T261-G276 PolarHBondContact N-O 3.5Å; T261-G276 VanDerWaalsContact N-O 3.09Å; T261-G276 PolarHBondContact O-N 3.09Å
277	G	95.7	Very high	90.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	-146.9	-171.5	0	0	0	0	0	114.3	Y258 Q260 S279 H307 I308	Y258-G277 WeakPolarHBondContact O-CA 3.17Å; Q260-G277 PolarHBondContact OE1-O 3Å; G277-S279 PolarHBondContact O-N 3.43Å; G277-H307 CarbonylContact O-C 3.5Å; G277-H307 WeakPolarHBondContact O-CA 3.15Å; G277-I308 PolarHBondContact O-N 2.95Å
278	N	95.2	Very high	91.4	Very high	37 Å²	37	38.4 Å²	38.4	20%	0.198	21%	0.207	C	C	.	.	S	Bend	trans	-76	31.5	-179.9	69.9	-34.3	0	0	0	115.2	T256 W257 Y258 H307	T256-N278 PolarHBondContact O-ND2 2.85Å; T256-N278 VanDerWaalsContact O-ND2 3.1Å; W257-N278 VanDerWaalsContact CA-OD1 3.3Å; W257-N278 WeakPolarHBondContact CA-OD1 3.47Å; W257-N278 VanDerWaalsContact CD1-OD1 3.29Å; Y258-N278 HydrophobicContact CD1-CB 4.26Å; Y258-N278 WeakPolarHBondContact CD1-ND2 3.38Å; Y258-N278 HydrophobicContact CD2-CB 4.22Å; Y258-N278 HydrophobicContact CE1-CB 3.78Å; Y258-N278 VanDerWaalsContact CE1-CG 3.5Å; Y258-N278 WeakPolarHBondContact CE1-ND2 3.49Å; Y258-N278 HydrophobicContact CE2-CB 3.71Å; Y258-N278 HydrophobicContact CG-CB 4.47Å; Y258-N278 VanDerWaalsContact CZ-CB 3.47Å; Y258-N278 PolarHBondContact N-OD1 2.88Å; Y258-N278 PolarHBondContact O-N 2.8Å; Y258-N278 PolarHBondContact O-OD1 3.04Å; N278-H307 VanDerWaalsContact CA-ND1 3.34Å; N278-H307 WeakPolarHBondContact CA-ND1 3.32Å
279	S	94	Very high	92.5	Very high	22 Å²	22	33.1 Å²	33.1	15%	0.154	18%	0.182	C	C	.	.	S	Bend	trans	-142.5	172.9	175.6	66.7	0	0	0	0	110.2	W257 G277 L281 S306	W257-S279 PolarHBondContact NE1-OG 3.49Å; W257-S279 VanDerWaalsContact NE1-OG 3.13Å; G277-S279 PolarHBondContact O-N 3.43Å; S279-L281 PolarHBondContact O-N 2.9Å; S279-L281 PolarHBondContact OG-N 2.77Å; S279-S306 CarbonylContact C-O 3.56Å; S279-S306 WeakPolarHBondContact CA-O 3.18Å
280	S	93.4	Very high	93.5	Very high	19 Å²	19	29 Å²	29	13%	0.133	16%	0.161	C	C	.	.	S	Bend	trans	-75.9	-2.6	172.4	58	0	0	0	0	113.9	D296 L297 L305	S280-D296 WeakPolarHBondContact CB-OD1 3.21Å; S280-D296 PolarHBondContact OG-OD1 2.79Å; S280-L297 VanDerWaalsContact O-CB 3.25Å; S280-L297 WeakPolarHBondContact O-CB 3.36Å; S280-L297 WeakPolarHBondContact O-CG 3.45Å; S280-L297 PolarHBondContact O-N 2.82Å; S280-L305 VanDerWaalsContact CA-O 3.24Å; S280-L305 WeakPolarHBondContact CA-O 3.4Å; S280-L305 WeakPolarHBondContact CB-O 3.3Å
281	L	93.9	Very high	94.1	Very high	39 Å²	39	27.8 Å²	27.8	20%	0.204	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	123.8	-168.5	-70.6	157.4	0	0	0	111.1	L253 S279 Y283 V295 D296 I308	L253-L281 HydrophobicContact CD2-CD1 4.28Å; S279-L281 PolarHBondContact O-N 2.9Å; S279-L281 PolarHBondContact OG-N 2.77Å; L281-Y283 HydrophobicContact CB-CE1 4.11Å; L281-Y283 HydrophobicContact CB-CE2 3.69Å; L281-Y283 VanDerWaalsContact CB-CZ 3.4Å; L281-Y283 WeakPolarHBondContact CB-OH 3.48Å; L281-Y283 WeakPolarHBondContact CD1-OH 3.3Å; L281-V295 WeakPolarHBondContact CA-O 3.41Å; L281-D296 HydrophobicContact CD2-CB 3.72Å; L281-I308 VanDerWaalsContact C-CD1 3.48Å; L281-I308 WeakPolarHBondContact O-CD1 3.44Å
282	L	94.6	Very high	94.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	130.8	166.8	-171.3	80.6	0	0	0	109	V274 S294 V295 L297 I308 V311 V335 I345	V274-L282 HydrophobicContact CG1-CD1 3.67Å; V274-L282 HydrophobicContact CG1-CD2 3.89Å; V274-L282 HydrophobicContact CG1-CG 3.84Å; L282-S294 CarbonylContact O-C 3.56Å; L282-S294 VanDerWaalsContact O-CA 3.28Å; L282-S294 WeakPolarHBondContact O-CA 3.46Å; L282-V295 HydrophobicContact CB-CB 4.3Å; L282-V295 PolarHBondContact N-O 2.72Å; L282-V295 PolarHBondContact O-N 2.89Å; L282-L297 HydrophobicContact CB-CD1 4.47Å; L282-I308 HydrophobicContact CB-CD1 3.99Å; L282-I308 HydrophobicContact CD1-CD1 4.18Å; L282-V311 HydrophobicContact CD1-CG1 4.37Å; L282-V311 HydrophobicContact CD1-CG2 3.75Å; L282-V335 HydrophobicContact CD1-CG1 4.37Å; L282-V335 HydrophobicContact CD1-CG2 4.02Å; L282-V335 HydrophobicContact CD2-CG2 4.05Å; L282-I345 HydrophobicContact CD2-CD1 3.82Å
283	Y	94.3	Very high	94.1	Very high	7 Å²	7	29 Å²	29	3%	0.027	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	146.2	178.6	-57.8	-76.7	0	0	0	111.8	P250 L253 W257 V274 S275 L281 W285 L291	P250-Y283 HydrophobicContact CB-CE1 4.17Å; P250-Y283 HydrophobicContact CG-CD1 3.82Å; P250-Y283 HydrophobicContact CG-CD2 4.39Å; P250-Y283 HydrophobicContact CG-CE1 3.57Å; P250-Y283 HydrophobicContact CG-CE2 4.17Å; P250-Y283 HydrophobicContact CG-CG 4.23Å; L253-Y283 HydrophobicContact CD1-CE2 4.08Å; L253-Y283 VanDerWaalsContact CD1-OH 3.27Å; L253-Y283 WeakPolarHBondContact CD1-OH 3.3Å; L253-Y283 WeakPolarHBondContact CD2-OH 3.23Å; L253-Y283 WeakPolarHBondContact CG-OH 3.15Å; W257-Y283 AromaticContact CE2-CE2 3.87Å; W257-Y283 HydrophobicContact CH2-CD2 4.42Å; W257-Y283 AromaticContact CZ2-CD2 3.87Å; W257-Y283 HydrophobicContact CZ2-CD2 3.87Å; W257-Y283 AromaticContact CZ2-CE2 3.89Å; W257-Y283 HydrophobicContact CZ2-CE2 3.89Å; W257-Y283 AromaticContact NE1-CE2 3.86Å; V274-Y283 CarbonylContact C-O 3.53Å; V274-Y283 WeakPolarHBondContact CA-O 3.32Å; S275-Y283 PolarHBondContact N-O 3.04Å; S275-Y283 PolarHBondContact O-N 2.61Å; L281-Y283 HydrophobicContact CB-CE1 4.11Å; L281-Y283 HydrophobicContact CB-CE2 3.69Å; L281-Y283 VanDerWaalsContact CB-CZ 3.4Å; L281-Y283 WeakPolarHBondContact CB-OH 3.48Å; L281-Y283 WeakPolarHBondContact CD1-OH 3.3Å; Y283-W285 HydrophobicContact CD1-CZ2 4.25Å; Y283-W285 HydrophobicContact CD2-CZ2 4.47Å; Y283-W285 AromaticContact CG-CZ2 3.84Å; Y283-W285 HydrophobicContact CG-CZ2 3.84Å; Y283-L291 HydrophobicContact CD1-CD1 3.69Å; Y283-L291 HydrophobicContact CD1-CD2 4.42Å; Y283-L291 HydrophobicContact CG-CD1 4.3Å
284	M	93.8	Very high	94	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131.1	172.9	-61.2	-169.7	73.2	0	0	110.2	I273 V274 L292 A293 F333 N347	I273-M284 CarbonylContact O-C 3.51Å; I273-M284 WeakPolarHBondContact O-CA 3.49Å; V274-M284 HydrophobicContact CG2-CE 4.01Å; V274-M284 HydrophobicContact CG2-CG 4.21Å; M284-L292 HydrophobicContact CB-CB 4.39Å; M284-L292 PolarHBondContact O-N 2.91Å; M284-A293 HydrophobicContact CB-CB 4.26Å; M284-A293 HydrophobicContact CG-CB 4.42Å; M284-A293 PolarHBondContact N-O 2.67Å; M284-A293 PolarHBondContact O-N 3.43Å; M284-A293 HydrophobicContact SD-CB 4.29Å; M284-F333 HydrophobicContact CE-CE2 3.83Å; M284-F333 HydrophobicContact CE-CZ 3.91Å; M284-F333 HydrophobicContact SD-CE2 4.25Å; M284-N347 WeakPolarHBondContact CE-O 3.43Å; M284-N347 VanDerWaalsContact SD-O 3.36Å
285	W	94.4	Very high	93.8	Very high	1 Å²	1	32.9 Å²	32.9	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.8	-173.3	-47.7	94	0	0	0	111.1	L248 H249 P250 R272 I273 S275 Y283 N290 L291	L248-W285 HydrophobicContact CB-CD2 3.89Å; L248-W285 HydrophobicContact CB-CE3 4.26Å; L248-W285 HydrophobicContact CB-CG 4.1Å; L248-W285 HydrophobicContact CD1-CB 4.34Å; L248-W285 HydrophobicContact CD1-CG 4.18Å; L248-W285 HydrophobicContact CD2-CB 4.05Å; L248-W285 HydrophobicContact CD2-CD2 4.46Å; L248-W285 HydrophobicContact CD2-CG 4.23Å; L248-W285 HydrophobicContact CG-CG 4.4Å; H249-W285 VanDerWaalsContact C-CH2 3.49Å; P250-W285 HydrophobicContact CB-CH2 4.15Å; P250-W285 HydrophobicContact CG-CH2 3.48Å; P250-W285 VanDerWaalsContact CG-CH2 3.48Å; P250-W285 HydrophobicContact CG-CZ2 3.75Å; P250-W285 VanDerWaalsContact N-CH2 3.33Å; R272-W285 WeakPolarHBondContact CA-O 3.16Å; I273-W285 HydrophobicContact CB-CB 4.22Å; I273-W285 PolarHBondContact N-O 2.91Å; I273-W285 VanDerWaalsContact O-CD1 3.32Å; I273-W285 PolarHBondContact O-N 3.39Å; S275-W285 PolarHBondContact OG-NE1 3.37Å; Y283-W285 HydrophobicContact CD1-CZ2 4.25Å; Y283-W285 HydrophobicContact CD2-CZ2 4.47Å; Y283-W285 AromaticContact CG-CZ2 3.84Å; Y283-W285 HydrophobicContact CG-CZ2 3.84Å; W285-N290 WeakPolarHBondContact CA-O 3.04Å; W285-L291 HydrophobicContact CD2-CD1 4.31Å; W285-L291 HydrophobicContact CE3-CB 4.14Å; W285-L291 HydrophobicContact CE3-CD1 4.11Å; W285-L291 HydrophobicContact CH2-CB 4.24Å; W285-L291 HydrophobicContact CH2-CD1 3.7Å; W285-L291 HydrophobicContact CH2-CG 4.45Å; W285-L291 HydrophobicContact CZ2-CD1 3.97Å; W285-L291 HydrophobicContact CZ3-CB 3.67Å; W285-L291 HydrophobicContact CZ3-CD1 3.82Å; W285-L291 HydrophobicContact CZ3-CG 4.31Å
286	D	93.4	Very high	93.6	Very high	35 Å²	35	37 Å²	37	19%	0.187	22%	0.215	C	C	.	.			trans	-84.7	177	157.6	71.6	17.9	0	0	0	111.2	V288 G289 N290 L292	D286-V288 VanDerWaalsContact C-N 3.27Å; D286-V288 PolarHBondContact O-N 3.39Å; D286-V288 WeakPolarHBondContact OD1-CA 3.37Å; D286-V288 WeakPolarHBondContact OD1-CB 3.5Å; D286-V288 PolarHBondContact OD1-N 2.8Å; D286-G289 PolarHBondContact O-N 3.36Å; D286-G289 PolarHBondContact OD1-N 2.93Å; D286-N290 PolarHBondContact N-O 3.19Å; D286-N290 PolarHBondContact OD1-N 2.84Å; D286-N290 WeakPolarHBondContact OD2-CB 3.05Å; D286-N290 PolarHBondContact OD2-ND2 2.84Å; D286-L292 HydrophobicContact CB-CD1 4.18Å; D286-L292 HydrophobicContact CB-CD2 4.23Å; D286-L292 HydrophobicContact CB-CG 4.33Å
287	H	94.4	Very high	93.5	Very high	48 Å²	48	37 Å²	37	22%	0.222	22%	0.215	C	C	.	.	S	Bend	trans	-76.7	-13.4	179.9	-68.1	-2.6	0	0	0	113.5	L236 S246 F264 S271	L236-H287 HydrophobicContact CD2-CB 3.67Å; L236-H287 WeakPolarHBondContact CD2-O 3.49Å; S246-H287 WeakPolarHBondContact CB-O 3.34Å; S246-H287 PolarHBondContact OG-O 3.26Å; F264-H287 AromaticContact CE1-CE1 3.87Å; S271-H287 WeakPolarHBondContact CB-NE2 3.38Å; S271-H287 PolarHBondContact O-CE1 2.82Å; S271-H287 PolarHBondContact O-NE2 3.17Å; S271-H287 PolarHBondContact OG-CE1 3.37Å; S271-H287 PolarHBondContact OG-NE2 3.15Å; S271-H287 VanDerWaalsContact OG-NE2 3.12Å
288	V	94.5	Very high	93.2	Very high	112 Å²	112	40.1 Å²	40.1	68%	0.679	23%	0.229	S	C	*	.	S	Bend	trans	-80.8	-23.8	176.1	-177.9	0	0	0	0	110.9	S246 D286	S246-V288 VanDerWaalsContact CB-C 3.44Å; S246-V288 WeakPolarHBondContact CB-O 3.32Å; D286-V288 VanDerWaalsContact C-N 3.27Å; D286-V288 PolarHBondContact O-N 3.39Å; D286-V288 WeakPolarHBondContact OD1-CA 3.37Å; D286-V288 WeakPolarHBondContact OD1-CB 3.5Å; D286-V288 PolarHBondContact OD1-N 2.8Å
289	G	93.8	Very high	92.8	Very high	16 Å²	16	42.5 Å²	42.5	17%	0.165	24%	0.242	C	C	.	.	S	Bend	trans	106.5	8.3	-178.4	0	0	0	0	0	114	D286	D286-G289 PolarHBondContact O-N 3.36Å; D286-G289 PolarHBondContact OD1-N 2.93Å
290	N	93.6	Very high	92.5	Very high	91 Å²	91	44.6 Å²	44.6	49%	0.487	26%	0.255	S	S	.	.			trans	-75.1	138.1	175.1	-53.9	-57.2	0	0	0	110.1	W285 D286 L292	W285-N290 WeakPolarHBondContact CA-O 3.04Å; D286-N290 PolarHBondContact N-O 3.19Å; D286-N290 PolarHBondContact OD1-N 2.84Å; D286-N290 WeakPolarHBondContact OD2-CB 3.05Å; D286-N290 PolarHBondContact OD2-ND2 2.84Å; N290-L292 PolarHBondContact O-N 2.9Å
291	L	93.1	Very high	92.1	Very high	74 Å²	74	48 Å²	48	39%	0.387	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	116.8	171.7	-177.9	65.4	0	0	0	109.5	Y283 W285 A293	Y283-L291 HydrophobicContact CD1-CD1 3.69Å; Y283-L291 HydrophobicContact CD1-CD2 4.42Å; Y283-L291 HydrophobicContact CG-CD1 4.3Å; W285-L291 HydrophobicContact CD2-CD1 4.31Å; W285-L291 HydrophobicContact CE3-CB 4.14Å; W285-L291 HydrophobicContact CE3-CD1 4.11Å; W285-L291 HydrophobicContact CH2-CB 4.24Å; W285-L291 HydrophobicContact CH2-CD1 3.7Å; W285-L291 HydrophobicContact CH2-CG 4.45Å; W285-L291 HydrophobicContact CZ2-CD1 3.97Å; W285-L291 HydrophobicContact CZ3-CB 3.67Å; W285-L291 HydrophobicContact CZ3-CD1 3.82Å; W285-L291 HydrophobicContact CZ3-CG 4.31Å; L291-A293 WeakPolarHBondContact CD1-O 3.49Å
292	L	90.9	Very high	91.7	Very high	81 Å²	81	51.8 Å²	51.8	42%	0.424	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-41.6	179.4	-60	178	0	0	0	112.1	R272 M284 D286 N290	R272-L292 HydrophobicContact CG-CD1 4.11Å; M284-L292 HydrophobicContact CB-CB 4.39Å; M284-L292 PolarHBondContact O-N 2.91Å; D286-L292 HydrophobicContact CB-CD1 4.18Å; D286-L292 HydrophobicContact CB-CD2 4.23Å; D286-L292 HydrophobicContact CB-CG 4.33Å; N290-L292 PolarHBondContact O-N 2.9Å
293	A	90.2	Very high	91.3	Very high	27 Å²	27	51.9 Å²	51.9	22%	0.223	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	150.9	-179.2	0	0	0	0	0	111.1	M284 L291	M284-A293 HydrophobicContact CB-CB 4.26Å; M284-A293 HydrophobicContact CG-CB 4.42Å; M284-A293 PolarHBondContact N-O 2.67Å; M284-A293 PolarHBondContact O-N 3.43Å; M284-A293 HydrophobicContact SD-CB 4.29Å; L291-A293 WeakPolarHBondContact CD1-O 3.49Å
294	S	91.8	Very high	91.1	Very high	70 Å²	70	56.5 Å²	56.5	49%	0.49	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	134.6	170.3	61	0	0	0	0	110.2	L282	L282-S294 CarbonylContact O-C 3.56Å; L282-S294 VanDerWaalsContact O-CA 3.28Å; L282-S294 WeakPolarHBondContact O-CA 3.46Å
295	V	92.5	Very high	91.1	Very high	11 Å²	11	56.5 Å²	56.5	7%	0.067	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	118.3	-179.5	-166.8	0	0	0	0	109	L281 L282 L297 I345 G349	L281-V295 WeakPolarHBondContact CA-O 3.41Å; L282-V295 HydrophobicContact CB-CB 4.3Å; L282-V295 PolarHBondContact N-O 2.72Å; L282-V295 PolarHBondContact O-N 2.89Å; V295-L297 HydrophobicContact CG1-CD2 3.82Å; V295-I345 HydrophobicContact CG1-CD1 4.36Å; V295-I345 HydrophobicContact CG2-CG2 4.23Å; V295-G349 WeakPolarHBondContact CG1-O 3.36Å; V295-G349 VanDerWaalsContact CG2-CA 3.41Å; V295-G349 WeakPolarHBondContact CG2-O 3.47Å
296	D	92.6	Very high	91	Very high	85 Å²	85	58.4 Å²	58.4	46%	0.455	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	121	173.9	-167.5	0.5	0	0	0	110.9	S280 L281 H298	S280-D296 WeakPolarHBondContact CB-OD1 3.21Å; S280-D296 PolarHBondContact OG-OD1 2.79Å; L281-D296 HydrophobicContact CD2-CB 3.72Å; D296-H298 WeakPolarHBondContact OD1-CB 3.36Å; D296-H298 PolarHBondContact OD1-N 3.4Å
297	L	93.2	Very high	91.1	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.332	C	S	.	.			trans	-103.9	16.9	178.7	-50.9	175.3	0	0	0	111.9	S280 L282 V295 R304 L305 I308 V335 R343 I345	S280-L297 VanDerWaalsContact O-CB 3.25Å; S280-L297 WeakPolarHBondContact O-CB 3.36Å; S280-L297 WeakPolarHBondContact O-CG 3.45Å; S280-L297 PolarHBondContact O-N 2.82Å; L282-L297 HydrophobicContact CB-CD1 4.47Å; V295-L297 HydrophobicContact CG1-CD2 3.82Å; L297-R304 CarbonylContact O-C 3.5Å; L297-R304 WeakPolarHBondContact O-CA 3.17Å; L297-L305 HydrophobicContact CB-CB 4.22Å; L297-L305 HydrophobicContact CB-CD1 4.43Å; L297-L305 HydrophobicContact CB-CG 4.48Å; L297-L305 HydrophobicContact CD1-CD1 3.91Å; L297-L305 PolarHBondContact O-N 2.87Å; L297-I308 HydrophobicContact CD1-CD1 3.96Å; L297-I308 HydrophobicContact CD1-CG1 4.48Å; L297-V335 HydrophobicContact CD1-CB 4.1Å; L297-V335 HydrophobicContact CD1-CG1 3.63Å; L297-R343 HydrophobicContact CB-CG 4.45Å; L297-R343 HydrophobicContact CD1-CB 4.35Å; L297-R343 HydrophobicContact CD1-CG 4.3Å; L297-R343 HydrophobicContact CD2-CB 4.29Å; L297-R343 HydrophobicContact CD2-CG 4.19Å; L297-R343 PolarHBondContact O-NH1 3.4Å; L297-I345 HydrophobicContact CD1-CD1 3.79Å; L297-I345 HydrophobicContact CD2-CD1 3.62Å; L297-I345 HydrophobicContact CD2-CG1 4.42Å; L297-I345 HydrophobicContact CG-CD1 4.27Å
298	H	89.9	Confident	91.2	Very high	66 Å²	66	57.1 Å²	57.1	31%	0.306	32%	0.322	S	S	.	.			trans	-68.2	-41.2	178.1	-180	-93.1	0	0	0	112.2	D296 R304	D296-H298 WeakPolarHBondContact OD1-CB 3.36Å; D296-H298 PolarHBondContact OD1-N 3.4Å; H298-R304 WeakPolarHBondContact O-CA 3.23Å; H298-R304 WeakPolarHBondContact O-CB 3Å
299	D	87.1	Confident	91.3	Very high	88 Å²	88	53.4 Å²	53.4	47%	0.471	30%	0.298	S	S	.	.			trans	-111.1	154.2	-173.4	-75.3	-58	0	0	0	113.4	R343	D299-R343 PolarHBondContact O-NH1 2.81Å; D299-R343 PolarHBondContact O-NH2 3.29Å
300	P	87.8	Confident	91.4	Very high	65 Å²	65	53 Å²	53	42%	0.422	29%	0.292	S	S	.	.	S	Bend	cis	-71.6	164	-9.5	27.9	-36.2	0	0	0	114.3	N302 S303 R304	P300-N302 VanDerWaalsContact CB-OD1 3.3Å; P300-N302 WeakPolarHBondContact CB-OD1 3.5Å; P300-N302 WeakPolarHBondContact CG-OD1 3.28Å; P300-N302 PolarHBondContact O-N 2.82Å; P300-S303 WeakPolarHBondContact CD-OG 3.49Å; P300-S303 VanDerWaalsContact CG-OG 3.32Å; P300-S303 WeakPolarHBondContact CG-OG 3.49Å; P300-S303 CarbonylContact O-C 3.58Å; P300-S303 PolarHBondContact O-N 3.26Å; P300-S303 PolarHBondContact O-OG 2.93Å; P300-R304 PolarHBondContact O-N 3.04Å
301	P	84.6	Confident	91.5	Very high	92 Å²	92	48.9 Å²	48.9	60%	0.597	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.1	-175.7	-28.3	35.1	0	0	0	115.7	S303 R304	P301-S303 VanDerWaalsContact C-N 3.29Å; P301-R304 WeakPolarHBondContact O-CG 3.4Å
302	N	85	Confident	91.4	Very high	118 Å²	118	47.8 Å²	47.8	63%	0.631	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-5	177.2	63.9	-26.8	0	0	0	113.7	P300 P340	P300-N302 VanDerWaalsContact CB-OD1 3.3Å; P300-N302 WeakPolarHBondContact CB-OD1 3.5Å; P300-N302 WeakPolarHBondContact CG-OD1 3.28Å; P300-N302 PolarHBondContact O-N 2.82Å; N302-P340 WeakPolarHBondContact O-CG 3.26Å
303	S	85.7	Confident	91.2	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.007	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	9	175.7	63.4	0	0	0	0	113.7	P300 P301 V341 R343 M354	P300-S303 WeakPolarHBondContact CD-OG 3.49Å; P300-S303 VanDerWaalsContact CG-OG 3.32Å; P300-S303 WeakPolarHBondContact CG-OG 3.49Å; P300-S303 CarbonylContact O-C 3.58Å; P300-S303 PolarHBondContact O-N 3.26Å; P300-S303 PolarHBondContact O-OG 2.93Å; P301-S303 VanDerWaalsContact C-N 3.29Å; S303-V341 VanDerWaalsContact O-CG2 3.23Å; S303-V341 WeakPolarHBondContact O-CG2 2.94Å; S303-R343 PolarHBondContact O-NH1 2.91Å; S303-R343 PolarHBondContact OG-NH1 3.29Å; S303-M354 WeakPolarHBondContact CB-SD 3.17Å
304	R	91.3	Very high	90.8	Very high	105 Å²	105	44.2 Å²	44.2	40%	0.396	24%	0.244	S	C	.	.			trans	-57.1	139.4	-177.4	69.2	-178.8	-94	163.4	-5.6	113.3	L297 H298 P300 P301 G339 P340	L297-R304 CarbonylContact O-C 3.5Å; L297-R304 WeakPolarHBondContact O-CA 3.17Å; H298-R304 WeakPolarHBondContact O-CA 3.23Å; H298-R304 WeakPolarHBondContact O-CB 3Å; P300-R304 PolarHBondContact O-N 3.04Å; P301-R304 WeakPolarHBondContact O-CG 3.4Å; R304-G339 VanDerWaalsContact O-CA 3.27Å; R304-G339 WeakPolarHBondContact O-CA 3.48Å; R304-P340 WeakPolarHBondContact O-CD 3.14Å
305	L	93.1	Very high	90.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.236	C	C	.	.			trans	-108.8	124.5	160.5	-63.8	-177	0	0	0	108.6	S280 L297 V335 C338 V341 R343	S280-L305 VanDerWaalsContact CA-O 3.24Å; S280-L305 WeakPolarHBondContact CA-O 3.4Å; S280-L305 WeakPolarHBondContact CB-O 3.3Å; L297-L305 HydrophobicContact CB-CB 4.22Å; L297-L305 HydrophobicContact CB-CD1 4.43Å; L297-L305 HydrophobicContact CB-CG 4.48Å; L297-L305 HydrophobicContact CD1-CD1 3.91Å; L297-L305 PolarHBondContact O-N 2.87Å; L305-V335 HydrophobicContact CD1-CB 4.45Å; L305-V335 HydrophobicContact CD1-CG1 3.84Å; L305-C338 CarbonylContact C-O 3.54Å; L305-C338 WeakPolarHBondContact CA-O 3.15Å; L305-V341 WeakPolarHBondContact CD2-O 3.35Å; L305-R343 HydrophobicContact CD1-CG 3.85Å; L305-R343 HydrophobicContact CG-CG 4.15Å
306	S	93	Very high	89.1	Confident	41 Å²	41	43.4 Å²	43.4	29%	0.287	23%	0.234	S	C	.	.	S	Bend	trans	-88.1	-28.7	174.2	55	0	0	0	0	113.1	S279 C338	S279-S306 CarbonylContact C-O 3.56Å; S279-S306 WeakPolarHBondContact CA-O 3.18Å; S306-C338 PolarHBondContact N-O 2.78Å; S306-C338 VanDerWaalsContact OG-CB 3.26Å; S306-C338 WeakPolarHBondContact OG-CB 3.4Å; S306-C338 PolarHBondContact OG-O 2.72Å
307	H	95.2	Very high	87.8	Confident	56 Å²	56	40.5 Å²	40.5	26%	0.259	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	141.9	174.8	-68.8	-118.9	0	0	0	107.9	Q260 G277 N278 L309 G337 C338	Q260-H307 PolarHBondContact OE1-ND1 2.8Å; G277-H307 CarbonylContact O-C 3.5Å; G277-H307 WeakPolarHBondContact O-CA 3.15Å; N278-H307 VanDerWaalsContact CA-ND1 3.34Å; N278-H307 WeakPolarHBondContact CA-ND1 3.32Å; H307-L309 HydrophobicContact CB-CD2 4.19Å; H307-G337 CarbonylContact O-C 3.49Å; H307-G337 VanDerWaalsContact O-CA 3.31Å; H307-G337 WeakPolarHBondContact O-CA 3.43Å; H307-C338 HydrophobicContact CB-CB 3.98Å; H307-C338 PolarHBondContact O-N 3.48Å
308	I	96.6	Very high	86.2	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	114.5	173.5	-62.3	171.9	0	0	0	108.1	T261 G277 L281 L282 L297 V311 V335	T261-I308 HydrophobicContact CG2-CG2 3.93Å; G277-I308 PolarHBondContact O-N 2.95Å; L281-I308 VanDerWaalsContact C-CD1 3.48Å; L281-I308 WeakPolarHBondContact O-CD1 3.44Å; L282-I308 HydrophobicContact CB-CD1 3.99Å; L282-I308 HydrophobicContact CD1-CD1 4.18Å; L297-I308 HydrophobicContact CD1-CD1 3.96Å; L297-I308 HydrophobicContact CD1-CG1 4.48Å; I308-V311 HydrophobicContact CG2-CG2 3.49Å; I308-V311 VanDerWaalsContact CG2-CG2 3.49Å; I308-V335 HydrophobicContact CB-CG1 4.29Å; I308-V335 HydrophobicContact CD1-CG1 3.97Å; I308-V335 HydrophobicContact CG1-CG1 3.87Å; I308-V335 HydrophobicContact CG2-CG1 3.51Å
309	L	96.7	Very high	84.5	Confident	35 Å²	35	49.5 Å²	49.5	18%	0.183	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-25.9	-174.8	-55.4	-179.2	0	0	0	112.7	L13 Q260 H307 G336	L13-L309 HydrophobicContact CD2-CD1 4.09Å; Q260-L309 HydrophobicContact CB-CD2 4.16Å; Q260-L309 VanDerWaalsContact CD-CD2 3.45Å; Q260-L309 HydrophobicContact CG-CD2 4.42Å; Q260-L309 VanDerWaalsContact NE2-CD2 3.34Å; H307-L309 HydrophobicContact CB-CD2 4.19Å; L309-G336 PolarHBondContact N-O 2.98Å
310	A	95.3	Very high	83.3	Confident	6 Å²	6	46 Å²	46	5%	0.05	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	128	-178.8	0	0	0	0	0	109.9	I12 V335 G336	I12-A310 HydrophobicContact CG2-CB 4.04Å; A310-V335 WeakPolarHBondContact O-CA 3.26Å; A310-G336 PolarHBondContact N-O 2.83Å; A310-G336 PolarHBondContact O-N 3.26Å
311	V	95.1	Very high	82.1	Confident	6 Å²	6	48 Å²	48	4%	0.036	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	132.7	171.6	-178.7	0	0	0	0	106.5	T261 I263 V274 L282 I308 F334 V335	T261-V311 HydrophobicContact CG2-CB 4.25Å; T261-V311 HydrophobicContact CG2-CG2 3.7Å; I263-V311 HydrophobicContact CD1-CG1 3.8Å; I263-V311 HydrophobicContact CG1-CG1 4.26Å; I263-V311 WeakPolarHBondContact CG2-O 3.47Å; V274-V311 HydrophobicContact CG1-CG1 3.97Å; L282-V311 HydrophobicContact CD1-CG1 4.37Å; L282-V311 HydrophobicContact CD1-CG2 3.75Å; I308-V311 HydrophobicContact CG2-CG2 3.49Å; I308-V311 VanDerWaalsContact CG2-CG2 3.49Å; V311-F334 WeakPolarHBondContact CA-O 3.46Å; V311-V335 HydrophobicContact CG1-CG2 4.44Å; V311-V335 HydrophobicContact CG2-CG1 4.15Å; V311-V335 HydrophobicContact CG2-CG2 4.26Å
312	D	91	Very high	81.2	Confident	50 Å²	50	47.5 Å²	47.5	27%	0.267	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	164.5	170.4	-150.8	-16.5	0	0	0	109.7	F333 F334	D312-F333 WeakPolarHBondContact O-CA 3.36Å; D312-F334 HydrophobicContact CB-CD1 4.34Å; D312-F334 HydrophobicContact CB-CE1 3.48Å; D312-F334 VanDerWaalsContact CB-CE1 3.48Å; D312-F334 HydrophobicContact CB-CE2 3.65Å; D312-F334 HydrophobicContact CB-CZ 3.09Å; D312-F334 PolarHBondContact N-O 3.35Å; D312-F334 PolarHBondContact O-N 3.33Å; D312-F334 VanDerWaalsContact O-N 3.09Å
313	T	87.1	Confident	80.2	Confident	31 Å²	31	42.6 Å²	42.6	19%	0.19	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	149.4	174.8	59.6	0	0	0	0	111	I263 M267 A332 F333	I263-T313 HydrophobicContact CD1-CG2 4.09Å; M267-T313 HydrophobicContact CE-CG2 4.32Å; T313-A332 CarbonylContact C-O 3.56Å; T313-A332 WeakPolarHBondContact CA-O 3.48Å; T313-F333 HydrophobicContact CG2-CD1 3.84Å; T313-F333 HydrophobicContact CG2-CE1 3.69Å
314	F	82	Confident	79.2	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	151.5	166.7	69.1	-87.2	0	0	0	110	L24 L38 L316 C331 A332 F333 F334 L344	L24-F314 HydrophobicContact CD2-CB 4.01Å; L38-F314 HydrophobicContact CD1-CB 4.08Å; L38-F314 HydrophobicContact CD1-CD2 3.88Å; L38-F314 HydrophobicContact CD1-CG 4.36Å; L38-F314 HydrophobicContact CD2-CD2 3.41Å; L38-F314 VanDerWaalsContact CD2-CD2 3.41Å; L38-F314 HydrophobicContact CD2-CE2 3.67Å; L38-F314 HydrophobicContact CD2-CG 4.05Å; L38-F314 HydrophobicContact CD2-CZ 4.49Å; L38-F314 HydrophobicContact CG-CD2 4.29Å; F314-L316 HydrophobicContact CE2-CD2 3.88Å; F314-C331 WeakPolarHBondContact O-CA 3.35Å; F314-A332 HydrophobicContact CD1-CB 4.35Å; F314-A332 VanDerWaalsContact CD1-O 3.3Å; F314-A332 WeakPolarHBondContact CD1-O 3.43Å; F314-A332 HydrophobicContact CE1-CB 3.66Å; F314-A332 HydrophobicContact CE2-CB 3.98Å; F314-A332 HydrophobicContact CZ-CB 3.45Å; F314-A332 VanDerWaalsContact CZ-CB 3.45Å; F314-A332 PolarHBondContact N-O 3.28Å; F314-A332 PolarHBondContact O-N 2.88Å; F314-F333 VanDerWaalsContact CE1-C 3.45Å; F314-F334 HydrophobicContact CD1-CB 4.36Å; F314-F334 AromaticContact CD1-CD1 4Å; F314-F334 HydrophobicContact CD1-CD1 4Å; F314-F334 HydrophobicContact CE1-CB 4.35Å; F314-L344 HydrophobicContact CE1-CD2 3.85Å; F314-L344 HydrophobicContact CZ-CD2 4.02Å
315	N	76.9	Confident	77.9	Confident	59 Å²	59	46.1 Å²	46.1	32%	0.316	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	133.5	176.6	-63.9	10.8	0	0	0	108.8	R21 S317 D330	R21-N315 PolarHBondContact NH1-OD1 2.74Å; N315-S317 PolarHBondContact O-N 3.4Å; N315-D330 CarbonylContact C-O 3.33Å; N315-D330 WeakPolarHBondContact CA-O 3.2Å
316	L	72.9	Confident	76.7	Confident	6 Å²	6	51.7 Å²	51.7	3%	0.031	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-68.5	121.1	166.5	-67.1	168.6	0	0	0	107.8	F314 I320 K324 D330 A332	F314-L316 HydrophobicContact CE2-CD2 3.88Å; L316-I320 HydrophobicContact CD2-CD1 4.21Å; L316-K324 HydrophobicContact CB-CG 4.23Å; L316-K324 HydrophobicContact CD1-CG 4.48Å; L316-K324 WeakPolarHBondContact O-CE 3.31Å; L316-K324 PolarHBondContact O-NZ 3.01Å; L316-D330 PolarHBondContact N-O 3.07Å; L316-A332 HydrophobicContact CD2-CB 4.39Å; L316-A332 HydrophobicContact CG-CB 4.39Å
317	S	65.4	Low	75.5	Confident	24 Å²	24	51.4 Å²	51.4	17%	0.168	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-62	153.1	176	63.8	0	0	0	0	110.8	N315 S319 I320 K324	N315-S317 PolarHBondContact O-N 3.4Å; S317-S319 PolarHBondContact O-N 2.84Å; S317-I320 PolarHBondContact O-N 3.03Å; S317-K324 WeakPolarHBondContact O-CE 3.38Å
318	E	57.8	Low	74.2	Confident	157 Å²	157	56.1 Å²	56.1	73%	0.734	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-51.7	-28.7	171.3	-65.7	176.6	176.2	0	0	112.6	I320 D321	E318-I320 PolarHBondContact O-N 2.82Å; E318-D321 PolarHBondContact O-N 2.81Å
319	S	55.5	Low	73	Confident	98 Å²	98	56.9 Å²	56.9	69%	0.685	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-60.5	-8.9	175.1	-47.7	0	0	0	0	114.7	S317	S317-S319 PolarHBondContact O-N 2.84Å
320	I	61.7	Low	72	Confident	14 Å²	14	59.5 Å²	59.5	7%	0.072	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-117.4	41	-178.4	-44.9	176.5	0	0	0	110.4	L316 S317 E318 S322 L323 K324	L316-I320 HydrophobicContact CD2-CD1 4.21Å; S317-I320 PolarHBondContact O-N 3.03Å; E318-I320 PolarHBondContact O-N 2.82Å; I320-S322 PolarHBondContact O-N 2.77Å; I320-S322 VanDerWaalsContact O-N 3.14Å; I320-L323 HydrophobicContact CG2-CB 3.55Å; I320-L323 HydrophobicContact CG2-CD1 3.4Å; I320-L323 HydrophobicContact CG2-CG 3.43Å; I320-L323 VanDerWaalsContact CG2-CG 3.43Å; I320-L323 PolarHBondContact O-N 2.86Å; I320-L323 VanDerWaalsContact O-N 3.1Å; I320-K324 PolarHBondContact O-N 3.24Å
321	D	63.2	Low	71.2	Confident	106 Å²	106	60.5 Å²	60.5	57%	0.567	32%	0.323	S	S	*	.	H	α-helix	trans	-53.7	-33.1	178.4	-76	-26.5	0	0	0	113.1	E318 L323 K324 L325	E318-D321 PolarHBondContact O-N 2.81Å; D321-L323 PolarHBondContact O-N 3.09Å; D321-K324 PolarHBondContact O-N 2.79Å; D321-L325 WeakPolarHBondContact O-CB 3.16Å; D321-L325 PolarHBondContact O-N 3.34Å
322	S	64.5	Low	70.8	Confident	82 Å²	82	60.2 Å²	60.2	57%	0.573	32%	0.321	S	S	*	.	H	α-helix	trans	-62.6	-38.7	178.4	61.4	0	0	0	0	113	I320 K326	I320-S322 PolarHBondContact O-N 2.77Å; I320-S322 VanDerWaalsContact O-N 3.14Å; S322-K326 WeakPolarHBondContact O-CB 3.43Å; S322-K326 PolarHBondContact O-N 2.87Å; S322-K326 VanDerWaalsContact O-N 3.07Å
323	L	63.6	Low	70.7	Confident	15 Å²	15	57.9 Å²	57.9	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-78.2	-37.6	177.2	-60.4	-177.2	0	0	0	111.1	I47 I320 D321 L325 K326 Y327	I47-L323 HydrophobicContact CD1-CD1 3.55Å; I47-L323 HydrophobicContact CG1-CD1 3.67Å; I320-L323 HydrophobicContact CG2-CB 3.55Å; I320-L323 HydrophobicContact CG2-CD1 3.4Å; I320-L323 HydrophobicContact CG2-CG 3.43Å; I320-L323 VanDerWaalsContact CG2-CG 3.43Å; I320-L323 PolarHBondContact O-N 2.86Å; I320-L323 VanDerWaalsContact O-N 3.1Å; D321-L323 PolarHBondContact O-N 3.09Å; L323-L325 VanDerWaalsContact C-N 3.29Å; L323-L325 PolarHBondContact O-N 3.2Å; L323-K326 PolarHBondContact O-N 3.28Å; L323-Y327 HydrophobicContact CB-CD2 4.14Å; L323-Y327 HydrophobicContact CB-CE2 4.46Å; L323-Y327 HydrophobicContact CD2-CD2 4.31Å; L323-Y327 HydrophobicContact CD2-CE2 3.78Å; L323-Y327 WeakPolarHBondContact O-CB 3.29Å; L323-Y327 VanDerWaalsContact O-CD2 3.3Å; L323-Y327 WeakPolarHBondContact O-CD2 3.3Å; L323-Y327 PolarHBondContact O-N 2.8Å
324	K	65.6	Low	70.9	Confident	40 Å²	40	56.4 Å²	56.4	17%	0.174	30%	0.299	C	S	.	.	H	α-helix	trans	-57	-46.1	172.8	-67.8	-179.2	173.7	-143.2	0	111.3	L316 S317 I320 D321 K326 H328 D330	L316-K324 HydrophobicContact CB-CG 4.23Å; L316-K324 HydrophobicContact CD1-CG 4.48Å; L316-K324 WeakPolarHBondContact O-CE 3.31Å; L316-K324 PolarHBondContact O-NZ 3.01Å; S317-K324 WeakPolarHBondContact O-CE 3.38Å; I320-K324 PolarHBondContact O-N 3.24Å; D321-K324 PolarHBondContact O-N 2.79Å; K324-K326 VanDerWaalsContact C-N 3.35Å; K324-H328 VanDerWaalsContact O-CA 3.25Å; K324-H328 WeakPolarHBondContact O-CA 3.41Å; K324-H328 PolarHBondContact O-N 3.27Å; K324-D330 VanDerWaalsContact CD-OD1 3.24Å; K324-D330 WeakPolarHBondContact CD-OD1 3.4Å; K324-D330 WeakPolarHBondContact CE-OD1 3.26Å; K324-D330 IonicContact NZ-OD1 2.75Å; K324-D330 PolarHBondContact NZ-OD1 2.91Å
325	L	64.3	Low	71.5	Confident	141 Å²	141	56.3 Å²	56.3	74%	0.738	30%	0.299	S	S	*	.	H	α-helix	trans	-66.1	-37.8	178	-155.7	106.9	0	0	0	112	D321 L323 H328	D321-L325 WeakPolarHBondContact O-CB 3.16Å; D321-L325 PolarHBondContact O-N 3.34Å; L323-L325 VanDerWaalsContact C-N 3.29Å; L323-L325 PolarHBondContact O-N 3.2Å; L325-H328 PolarHBondContact O-CE1 3.47Å
326	K	68.2	Low	72.3	Confident	117 Å²	117	53.5 Å²	53.5	51%	0.509	28%	0.284	S	S	.	.	H	α-helix	trans	-74.4	-37.4	-178.5	-176.5	178.2	177.7	-168.6	0	113.5	S322 L323 K324	S322-K326 WeakPolarHBondContact O-CB 3.43Å; S322-K326 PolarHBondContact O-N 2.87Å; S322-K326 VanDerWaalsContact O-N 3.07Å; L323-K326 PolarHBondContact O-N 3.28Å; K324-K326 VanDerWaalsContact C-N 3.35Å
327	Y	67	Low	73.4	Confident	34 Å²	34	53.2 Å²	53.2	13%	0.133	28%	0.283	C	S	.	.	H	α-helix	trans	-107.7	0.8	-174.9	-63.9	-74.6	0	0	0	113.6	L323 S329 A346 Y350 L352	L323-Y327 HydrophobicContact CB-CD2 4.14Å; L323-Y327 HydrophobicContact CB-CE2 4.46Å; L323-Y327 HydrophobicContact CD2-CD2 4.31Å; L323-Y327 HydrophobicContact CD2-CE2 3.78Å; L323-Y327 WeakPolarHBondContact O-CB 3.29Å; L323-Y327 VanDerWaalsContact O-CD2 3.3Å; L323-Y327 WeakPolarHBondContact O-CD2 3.3Å; L323-Y327 PolarHBondContact O-N 2.8Å; Y327-S329 PolarHBondContact O-N 3.04Å; Y327-S329 VanDerWaalsContact O-N 3.13Å; Y327-A346 HydrophobicContact CD1-CB 3.89Å; Y327-A346 HydrophobicContact CE1-CB 4.26Å; Y327-A346 HydrophobicContact CG-CB 4.2Å; Y327-Y350 HydrophobicContact CD1-CD2 4.2Å; Y327-Y350 HydrophobicContact CE1-CD2 4.11Å; Y327-Y350 HydrophobicContact CE1-CG 4.29Å; Y327-L352 HydrophobicContact CD2-CD2 3.64Å; Y327-L352 HydrophobicContact CE1-CD2 4.15Å; Y327-L352 HydrophobicContact CE2-CD2 3.23Å; Y327-L352 HydrophobicContact CG-CD2 4.29Å
328	H	67.5	Low	74.8	Confident	156 Å²	156	53 Å²	53	72%	0.722	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	34.9	177.9	-59.5	-72	0	0	0	113.6	K324 L325	K324-H328 VanDerWaalsContact O-CA 3.25Å; K324-H328 WeakPolarHBondContact O-CA 3.41Å; K324-H328 PolarHBondContact O-N 3.27Å; L325-H328 PolarHBondContact O-CE1 3.47Å
329	S	72.5	Confident	76.3	Confident	15 Å²	15	45.9 Å²	45.9	11%	0.105	25%	0.249	C	C	.	.			trans	-152.6	146.2	179.5	-153.9	0	0	0	0	112.4	Y327 N347	Y327-S329 PolarHBondContact O-N 3.04Å; Y327-S329 VanDerWaalsContact O-N 3.13Å; S329-N347 WeakPolarHBondContact CB-ND2 3.38Å; S329-N347 PolarHBondContact OG-ND2 3.28Å
330	D	75.3	Confident	77.8	Confident	90 Å²	90	42.2 Å²	42.2	48%	0.481	22%	0.223	S	C	.	.	S	Bend	trans	-88.7	-4	179.6	-78.4	-41.2	0	0	0	113.6	N315 L316 K324	N315-D330 CarbonylContact C-O 3.33Å; N315-D330 WeakPolarHBondContact CA-O 3.2Å; L316-D330 PolarHBondContact N-O 3.07Å; K324-D330 VanDerWaalsContact CD-OD1 3.24Å; K324-D330 WeakPolarHBondContact CD-OD1 3.4Å; K324-D330 WeakPolarHBondContact CE-OD1 3.26Å; K324-D330 IonicContact NZ-OD1 2.75Å; K324-D330 PolarHBondContact NZ-OD1 2.91Å
331	C	79	Confident	79.2	Confident	28 Å²	28	41.6 Å²	41.6	19%	0.189	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	156.8	-176.1	-65.2	0	0	0	0	111.1	M267 F314 N347	M267-C331 HydrophobicContact CE-CB 3.43Å; M267-C331 VanDerWaalsContact CE-CB 3.43Å; M267-C331 HydrophobicContact SD-CB 3.67Å; F314-C331 WeakPolarHBondContact O-CA 3.35Å; C331-N347 VanDerWaalsContact C-OD1 3.32Å; C331-N347 PolarHBondContact O-ND2 3.15Å; C331-N347 PolarHBondContact O-OD1 2.66Å
332	A	85.7	Confident	80.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	169.8	171.9	0	0	0	0	0	109.5	T313 F314 L316 N347 L352	T313-A332 CarbonylContact C-O 3.56Å; T313-A332 WeakPolarHBondContact CA-O 3.48Å; F314-A332 HydrophobicContact CD1-CB 4.35Å; F314-A332 VanDerWaalsContact CD1-O 3.3Å; F314-A332 WeakPolarHBondContact CD1-O 3.43Å; F314-A332 HydrophobicContact CE1-CB 3.66Å; F314-A332 HydrophobicContact CE2-CB 3.98Å; F314-A332 HydrophobicContact CZ-CB 3.45Å; F314-A332 VanDerWaalsContact CZ-CB 3.45Å; F314-A332 PolarHBondContact N-O 3.28Å; F314-A332 PolarHBondContact O-N 2.88Å; L316-A332 HydrophobicContact CD2-CB 4.39Å; L316-A332 HydrophobicContact CG-CB 4.39Å; A332-N347 WeakPolarHBondContact CA-OD1 3.36Å; A332-L352 HydrophobicContact CB-CD1 3.65Å
333	F	88.4	Confident	82	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	139.8	177.4	-49.7	-68.5	0	0	0	110.7	I263 C265 M267 V274 M284 D312 T313 F314 V335 L344 I345	I263-F333 HydrophobicContact CD1-CD1 4.5Å; C265-F333 HydrophobicContact CB-CE1 4.22Å; C265-F333 WeakPolarHBondContact SG-CE1 3.37Å; C265-F333 WeakPolarHBondContact SG-CZ 3.36Å; M267-F333 HydrophobicContact CE-CE1 4.06Å; M267-F333 HydrophobicContact CE-CZ 4.01Å; V274-F333 HydrophobicContact CG2-CE1 3.78Å; V274-F333 HydrophobicContact CG2-CE2 4.24Å; V274-F333 HydrophobicContact CG2-CZ 3.64Å; M284-F333 HydrophobicContact CE-CE2 3.83Å; M284-F333 HydrophobicContact CE-CZ 3.91Å; M284-F333 HydrophobicContact SD-CE2 4.25Å; D312-F333 WeakPolarHBondContact O-CA 3.36Å; T313-F333 HydrophobicContact CG2-CD1 3.84Å; T313-F333 HydrophobicContact CG2-CE1 3.69Å; F314-F333 VanDerWaalsContact CE1-C 3.45Å; F333-V335 HydrophobicContact CB-CG2 4.44Å; F333-L344 WeakPolarHBondContact O-CA 3.43Å; F333-I345 PolarHBondContact N-O 2.91Å; F333-I345 PolarHBondContact O-N 3.18Å
334	F	91.4	Very high	83.3	Confident	1 Å²	1	32.7 Å²	32.7	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	146	154.5	65.9	-107.3	0	0	0	109	S15 L24 F26 V311 D312 F314 I342 R343 L344	S15-F334 VanDerWaalsContact CB-CE2 3.41Å; S15-F334 VanDerWaalsContact OG-CE2 3.31Å; S15-F334 WeakPolarHBondContact OG-CE2 3.37Å; S15-F334 WeakPolarHBondContact OG-CZ 3.33Å; L24-F334 HydrophobicContact CD1-CD1 3.7Å; L24-F334 HydrophobicContact CD1-CE1 4.26Å; L24-F334 HydrophobicContact CD1-CG 4.38Å; L24-F334 HydrophobicContact CD2-CD1 3.97Å; L24-F334 HydrophobicContact CD2-CE1 3.75Å; L24-F334 HydrophobicContact CG-CD1 4.42Å; F26-F334 HydrophobicContact CD1-CE2 4.39Å; F26-F334 AromaticContact CE1-CD2 3.37Å; F26-F334 HydrophobicContact CE1-CD2 3.37Å; F26-F334 AromaticContact CE1-CE2 3.4Å; F26-F334 HydrophobicContact CE1-CE2 3.4Å; F26-F334 VanDerWaalsContact CE1-CE2 3.4Å; F26-F334 AromaticContact CE1-CG 3.97Å; F26-F334 HydrophobicContact CE1-CG 3.97Å; F26-F334 AromaticContact CE1-CZ 3.98Å; F26-F334 HydrophobicContact CE1-CZ 3.98Å; F26-F334 HydrophobicContact CZ-CB 4.25Å; F26-F334 HydrophobicContact CZ-CD1 4.18Å; F26-F334 AromaticContact CZ-CD2 3.7Å; F26-F334 HydrophobicContact CZ-CD2 3.7Å; F26-F334 HydrophobicContact CZ-CE1 4.4Å; F26-F334 AromaticContact CZ-CE2 3.99Å; F26-F334 HydrophobicContact CZ-CE2 3.99Å; F26-F334 AromaticContact CZ-CG 3.79Å; F26-F334 HydrophobicContact CZ-CG 3.79Å; F26-F334 HydrophobicContact CZ-CZ 4.28Å; V311-F334 WeakPolarHBondContact CA-O 3.46Å; D312-F334 HydrophobicContact CB-CD1 4.34Å; D312-F334 HydrophobicContact CB-CE1 3.48Å; D312-F334 VanDerWaalsContact CB-CE1 3.48Å; D312-F334 HydrophobicContact CB-CE2 3.65Å; D312-F334 HydrophobicContact CB-CZ 3.09Å; D312-F334 PolarHBondContact N-O 3.35Å; D312-F334 PolarHBondContact O-N 3.33Å; D312-F334 VanDerWaalsContact O-N 3.09Å; F314-F334 HydrophobicContact CD1-CB 4.36Å; F314-F334 AromaticContact CD1-CD1 4Å; F314-F334 HydrophobicContact CD1-CD1 4Å; F314-F334 HydrophobicContact CE1-CB 4.35Å; F334-I342 HydrophobicContact CB-CG2 3.91Å; F334-R343 CarbonylContact C-O 3.47Å; F334-R343 WeakPolarHBondContact CA-O 3.4Å; F334-L344 HydrophobicContact CB-CD2 3.83Å
335	V	94.9	Very high	84.4	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	117	-179.2	-175.8	0	0	0	0	108.7	L282 L297 L305 I308 A310 V311 F333 I342 R343 I345	L282-V335 HydrophobicContact CD1-CG1 4.37Å; L282-V335 HydrophobicContact CD1-CG2 4.02Å; L282-V335 HydrophobicContact CD2-CG2 4.05Å; L297-V335 HydrophobicContact CD1-CB 4.1Å; L297-V335 HydrophobicContact CD1-CG1 3.63Å; L305-V335 HydrophobicContact CD1-CB 4.45Å; L305-V335 HydrophobicContact CD1-CG1 3.84Å; I308-V335 HydrophobicContact CB-CG1 4.29Å; I308-V335 HydrophobicContact CD1-CG1 3.97Å; I308-V335 HydrophobicContact CG1-CG1 3.87Å; I308-V335 HydrophobicContact CG2-CG1 3.51Å; A310-V335 WeakPolarHBondContact O-CA 3.26Å; V311-V335 HydrophobicContact CG1-CG2 4.44Å; V311-V335 HydrophobicContact CG2-CG1 4.15Å; V311-V335 HydrophobicContact CG2-CG2 4.26Å; F333-V335 HydrophobicContact CB-CG2 4.44Å; V335-I342 CarbonylContact O-C 3.57Å; V335-I342 WeakPolarHBondContact O-CA 3.5Å; V335-R343 HydrophobicContact CB-CB 4.35Å; V335-R343 PolarHBondContact N-O 3.13Å; V335-R343 PolarHBondContact O-N 2.76Å; V335-I345 HydrophobicContact CB-CD1 4.25Å; V335-I345 HydrophobicContact CG2-CD1 3.58Å; V335-I345 HydrophobicContact CG2-CG1 4.3Å
336	G	95	Very high	85.3	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	159.6	177.8	0	0	0	0	0	111.6	L309 A310	L309-G336 PolarHBondContact N-O 2.98Å; A310-G336 PolarHBondContact N-O 2.83Å; A310-G336 PolarHBondContact O-N 3.26Å
337	G	95.3	Very high	85.8	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.7	-135.2	173.7	0	0	0	0	0	111.5	F11 I12 H307 G339	F11-G337 WeakPolarHBondContact CA-O 3.49Å; I12-G337 PolarHBondContact N-O 3.18Å; H307-G337 CarbonylContact O-C 3.49Å; H307-G337 VanDerWaalsContact O-CA 3.31Å; H307-G337 WeakPolarHBondContact O-CA 3.43Å; G337-G339 PolarHBondContact O-N 3.46Å
338	C	93.8	Very high	86.3	Confident	20 Å²	20	22 Å²	22	14%	0.135	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	95.9	179.7	-65.5	0	0	0	0	110.6	F11 L305 S306 H307	F11-C338 HydrophobicContact CD1-CB 4.01Å; F11-C338 HydrophobicContact CE1-CB 4.11Å; L305-C338 CarbonylContact C-O 3.54Å; L305-C338 WeakPolarHBondContact CA-O 3.15Å; S306-C338 PolarHBondContact N-O 2.78Å; S306-C338 VanDerWaalsContact OG-CB 3.26Å; S306-C338 WeakPolarHBondContact OG-CB 3.4Å; S306-C338 PolarHBondContact OG-O 2.72Å; H307-C338 HydrophobicContact CB-CB 3.98Å; H307-C338 PolarHBondContact O-N 3.48Å
339	G	90	Very high	86.8	Confident	6 Å²	6	15 Å²	15	6%	0.062	9%	0.088	C	C	.	.	S	Bend	trans	172.2	176.8	178.2	0	0	0	0	0	112.2	R304 G337 V341 Y357	R304-G339 VanDerWaalsContact O-CA 3.27Å; R304-G339 WeakPolarHBondContact O-CA 3.48Å; G337-G339 PolarHBondContact O-N 3.46Å; G339-V341 PolarHBondContact O-N 2.74Å; G339-Y357 WeakPolarHBondContact O-CE2 3.19Å; G339-Y357 PolarHBondContact O-OH 3.42Å
340	P	87.2	Confident	87.2	Confident	21 Å²	21	20.5 Å²	20.5	14%	0.136	11%	0.108	C	C	.	.	S	Bend	trans	-87.2	-0.8	-170.4	34.8	-35	0	0	0	114.6	I7 N302 R304 Y357	I7-P340 HydrophobicContact CG2-CB 4.01Å; N302-P340 WeakPolarHBondContact O-CG 3.26Å; R304-P340 WeakPolarHBondContact O-CD 3.14Å; P340-Y357 VanDerWaalsContact C-CZ 3.49Å; P340-Y357 VanDerWaalsContact O-CD2 3.23Å; P340-Y357 WeakPolarHBondContact O-CD2 3.49Å; P340-Y357 VanDerWaalsContact O-CE2 3.3Å; P340-Y357 WeakPolarHBondContact O-CE2 3.24Å
341	V	91.6	Very high	87.6	Confident	2 Å²	2	19.5 Å²	19.5	1%	0.012	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	166.3	-175.5	-59.1	0	0	0	0	111.5	S303 L305 G339 R343 M354 L355 Y357	S303-V341 VanDerWaalsContact O-CG2 3.23Å; S303-V341 WeakPolarHBondContact O-CG2 2.94Å; L305-V341 WeakPolarHBondContact CD2-O 3.35Å; G339-V341 PolarHBondContact O-N 2.74Å; V341-R343 HydrophobicContact CG2-CG 4.43Å; V341-M354 HydrophobicContact CG2-SD 4.43Å; V341-L355 WeakPolarHBondContact CA-O 3.34Å; V341-L355 WeakPolarHBondContact CB-O 3.02Å; V341-Y357 VanDerWaalsContact C-OH 3.32Å; V341-Y357 PolarHBondContact N-OH 2.89Å; V341-Y357 PolarHBondContact O-OH 2.83Å
342	I	93.7	Very high	87.8	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.2	160.1	-65.6	134.5	0	0	0	107.7	I12 F26 Y36 F334 V335 M354 L355 Y357	I12-I342 HydrophobicContact CD1-CD1 4.1Å; I12-I342 HydrophobicContact CD1-CG1 4.26Å; I12-I342 HydrophobicContact CG1-CD1 4.1Å; I12-I342 HydrophobicContact CG1-CG1 3.71Å; F26-I342 HydrophobicContact CB-CD1 4.36Å; F26-I342 HydrophobicContact CD1-CD1 3.95Å; F26-I342 HydrophobicContact CD1-CG1 4.3Å; F26-I342 HydrophobicContact CD2-CD1 3.55Å; F26-I342 HydrophobicContact CE1-CD1 4.04Å; F26-I342 HydrophobicContact CE1-CG1 4.17Å; F26-I342 HydrophobicContact CE1-CG2 4.16Å; F26-I342 HydrophobicContact CE2-CD1 3.68Å; F26-I342 HydrophobicContact CG-CD1 3.68Å; F26-I342 HydrophobicContact CZ-CD1 3.93Å; F26-I342 HydrophobicContact CZ-CG1 4.3Å; F26-I342 HydrophobicContact CZ-CG2 3.94Å; Y36-I342 HydrophobicContact CE2-CD1 3.98Å; F334-I342 HydrophobicContact CB-CG2 3.91Å; V335-I342 CarbonylContact O-C 3.57Å; V335-I342 WeakPolarHBondContact O-CA 3.5Å; I342-M354 CarbonylContact O-C 3.59Å; I342-M354 VanDerWaalsContact O-CA 3.28Å; I342-M354 WeakPolarHBondContact O-CA 3.5Å; I342-L355 HydrophobicContact CB-CB 4.11Å; I342-L355 HydrophobicContact CB-CD1 4.47Å; I342-L355 HydrophobicContact CD1-CB 4.44Å; I342-L355 HydrophobicContact CG2-CD1 4.26Å; I342-L355 PolarHBondContact N-O 3.14Å; I342-L355 PolarHBondContact O-N 3.3Å; I342-Y357 HydrophobicContact CD1-CD1 4.38Å; I342-Y357 HydrophobicContact CD1-CE1 3.85Å; I342-Y357 HydrophobicContact CG1-CE1 3.95Å
343	R	92.5	Very high	87.8	Confident	15 Å²	15	18.7 Å²	18.7	6%	0.057	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	139.9	178.7	-59.3	-74.7	-87.9	-101.8	2.6	109.6	L297 D299 S303 L305 F334 V335 V341 I345	L297-R343 HydrophobicContact CB-CG 4.45Å; L297-R343 HydrophobicContact CD1-CB 4.35Å; L297-R343 HydrophobicContact CD1-CG 4.3Å; L297-R343 HydrophobicContact CD2-CB 4.29Å; L297-R343 HydrophobicContact CD2-CG 4.19Å; L297-R343 PolarHBondContact O-NH1 3.4Å; D299-R343 PolarHBondContact O-NH1 2.81Å; D299-R343 PolarHBondContact O-NH2 3.29Å; S303-R343 PolarHBondContact O-NH1 2.91Å; S303-R343 PolarHBondContact OG-NH1 3.29Å; L305-R343 HydrophobicContact CD1-CG 3.85Å; L305-R343 HydrophobicContact CG-CG 4.15Å; F334-R343 CarbonylContact C-O 3.47Å; F334-R343 WeakPolarHBondContact CA-O 3.4Å; V335-R343 HydrophobicContact CB-CB 4.35Å; V335-R343 PolarHBondContact N-O 3.13Å; V335-R343 PolarHBondContact O-N 2.76Å; V341-R343 HydrophobicContact CG2-CG 4.43Å; R343-I345 HydrophobicContact CB-CG1 4.43Å
344	L	90	Very high	87.8	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.5	171.5	-57.6	178.2	0	0	0	108.5	L41 I47 F314 F333 F334 L352 G353 L355	L41-L344 HydrophobicContact CD1-CD1 4.29Å; I47-L344 HydrophobicContact CB-CD1 3.82Å; I47-L344 HydrophobicContact CD1-CD1 4.21Å; I47-L344 HydrophobicContact CG2-CD1 3.32Å; F314-L344 HydrophobicContact CE1-CD2 3.85Å; F314-L344 HydrophobicContact CZ-CD2 4.02Å; F333-L344 WeakPolarHBondContact O-CA 3.43Å; F334-L344 HydrophobicContact CB-CD2 3.83Å; L344-L352 HydrophobicContact CB-CB 4.07Å; L344-L352 PolarHBondContact O-N 3.19Å; L344-G353 PolarHBondContact N-O 3.39Å; L344-G353 PolarHBondContact O-N 3.42Å; L344-L355 HydrophobicContact CD1-CD2 3.99Å; L344-L355 HydrophobicContact CD1-CG 4.18Å; L344-L355 HydrophobicContact CD2-CD1 4.11Å; L344-L355 HydrophobicContact CD2-CG 4.19Å; L344-L355 HydrophobicContact CG-CG 4.24Å
345	I	89.4	Confident	87.8	Confident	1 Å²	1	20 Å²	20	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	132.9	-170.7	-54.1	177.4	0	0	0	108.7	L282 V295 L297 F333 V335 R343 Y350	L282-I345 HydrophobicContact CD2-CD1 3.82Å; V295-I345 HydrophobicContact CG1-CD1 4.36Å; V295-I345 HydrophobicContact CG2-CG2 4.23Å; L297-I345 HydrophobicContact CD1-CD1 3.79Å; L297-I345 HydrophobicContact CD2-CD1 3.62Å; L297-I345 HydrophobicContact CD2-CG1 4.42Å; L297-I345 HydrophobicContact CG-CD1 4.27Å; F333-I345 PolarHBondContact N-O 2.91Å; F333-I345 PolarHBondContact O-N 3.18Å; V335-I345 HydrophobicContact CB-CD1 4.25Å; V335-I345 HydrophobicContact CG2-CD1 3.58Å; V335-I345 HydrophobicContact CG2-CG1 4.3Å; R343-I345 HydrophobicContact CB-CG1 4.43Å; I345-Y350 CarbonylContact C-O 3.54Å; I345-Y350 WeakPolarHBondContact CA-O 3.22Å
346	A	83.9	Confident	87.5	Confident	3 Å²	3	22.7 Å²	22.7	3%	0.025	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	162.8	175.9	0	0	0	0	0	110.9	Y327 L348 G349 Y350 L352	Y327-A346 HydrophobicContact CD1-CB 3.89Å; Y327-A346 HydrophobicContact CE1-CB 4.26Å; Y327-A346 HydrophobicContact CG-CB 4.2Å; A346-L348 PolarHBondContact O-N 3.07Å; A346-L348 VanDerWaalsContact O-N 3.09Å; A346-G349 PolarHBondContact O-N 2.75Å; A346-Y350 WeakPolarHBondContact CB-O 2.98Å; A346-Y350 PolarHBondContact N-O 2.94Å; A346-L352 HydrophobicContact CB-CD1 4.02Å; A346-L352 HydrophobicContact CB-CD2 3.9Å; A346-L352 HydrophobicContact CB-CG 3.83Å
347	N	78.6	Confident	87.1	Confident	10 Å²	10	23.3 Å²	23.3	5%	0.053	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.1	-179.3	-66.8	-12.7	0	0	0	114.9	M267 M284 S329 C331 A332 G349	M267-N347 VanDerWaalsContact CE-CG 3.43Å; M267-N347 VanDerWaalsContact CE-ND2 3.29Å; M267-N347 WeakPolarHBondContact CE-ND2 2.9Å; M267-N347 VanDerWaalsContact CE-OD1 3.26Å; M267-N347 WeakPolarHBondContact CE-OD1 3.36Å; M267-N347 PolarHBondContact SD-ND2 3Å; M284-N347 WeakPolarHBondContact CE-O 3.43Å; M284-N347 VanDerWaalsContact SD-O 3.36Å; S329-N347 WeakPolarHBondContact CB-ND2 3.38Å; S329-N347 PolarHBondContact OG-ND2 3.28Å; C331-N347 VanDerWaalsContact C-OD1 3.32Å; C331-N347 PolarHBondContact O-ND2 3.15Å; C331-N347 PolarHBondContact O-OD1 2.66Å; A332-N347 WeakPolarHBondContact CA-OD1 3.36Å; N347-G349 VanDerWaalsContact C-N 3.33Å
348	L	76.2	Confident	86.5	Confident	93 Å²	93	25.3 Å²	25.3	49%	0.487	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	4.7	174.1	-64.2	174.1	0	0	0	113.1	A346 Y350	A346-L348 PolarHBondContact O-N 3.07Å; A346-L348 VanDerWaalsContact O-N 3.09Å; L348-Y350 HydrophobicContact CB-CD2 3.65Å; L348-Y350 HydrophobicContact CB-CE2 3.48Å; L348-Y350 VanDerWaalsContact CB-CE2 3.48Å; L348-Y350 HydrophobicContact CD1-CD2 4.47Å; L348-Y350 HydrophobicContact CD1-CE2 3.89Å; L348-Y350 HydrophobicContact CG-CE2 4.35Å
349	G	78.5	Confident	85	Confident	9 Å²	9	33 Å²	33	9%	0.093	16%	0.163	C	C	.	.	S	Bend	trans	88	5.5	-178.2	0	0	0	0	0	114.9	V295 A346 N347	V295-G349 WeakPolarHBondContact CG1-O 3.36Å; V295-G349 VanDerWaalsContact CG2-CA 3.41Å; V295-G349 WeakPolarHBondContact CG2-O 3.47Å; A346-G349 PolarHBondContact O-N 2.75Å; N347-G349 VanDerWaalsContact C-N 3.33Å
350	Y	81.6	Confident	84.8	Confident	132 Å²	132	34.4 Å²	34.4	52%	0.518	17%	0.168	S	C	.	.			trans	-75.4	134.3	176.5	-60	-69.8	0	0	0	111.5	Y327 I345 A346 L348 L352	Y327-Y350 HydrophobicContact CD1-CD2 4.2Å; Y327-Y350 HydrophobicContact CE1-CD2 4.11Å; Y327-Y350 HydrophobicContact CE1-CG 4.29Å; I345-Y350 CarbonylContact C-O 3.54Å; I345-Y350 WeakPolarHBondContact CA-O 3.22Å; A346-Y350 WeakPolarHBondContact CB-O 2.98Å; A346-Y350 PolarHBondContact N-O 2.94Å; L348-Y350 HydrophobicContact CB-CD2 3.65Å; L348-Y350 HydrophobicContact CB-CE2 3.48Å; L348-Y350 VanDerWaalsContact CB-CE2 3.48Å; L348-Y350 HydrophobicContact CD1-CD2 4.47Å; L348-Y350 HydrophobicContact CD1-CE2 3.89Å; L348-Y350 HydrophobicContact CG-CE2 4.35Å; Y350-L352 PolarHBondContact O-N 3.36Å
351	P	83.6	Confident	84.7	Confident	68 Å²	68	35.1 Å²	35.1	44%	0.442	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	124.2	169.3	-21.9	32.9	0	0	0	110.7
352	L	82.8	Confident	84.3	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	-32	173.2	-70.1	176.3	0	0	0	111.7	Q46 I47 Y327 A332 L344 A346 Y350	Q46-L352 CarbonylContact C-O 3.55Å; Q46-L352 WeakPolarHBondContact CA-O 3.12Å; I47-L352 HydrophobicContact CD1-CB 4.2Å; I47-L352 PolarHBondContact N-O 3.1Å; Y327-L352 HydrophobicContact CD2-CD2 3.64Å; Y327-L352 HydrophobicContact CE1-CD2 4.15Å; Y327-L352 HydrophobicContact CE2-CD2 3.23Å; Y327-L352 HydrophobicContact CG-CD2 4.29Å; A332-L352 HydrophobicContact CB-CD1 3.65Å; L344-L352 HydrophobicContact CB-CB 4.07Å; L344-L352 PolarHBondContact O-N 3.19Å; A346-L352 HydrophobicContact CB-CD1 4.02Å; A346-L352 HydrophobicContact CB-CD2 3.9Å; A346-L352 HydrophobicContact CB-CG 3.83Å; Y350-L352 PolarHBondContact O-N 3.36Å
353	G	86	Confident	83.7	Confident	7 Å²	7	39.1 Å²	39.1	7%	0.072	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159	-160	-175.8	0	0	0	0	0	113.5	I47 L344	I47-G353 CarbonylContact O-C 3.52Å; I47-G353 WeakPolarHBondContact O-CA 3.03Å; L344-G353 PolarHBondContact N-O 3.39Å; L344-G353 PolarHBondContact O-N 3.42Å
354	M	88.4	Confident	83.2	Confident	30 Å²	30	40.6 Å²	40.6	15%	0.148	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	146	-170.3	-52.7	-178.2	-62.8	0	0	112.4	I47 E48 G49 S303 V341 I342	I47-M354 PolarHBondContact O-N 3.11Å; E48-M354 WeakPolarHBondContact CA-O 3.5Å; G49-M354 PolarHBondContact N-O 3.07Å; S303-M354 WeakPolarHBondContact CB-SD 3.17Å; V341-M354 HydrophobicContact CG2-SD 4.43Å; I342-M354 CarbonylContact O-C 3.59Å; I342-M354 VanDerWaalsContact O-CA 3.28Å; I342-M354 WeakPolarHBondContact O-CA 3.5Å
355	L	89.8	Confident	82.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.3	170.7	-49.4	175.4	0	0	0	109.7	F26 Y36 L41 G49 V341 I342 L344	F26-L355 HydrophobicContact CE2-CD1 4.19Å; Y36-L355 HydrophobicContact CD1-CB 4Å; Y36-L355 HydrophobicContact CD1-CD1 3.98Å; Y36-L355 HydrophobicContact CD1-CD2 4.01Å; Y36-L355 HydrophobicContact CD1-CG 4.23Å; Y36-L355 HydrophobicContact CD2-CD1 4.15Å; Y36-L355 HydrophobicContact CE1-CB 3.58Å; Y36-L355 HydrophobicContact CE1-CD1 4.33Å; Y36-L355 HydrophobicContact CE1-CD2 4.38Å; Y36-L355 HydrophobicContact CE1-CG 4.33Å; Y36-L355 HydrophobicContact CE2-CB 4.5Å; Y36-L355 HydrophobicContact CE2-CD1 4.47Å; Y36-L355 HydrophobicContact CG-CD1 3.88Å; L41-L355 HydrophobicContact CD1-CD2 4.43Å; L41-L355 HydrophobicContact CD2-CD2 3.51Å; G49-L355 CarbonylContact O-C 3.57Å; G49-L355 WeakPolarHBondContact O-CA 3.23Å; V341-L355 WeakPolarHBondContact CA-O 3.34Å; V341-L355 WeakPolarHBondContact CB-O 3.02Å; I342-L355 HydrophobicContact CB-CB 4.11Å; I342-L355 HydrophobicContact CB-CD1 4.47Å; I342-L355 HydrophobicContact CD1-CB 4.44Å; I342-L355 HydrophobicContact CG2-CD1 4.26Å; I342-L355 PolarHBondContact N-O 3.14Å; I342-L355 PolarHBondContact O-N 3.3Å; L344-L355 HydrophobicContact CD1-CD2 3.99Å; L344-L355 HydrophobicContact CD1-CG 4.18Å; L344-L355 HydrophobicContact CD2-CD1 4.11Å; L344-L355 HydrophobicContact CD2-CG 4.19Å; L344-L355 HydrophobicContact CG-CG 4.24Å
356	H	89.5	Confident	82.2	Confident	56 Å²	56	46.4 Å²	46.4	26%	0.259	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	148.7	-179.3	-61.2	-80.2	0	0	0	111.3	Y36 G49 P51 S358	Y36-H356 PolarHBondContact OH-O 3.02Å; G49-H356 PolarHBondContact O-N 2.86Å; P51-H356 WeakPolarHBondContact CD-O 3.49Å; H356-S358 VanDerWaalsContact C-N 3.34Å; H356-S358 PolarHBondContact O-N 3.19Å
357	Y	87.1	Confident	82.1	Confident	13 Å²	13	49.7 Å²	49.7	5%	0.051	24%	0.24	C	C	.	.	S	Bend	trans	-78.2	-12.2	-177	-57	-26.2	0	0	0	115.4	I7 T10 I12 L34 G339 P340 V341 I342	I7-Y357 HydrophobicContact CG2-CD2 4.3Å; T10-Y357 VanDerWaalsContact CB-CD2 3.47Å; T10-Y357 HydrophobicContact CG2-CD2 3.46Å; T10-Y357 VanDerWaalsContact CG2-CD2 3.46Å; T10-Y357 HydrophobicContact CG2-CE2 3.48Å; T10-Y357 VanDerWaalsContact CG2-CE2 3.48Å; T10-Y357 HydrophobicContact CG2-CG 4.16Å; I12-Y357 HydrophobicContact CD1-CD1 4.48Å; I12-Y357 HydrophobicContact CD1-CE1 3.74Å; I12-Y357 HydrophobicContact CG1-CE1 4.07Å; L34-Y357 HydrophobicContact CD1-CD1 3.55Å; L34-Y357 HydrophobicContact CD1-CE1 4.26Å; L34-Y357 HydrophobicContact CD1-CG 4.09Å; G339-Y357 WeakPolarHBondContact O-CE2 3.19Å; G339-Y357 PolarHBondContact O-OH 3.42Å; P340-Y357 VanDerWaalsContact C-CZ 3.49Å; P340-Y357 VanDerWaalsContact O-CD2 3.23Å; P340-Y357 WeakPolarHBondContact O-CD2 3.49Å; P340-Y357 VanDerWaalsContact O-CE2 3.3Å; P340-Y357 WeakPolarHBondContact O-CE2 3.24Å; V341-Y357 VanDerWaalsContact C-OH 3.32Å; V341-Y357 PolarHBondContact N-OH 2.89Å; V341-Y357 PolarHBondContact O-OH 2.83Å; I342-Y357 HydrophobicContact CD1-CD1 4.38Å; I342-Y357 HydrophobicContact CD1-CE1 3.85Å; I342-Y357 HydrophobicContact CG1-CE1 3.95Å
358	S	82	Confident	82.4	Confident	41 Å²	41	53 Å²	53	29%	0.287	26%	0.256	S	S	.	.			trans	-111.5	148.8	-179.1	59.7	0	0	0	0	111.8	K50 H356	K50-S358 WeakPolarHBondContact CD-O 3.21Å; H356-S358 VanDerWaalsContact C-N 3.34Å; H356-S358 PolarHBondContact O-N 3.19Å
359	R	63.4	Low	83	Confident	183 Å²	183	49.4 Å²	49.4	69%	0.691	24%	0.235	S	C	*	.			trans	-68.5	0	171	-82	-171.5	178.8	169.3	0.2	113.9	K50 P51 E52	K50-R359 WeakPolarHBondContact CD-OXT 3.3Å; K50-R359 WeakPolarHBondContact CE-OXT 3.32Å; K50-R359 PolarHBondContact NZ-O 3.36Å; K50-R359 PolarHBondContact NZ-OXT 3.25Å; P51-R359 HydrophobicContact CG-CG 4.21Å; P51-R359 VanDerWaalsContact O-CG 3.31Å; P51-R359 WeakPolarHBondContact O-CG 3.25Å; P51-R359 PolarHBondContact O-NE 3.25Å; E52-R359 PolarHBondContact O-NH2 3.4Å

Retrieved 359 of 359 residues in 866.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).