A0A3Q0KBG1_SCHMA Loading...

UBA domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KBG1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 637 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	C	84.9	Confident	93.1	Very high	60 Å²	60	50.8 Å²	50.8	41%	0.405	30%	0.299	S	S	.	.				0	138.2	0	-178.5	0	0	0	0	109.4	L22 E28	C1-L22 HydrophobicContact CB-CD1 3.94Å; C1-E28 WeakPolarHBondContact CB-O 3.37Å
2	S	91.8	Very high	93.2	Very high	49 Å²	49	48.9 Å²	48.9	34%	0.343	29%	0.29	S	S	.	.			trans	-111.5	148.2	176.7	68.5	0	0	0	0	112.1	T4 E5 V6	S2-T4 PolarHBondContact O-N 3.05Å; S2-T4 PolarHBondContact OG-OG1 3.44Å; S2-T4 VanDerWaalsContact OG-OG1 3.1Å; S2-E5 WeakPolarHBondContact O-CB 3.35Å; S2-E5 PolarHBondContact O-N 2.85Å; S2-E5 VanDerWaalsContact OG-CB 3.23Å; S2-E5 WeakPolarHBondContact OG-CB 3.29Å; S2-E5 PolarHBondContact OG-N 3.49Å; S2-V6 PolarHBondContact O-N 2.77Å
3	L	93.4	Very high	93.3	Very high	34 Å²	34	46.2 Å²	46.2	18%	0.178	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-38.3	176.3	176.2	60.2	0	0	0	111.4	E5 V6 T7 L13 Q15 F18	L3-E5 PolarHBondContact O-N 3.18Å; L3-V6 PolarHBondContact O-N 2.73Å; L3-T7 HydrophobicContact CD1-CG2 3.91Å; L3-T7 HydrophobicContact CG-CG2 4.17Å; L3-T7 WeakPolarHBondContact O-CG2 3.16Å; L3-T7 PolarHBondContact O-N 2.94Å; L3-T7 PolarHBondContact O-OG1 3.45Å; L3-T7 VanDerWaalsContact O-OG1 3.12Å; L3-L13 HydrophobicContact CD1-CB 4.05Å; L3-Q15 HydrophobicContact CD2-CB 4.42Å; L3-F18 HydrophobicContact CB-CD1 4.01Å; L3-F18 HydrophobicContact CB-CD2 4.3Å; L3-F18 HydrophobicContact CB-CE1 4.13Å; L3-F18 HydrophobicContact CB-CE2 4.4Å; L3-F18 HydrophobicContact CB-CG 4.11Å; L3-F18 HydrophobicContact CB-CZ 4.32Å; L3-F18 HydrophobicContact CD1-CB 3.79Å; L3-F18 HydrophobicContact CD1-CD2 3.9Å; L3-F18 HydrophobicContact CD1-CG 3.8Å; L3-F18 HydrophobicContact CG-CG 4.46Å
4	T	93.8	Very high	93.4	Very high	90 Å²	90	46.1 Å²	46.1	55%	0.552	28%	0.276	S	S	*	.	H	α-helix	trans	-60	-44.8	179.5	46.4	0	0	0	0	111.9	S2 V6 T7 N8	S2-T4 PolarHBondContact O-N 3.05Å; S2-T4 PolarHBondContact OG-OG1 3.44Å; S2-T4 VanDerWaalsContact OG-OG1 3.1Å; T4-V6 PolarHBondContact O-N 2.93Å; T4-T7 VanDerWaalsContact CA-OG1 3.3Å; T4-T7 WeakPolarHBondContact CA-OG1 3.49Å; T4-T7 PolarHBondContact O-N 2.87Å; T4-T7 PolarHBondContact O-OG1 3Å; T4-N8 WeakPolarHBondContact O-CB 3.21Å; T4-N8 PolarHBondContact O-N 2.72Å; T4-N8 PolarHBondContact O-ND2 3.25Å; T4-N8 PolarHBondContact O-OD1 3.08Å
5	E	93.9	Very high	93.4	Very high	87 Å²	87	50.6 Å²	50.6	41%	0.407	29%	0.293	S	S	.	.	H	α-helix	trans	-59.2	-45.9	175.5	-175	179.3	-156.9	0	0	112	S2 L3 N8 A9 Y30	S2-E5 WeakPolarHBondContact O-CB 3.35Å; S2-E5 PolarHBondContact O-N 2.85Å; S2-E5 VanDerWaalsContact OG-CB 3.23Å; S2-E5 WeakPolarHBondContact OG-CB 3.29Å; S2-E5 PolarHBondContact OG-N 3.49Å; L3-E5 PolarHBondContact O-N 3.18Å; E5-N8 PolarHBondContact O-N 2.97Å; E5-A9 PolarHBondContact O-N 3.04Å; E5-Y30 HydrophobicContact CG-CD2 3.89Å; E5-Y30 HydrophobicContact CG-CE2 3.72Å
6	V	94.7	Very high	93.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.6	-39.5	178.3	177.5	0	0	0	0	111.8	S2 L3 T4 A9 G10 W11 L13 F18 Y30 L33 L37	S2-V6 PolarHBondContact O-N 2.77Å; L3-V6 PolarHBondContact O-N 2.73Å; T4-V6 PolarHBondContact O-N 2.93Å; V6-A9 WeakPolarHBondContact O-CB 3.3Å; V6-A9 PolarHBondContact O-N 3.41Å; V6-G10 PolarHBondContact O-N 3.33Å; V6-W11 HydrophobicContact CG1-CB 3.59Å; V6-W11 HydrophobicContact CG1-CG 4.03Å; V6-W11 WeakPolarHBondContact O-CB 3.33Å; V6-W11 PolarHBondContact O-N 2.92Å; V6-L13 HydrophobicContact CG1-CD1 3.54Å; V6-F18 HydrophobicContact CG2-CE2 4.09Å; V6-Y30 HydrophobicContact CG2-CD2 4.07Å; V6-Y30 HydrophobicContact CG2-CE2 3.94Å; V6-L33 HydrophobicContact CG2-CD2 3.84Å; V6-L37 HydrophobicContact CG1-CD1 4.27Å
7	T	94.3	Very high	93.6	Very high	58 Å²	58	55.4 Å²	55.4	36%	0.356	31%	0.308	S	S	.	.	H	α-helix	trans	-68.3	-36.3	175	54.7	0	0	0	0	112.8	L3 T4 A9 G10 W11	L3-T7 HydrophobicContact CD1-CG2 3.91Å; L3-T7 HydrophobicContact CG-CG2 4.17Å; L3-T7 WeakPolarHBondContact O-CG2 3.16Å; L3-T7 PolarHBondContact O-N 2.94Å; L3-T7 PolarHBondContact O-OG1 3.45Å; L3-T7 VanDerWaalsContact O-OG1 3.12Å; T4-T7 VanDerWaalsContact CA-OG1 3.3Å; T4-T7 WeakPolarHBondContact CA-OG1 3.49Å; T4-T7 PolarHBondContact O-N 2.87Å; T4-T7 PolarHBondContact O-OG1 3Å; T7-A9 VanDerWaalsContact C-N 3.26Å; T7-A9 PolarHBondContact O-N 2.95Å; T7-G10 WeakPolarHBondContact O-CA 3.37Å; T7-G10 PolarHBondContact O-N 3.01Å; T7-W11 WeakPolarHBondContact CA-O 3.46Å
8	N	93.4	Very high	93.7	Very high	141 Å²	141	52.9 Å²	52.9	75%	0.754	29%	0.294	S	S	*	.	H	α-helix	trans	-67.1	-29.6	175.2	-72.4	-15.9	0	0	0	111.7	T4 E5 G10	T4-N8 WeakPolarHBondContact O-CB 3.21Å; T4-N8 PolarHBondContact O-N 2.72Å; T4-N8 PolarHBondContact O-ND2 3.25Å; T4-N8 PolarHBondContact O-OD1 3.08Å; E5-N8 PolarHBondContact O-N 2.97Å; N8-G10 PolarHBondContact O-N 2.85Å
9	A	93.8	Very high	93.8	Very high	27 Å²	27	53.1 Å²	53.1	22%	0.223	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-8.9	171.4	0	0	0	0	0	113.6	E5 V6 T7 Y30	E5-A9 PolarHBondContact O-N 3.04Å; V6-A9 WeakPolarHBondContact O-CB 3.3Å; V6-A9 PolarHBondContact O-N 3.41Å; T7-A9 VanDerWaalsContact C-N 3.26Å; T7-A9 PolarHBondContact O-N 2.95Å; A9-Y30 VanDerWaalsContact CB-OH 3.28Å; A9-Y30 WeakPolarHBondContact CB-OH 3.24Å
10	G	94.6	Very high	93.8	Very high	3 Å²	3	56 Å²	56	3%	0.031	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.4	-1.3	175.6	0	0	0	0	0	115.2	V6 T7 N8 G63 R64 I65	V6-G10 PolarHBondContact O-N 3.33Å; T7-G10 WeakPolarHBondContact O-CA 3.37Å; T7-G10 PolarHBondContact O-N 3.01Å; N8-G10 PolarHBondContact O-N 2.85Å; G10-G63 VanDerWaalsContact CA-O 3.31Å; G10-G63 WeakPolarHBondContact CA-O 3.4Å; G10-R64 WeakPolarHBondContact O-CA 3.38Å; G10-I65 PolarHBondContact O-N 3.29Å
11	W	96.1	Very high	93.9	Very high	10 Å²	10	53.6 Å²	53.6	4%	0.038	29%	0.294	C	S	.	.			trans	-77.9	124.8	178.1	-65.7	99.1	0	0	0	110.9	V6 T7 L13 I34 L37 L38 Y45 I65 K128	V6-W11 HydrophobicContact CG1-CB 3.59Å; V6-W11 HydrophobicContact CG1-CG 4.03Å; V6-W11 WeakPolarHBondContact O-CB 3.33Å; V6-W11 PolarHBondContact O-N 2.92Å; T7-W11 WeakPolarHBondContact CA-O 3.46Å; W11-L13 HydrophobicContact CB-CD1 4.47Å; W11-L13 PolarHBondContact O-N 2.83Å; W11-I34 HydrophobicContact CZ2-CG2 4.46Å; W11-L37 HydrophobicContact CD2-CB 4.33Å; W11-L37 HydrophobicContact CD2-CD1 4.05Å; W11-L37 HydrophobicContact CE3-CB 4.15Å; W11-L37 HydrophobicContact CE3-CD1 4.38Å; W11-L37 HydrophobicContact CG-CD1 4.2Å; W11-L37 HydrophobicContact CH2-CB 3.81Å; W11-L37 HydrophobicContact CZ2-CB 4.02Å; W11-L37 HydrophobicContact CZ3-CB 3.93Å; W11-L38 HydrophobicContact CH2-CD2 3.94Å; W11-L38 HydrophobicContact CH2-CG 4.19Å; W11-L38 HydrophobicContact CZ2-CD2 3.9Å; W11-L38 HydrophobicContact CZ2-CG 4Å; W11-Y45 HydrophobicContact CE3-CE2 4.14Å; W11-Y45 HydrophobicContact CZ3-CE2 4.26Å; W11-Y45 WeakPolarHBondContact CZ3-OH 3.26Å; W11-I65 HydrophobicContact CD2-CD1 3.41Å; W11-I65 VanDerWaalsContact CD2-CD1 3.41Å; W11-I65 HydrophobicContact CE3-CB 4.39Å; W11-I65 HydrophobicContact CE3-CD1 3.86Å; W11-I65 HydrophobicContact CE3-CG2 4.19Å; W11-I65 HydrophobicContact CG-CD1 3.74Å; W11-I65 HydrophobicContact CH2-CD1 4.27Å; W11-I65 HydrophobicContact CH2-CG2 4.33Å; W11-I65 HydrophobicContact CZ2-CD1 3.85Å; W11-I65 HydrophobicContact CZ3-CD1 4.22Å; W11-I65 HydrophobicContact CZ3-CG2 3.89Å; W11-K128 HydrophobicContact CH2-CD 4.32Å; W11-K128 HydrophobicContact CH2-CG 4.05Å; W11-K128 HydrophobicContact CZ3-CD 4.26Å; W11-K128 HydrophobicContact CZ3-CG 4.48Å
12	S	94.3	Very high	94.3	Very high	28 Å²	28	51.6 Å²	51.6	20%	0.196	28%	0.279	C	S	.	.			trans	-94	100.8	179.1	-60.6	0	0	0	0	109.8	G46 S47	S12-G46 WeakPolarHBondContact O-CA 3.23Å; S12-S47 WeakPolarHBondContact CB-O 3.26Å; S12-S47 PolarHBondContact O-N 2.94Å
13	L	94.6	Very high	94.4	Very high	14 Å²	14	57 Å²	57	7%	0.073	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-125.5	146.9	-178.2	-66.9	167.3	0	0	0	110.7	L3 V6 W11 F18 L37 Y45	L3-L13 HydrophobicContact CD1-CB 4.05Å; V6-L13 HydrophobicContact CG1-CD1 3.54Å; W11-L13 HydrophobicContact CB-CD1 4.47Å; W11-L13 PolarHBondContact O-N 2.83Å; L13-F18 HydrophobicContact CB-CB 4.43Å; L13-F18 HydrophobicContact CD1-CD2 4.36Å; L13-L37 HydrophobicContact CD1-CD1 3.99Å; L13-L37 HydrophobicContact CD1-CD2 4.45Å; L13-L37 HydrophobicContact CD2-CD2 4.14Å; L13-Y45 HydrophobicContact CD2-CD2 3.39Å; L13-Y45 HydrophobicContact CD2-CE2 4.17Å; L13-Y45 HydrophobicContact CD2-CG 4.14Å
14	S	93.7	Very high	94.4	Very high	45 Å²	45	61.6 Å²	61.6	32%	0.315	32%	0.315	S	S	.	.			trans	-81.3	159.5	165.3	75	0	0	0	0	109.8	K16 T17 F18	S14-K16 PolarHBondContact O-N 2.85Å; S14-T17 PolarHBondContact N-OG1 2.94Å; S14-T17 PolarHBondContact O-N 3.34Å; S14-T17 PolarHBondContact O-OG1 3.03Å; S14-T17 WeakPolarHBondContact OG-CG2 3.39Å; S14-T17 PolarHBondContact OG-N 3.35Å; S14-T17 VanDerWaalsContact OG-N 3.08Å; S14-T17 PolarHBondContact OG-OG1 3.43Å; S14-F18 WeakPolarHBondContact O-CB 3.39Å; S14-F18 PolarHBondContact O-N 2.89Å
15	Q	94.3	Very high	94.3	Very high	113 Å²	113	58.1 Å²	58.1	53%	0.528	29%	0.293	S	S	.	.	H	α-helix	trans	-56.2	-38.1	174.5	-174.4	63.3	45.9	0	0	111.9	L3 T19	L3-Q15 HydrophobicContact CD2-CB 4.42Å; Q15-T19 WeakPolarHBondContact O-CG2 3.49Å; Q15-T19 PolarHBondContact O-N 3.5Å; Q15-T19 VanDerWaalsContact O-N 3.14Å; Q15-T19 PolarHBondContact O-OG1 3Å
16	K	95	Very high	94.1	Very high	158 Å²	158	62.2 Å²	62.2	69%	0.687	31%	0.313	S	S	*	.	H	α-helix	trans	-63.9	-54.8	178.9	-64	-176.2	179.2	-176.3	0	111.1	S14 F18 T19 E20	S14-K16 PolarHBondContact O-N 2.85Å; K16-F18 VanDerWaalsContact C-N 3.3Å; K16-F18 PolarHBondContact O-N 3Å; K16-T19 PolarHBondContact O-N 3.24Å; K16-T19 VanDerWaalsContact O-N 3.13Å; K16-T19 PolarHBondContact O-OG1 3.23Å; K16-E20 WeakPolarHBondContact O-CG 3.14Å; K16-E20 PolarHBondContact O-N 3.12Å
17	T	94.5	Very high	93.8	Very high	24 Å²	24	68.3 Å²	68.3	15%	0.147	34%	0.341	C	S	.	.	H	α-helix	trans	-64.6	-35.3	-177.8	53.3	0	0	0	0	112.1	S14 E20 Y21 Y45	S14-T17 PolarHBondContact N-OG1 2.94Å; S14-T17 PolarHBondContact O-N 3.34Å; S14-T17 PolarHBondContact O-OG1 3.03Å; S14-T17 WeakPolarHBondContact OG-CG2 3.39Å; S14-T17 PolarHBondContact OG-N 3.35Å; S14-T17 VanDerWaalsContact OG-N 3.08Å; S14-T17 PolarHBondContact OG-OG1 3.43Å; T17-E20 PolarHBondContact O-N 3.11Å; T17-Y21 WeakPolarHBondContact O-CB 3.24Å; T17-Y21 WeakPolarHBondContact O-CD2 3.41Å; T17-Y21 PolarHBondContact O-N 2.93Å; T17-Y45 PolarHBondContact OG1-O 3.43Å; T17-Y45 VanDerWaalsContact OG1-O 3.06Å
18	F	96.1	Very high	93.6	Very high	12 Å²	12	70.4 Å²	70.4	5%	0.053	35%	0.347	C	S	.	.	H	α-helix	trans	-59	-49.5	171.8	171.2	-100.9	0	0	0	112.2	L3 V6 L13 S14 K16 E20 Y21 L22 L33	L3-F18 HydrophobicContact CB-CD1 4.01Å; L3-F18 HydrophobicContact CB-CD2 4.3Å; L3-F18 HydrophobicContact CB-CE1 4.13Å; L3-F18 HydrophobicContact CB-CE2 4.4Å; L3-F18 HydrophobicContact CB-CG 4.11Å; L3-F18 HydrophobicContact CB-CZ 4.32Å; L3-F18 HydrophobicContact CD1-CB 3.79Å; L3-F18 HydrophobicContact CD1-CD2 3.9Å; L3-F18 HydrophobicContact CD1-CG 3.8Å; L3-F18 HydrophobicContact CG-CG 4.46Å; V6-F18 HydrophobicContact CG2-CE2 4.09Å; L13-F18 HydrophobicContact CB-CB 4.43Å; L13-F18 HydrophobicContact CD1-CD2 4.36Å; S14-F18 WeakPolarHBondContact O-CB 3.39Å; S14-F18 PolarHBondContact O-N 2.89Å; K16-F18 VanDerWaalsContact C-N 3.3Å; K16-F18 PolarHBondContact O-N 3Å; F18-E20 VanDerWaalsContact C-N 3.33Å; F18-E20 PolarHBondContact O-N 3.44Å; F18-Y21 PolarHBondContact O-N 2.96Å; F18-L22 HydrophobicContact CE1-CD2 4.19Å; F18-L22 HydrophobicContact CZ-CD2 4.08Å; F18-L22 VanDerWaalsContact O-CB 3.27Å; F18-L22 WeakPolarHBondContact O-CB 3.38Å; F18-L22 PolarHBondContact O-N 3.46Å; F18-L33 HydrophobicContact CD2-CD2 4.05Å; F18-L33 HydrophobicContact CE2-CD2 3.69Å
19	T	94.4	Very high	93.6	Very high	55 Å²	55	66.2 Å²	66.2	34%	0.337	33%	0.326	S	S	.	.	H	α-helix	trans	-66.5	-34.2	179.4	57	0	0	0	0	112.9	Q15 K16 K23	Q15-T19 WeakPolarHBondContact O-CG2 3.49Å; Q15-T19 PolarHBondContact O-N 3.5Å; Q15-T19 VanDerWaalsContact O-N 3.14Å; Q15-T19 PolarHBondContact O-OG1 3Å; K16-T19 PolarHBondContact O-N 3.24Å; K16-T19 VanDerWaalsContact O-N 3.13Å; K16-T19 PolarHBondContact O-OG1 3.23Å; T19-K23 VanDerWaalsContact O-CG 3.26Å; T19-K23 WeakPolarHBondContact O-CG 3.44Å; T19-K23 PolarHBondContact O-N 3.25Å
20	E	95.1	Very high	93.6	Very high	112 Å²	112	68.2 Å²	68.2	52%	0.523	33%	0.328	S	S	.	.	H	α-helix	trans	-68.2	-42.6	177.2	-73.7	172	-172.1	0	0	112	K16 T17 F18	K16-E20 WeakPolarHBondContact O-CG 3.14Å; K16-E20 PolarHBondContact O-N 3.12Å; T17-E20 PolarHBondContact O-N 3.11Å; F18-E20 VanDerWaalsContact C-N 3.33Å; F18-E20 PolarHBondContact O-N 3.44Å
21	Y	94.7	Very high	93.5	Very high	5 Å²	5	73.6 Å²	73.6	2%	0.02	36%	0.356	C	S	.	.	H	α-helix	trans	-75	-34.5	178.9	-88.3	-105.9	0	0	0	112.6	T17 F18 K23 K24 L36 L37 E44 Y45	T17-Y21 WeakPolarHBondContact O-CB 3.24Å; T17-Y21 WeakPolarHBondContact O-CD2 3.41Å; T17-Y21 PolarHBondContact O-N 2.93Å; F18-Y21 PolarHBondContact O-N 2.96Å; Y21-K23 VanDerWaalsContact C-N 3.3Å; Y21-K23 PolarHBondContact O-N 2.95Å; Y21-K24 WeakPolarHBondContact O-CB 3.41Å; Y21-K24 PolarHBondContact O-N 3.42Å; Y21-K24 VanDerWaalsContact O-N 3.12Å; Y21-L36 HydrophobicContact CD1-CD2 3.69Å; Y21-L36 HydrophobicContact CD1-CG 3.97Å; Y21-L36 HydrophobicContact CE1-CD2 4.41Å; Y21-L36 HydrophobicContact CE1-CG 4.35Å; Y21-L36 HydrophobicContact CG-CD2 4.49Å; Y21-L37 HydrophobicContact CD1-CD2 3.96Å; Y21-L37 HydrophobicContact CE1-CD2 4.39Å; Y21-L37 HydrophobicContact CG-CD2 4.41Å; Y21-E44 PolarHBondContact OH-OE2 3.39Å; Y21-Y45 HydrophobicContact CE1-CD1 4.02Å; Y21-Y45 HydrophobicContact CE1-CG 4.45Å; Y21-Y45 VanDerWaalsContact CE2-CB 3.45Å; Y21-Y45 HydrophobicContact CE2-CD1 4.49Å; Y21-Y45 HydrophobicContact CE2-CG 4.36Å; Y21-Y45 AromaticContact CZ-CD1 3.78Å
22	L	94.4	Very high	93.5	Very high	19 Å²	19	76 Å²	76	10%	0.099	37%	0.368	C	S	.	.	H	α-helix	trans	-61.4	-41.1	174.3	-167.6	68.9	0	0	0	111	C1 F18 K24 T25 E28 L33	C1-L22 HydrophobicContact CB-CD1 3.94Å; F18-L22 HydrophobicContact CE1-CD2 4.19Å; F18-L22 HydrophobicContact CZ-CD2 4.08Å; F18-L22 VanDerWaalsContact O-CB 3.27Å; F18-L22 WeakPolarHBondContact O-CB 3.38Å; F18-L22 PolarHBondContact O-N 3.46Å; L22-K24 PolarHBondContact O-N 2.76Å; L22-T25 PolarHBondContact O-N 3.31Å; L22-T25 PolarHBondContact O-OG1 3.23Å; L22-E28 HydrophobicContact CD1-CB 3.87Å; L22-E28 HydrophobicContact CD1-CG 4.49Å; L22-E28 HydrophobicContact CD2-CB 4.26Å; L22-E28 HydrophobicContact CG-CB 3.85Å; L22-E28 HydrophobicContact CG-CG 3.99Å; L22-L33 HydrophobicContact CD1-CD2 4.19Å
23	K	93.8	Very high	93.6	Very high	161 Å²	161	74.6 Å²	74.6	70%	0.7	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.4	175.2	-73.6	174.8	-179.3	-176.5	0	114.9	T19 Y21 T25	T19-K23 VanDerWaalsContact O-CG 3.26Å; T19-K23 WeakPolarHBondContact O-CG 3.44Å; T19-K23 PolarHBondContact O-N 3.25Å; Y21-K23 VanDerWaalsContact C-N 3.3Å; Y21-K23 PolarHBondContact O-N 2.95Å; K23-T25 VanDerWaalsContact C-N 3.31Å
24	K	93.2	Very high	93.7	Very high	131 Å²	131	75.2 Å²	75.2	57%	0.57	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.2	175	-68.8	177.1	-178.4	178	0	112.4	Y21 L22 L36	Y21-K24 WeakPolarHBondContact O-CB 3.41Å; Y21-K24 PolarHBondContact O-N 3.42Å; Y21-K24 VanDerWaalsContact O-N 3.12Å; L22-K24 PolarHBondContact O-N 2.76Å; K24-L36 HydrophobicContact CB-CD2 3.78Å; K24-L36 HydrophobicContact CD-CD2 4.36Å
25	T	92.5	Very high	93.8	Very high	17 Å²	17	76.7 Å²	76.7	10%	0.104	37%	0.369	C	S	.	.	S	Bend	trans	-86.5	149.9	174.9	66.1	0	0	0	0	109.9	L22 K23 E28 E32 L33 L36	L22-T25 PolarHBondContact O-N 3.31Å; L22-T25 PolarHBondContact O-OG1 3.23Å; K23-T25 VanDerWaalsContact C-N 3.31Å; T25-E28 VanDerWaalsContact OG1-CA 3.24Å; T25-E28 WeakPolarHBondContact OG1-CA 3.42Å; T25-E28 PolarHBondContact OG1-N 2.78Å; T25-E32 HydrophobicContact CG2-CB 3.9Å; T25-L33 HydrophobicContact CG2-CB 4.33Å; T25-L36 HydrophobicContact CG2-CD2 4.14Å
26	E	89.3	Confident	93.9	Very high	173 Å²	173	73.7 Å²	73.7	81%	0.808	36%	0.356	S	S	*	.	S	Bend	trans	-75.8	-32.5	-176.3	-66.9	-175.4	179.9	0	0	111.6	E32	E26-E32 PolarHBondContact N-OE2 3.41Å
27	H	89	Confident	94	Very high	128 Å²	128	66.2 Å²	66.2	59%	0.593	32%	0.324	S	S	*	.	S	Bend	trans	-119.9	4.2	-172.2	-57.9	-38.5	0	0	0	114.4	T29 E32	H27-T29 HydrophobicContact CB-CG2 3.61Å; H27-T29 PolarHBondContact O-N 2.83Å; H27-E32 WeakPolarHBondContact CB-OE1 3.43Å; H27-E32 IonicContact CD2-OE1 3.18Å; H27-E32 PolarHBondContact CD2-OE1 3Å; H27-E32 IonicContact CG-OE1 3.63Å; H27-E32 PolarHBondContact N-OE2 2.82Å; H27-E32 VanDerWaalsContact N-OE2 3.12Å
28	E	90	Very high	94.1	Very high	103 Å²	103	66.6 Å²	66.6	48%	0.481	33%	0.325	S	S	.	.			trans	53.3	29	-177.1	-55.3	-170	161.6	0	0	112.7	C1 L22 T25	C1-E28 WeakPolarHBondContact CB-O 3.37Å; L22-E28 HydrophobicContact CD1-CB 3.87Å; L22-E28 HydrophobicContact CD1-CG 4.49Å; L22-E28 HydrophobicContact CD2-CB 4.26Å; L22-E28 HydrophobicContact CG-CB 3.85Å; L22-E28 HydrophobicContact CG-CG 3.99Å; T25-E28 VanDerWaalsContact OG1-CA 3.24Å; T25-E28 WeakPolarHBondContact OG1-CA 3.42Å; T25-E28 PolarHBondContact OG1-N 2.78Å
29	T	92	Very high	94.2	Very high	52 Å²	52	69.2 Å²	69.2	32%	0.319	34%	0.339	S	S	.	.			trans	-81.5	153.4	-179.5	60.5	0	0	0	0	110.6	H27 E32 L33	H27-T29 HydrophobicContact CB-CG2 3.61Å; H27-T29 PolarHBondContact O-N 2.83Å; T29-E32 VanDerWaalsContact OG1-CB 3.3Å; T29-E32 WeakPolarHBondContact OG1-CB 3.45Å; T29-E32 VanDerWaalsContact OG1-CG 3.23Å; T29-E32 WeakPolarHBondContact OG1-CG 3.49Å; T29-E32 PolarHBondContact OG1-OE1 2.8Å; T29-L33 WeakPolarHBondContact O-CB 3.39Å; T29-L33 PolarHBondContact O-N 3.48Å
30	Y	93.7	Very high	94.3	Very high	69 Å²	69	67.5 Å²	67.5	27%	0.271	33%	0.329	S	S	.	.	H	α-helix	trans	-63.2	-44.7	178.2	175.9	-94.1	0	0	0	111.2	E5 V6 A9 L33 I34	E5-Y30 HydrophobicContact CG-CD2 3.89Å; E5-Y30 HydrophobicContact CG-CE2 3.72Å; V6-Y30 HydrophobicContact CG2-CD2 4.07Å; V6-Y30 HydrophobicContact CG2-CE2 3.94Å; A9-Y30 VanDerWaalsContact CB-OH 3.28Å; A9-Y30 WeakPolarHBondContact CB-OH 3.24Å; Y30-L33 PolarHBondContact O-N 2.85Å; Y30-I34 HydrophobicContact CD1-CG1 4.05Å; Y30-I34 HydrophobicContact CD2-CG1 4.35Å; Y30-I34 HydrophobicContact CE1-CD1 4.3Å; Y30-I34 HydrophobicContact CE1-CG1 3.69Å; Y30-I34 HydrophobicContact CE2-CD1 3.93Å; Y30-I34 HydrophobicContact CE2-CG1 3.99Å; Y30-I34 HydrophobicContact CG-CG1 4.37Å; Y30-I34 VanDerWaalsContact O-CG1 3.24Å; Y30-I34 WeakPolarHBondContact O-CG1 3.44Å; Y30-I34 PolarHBondContact O-N 3.18Å
31	D	94.1	Very high	94.4	Very high	116 Å²	116	62.5 Å²	62.5	62%	0.62	31%	0.306	S	S	*	.	H	α-helix	trans	-68.1	-39.2	-174.9	-63	-35.4	0	0	0	113.5	I34 T35	D31-I34 PolarHBondContact O-N 3.42Å; D31-T35 WeakPolarHBondContact O-CB 3.27Å; D31-T35 PolarHBondContact O-N 3.05Å; D31-T35 PolarHBondContact O-OG1 3.12Å
32	E	95.3	Very high	94.5	Very high	60 Å²	60	62.6 Å²	62.6	28%	0.28	31%	0.307	S	S	.	.	H	α-helix	trans	-62.9	-44.7	173	-76.9	165.6	-134.9	0	0	111.1	T25 E26 H27 T29 I34 T35 L36	T25-E32 HydrophobicContact CG2-CB 3.9Å; E26-E32 PolarHBondContact N-OE2 3.41Å; H27-E32 WeakPolarHBondContact CB-OE1 3.43Å; H27-E32 IonicContact CD2-OE1 3.18Å; H27-E32 PolarHBondContact CD2-OE1 3Å; H27-E32 IonicContact CG-OE1 3.63Å; H27-E32 PolarHBondContact N-OE2 2.82Å; H27-E32 VanDerWaalsContact N-OE2 3.12Å; T29-E32 VanDerWaalsContact OG1-CB 3.3Å; T29-E32 WeakPolarHBondContact OG1-CB 3.45Å; T29-E32 VanDerWaalsContact OG1-CG 3.23Å; T29-E32 WeakPolarHBondContact OG1-CG 3.49Å; T29-E32 PolarHBondContact OG1-OE1 2.8Å; E32-I34 PolarHBondContact O-N 3.2Å; E32-T35 PolarHBondContact O-N 2.91Å; E32-L36 WeakPolarHBondContact O-CB 3.48Å; E32-L36 PolarHBondContact O-N 3.43Å
33	L	96.2	Very high	94.6	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.2	-45.2	178.1	179.2	63.9	0	0	0	111.1	V6 F18 L22 T25 T29 Y30 T35 L36 L37	V6-L33 HydrophobicContact CG2-CD2 3.84Å; F18-L33 HydrophobicContact CD2-CD2 4.05Å; F18-L33 HydrophobicContact CE2-CD2 3.69Å; L22-L33 HydrophobicContact CD1-CD2 4.19Å; T25-L33 HydrophobicContact CG2-CB 4.33Å; T29-L33 WeakPolarHBondContact O-CB 3.39Å; T29-L33 PolarHBondContact O-N 3.48Å; Y30-L33 PolarHBondContact O-N 2.85Å; L33-T35 VanDerWaalsContact C-N 3.33Å; L33-T35 PolarHBondContact O-N 2.97Å; L33-L36 PolarHBondContact O-N 2.63Å; L33-L37 HydrophobicContact CD1-CD1 4.3Å; L33-L37 HydrophobicContact CD1-CG 4.28Å; L33-L37 HydrophobicContact CG-CD1 4.03Å; L33-L37 HydrophobicContact CG-CG 4.44Å; L33-L37 VanDerWaalsContact O-CG 3.23Å; L33-L37 WeakPolarHBondContact O-CG 3.38Å; L33-L37 PolarHBondContact O-N 3.19Å
34	I	96.1	Very high	94.6	Very high	26 Å²	26	66.4 Å²	66.4	13%	0.133	32%	0.321	C	S	.	.	H	α-helix	trans	-64.1	-40.5	179.2	-63.4	-68.7	0	0	0	111	W11 Y30 D31 E32 L37 L38	W11-I34 HydrophobicContact CZ2-CG2 4.46Å; Y30-I34 HydrophobicContact CD1-CG1 4.05Å; Y30-I34 HydrophobicContact CD2-CG1 4.35Å; Y30-I34 HydrophobicContact CE1-CD1 4.3Å; Y30-I34 HydrophobicContact CE1-CG1 3.69Å; Y30-I34 HydrophobicContact CE2-CD1 3.93Å; Y30-I34 HydrophobicContact CE2-CG1 3.99Å; Y30-I34 HydrophobicContact CG-CG1 4.37Å; Y30-I34 VanDerWaalsContact O-CG1 3.24Å; Y30-I34 WeakPolarHBondContact O-CG1 3.44Å; Y30-I34 PolarHBondContact O-N 3.18Å; D31-I34 PolarHBondContact O-N 3.42Å; E32-I34 PolarHBondContact O-N 3.2Å; I34-L37 PolarHBondContact O-N 3.06Å; I34-L38 HydrophobicContact CG2-CD1 4.12Å; I34-L38 HydrophobicContact CG2-CG 4.38Å; I34-L38 WeakPolarHBondContact O-CB 3.38Å; I34-L38 VanDerWaalsContact O-CG 3.28Å; I34-L38 WeakPolarHBondContact O-CG 3.27Å; I34-L38 PolarHBondContact O-N 2.98Å
35	T	96	Very high	94.7	Very high	77 Å²	77	60.4 Å²	60.4	47%	0.472	30%	0.295	S	S	.	.	H	α-helix	trans	-65.6	-39.7	177.1	-61.6	0	0	0	0	111.4	D31 E32 L33 L38 N39	D31-T35 WeakPolarHBondContact O-CB 3.27Å; D31-T35 PolarHBondContact O-N 3.05Å; D31-T35 PolarHBondContact O-OG1 3.12Å; E32-T35 PolarHBondContact O-N 2.91Å; L33-T35 VanDerWaalsContact C-N 3.33Å; L33-T35 PolarHBondContact O-N 2.97Å; T35-L38 PolarHBondContact O-N 3.18Å; T35-N39 PolarHBondContact O-N 3.34Å; T35-N39 PolarHBondContact O-ND2 2.97Å
36	L	96.5	Very high	94.7	Very high	50 Å²	50	60.6 Å²	60.6	26%	0.262	30%	0.299	S	S	.	.	H	α-helix	trans	-62.7	-45.8	173.7	-177.3	64	0	0	0	111.4	Y21 K24 T25 E32 L33 N39 S40	Y21-L36 HydrophobicContact CD1-CD2 3.69Å; Y21-L36 HydrophobicContact CD1-CG 3.97Å; Y21-L36 HydrophobicContact CE1-CD2 4.41Å; Y21-L36 HydrophobicContact CE1-CG 4.35Å; Y21-L36 HydrophobicContact CG-CD2 4.49Å; K24-L36 HydrophobicContact CB-CD2 3.78Å; K24-L36 HydrophobicContact CD-CD2 4.36Å; T25-L36 HydrophobicContact CG2-CD2 4.14Å; E32-L36 WeakPolarHBondContact O-CB 3.48Å; E32-L36 PolarHBondContact O-N 3.43Å; L33-L36 PolarHBondContact O-N 2.63Å; L36-N39 CarbonylContact O-C 3.58Å; L36-N39 PolarHBondContact O-N 2.89Å; L36-S40 WeakPolarHBondContact O-CB 3.4Å; L36-S40 PolarHBondContact O-N 3.37Å; L36-S40 VanDerWaalsContact O-N 3.08Å; L36-S40 PolarHBondContact O-OG 3.05Å
37	L	96.9	Very high	94.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-41	177.8	-67.3	171.1	0	0	0	112	V6 W11 L13 Y21 L33 I34 N39 S40 Y45 K128	V6-L37 HydrophobicContact CG1-CD1 4.27Å; W11-L37 HydrophobicContact CD2-CB 4.33Å; W11-L37 HydrophobicContact CD2-CD1 4.05Å; W11-L37 HydrophobicContact CE3-CB 4.15Å; W11-L37 HydrophobicContact CE3-CD1 4.38Å; W11-L37 HydrophobicContact CG-CD1 4.2Å; W11-L37 HydrophobicContact CH2-CB 3.81Å; W11-L37 HydrophobicContact CZ2-CB 4.02Å; W11-L37 HydrophobicContact CZ3-CB 3.93Å; L13-L37 HydrophobicContact CD1-CD1 3.99Å; L13-L37 HydrophobicContact CD1-CD2 4.45Å; L13-L37 HydrophobicContact CD2-CD2 4.14Å; Y21-L37 HydrophobicContact CD1-CD2 3.96Å; Y21-L37 HydrophobicContact CE1-CD2 4.39Å; Y21-L37 HydrophobicContact CG-CD2 4.41Å; L33-L37 HydrophobicContact CD1-CD1 4.3Å; L33-L37 HydrophobicContact CD1-CG 4.28Å; L33-L37 HydrophobicContact CG-CD1 4.03Å; L33-L37 HydrophobicContact CG-CG 4.44Å; L33-L37 VanDerWaalsContact O-CG 3.23Å; L33-L37 WeakPolarHBondContact O-CG 3.38Å; L33-L37 PolarHBondContact O-N 3.19Å; I34-L37 PolarHBondContact O-N 3.06Å; L37-N39 PolarHBondContact O-N 3.27Å; L37-S40 PolarHBondContact O-N 3.05Å; L37-Y45 HydrophobicContact CD2-CD1 4.2Å; L37-Y45 HydrophobicContact CD2-CD2 3.75Å; L37-Y45 HydrophobicContact CD2-CE1 4.14Å; L37-Y45 HydrophobicContact CD2-CE2 3.64Å; L37-Y45 HydrophobicContact CD2-CG 3.99Å; L37-Y45 PolarHBondContact O-OH 3.04Å; L37-K128 WeakPolarHBondContact O-CE 3.44Å
38	L	97.2	Very high	95.1	Very high	33 Å²	33	51.6 Å²	51.6	17%	0.173	27%	0.269	C	S	.	.	H	α-helix	trans	-56.8	-40	175.6	-77.6	170.8	0	0	0	111.7	W11 I34 T35 K128 L152 G154	W11-L38 HydrophobicContact CH2-CD2 3.94Å; W11-L38 HydrophobicContact CH2-CG 4.19Å; W11-L38 HydrophobicContact CZ2-CD2 3.9Å; W11-L38 HydrophobicContact CZ2-CG 4Å; I34-L38 HydrophobicContact CG2-CD1 4.12Å; I34-L38 HydrophobicContact CG2-CG 4.38Å; I34-L38 WeakPolarHBondContact O-CB 3.38Å; I34-L38 VanDerWaalsContact O-CG 3.28Å; I34-L38 WeakPolarHBondContact O-CG 3.27Å; I34-L38 PolarHBondContact O-N 2.98Å; T35-L38 PolarHBondContact O-N 3.18Å; L38-K128 HydrophobicContact CD2-CB 4.02Å; L38-K128 HydrophobicContact CD2-CG 3.99Å; L38-K128 PolarHBondContact O-NZ 3.28Å; L38-L152 HydrophobicContact CD2-CB 3.89Å; L38-G154 VanDerWaalsContact O-CA 3.29Å; L38-G154 WeakPolarHBondContact O-CA 3.45Å
39	N	97.4	Very high	95.2	Very high	67 Å²	67	48.5 Å²	48.5	36%	0.358	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	6.5	-175.4	-62.9	-44.2	0	0	0	114.9	T35 L36 L37 T155	T35-N39 PolarHBondContact O-N 3.34Å; T35-N39 PolarHBondContact O-ND2 2.97Å; L36-N39 CarbonylContact O-C 3.58Å; L36-N39 PolarHBondContact O-N 2.89Å; L37-N39 PolarHBondContact O-N 3.27Å; N39-T155 CarbonylContact C-O 3.56Å; N39-T155 WeakPolarHBondContact CA-O 2.97Å; N39-T155 PolarHBondContact OD1-N 2.83Å; N39-T155 PolarHBondContact OD1-OG1 3.08Å
40	S	96.8	Very high	95.2	Very high	18 Å²	18	46.4 Å²	46.4	13%	0.126	24%	0.239	C	C	.	.	S	Bend	trans	-108.3	157.3	176.5	-59.1	0	0	0	0	110.9	L36 L37 K128	L36-S40 WeakPolarHBondContact O-CB 3.4Å; L36-S40 PolarHBondContact O-N 3.37Å; L36-S40 VanDerWaalsContact O-N 3.08Å; L36-S40 PolarHBondContact O-OG 3.05Å; L37-S40 PolarHBondContact O-N 3.05Å; S40-K128 WeakPolarHBondContact O-CE 3.3Å; S40-K128 PolarHBondContact O-NZ 3.38Å
41	D	97.1	Very high	94.3	Very high	8 Å²	8	45 Å²	45	4%	0.043	25%	0.246	C	C	.	.			trans	-77.2	126.2	175.8	-165.1	-38.1	0	0	0	110.3	R43 E44 Y45 Q67 V156	D41-R43 PolarHBondContact O-N 3.22Å; D41-R43 WeakPolarHBondContact OD1-CB 3.4Å; D41-R43 WeakPolarHBondContact OD1-CG 3.49Å; D41-R43 PolarHBondContact OD1-N 2.91Å; D41-R43 IonicContact OD1-NE 3.32Å; D41-R43 PolarHBondContact OD1-NE 2.9Å; D41-R43 VanDerWaalsContact OD1-NE 3.13Å; D41-R43 IonicContact OD2-CZ 3.38Å; D41-R43 VanDerWaalsContact OD2-CZ 3.27Å; D41-R43 IonicContact OD2-NE 3.74Å; D41-R43 PolarHBondContact OD2-NE 3.12Å; D41-R43 VanDerWaalsContact OD2-NE 3.08Å; D41-R43 IonicContact OD2-NH2 3.8Å; D41-R43 PolarHBondContact OD2-NH2 3.21Å; D41-E44 HydrophobicContact CB-CG 4.28Å; D41-E44 WeakPolarHBondContact O-CB 3.32Å; D41-E44 PolarHBondContact O-N 2.98Å; D41-Y45 VanDerWaalsContact O-CD1 3.27Å; D41-Y45 WeakPolarHBondContact O-CD1 3.39Å; D41-Y45 WeakPolarHBondContact O-CE1 3.39Å; D41-Q67 VanDerWaalsContact CG-NE2 3.3Å; D41-Q67 PolarHBondContact OD1-NE2 2.91Å; D41-V156 HydrophobicContact CB-CG1 3.94Å
42	I	97.3	Very high	93	Very high	7 Å²	7	47 Å²	47	4%	0.036	26%	0.257	C	S	.	.	H	α-helix	trans	-54.4	-29.1	178.8	-63.2	-172.7	0	0	0	111.7	E44 Y45 G46 I65 Q67 D103 K128	I42-E44 PolarHBondContact O-N 3.41Å; I42-E44 VanDerWaalsContact O-N 3.09Å; I42-Y45 HydrophobicContact CG1-CE1 4.49Å; I42-Y45 HydrophobicContact CG1-CE2 4.28Å; I42-Y45 WeakPolarHBondContact CG1-OH 3.37Å; I42-Y45 PolarHBondContact O-N 3Å; I42-G46 WeakPolarHBondContact O-CA 3.42Å; I42-G46 PolarHBondContact O-N 3.44Å; I42-I65 HydrophobicContact CD1-CG2 4.32Å; I42-Q67 HydrophobicContact CB-CB 4.24Å; I42-Q67 HydrophobicContact CD1-CB 3.49Å; I42-Q67 VanDerWaalsContact CD1-CB 3.49Å; I42-Q67 HydrophobicContact CG1-CB 3.73Å; I42-D103 VanDerWaalsContact CG2-O 3.28Å; I42-D103 WeakPolarHBondContact CG2-O 3.41Å; I42-K128 HydrophobicContact CD1-CD 3.86Å; I42-K128 HydrophobicContact CG1-CD 3.94Å
43	R	95.6	Very high	92.1	Very high	144 Å²	144	45.9 Å²	45.9	54%	0.543	25%	0.253	S	S	.	.	H	α-helix	trans	-60.2	-20.5	178	-64.3	178	-71.4	178.1	2.8	113.8	D41	D41-R43 PolarHBondContact O-N 3.22Å; D41-R43 WeakPolarHBondContact OD1-CB 3.4Å; D41-R43 WeakPolarHBondContact OD1-CG 3.49Å; D41-R43 PolarHBondContact OD1-N 2.91Å; D41-R43 IonicContact OD1-NE 3.32Å; D41-R43 PolarHBondContact OD1-NE 2.9Å; D41-R43 VanDerWaalsContact OD1-NE 3.13Å; D41-R43 IonicContact OD2-CZ 3.38Å; D41-R43 VanDerWaalsContact OD2-CZ 3.27Å; D41-R43 IonicContact OD2-NE 3.74Å; D41-R43 PolarHBondContact OD2-NE 3.12Å; D41-R43 VanDerWaalsContact OD2-NE 3.08Å; D41-R43 IonicContact OD2-NH2 3.8Å; D41-R43 PolarHBondContact OD2-NH2 3.21Å
44	E	95	Very high	90.6	Very high	116 Å²	116	55.7 Å²	55.7	54%	0.542	30%	0.295	S	S	.	.	H	α-helix	trans	-87.1	-24.3	-179.3	-63.1	177.8	-168.4	0	0	113.4	Y21 D41 I42	Y21-E44 PolarHBondContact OH-OE2 3.39Å; D41-E44 HydrophobicContact CB-CG 4.28Å; D41-E44 WeakPolarHBondContact O-CB 3.32Å; D41-E44 PolarHBondContact O-N 2.98Å; I42-E44 PolarHBondContact O-N 3.41Å; I42-E44 VanDerWaalsContact O-N 3.09Å
45	Y	94.6	Very high	89.4	Confident	5 Å²	5	64.6 Å²	64.6	2%	0.02	33%	0.333	C	S	.	.	H	α-helix	trans	-134.7	-19.8	-170.8	63.7	-102.5	0	0	0	115.5	W11 L13 T17 Y21 L37 D41 I42 K128	W11-Y45 HydrophobicContact CE3-CE2 4.14Å; W11-Y45 HydrophobicContact CZ3-CE2 4.26Å; W11-Y45 WeakPolarHBondContact CZ3-OH 3.26Å; L13-Y45 HydrophobicContact CD2-CD2 3.39Å; L13-Y45 HydrophobicContact CD2-CE2 4.17Å; L13-Y45 HydrophobicContact CD2-CG 4.14Å; T17-Y45 PolarHBondContact OG1-O 3.43Å; T17-Y45 VanDerWaalsContact OG1-O 3.06Å; Y21-Y45 HydrophobicContact CE1-CD1 4.02Å; Y21-Y45 HydrophobicContact CE1-CG 4.45Å; Y21-Y45 VanDerWaalsContact CE2-CB 3.45Å; Y21-Y45 HydrophobicContact CE2-CD1 4.49Å; Y21-Y45 HydrophobicContact CE2-CG 4.36Å; Y21-Y45 AromaticContact CZ-CD1 3.78Å; L37-Y45 HydrophobicContact CD2-CD1 4.2Å; L37-Y45 HydrophobicContact CD2-CD2 3.75Å; L37-Y45 HydrophobicContact CD2-CE1 4.14Å; L37-Y45 HydrophobicContact CD2-CE2 3.64Å; L37-Y45 HydrophobicContact CD2-CG 3.99Å; L37-Y45 PolarHBondContact O-OH 3.04Å; D41-Y45 VanDerWaalsContact O-CD1 3.27Å; D41-Y45 WeakPolarHBondContact O-CD1 3.39Å; D41-Y45 WeakPolarHBondContact O-CE1 3.39Å; I42-Y45 HydrophobicContact CG1-CE1 4.49Å; I42-Y45 HydrophobicContact CG1-CE2 4.28Å; I42-Y45 WeakPolarHBondContact CG1-OH 3.37Å; I42-Y45 PolarHBondContact O-N 3Å; Y45-K128 VanDerWaalsContact OH-CE 3.3Å; Y45-K128 WeakPolarHBondContact OH-CE 3.31Å
46	G	93.2	Very high	88.9	Confident	20 Å²	20	62.6 Å²	62.6	21%	0.206	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-70.8	133.1	-169.8	0	0	0	0	0	112.6	S12 I42	S12-G46 WeakPolarHBondContact O-CA 3.23Å; I42-G46 WeakPolarHBondContact O-CA 3.42Å; I42-G46 PolarHBondContact O-N 3.44Å
47	S	93.8	Very high	88.6	Confident	49 Å²	49	64.7 Å²	64.7	34%	0.343	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-82.6	124.9	164.3	-174.2	0	0	0	0	108.9	S12	S12-S47 WeakPolarHBondContact CB-O 3.26Å; S12-S47 PolarHBondContact O-N 2.94Å
48	P	92.9	Very high	88.3	Confident	64 Å²	64	68 Å²	68	42%	0.416	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-66.1	143.5	-177.9	28.7	-35.4	0	0	0	111.4	D103 R105	P48-D103 WeakPolarHBondContact CA-OD2 3.3Å; P48-R105 HydrophobicContact CB-CB 3.84Å; P48-R105 HydrophobicContact CG-CB 4.4Å
49	W	92.4	Very high	88.1	Confident	37 Å²	37	66.7 Å²	66.7	14%	0.14	35%	0.351	C	S	.	.			trans	-142.8	-8.1	-177.3	70.9	-94.8	0	0	0	114.4	G51 L59 A61 R64 I65 V66 D103 L131	W49-G51 VanDerWaalsContact C-N 3.34Å; W49-L59 HydrophobicContact CH2-CD1 4.38Å; W49-L59 HydrophobicContact CH2-CD2 4.24Å; W49-L59 HydrophobicContact CZ3-CD1 3.81Å; W49-L59 HydrophobicContact CZ3-CD2 4.47Å; W49-L59 HydrophobicContact CZ3-CG 4.43Å; W49-A61 HydrophobicContact CH2-CB 4.5Å; W49-R64 HydrophobicContact CD2-CB 4.22Å; W49-R64 VanDerWaalsContact CD2-CD 3.46Å; W49-R64 HydrophobicContact CD2-CG 4.49Å; W49-R64 HydrophobicContact CH2-CB 3.83Å; W49-R64 HydrophobicContact CZ2-CB 3.45Å; W49-R64 VanDerWaalsContact CZ2-CB 3.45Å; W49-R64 HydrophobicContact CZ2-CG 4.49Å; W49-R64 HydrophobicContact CZ3-CB 4.34Å; W49-I65 PolarHBondContact NE1-O 2.96Å; W49-V66 HydrophobicContact CZ2-CG1 3.68Å; W49-D103 HydrophobicContact CG-CB 4.37Å; W49-D103 PolarHBondContact N-OD2 2.7Å; W49-L131 HydrophobicContact CH2-CD1 4.49Å
50	L	91.7	Very high	87.8	Confident	8 Å²	8	68.4 Å²	68.4	4%	0.042	36%	0.358	C	S	.	.			trans	-86.8	3.5	177.1	-62.9	169.4	0	0	0	113.6	D52 L53 L59 D103 N106 I108	L50-D52 VanDerWaalsContact C-N 3.27Å; L50-D52 PolarHBondContact O-N 3.35Å; L50-D52 VanDerWaalsContact O-N 3.07Å; L50-L53 HydrophobicContact CB-CD1 4.02Å; L50-L53 HydrophobicContact CD2-CD1 3.84Å; L50-L53 WeakPolarHBondContact O-CD1 3.47Å; L50-L53 WeakPolarHBondContact O-CG 3.47Å; L50-L59 HydrophobicContact CD2-CD1 4.18Å; L50-L59 HydrophobicContact CD2-CD2 4.35Å; L50-D103 WeakPolarHBondContact CB-OD2 3.37Å; L50-D103 HydrophobicContact CD1-CB 3.72Å; L50-D103 HydrophobicContact CG-CB 3.89Å; L50-D103 PolarHBondContact N-OD2 2.75Å; L50-N106 HydrophobicContact CB-CB 3.87Å; L50-N106 HydrophobicContact CD1-CB 4.47Å; L50-I108 HydrophobicContact CD1-CB 4.21Å; L50-I108 HydrophobicContact CD1-CG2 3.74Å; L50-I108 HydrophobicContact CD2-CD1 4.38Å; L50-I108 HydrophobicContact CD2-CG2 4.23Å
51	G	75.2	Confident	87.5	Confident	40 Å²	40	67.6 Å²	67.6	41%	0.412	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.6	-163.8	0	0	0	0	0	117	W49 N106	W49-G51 VanDerWaalsContact C-N 3.34Å; G51-N106 PolarHBondContact N-ND2 2.88Å
52	D	66.5	Low	87.1	Confident	159 Å²	159	72.8 Å²	72.8	85%	0.85	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	47.3	-169.6	-69.8	-30.9	0	0	0	114.4	L50	L50-D52 VanDerWaalsContact C-N 3.27Å; L50-D52 PolarHBondContact O-N 3.35Å; L50-D52 VanDerWaalsContact O-N 3.07Å
53	L	75.7	Confident	86.9	Confident	36 Å²	36	73.2 Å²	73.2	19%	0.188	39%	0.386	C	S	.	.			trans	-95.2	-5.1	-178	-63.7	171.5	0	0	0	115.1	L50 K55 A56 L59 I108 L137	L50-L53 HydrophobicContact CB-CD1 4.02Å; L50-L53 HydrophobicContact CD2-CD1 3.84Å; L50-L53 WeakPolarHBondContact O-CD1 3.47Å; L50-L53 WeakPolarHBondContact O-CG 3.47Å; L53-K55 PolarHBondContact O-N 3.14Å; L53-A56 HydrophobicContact CD2-CB 4.36Å; L53-A56 PolarHBondContact O-N 3.13Å; L53-A56 VanDerWaalsContact O-N 3.13Å; L53-L59 HydrophobicContact CD1-CD1 3.86Å; L53-L59 HydrophobicContact CD2-CB 4.46Å; L53-L59 HydrophobicContact CD2-CD1 3.39Å; L53-L59 HydrophobicContact CG-CD1 4.25Å; L53-I108 HydrophobicContact CD1-CD1 3.49Å; L53-I108 VanDerWaalsContact CD1-CD1 3.49Å; L53-L137 HydrophobicContact CB-CD2 3.97Å; L53-L137 WeakPolarHBondContact O-CD2 3.21Å
54	K	64.9	Low	86.9	Confident	206 Å²	206	70.6 Å²	70.6	90%	0.896	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.6	-170.8	-64.3	-177.6	-178.9	177.6	0	114.6
55	K	71.8	Confident	87	Confident	212 Å²	212	65.4 Å²	65.4	92%	0.922	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	2.5	-179.3	-62.9	-177	-179.4	178.2	0	113.5	L53	L53-K55 PolarHBondContact O-N 3.14Å
56	A	84.1	Confident	87.1	Confident	36 Å²	36	65.1 Å²	65.1	30%	0.298	35%	0.351	S	S	.	.			trans	-85.1	137.4	-174.1	0	0	0	0	0	110.7	L53 H58 L137	L53-A56 HydrophobicContact CD2-CB 4.36Å; L53-A56 PolarHBondContact O-N 3.13Å; L53-A56 VanDerWaalsContact O-N 3.13Å; A56-H58 VanDerWaalsContact C-N 3.32Å; A56-H58 WeakPolarHBondContact CB-O 3.42Å; A56-L137 HydrophobicContact CB-CD2 4.31Å; A56-L137 WeakPolarHBondContact O-CD2 3.45Å
57	S	90.3	Very high	87.4	Confident	93 Å²	93	64.2 Å²	64.2	65%	0.65	34%	0.341	S	S	*	.	S	Bend	trans	-85.2	-12.3	166.8	55.3	0	0	0	0	112.4	L137	S57-L137 PolarHBondContact O-N 2.8Å
58	H	92.1	Very high	87.5	Confident	70 Å²	70	61.9 Å²	61.9	32%	0.324	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	142.4	-175.7	-117.7	-96.1	0	0	0	110.6	A56 S134 I135 P136	A56-H58 VanDerWaalsContact C-N 3.32Å; A56-H58 WeakPolarHBondContact CB-O 3.42Å; H58-S134 PolarHBondContact CE1-O 3.32Å; H58-S134 PolarHBondContact CE1-OG 3.44Å; H58-S134 WeakPolarHBondContact ND1-CB 3.5Å; H58-S134 PolarHBondContact ND1-OG 3.08Å; H58-I135 CarbonylContact C-O 3.38Å; H58-I135 WeakPolarHBondContact CA-O 3.39Å; H58-I135 PolarHBondContact CE1-N 3.4Å; H58-I135 PolarHBondContact ND1-N 2.89Å; H58-I135 PolarHBondContact ND1-O 2.97Å; H58-P136 VanDerWaalsContact CD2-CA 3.48Å; H58-P136 WeakPolarHBondContact CD2-CA 3.44Å; H58-P136 VanDerWaalsContact CE1-CD 3.42Å; H58-P136 WeakPolarHBondContact CE1-CD 3.32Å; H58-P136 WeakPolarHBondContact NE2-CA 3.35Å; H58-P136 WeakPolarHBondContact NE2-CG 3.32Å
59	L	92.5	Very high	87.7	Confident	5 Å²	5	60.3 Å²	60.3	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	115.2	169.3	174.8	70.8	0	0	0	109	W49 L50 L53 A61 I108 L131 S134 I135 L142	W49-L59 HydrophobicContact CH2-CD1 4.38Å; W49-L59 HydrophobicContact CH2-CD2 4.24Å; W49-L59 HydrophobicContact CZ3-CD1 3.81Å; W49-L59 HydrophobicContact CZ3-CD2 4.47Å; W49-L59 HydrophobicContact CZ3-CG 4.43Å; L50-L59 HydrophobicContact CD2-CD1 4.18Å; L50-L59 HydrophobicContact CD2-CD2 4.35Å; L53-L59 HydrophobicContact CD1-CD1 3.86Å; L53-L59 HydrophobicContact CD2-CB 4.46Å; L53-L59 HydrophobicContact CD2-CD1 3.39Å; L53-L59 HydrophobicContact CG-CD1 4.25Å; L59-A61 PolarHBondContact O-N 3.31Å; L59-I108 HydrophobicContact CD2-CD1 4.22Å; L59-L131 HydrophobicContact CD2-CD1 4.1Å; L59-S134 WeakPolarHBondContact O-CA 3.23Å; L59-I135 HydrophobicContact CB-CB 4.48Å; L59-I135 PolarHBondContact N-O 3.48Å; L59-I135 PolarHBondContact O-N 3.23Å; L59-L142 HydrophobicContact CB-CD2 3.55Å; L59-L142 HydrophobicContact CD2-CD1 3.68Å; L59-L142 HydrophobicContact CD2-CD2 3.6Å; L59-L142 HydrophobicContact CD2-CG 4.26Å; L59-L142 HydrophobicContact CG-CD2 4.21Å
60	E	91.6	Very high	87.8	Confident	104 Å²	104	63.9 Å²	63.9	49%	0.486	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	95.3	167	-67	-59.1	157.3	0	0	109.4	S134	E60-S134 VanDerWaalsContact OE1-CB 3.24Å; E60-S134 WeakPolarHBondContact OE1-CB 3.5Å; E60-S134 PolarHBondContact OE1-OG 2.95Å; E60-S134 WeakPolarHBondContact OE2-CB 3.36Å; E60-S134 PolarHBondContact OE2-OG 3.26Å
61	A	89.8	Confident	87.9	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.33	C	S	.	.			trans	-77.7	-27.8	-172.9	0	0	0	0	0	113.1	W49 L59 G63 R64 L131 G133 I135	W49-A61 HydrophobicContact CH2-CB 4.5Å; L59-A61 PolarHBondContact O-N 3.31Å; A61-G63 PolarHBondContact O-N 3.11Å; A61-R64 VanDerWaalsContact O-CB 3.24Å; A61-R64 WeakPolarHBondContact O-CB 3.3Å; A61-R64 VanDerWaalsContact O-CG 3.28Å; A61-R64 WeakPolarHBondContact O-CG 3.37Å; A61-R64 PolarHBondContact O-N 2.75Å; A61-L131 HydrophobicContact CB-CB 3.5Å; A61-L131 WeakPolarHBondContact CB-O 3.46Å; A61-G133 WeakPolarHBondContact CB-O 3.37Å; A61-G133 PolarHBondContact N-O 3.47Å; A61-I135 HydrophobicContact CB-CD1 4.13Å
62	N	88.9	Confident	88.6	Confident	117 Å²	117	64.5 Å²	64.5	63%	0.626	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	31.7	178.6	-65.7	-20.6	0	0	0	114.8	R64	N62-R64 VanDerWaalsContact C-N 3.31Å; N62-R64 PolarHBondContact O-N 2.73Å
63	G	93.4	Very high	89.8	Confident	17 Å²	17	57.6 Å²	57.6	18%	0.175	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	77	12.8	-179	0	0	0	0	0	114.4	G10 A61 R130 L131	G10-G63 VanDerWaalsContact CA-O 3.31Å; G10-G63 WeakPolarHBondContact CA-O 3.4Å; A61-G63 PolarHBondContact O-N 3.11Å; G63-R130 WeakPolarHBondContact O-CD 3.48Å; G63-R130 WeakPolarHBondContact O-CG 3.37Å; G63-L131 CarbonylContact C-O 3.58Å; G63-L131 WeakPolarHBondContact CA-O 3.49Å; G63-L131 PolarHBondContact N-O 3.39Å; G63-L131 VanDerWaalsContact N-O 3.07Å
64	R	95.1	Very high	90.5	Very high	89 Å²	89	58.5 Å²	58.5	34%	0.336	29%	0.286	S	S	.	.			trans	-73	153.1	-178.2	-69.5	179.4	180	167.8	-1.6	112.7	G10 W49 A61 N62 L131	G10-R64 WeakPolarHBondContact O-CA 3.38Å; W49-R64 HydrophobicContact CD2-CB 4.22Å; W49-R64 VanDerWaalsContact CD2-CD 3.46Å; W49-R64 HydrophobicContact CD2-CG 4.49Å; W49-R64 HydrophobicContact CH2-CB 3.83Å; W49-R64 HydrophobicContact CZ2-CB 3.45Å; W49-R64 VanDerWaalsContact CZ2-CB 3.45Å; W49-R64 HydrophobicContact CZ2-CG 4.49Å; W49-R64 HydrophobicContact CZ3-CB 4.34Å; A61-R64 VanDerWaalsContact O-CB 3.24Å; A61-R64 WeakPolarHBondContact O-CB 3.3Å; A61-R64 VanDerWaalsContact O-CG 3.28Å; A61-R64 WeakPolarHBondContact O-CG 3.37Å; A61-R64 PolarHBondContact O-N 2.75Å; N62-R64 VanDerWaalsContact C-N 3.31Å; N62-R64 PolarHBondContact O-N 2.73Å; R64-L131 PolarHBondContact N-O 3.2Å; R64-L131 PolarHBondContact O-N 3.03Å
65	I	97.1	Very high	91.7	Very high	6 Å²	6	50.8 Å²	50.8	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	141	-175	-63.3	168.4	0	0	0	110.8	G10 W11 I42 W49 K128 F129 R130 L152	G10-I65 PolarHBondContact O-N 3.29Å; W11-I65 HydrophobicContact CD2-CD1 3.41Å; W11-I65 VanDerWaalsContact CD2-CD1 3.41Å; W11-I65 HydrophobicContact CE3-CB 4.39Å; W11-I65 HydrophobicContact CE3-CD1 3.86Å; W11-I65 HydrophobicContact CE3-CG2 4.19Å; W11-I65 HydrophobicContact CG-CD1 3.74Å; W11-I65 HydrophobicContact CH2-CD1 4.27Å; W11-I65 HydrophobicContact CH2-CG2 4.33Å; W11-I65 HydrophobicContact CZ2-CD1 3.85Å; W11-I65 HydrophobicContact CZ3-CD1 4.22Å; W11-I65 HydrophobicContact CZ3-CG2 3.89Å; I42-I65 HydrophobicContact CD1-CG2 4.32Å; W49-I65 PolarHBondContact NE1-O 2.96Å; I65-K128 HydrophobicContact CG2-CB 4.11Å; I65-K128 HydrophobicContact CG2-CD 4.42Å; I65-F129 CarbonylContact C-O 3.58Å; I65-F129 VanDerWaalsContact CA-O 3.3Å; I65-F129 WeakPolarHBondContact CA-O 3.28Å; I65-R130 HydrophobicContact CG1-CB 4.48Å; I65-R130 HydrophobicContact CG1-CG 4.35Å; I65-L152 HydrophobicContact CD1-CD1 3.52Å; I65-L152 HydrophobicContact CG1-CD1 3.73Å; I65-L152 HydrophobicContact CG2-CD1 4.31Å
66	V	97	Very high	92.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	158.8	171.5	-61.7	0	0	0	0	110.2	W49 F101 T102 K128 F129 L131	W49-V66 HydrophobicContact CZ2-CG1 3.68Å; V66-F101 HydrophobicContact CB-CB 3.98Å; V66-F101 HydrophobicContact CB-CD1 4.37Å; V66-F101 HydrophobicContact CB-CG 4.29Å; V66-F101 HydrophobicContact CG2-CB 3.86Å; V66-F101 HydrophobicContact CG2-CD1 3.54Å; V66-F101 HydrophobicContact CG2-CD2 4.22Å; V66-F101 HydrophobicContact CG2-CE1 4.1Å; V66-F101 HydrophobicContact CG2-CG 3.61Å; V66-T102 WeakPolarHBondContact CA-O 3.32Å; V66-K128 WeakPolarHBondContact O-CA 3.45Å; V66-F129 HydrophobicContact CG2-CB 4.05Å; V66-F129 PolarHBondContact N-O 3.23Å; V66-F129 PolarHBondContact O-N 3.17Å; V66-L131 HydrophobicContact CG1-CD1 3.89Å; V66-L131 HydrophobicContact CG1-CG 4.48Å; V66-L131 HydrophobicContact CG2-CD1 3.99Å; V66-L131 HydrophobicContact CG2-CD2 4.45Å; V66-L131 HydrophobicContact CG2-CG 3.99Å
67	Q	98.1	Very high	92.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.3	175.1	177.9	173.4	-67.9	0	0	110.6	D41 I42 T69 F101 T102 K128	D41-Q67 VanDerWaalsContact CG-NE2 3.3Å; D41-Q67 PolarHBondContact OD1-NE2 2.91Å; I42-Q67 HydrophobicContact CB-CB 4.24Å; I42-Q67 HydrophobicContact CD1-CB 3.49Å; I42-Q67 VanDerWaalsContact CD1-CB 3.49Å; I42-Q67 HydrophobicContact CG1-CB 3.73Å; Q67-T69 PolarHBondContact O-N 3.47Å; Q67-F101 CarbonylContact O-C 3.58Å; Q67-F101 VanDerWaalsContact O-CA 3.27Å; Q67-F101 WeakPolarHBondContact O-CA 3.37Å; Q67-T102 HydrophobicContact CB-CG2 4.02Å; Q67-T102 PolarHBondContact N-O 3.34Å; Q67-T102 PolarHBondContact O-N 3.43Å; Q67-K128 HydrophobicContact CB-CD 4.13Å; Q67-K128 HydrophobicContact CG-CD 4.43Å
68	L	97.8	Very high	92.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	124.9	170.4	-178.5	64.6	0	0	0	110.2	R70 L71 F99 F101 I123 G126 T127 F129	L68-R70 VanDerWaalsContact CD1-O 3.28Å; L68-R70 WeakPolarHBondContact CD1-O 3.26Å; L68-L71 HydrophobicContact CD1-CB 4.3Å; L68-L71 HydrophobicContact CD2-CB 4.16Å; L68-L71 HydrophobicContact CD2-CD2 4.46Å; L68-F99 HydrophobicContact CD1-CB 4.33Å; L68-F99 HydrophobicContact CD1-CD1 3.94Å; L68-F101 HydrophobicContact CB-CD1 4.45Å; L68-F101 HydrophobicContact CB-CE1 4.36Å; L68-F101 HydrophobicContact CD1-CD1 4.35Å; L68-F101 HydrophobicContact CD1-CE1 4.09Å; L68-I123 HydrophobicContact CD2-CB 4.31Å; L68-I123 HydrophobicContact CD2-CG2 3.72Å; L68-G126 PolarHBondContact O-N 2.86Å; L68-T127 WeakPolarHBondContact CB-O 3.28Å; L68-T127 PolarHBondContact N-O 3.34Å; L68-F129 HydrophobicContact CB-CD2 4.12Å; L68-F129 HydrophobicContact CB-CE2 3.71Å; L68-F129 HydrophobicContact CD2-CE2 3.97Å; L68-F129 HydrophobicContact CD2-CZ 4.38Å; L68-F129 HydrophobicContact CG-CE2 4.36Å
69	T	96.2	Very high	91.8	Very high	32 Å²	32	44.4 Å²	44.4	20%	0.196	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-36.5	173.9	57.7	0	0	0	0	111.6	Q67 T100 T102	Q67-T69 PolarHBondContact O-N 3.47Å; T69-T100 PolarHBondContact N-O 2.99Å; T69-T100 WeakPolarHBondContact OG1-CB 2.93Å; T69-T100 VanDerWaalsContact OG1-CG2 3.27Å; T69-T100 WeakPolarHBondContact OG1-CG2 3.35Å; T69-T100 PolarHBondContact OG1-O 3.46Å; T69-T102 HydrophobicContact CG2-CG2 3.47Å; T69-T102 VanDerWaalsContact CG2-CG2 3.47Å
70	R	94.4	Very high	91.3	Very high	112 Å²	112	47 Å²	47	42%	0.423	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	138.8	178.9	-176.2	175.7	177.2	-179.9	0.6	110.4	L68 T100	L68-R70 VanDerWaalsContact CD1-O 3.28Å; L68-R70 WeakPolarHBondContact CD1-O 3.26Å; R70-T100 PolarHBondContact O-N 2.93Å
71	L	93.1	Very high	90.8	Very high	18 Å²	18	42.8 Å²	42.8	9%	0.094	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	139.2	170.5	-172.4	55.5	0	0	0	108.8	L68 L97 F99 N120 I123	L68-L71 HydrophobicContact CD1-CB 4.3Å; L68-L71 HydrophobicContact CD2-CB 4.16Å; L68-L71 HydrophobicContact CD2-CD2 4.46Å; L71-L97 HydrophobicContact CD1-CB 4.08Å; L71-L97 HydrophobicContact CD1-CD1 4.42Å; L71-L97 HydrophobicContact CD1-CD2 4.5Å; L71-F99 HydrophobicContact CD1-CD1 3.57Å; L71-F99 HydrophobicContact CD1-CD2 4.19Å; L71-F99 HydrophobicContact CD1-CE1 3.51Å; L71-F99 HydrophobicContact CD1-CE2 4.12Å; L71-F99 HydrophobicContact CD1-CG 3.9Å; L71-F99 HydrophobicContact CD1-CZ 3.77Å; L71-F99 HydrophobicContact CD2-CE1 4.34Å; L71-N120 WeakPolarHBondContact CD2-O 3.47Å; L71-I123 HydrophobicContact CD2-CB 3.98Å; L71-I123 HydrophobicContact CD2-CD1 4.49Å
72	R	90.8	Very high	90.3	Very high	43 Å²	43	43.9 Å²	43.9	16%	0.162	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	139.3	-179.7	-164.5	-171.1	174.8	-130.9	-19.2	110.7	I74 I76 Q78 E81 L97 R98	R72-I74 HydrophobicContact CB-CG2 4.38Å; R72-I74 HydrophobicContact CG-CG2 4.34Å; R72-I74 PolarHBondContact O-N 3.21Å; R72-I76 PolarHBondContact NH2-O 3.46Å; R72-Q78 VanDerWaalsContact NH2-CA 3.32Å; R72-E81 WeakPolarHBondContact CA-OE1 3.33Å; R72-E81 WeakPolarHBondContact CG-OE1 3.34Å; R72-E81 WeakPolarHBondContact CG-OE2 3.23Å; R72-E81 IonicContact CZ-OE2 2.68Å; R72-E81 IonicContact NE-OE2 3.08Å; R72-E81 PolarHBondContact NE-OE2 3.03Å; R72-E81 IonicContact NH2-OE2 3.97Å; R72-L97 WeakPolarHBondContact O-CA 3.12Å; R72-R98 PolarHBondContact N-O 3.19Å; R72-R98 VanDerWaalsContact N-O 3.13Å; R72-R98 PolarHBondContact O-N 3.49Å
73	N	90.3	Very high	89.5	Confident	13 Å²	13	42.5 Å²	42.5	7%	0.07	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	105.4	164.4	-170.8	13	0	0	0	109.8	S75 I76 E81 P94 L96 L97 I121	N73-S75 VanDerWaalsContact C-N 3.33Å; N73-S75 VanDerWaalsContact CG-OG 3.23Å; N73-S75 PolarHBondContact ND2-OG 2.63Å; N73-S75 PolarHBondContact OD1-N 3.3Å; N73-S75 PolarHBondContact OD1-OG 3.47Å; N73-I76 HydrophobicContact CB-CD1 4.44Å; N73-I76 HydrophobicContact CB-CG1 4.21Å; N73-E81 PolarHBondContact N-OE1 3.1Å; N73-P94 PolarHBondContact ND2-O 2.98Å; N73-L96 PolarHBondContact OD1-N 3.29Å; N73-L96 PolarHBondContact OD1-O 2.87Å; N73-L97 HydrophobicContact CB-CD2 4.09Å; N73-I121 HydrophobicContact CB-CD1 3.94Å
74	I	92.3	Very high	88.5	Confident	55 Å²	55	44.1 Å²	44.1	28%	0.282	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-0.7	-176	57.7	159.9	0	0	0	113.7	R72 I76 L96 R98 L111	R72-I74 HydrophobicContact CB-CG2 4.38Å; R72-I74 HydrophobicContact CG-CG2 4.34Å; R72-I74 PolarHBondContact O-N 3.21Å; I74-I76 VanDerWaalsContact C-N 3.28Å; I74-L96 HydrophobicContact CD1-CD2 3.64Å; I74-L96 HydrophobicContact CD1-CG 3.89Å; I74-L96 HydrophobicContact CG1-CB 4.08Å; I74-L96 HydrophobicContact CG1-CD2 3.85Å; I74-L96 HydrophobicContact CG1-CG 3.73Å; I74-L96 WeakPolarHBondContact CG1-O 3.44Å; I74-L96 PolarHBondContact N-O 2.95Å; I74-R98 HydrophobicContact CD1-CB 4.2Å; I74-R98 HydrophobicContact CG1-CB 4.18Å; I74-R98 HydrophobicContact CG2-CB 3.6Å; I74-L111 HydrophobicContact CD1-CD2 3.71Å
75	S	89.3	Confident	87.1	Confident	45 Å²	45	42.2 Å²	42.2	32%	0.315	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-14.5	171.7	62.6	0	0	0	0	113.3	N73 P94	N73-S75 VanDerWaalsContact C-N 3.33Å; N73-S75 VanDerWaalsContact CG-OG 3.23Å; N73-S75 PolarHBondContact ND2-OG 2.63Å; N73-S75 PolarHBondContact OD1-N 3.3Å; N73-S75 PolarHBondContact OD1-OG 3.47Å; S75-P94 WeakPolarHBondContact CB-O 3.38Å; S75-P94 VanDerWaalsContact OG-C 3.31Å; S75-P94 PolarHBondContact OG-O 3.42Å
76	I	86.6	Confident	85.3	Confident	33 Å²	33	46.9 Å²	46.9	17%	0.169	26%	0.255	C	S	.	.	S	Bend	trans	-121.5	151.7	-179	61.7	172.6	0	0	0	111.5	R72 N73 I74 E81 M84	R72-I76 PolarHBondContact NH2-O 3.46Å; N73-I76 HydrophobicContact CB-CD1 4.44Å; N73-I76 HydrophobicContact CB-CG1 4.21Å; I74-I76 VanDerWaalsContact C-N 3.28Å; I76-E81 HydrophobicContact CD1-CB 3.82Å; I76-E81 HydrophobicContact CD1-CG 4.36Å; I76-E81 HydrophobicContact CG1-CB 4.2Å; I76-M84 HydrophobicContact CD1-SD 4.15Å
77	P	88.1	Confident	83.4	Confident	85 Å²	85	49.5 Å²	49.5	55%	0.552	27%	0.273	S	S	*	.			trans	-58.8	147.4	172.5	-22.8	34	0	0	0	111.7	A79 T80 E81	P77-A79 VanDerWaalsContact C-N 3.29Å; P77-A79 PolarHBondContact O-N 3.27Å; P77-T80 WeakPolarHBondContact O-CB 3.16Å; P77-T80 PolarHBondContact O-N 3.2Å; P77-T80 VanDerWaalsContact O-N 3.12Å; P77-E81 PolarHBondContact O-N 3.32Å
78	Q	85.4	Confident	81.2	Confident	83 Å²	83	55.7 Å²	55.7	39%	0.388	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-37.2	-178.5	-165.5	-174.9	-61.4	0	0	111.8	R72 T80 E81 D82	R72-Q78 VanDerWaalsContact NH2-CA 3.32Å; Q78-T80 VanDerWaalsContact C-N 3.27Å; Q78-T80 PolarHBondContact O-N 3.27Å; Q78-E81 WeakPolarHBondContact O-CB 3.41Å; Q78-E81 PolarHBondContact O-N 3.34Å; Q78-D82 PolarHBondContact NE2-OD2 3.06Å; Q78-D82 VanDerWaalsContact O-CB 3.31Å; Q78-D82 WeakPolarHBondContact O-CB 3.44Å; Q78-D82 PolarHBondContact O-N 3.31Å
79	A	80.8	Confident	78.9	Confident	75 Å²	75	59.8 Å²	59.8	62%	0.62	35%	0.346	S	S	*	.	H	α-helix	trans	-60.8	-37.9	176	0	0	0	0	0	112.2	P77 L83	P77-A79 VanDerWaalsContact C-N 3.29Å; P77-A79 PolarHBondContact O-N 3.27Å; A79-L83 WeakPolarHBondContact O-CB 3.24Å; A79-L83 PolarHBondContact O-N 3.25Å
80	T	81.6	Confident	76.7	Confident	59 Å²	59	63.1 Å²	63.1	36%	0.362	36%	0.362	S	S	.	.	H	α-helix	trans	-69.2	-45.6	175.3	-50.6	0	0	0	0	111.2	P77 Q78 D82 L83 M84	P77-T80 WeakPolarHBondContact O-CB 3.16Å; P77-T80 PolarHBondContact O-N 3.2Å; P77-T80 VanDerWaalsContact O-N 3.12Å; Q78-T80 VanDerWaalsContact C-N 3.27Å; Q78-T80 PolarHBondContact O-N 3.27Å; T80-D82 VanDerWaalsContact C-N 3.32Å; T80-D82 PolarHBondContact O-N 3.06Å; T80-L83 PolarHBondContact O-N 2.87Å; T80-M84 HydrophobicContact CG2-SD 4.17Å; T80-M84 VanDerWaalsContact O-CG 3.28Å; T80-M84 WeakPolarHBondContact O-CG 3.28Å; T80-M84 PolarHBondContact O-N 3.09Å
81	E	81.5	Confident	75	Confident	16 Å²	16	61.8 Å²	61.8	8%	0.075	36%	0.361	C	S	.	.	H	α-helix	trans	-55.4	-48.8	175.1	-174.8	176.9	-151.5	0	0	110.7	R72 N73 I76 P77 Q78 L83 M84 L85 I121	R72-E81 WeakPolarHBondContact CA-OE1 3.33Å; R72-E81 WeakPolarHBondContact CG-OE1 3.34Å; R72-E81 WeakPolarHBondContact CG-OE2 3.23Å; R72-E81 IonicContact CZ-OE2 2.68Å; R72-E81 IonicContact NE-OE2 3.08Å; R72-E81 PolarHBondContact NE-OE2 3.03Å; R72-E81 IonicContact NH2-OE2 3.97Å; N73-E81 PolarHBondContact N-OE1 3.1Å; I76-E81 HydrophobicContact CD1-CB 3.82Å; I76-E81 HydrophobicContact CD1-CG 4.36Å; I76-E81 HydrophobicContact CG1-CB 4.2Å; P77-E81 PolarHBondContact O-N 3.32Å; Q78-E81 WeakPolarHBondContact O-CB 3.41Å; Q78-E81 PolarHBondContact O-N 3.34Å; E81-L83 VanDerWaalsContact C-N 3.35Å; E81-L83 PolarHBondContact O-N 3.46Å; E81-M84 PolarHBondContact O-N 2.81Å; E81-L85 WeakPolarHBondContact O-CG 3.32Å; E81-L85 PolarHBondContact O-N 3.44Å; E81-I121 HydrophobicContact CG-CD1 4.01Å; E81-I121 WeakPolarHBondContact OE1-CD1 3.39Å
82	D	78.9	Confident	73.2	Confident	23 Å²	23	71.1 Å²	71.1	12%	0.123	39%	0.394	C	S	.	.	H	α-helix	trans	-61.9	-38.9	179.9	-72	-17.2	0	0	0	112	Q78 T80 L85 K170	Q78-D82 PolarHBondContact NE2-OD2 3.06Å; Q78-D82 VanDerWaalsContact O-CB 3.31Å; Q78-D82 WeakPolarHBondContact O-CB 3.44Å; Q78-D82 PolarHBondContact O-N 3.31Å; T80-D82 VanDerWaalsContact C-N 3.32Å; T80-D82 PolarHBondContact O-N 3.06Å; D82-L85 WeakPolarHBondContact O-CB 3.44Å; D82-L85 PolarHBondContact O-N 2.9Å; D82-K170 HydrophobicContact CB-CB 4.11Å; D82-K170 WeakPolarHBondContact OD1-CD 3.45Å; D82-K170 IonicContact OD1-NZ 3.09Å; D82-K170 PolarHBondContact OD1-NZ 3.24Å; D82-K170 IonicContact OD2-NZ 3.52Å; D82-K170 PolarHBondContact OD2-NZ 3.12Å
83	L	72.3	Confident	72.1	Confident	89 Å²	89	71 Å²	71	47%	0.466	41%	0.407	S	S	.	.	H	α-helix	trans	-68	-36.5	175	-175.1	65	0	0	0	112.8	A79 T80 E81 L85	A79-L83 WeakPolarHBondContact O-CB 3.24Å; A79-L83 PolarHBondContact O-N 3.25Å; T80-L83 PolarHBondContact O-N 2.87Å; E81-L83 VanDerWaalsContact C-N 3.35Å; E81-L83 PolarHBondContact O-N 3.46Å; L83-L85 VanDerWaalsContact C-N 3.26Å; L83-L85 PolarHBondContact O-N 3.08Å
84	M	71.7	Confident	71.1	Confident	50 Å²	50	74.8 Å²	74.8	25%	0.246	43%	0.432	C	S	.	.	H	α-helix	trans	-72.9	-16.2	-179.2	-71.5	-179.9	77.7	0	0	113.3	I76 T80 E81 N86 S87 D90	I76-M84 HydrophobicContact CD1-SD 4.15Å; T80-M84 HydrophobicContact CG2-SD 4.17Å; T80-M84 VanDerWaalsContact O-CG 3.28Å; T80-M84 WeakPolarHBondContact O-CG 3.28Å; T80-M84 PolarHBondContact O-N 3.09Å; E81-M84 PolarHBondContact O-N 2.81Å; M84-N86 PolarHBondContact O-N 2.84Å; M84-N86 VanDerWaalsContact O-N 3.1Å; M84-S87 PolarHBondContact O-N 2.66Å; M84-S87 VanDerWaalsContact O-N 3.17Å; M84-S87 PolarHBondContact O-OG 3.39Å; M84-S87 VanDerWaalsContact O-OG 3.13Å; M84-D90 WeakPolarHBondContact CE-O 3.4Å
85	L	66	Low	70.6	Confident	50 Å²	50	73.8 Å²	73.8	26%	0.262	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.3	-177.9	-67.8	174.6	0	0	0	113.9	E81 D82 L83 K167	E81-L85 WeakPolarHBondContact O-CG 3.32Å; E81-L85 PolarHBondContact O-N 3.44Å; D82-L85 WeakPolarHBondContact O-CB 3.44Å; D82-L85 PolarHBondContact O-N 2.9Å; L83-L85 VanDerWaalsContact C-N 3.26Å; L83-L85 PolarHBondContact O-N 3.08Å; L85-K167 HydrophobicContact CD1-CB 4.34Å; L85-K167 HydrophobicContact CD1-CG 4.03Å; L85-K167 HydrophobicContact CD2-CD 4.38Å
86	N	59.5	Low	70.6	Confident	103 Å²	103	74.6 Å²	74.6	55%	0.551	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-13.7	179.8	-68.9	-15.2	0	0	0	114.1	M84 G171	M84-N86 PolarHBondContact O-N 2.84Å; M84-N86 VanDerWaalsContact O-N 3.1Å; N86-G171 VanDerWaalsContact ND2-C 3.31Å; N86-G171 WeakPolarHBondContact ND2-CA 3.27Å; N86-G171 PolarHBondContact ND2-O 3.39Å
87	S	57	Low	70.9	Confident	55 Å²	55	73.1 Å²	73.1	39%	0.385	42%	0.422	S	S	.	.			trans	-98.4	106.5	179.2	54.8	0	0	0	0	109.1	M84 S89	M84-S87 PolarHBondContact O-N 2.66Å; M84-S87 VanDerWaalsContact O-N 3.17Å; M84-S87 PolarHBondContact O-OG 3.39Å; M84-S87 VanDerWaalsContact O-OG 3.13Å; S87-S89 PolarHBondContact O-N 3.38Å
88	S	52.4	Low	71.2	Confident	131 Å²	131	72 Å²	72	92%	0.916	41%	0.407	S	S	*	.			trans	-70	29.2	-178.2	59.6	0	0	0	0	114.7
89	S	49.5	Very low	71.7	Confident	86 Å²	86	68.1 Å²	68.1	60%	0.601	39%	0.389	S	S	*	.	S	Bend	trans	-147.3	119.4	-172.8	57.3	0	0	0	0	111.8	S87	S87-S89 PolarHBondContact O-N 3.38Å
90	D	50.3	Low	72.5	Confident	102 Å²	102	64.9 Å²	64.9	55%	0.545	36%	0.362	S	S	.	.			trans	67.9	87.4	163.9	-84.2	5.5	0	0	0	117.4	M84 R92	M84-D90 WeakPolarHBondContact CE-O 3.4Å; D90-R92 HydrophobicContact CB-CB 3.86Å; D90-R92 PolarHBondContact O-N 3.14Å; D90-R92 VanDerWaalsContact OD2-CD 3.26Å; D90-R92 WeakPolarHBondContact OD2-CD 3.34Å; D90-R92 IonicContact OD2-NH1 3.94Å; D90-R92 PolarHBondContact OD2-NH1 3.06Å
91	H	58.4	Low	73.2	Confident	84 Å²	84	62.1 Å²	62.1	39%	0.389	35%	0.345	S	S	.	.			trans	-67.8	36.2	154.2	-56.4	-52	0	0	0	112.6	G93 D122	H91-G93 PolarHBondContact O-N 3.03Å; H91-D122 IonicContact NE2-OD2 3.9Å
92	R	55.7	Low	73.9	Confident	213 Å²	213	61.5 Å²	61.5	80%	0.804	34%	0.342	S	S	*	.			trans	-77.3	17.1	-166.3	-159.6	169.5	177	160.7	0.3	114.2	D90	D90-R92 HydrophobicContact CB-CB 3.86Å; D90-R92 PolarHBondContact O-N 3.14Å; D90-R92 VanDerWaalsContact OD2-CD 3.26Å; D90-R92 WeakPolarHBondContact OD2-CD 3.34Å; D90-R92 IonicContact OD2-NH1 3.94Å; D90-R92 PolarHBondContact OD2-NH1 3.06Å
93	G	65.6	Low	74.7	Confident	41 Å²	41	60.5 Å²	60.5	42%	0.423	34%	0.337	S	S	.	.	S	Bend	trans	-88.8	177.8	174.5	0	0	0	0	0	112.7	H91 C95	H91-G93 PolarHBondContact O-N 3.03Å; G93-C95 PolarHBondContact O-N 3.22Å
94	P	70.8	Confident	75.7	Confident	92 Å²	92	57.1 Å²	57.1	60%	0.597	32%	0.323	S	S	*	.			trans	-53	139.1	166.1	24.9	-32.8	0	0	0	108.7	N73 S75	N73-P94 PolarHBondContact ND2-O 2.98Å; S75-P94 WeakPolarHBondContact CB-O 3.38Å; S75-P94 VanDerWaalsContact OG-C 3.31Å; S75-P94 PolarHBondContact OG-O 3.42Å
95	C	80.3	Confident	76.8	Confident	35 Å²	35	64.4 Å²	64.4	24%	0.236	35%	0.348	C	S	.	.			trans	-126.4	117.5	-179.5	-176.5	0	0	0	0	108.6	G93 N115	G93-C95 PolarHBondContact O-N 3.22Å; C95-N115 VanDerWaalsContact CB-OD1 3.27Å; C95-N115 WeakPolarHBondContact CB-OD1 3.1Å
96	L	90	Very high	78.1	Confident	61 Å²	61	64.4 Å²	64.4	32%	0.319	35%	0.348	S	S	.	.			trans	-131.3	101.1	170.4	178.9	61.4	0	0	0	106.7	N73 I74 D112	N73-L96 PolarHBondContact OD1-N 3.29Å; N73-L96 PolarHBondContact OD1-O 2.87Å; I74-L96 HydrophobicContact CD1-CD2 3.64Å; I74-L96 HydrophobicContact CD1-CG 3.89Å; I74-L96 HydrophobicContact CG1-CB 4.08Å; I74-L96 HydrophobicContact CG1-CD2 3.85Å; I74-L96 HydrophobicContact CG1-CG 3.73Å; I74-L96 WeakPolarHBondContact CG1-O 3.44Å; I74-L96 PolarHBondContact N-O 2.95Å; L96-D112 WeakPolarHBondContact CD1-O 3.46Å
97	L	92.5	Very high	79.8	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.01	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	125.1	-176.5	-65	-177	0	0	0	111	L71 R72 N73 F99 L111 D112 L119 I121	L71-L97 HydrophobicContact CD1-CB 4.08Å; L71-L97 HydrophobicContact CD1-CD1 4.42Å; L71-L97 HydrophobicContact CD1-CD2 4.5Å; R72-L97 WeakPolarHBondContact O-CA 3.12Å; N73-L97 HydrophobicContact CB-CD2 4.09Å; L97-F99 HydrophobicContact CB-CD2 4.41Å; L97-F99 HydrophobicContact CB-CE2 3.66Å; L97-F99 HydrophobicContact CB-CZ 4.07Å; L97-F99 HydrophobicContact CD1-CZ 4.14Å; L97-L111 WeakPolarHBondContact O-CA 3.49Å; L97-D112 HydrophobicContact CB-CB 4.38Å; L97-D112 PolarHBondContact O-N 3.29Å; L97-D112 VanDerWaalsContact O-N 3.12Å; L97-L119 HydrophobicContact CD1-CB 4.16Å; L97-L119 WeakPolarHBondContact CD1-O 3.48Å; L97-I121 HydrophobicContact CD2-CB 4.47Å
98	R	94.8	Very high	81.6	Confident	63 Å²	63	63.1 Å²	63.1	24%	0.238	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.6	167.7	-172.8	-179.4	71.5	166.4	5.9	109.8	R72 I74 G110 L111 F141	R72-R98 PolarHBondContact N-O 3.19Å; R72-R98 VanDerWaalsContact N-O 3.13Å; R72-R98 PolarHBondContact O-N 3.49Å; I74-R98 HydrophobicContact CD1-CB 4.2Å; I74-R98 HydrophobicContact CG1-CB 4.18Å; I74-R98 HydrophobicContact CG2-CB 3.6Å; R98-G110 CarbonylContact C-O 3.43Å; R98-G110 WeakPolarHBondContact CA-O 3.28Å; R98-L111 HydrophobicContact CB-CD2 4.05Å; R98-L111 HydrophobicContact CG-CD2 4.08Å; R98-F141 HydrophobicContact CG-CE1 4.26Å
99	F	96	Very high	83.6	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	139.4	172.1	-60.5	-98.3	0	0	0	109.7	L68 L71 L97 F101 F109 G110 D112 L119 F129 L144	L68-F99 HydrophobicContact CD1-CB 4.33Å; L68-F99 HydrophobicContact CD1-CD1 3.94Å; L71-F99 HydrophobicContact CD1-CD1 3.57Å; L71-F99 HydrophobicContact CD1-CD2 4.19Å; L71-F99 HydrophobicContact CD1-CE1 3.51Å; L71-F99 HydrophobicContact CD1-CE2 4.12Å; L71-F99 HydrophobicContact CD1-CG 3.9Å; L71-F99 HydrophobicContact CD1-CZ 3.77Å; L71-F99 HydrophobicContact CD2-CE1 4.34Å; L97-F99 HydrophobicContact CB-CD2 4.41Å; L97-F99 HydrophobicContact CB-CE2 3.66Å; L97-F99 HydrophobicContact CB-CZ 4.07Å; L97-F99 HydrophobicContact CD1-CZ 4.14Å; F99-F101 HydrophobicContact CB-CD2 4Å; F99-F101 HydrophobicContact CB-CE1 4.02Å; F99-F101 HydrophobicContact CB-CE2 3.4Å; F99-F101 VanDerWaalsContact CB-CE2 3.4Å; F99-F101 HydrophobicContact CB-CZ 3.41Å; F99-F101 VanDerWaalsContact CB-CZ 3.41Å; F99-F101 AromaticContact CD1-CE1 3.97Å; F99-F101 HydrophobicContact CD1-CE1 3.97Å; F99-F101 HydrophobicContact CD1-CE2 4.33Å; F99-F101 AromaticContact CD1-CZ 3.5Å; F99-F101 HydrophobicContact CD1-CZ 3.5Å; F99-F101 HydrophobicContact CE1-CZ 4.49Å; F99-F101 HydrophobicContact CG-CE1 4.33Å; F99-F101 AromaticContact CG-CE2 3.94Å; F99-F101 HydrophobicContact CG-CE2 3.94Å; F99-F101 AromaticContact CG-CZ 3.58Å; F99-F101 HydrophobicContact CG-CZ 3.58Å; F99-F109 CarbonylContact O-C 3.55Å; F99-F109 VanDerWaalsContact O-CA 3.27Å; F99-F109 WeakPolarHBondContact O-CA 3.46Å; F99-G110 PolarHBondContact N-O 3.29Å; F99-G110 PolarHBondContact O-N 3.48Å; F99-D112 HydrophobicContact CE2-CB 4.06Å; F99-L119 HydrophobicContact CE2-CD1 4.44Å; F99-L119 HydrophobicContact CZ-CB 4.16Å; F99-L119 HydrophobicContact CZ-CD1 3.88Å; F99-L119 HydrophobicContact CZ-CD2 4.39Å; F99-L119 HydrophobicContact CZ-CG 4.37Å; F99-F129 HydrophobicContact CE1-CE1 4.39Å; F99-F129 HydrophobicContact CE1-CZ 4.25Å; F99-L144 HydrophobicContact CD2-CD1 3.99Å; F99-L144 HydrophobicContact CE2-CD1 4.5Å; F99-L144 HydrophobicContact CG-CD1 4.46Å
100	T	96.9	Very high	85.8	Confident	8 Å²	8	56.2 Å²	56.2	5%	0.049	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	108.9	165.5	-49.1	0	0	0	0	107.8	T69 R70 F109	T69-T100 PolarHBondContact N-O 2.99Å; T69-T100 WeakPolarHBondContact OG1-CB 2.93Å; T69-T100 VanDerWaalsContact OG1-CG2 3.27Å; T69-T100 WeakPolarHBondContact OG1-CG2 3.35Å; T69-T100 PolarHBondContact OG1-O 3.46Å; R70-T100 PolarHBondContact O-N 2.93Å; T100-F109 HydrophobicContact CG2-CD1 3.98Å; T100-F109 HydrophobicContact CG2-CE1 3.63Å
101	F	96.7	Very high	87.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	156.7	-178.5	-66	-56.6	0	0	0	111.8	V66 Q67 L68 F99 Q107 I108 F129 L144 I149	V66-F101 HydrophobicContact CB-CB 3.98Å; V66-F101 HydrophobicContact CB-CD1 4.37Å; V66-F101 HydrophobicContact CB-CG 4.29Å; V66-F101 HydrophobicContact CG2-CB 3.86Å; V66-F101 HydrophobicContact CG2-CD1 3.54Å; V66-F101 HydrophobicContact CG2-CD2 4.22Å; V66-F101 HydrophobicContact CG2-CE1 4.1Å; V66-F101 HydrophobicContact CG2-CG 3.61Å; Q67-F101 CarbonylContact O-C 3.58Å; Q67-F101 VanDerWaalsContact O-CA 3.27Å; Q67-F101 WeakPolarHBondContact O-CA 3.37Å; L68-F101 HydrophobicContact CB-CD1 4.45Å; L68-F101 HydrophobicContact CB-CE1 4.36Å; L68-F101 HydrophobicContact CD1-CD1 4.35Å; L68-F101 HydrophobicContact CD1-CE1 4.09Å; F99-F101 HydrophobicContact CB-CD2 4Å; F99-F101 HydrophobicContact CB-CE1 4.02Å; F99-F101 HydrophobicContact CB-CE2 3.4Å; F99-F101 VanDerWaalsContact CB-CE2 3.4Å; F99-F101 HydrophobicContact CB-CZ 3.41Å; F99-F101 VanDerWaalsContact CB-CZ 3.41Å; F99-F101 AromaticContact CD1-CE1 3.97Å; F99-F101 HydrophobicContact CD1-CE1 3.97Å; F99-F101 HydrophobicContact CD1-CE2 4.33Å; F99-F101 AromaticContact CD1-CZ 3.5Å; F99-F101 HydrophobicContact CD1-CZ 3.5Å; F99-F101 HydrophobicContact CE1-CZ 4.49Å; F99-F101 HydrophobicContact CG-CE1 4.33Å; F99-F101 AromaticContact CG-CE2 3.94Å; F99-F101 HydrophobicContact CG-CE2 3.94Å; F99-F101 AromaticContact CG-CZ 3.58Å; F99-F101 HydrophobicContact CG-CZ 3.58Å; F101-Q107 CarbonylContact O-C 3.53Å; F101-Q107 WeakPolarHBondContact O-CA 3.35Å; F101-I108 HydrophobicContact CB-CG2 3.8Å; F101-I108 HydrophobicContact CD2-CG2 4.5Å; F101-I108 PolarHBondContact N-O 3.44Å; F101-I108 PolarHBondContact O-N 2.9Å; F101-F129 HydrophobicContact CD1-CD2 4.49Å; F101-F129 HydrophobicContact CE1-CB 4.19Å; F101-F129 AromaticContact CE1-CD2 3.67Å; F101-F129 HydrophobicContact CE1-CD2 3.67Å; F101-F129 HydrophobicContact CE1-CE2 4.12Å; F101-F129 AromaticContact CE1-CG 3.89Å; F101-F129 HydrophobicContact CE1-CG 3.89Å; F101-F129 HydrophobicContact CZ-CD2 4.49Å; F101-F129 HydrophobicContact CZ-CG 4.34Å; F101-L144 HydrophobicContact CE2-CD1 3.95Å; F101-L144 HydrophobicContact CZ-CD1 4.49Å; F101-I149 HydrophobicContact CE2-CD1 4.31Å; F101-I149 HydrophobicContact CZ-CD1 3.74Å
102	T	96.4	Very high	89.5	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.025	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	146.9	170.2	-171.7	0	0	0	0	112	V66 Q67 T69 G104 N106	V66-T102 WeakPolarHBondContact CA-O 3.32Å; Q67-T102 HydrophobicContact CB-CG2 4.02Å; Q67-T102 PolarHBondContact N-O 3.34Å; Q67-T102 PolarHBondContact O-N 3.43Å; T69-T102 HydrophobicContact CG2-CG2 3.47Å; T69-T102 VanDerWaalsContact CG2-CG2 3.47Å; T102-G104 PolarHBondContact OG1-N 3.08Å; T102-G104 VanDerWaalsContact OG1-N 3.07Å; T102-N106 VanDerWaalsContact CA-O 3.26Å; T102-N106 WeakPolarHBondContact CA-O 3.44Å; T102-N106 WeakPolarHBondContact CB-O 3.31Å; T102-N106 PolarHBondContact OG1-O 3.08Å
103	D	95.2	Very high	91	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.011	23%	0.225	C	C	.	.	S	Bend	trans	-95.2	8.3	167.5	66.3	-5	0	0	0	112.6	I42 P48 W49 L50 R105 N106	I42-D103 VanDerWaalsContact CG2-O 3.28Å; I42-D103 WeakPolarHBondContact CG2-O 3.41Å; P48-D103 WeakPolarHBondContact CA-OD2 3.3Å; W49-D103 HydrophobicContact CG-CB 4.37Å; W49-D103 PolarHBondContact N-OD2 2.7Å; L50-D103 WeakPolarHBondContact CB-OD2 3.37Å; L50-D103 HydrophobicContact CD1-CB 3.72Å; L50-D103 HydrophobicContact CG-CB 3.89Å; L50-D103 PolarHBondContact N-OD2 2.75Å; D103-R105 PolarHBondContact OD1-N 3.3Å; D103-N106 PolarHBondContact N-O 2.85Å; D103-N106 WeakPolarHBondContact OD1-CA 3.44Å; D103-N106 WeakPolarHBondContact OD1-CB 3.33Å; D103-N106 PolarHBondContact OD1-N 2.66Å; D103-N106 PolarHBondContact OD2-ND2 3.32Å; D103-N106 VanDerWaalsContact OD2-ND2 3.1Å
104	G	94	Very high	91.7	Very high	17 Å²	17	46.5 Å²	46.5	18%	0.175	23%	0.228	C	C	.	.	S	Bend	trans	103.8	-18.7	-175.4	0	0	0	0	0	114	T102	T102-G104 PolarHBondContact OG1-N 3.08Å; T102-G104 VanDerWaalsContact OG1-N 3.07Å
105	R	94.1	Very high	91.6	Very high	203 Å²	203	46.3 Å²	46.3	77%	0.766	22%	0.222	S	C	*	.	S	Bend	trans	-135.8	-39.9	178.2	-163.9	153.6	177.9	78.5	0.1	114	P48 D103	P48-R105 HydrophobicContact CB-CB 3.84Å; P48-R105 HydrophobicContact CG-CB 4.4Å; D103-R105 PolarHBondContact OD1-N 3.3Å
106	N	94.5	Very high	90.9	Very high	51 Å²	51	45.7 Å²	45.7	27%	0.273	22%	0.215	S	C	.	.			trans	-101.9	158.2	178.5	-54.7	-60.7	0	0	0	109.9	L50 G51 T102 D103	L50-N106 HydrophobicContact CB-CB 3.87Å; L50-N106 HydrophobicContact CD1-CB 4.47Å; G51-N106 PolarHBondContact N-ND2 2.88Å; T102-N106 VanDerWaalsContact CA-O 3.26Å; T102-N106 WeakPolarHBondContact CA-O 3.44Å; T102-N106 WeakPolarHBondContact CB-O 3.31Å; T102-N106 PolarHBondContact OG1-O 3.08Å; D103-N106 PolarHBondContact N-O 2.85Å; D103-N106 WeakPolarHBondContact OD1-CA 3.44Å; D103-N106 WeakPolarHBondContact OD1-CB 3.33Å; D103-N106 PolarHBondContact OD1-N 2.66Å; D103-N106 PolarHBondContact OD2-ND2 3.32Å; D103-N106 VanDerWaalsContact OD2-ND2 3.1Å
107	Q	94.2	Very high	89.5	Confident	123 Å²	123	47.6 Å²	47.6	58%	0.575	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	148	173.6	-68.8	-174.2	-8.2	0	0	110.8	F101	F101-Q107 CarbonylContact O-C 3.53Å; F101-Q107 WeakPolarHBondContact O-CA 3.35Å
108	I	94.5	Very high	88.5	Confident	8 Å²	8	52.7 Å²	52.7	4%	0.041	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	144.5	172.8	-168.2	165.3	0	0	0	110.5	L50 L53 L59 F101 L137 L142	L50-I108 HydrophobicContact CD1-CB 4.21Å; L50-I108 HydrophobicContact CD1-CG2 3.74Å; L50-I108 HydrophobicContact CD2-CD1 4.38Å; L50-I108 HydrophobicContact CD2-CG2 4.23Å; L53-I108 HydrophobicContact CD1-CD1 3.49Å; L53-I108 VanDerWaalsContact CD1-CD1 3.49Å; L59-I108 HydrophobicContact CD2-CD1 4.22Å; F101-I108 HydrophobicContact CB-CG2 3.8Å; F101-I108 HydrophobicContact CD2-CG2 4.5Å; F101-I108 PolarHBondContact N-O 3.44Å; F101-I108 PolarHBondContact O-N 2.9Å; I108-L137 HydrophobicContact CD1-CD1 4.26Å; I108-L142 HydrophobicContact CD1-CD1 3.72Å; I108-L142 HydrophobicContact CD1-CD2 3.73Å; I108-L142 HydrophobicContact CD1-CG 3.55Å; I108-L142 HydrophobicContact CG1-CD1 4.11Å; I108-L142 HydrophobicContact CG1-CG 3.93Å; I108-L142 HydrophobicContact CG2-CD1 4.28Å
109	F	95.8	Very high	87.7	Confident	71 Å²	71	50 Å²	50	31%	0.311	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	141.2	178.7	-55.8	-69.1	0	0	0	110.6	F99 T100 F141 L142	F99-F109 CarbonylContact O-C 3.55Å; F99-F109 VanDerWaalsContact O-CA 3.27Å; F99-F109 WeakPolarHBondContact O-CA 3.46Å; T100-F109 HydrophobicContact CG2-CD1 3.98Å; T100-F109 HydrophobicContact CG2-CE1 3.63Å; F109-F141 HydrophobicContact CB-CD1 3.45Å; F109-F141 VanDerWaalsContact CB-CD1 3.45Å; F109-F141 HydrophobicContact CB-CE1 3.58Å; F109-F141 HydrophobicContact CB-CG 4.36Å; F109-F141 HydrophobicContact CG-CD1 4.44Å; F109-F141 HydrophobicContact CG-CE1 4.13Å; F109-F141 CarbonylContact O-C 3.59Å; F109-F141 WeakPolarHBondContact O-CA 3.35Å; F109-L142 PolarHBondContact O-N 2.95Å
110	G	95	Very high	87	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.9	173.4	0	0	0	0	0	111.4	R98 F99 L142	R98-G110 CarbonylContact C-O 3.43Å; R98-G110 WeakPolarHBondContact CA-O 3.28Å; F99-G110 PolarHBondContact N-O 3.29Å; F99-G110 PolarHBondContact O-N 3.48Å; G110-L142 CarbonylContact C-O 3.58Å; G110-L142 WeakPolarHBondContact CA-O 3.46Å
111	L	94.8	Very high	86.5	Confident	26 Å²	26	53.3 Å²	53.3	14%	0.136	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	126.6	173.9	-64.2	176.8	0	0	0	109	I74 L97 R98 M113 F141 L142 L144	I74-L111 HydrophobicContact CD1-CD2 3.71Å; L97-L111 WeakPolarHBondContact O-CA 3.49Å; R98-L111 HydrophobicContact CB-CD2 4.05Å; R98-L111 HydrophobicContact CG-CD2 4.08Å; L111-M113 HydrophobicContact CB-SD 4.26Å; L111-M113 PolarHBondContact O-N 3.03Å; L111-F141 HydrophobicContact CD1-CB 3.88Å; L111-F141 HydrophobicContact CD1-CD1 3.86Å; L111-F141 HydrophobicContact CD1-CG 3.84Å; L111-F141 HydrophobicContact CD2-CD1 3.97Å; L111-F141 HydrophobicContact CD2-CE1 4.26Å; L111-F141 HydrophobicContact CG-CB 4.08Å; L111-F141 HydrophobicContact CG-CD1 3.65Å; L111-F141 HydrophobicContact CG-CE1 4.41Å; L111-F141 HydrophobicContact CG-CG 4.08Å; L111-L142 PolarHBondContact N-O 3.41Å; L111-L144 WeakPolarHBondContact O-CA 3.2Å; L111-L144 WeakPolarHBondContact O-CB 3.45Å; L111-L144 PolarHBondContact O-N 3.46Å
112	D	91.3	Very high	86	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	109	171	-177.6	11.5	0	0	0	110.5	L96 L97 F99 Q114 N115 K116	L96-D112 WeakPolarHBondContact CD1-O 3.46Å; L97-D112 HydrophobicContact CB-CB 4.38Å; L97-D112 PolarHBondContact O-N 3.29Å; L97-D112 VanDerWaalsContact O-N 3.12Å; F99-D112 HydrophobicContact CE2-CB 4.06Å; D112-Q114 PolarHBondContact OD1-N 3.13Å; D112-N115 PolarHBondContact OD1-N 3.09Å; D112-N115 WeakPolarHBondContact OD2-CA 3.29Å; D112-N115 PolarHBondContact OD2-N 2.94Å; D112-K116 PolarHBondContact OD2-N 2.77Å
113	M	88.2	Confident	85.7	Confident	105 Å²	105	58 Å²	58	52%	0.517	29%	0.293	S	S	.	.	S	Bend	trans	-85.2	-11.7	-178.3	-59.6	-58.4	-63.7	0	0	113.5	L111 L143 L144	L111-M113 HydrophobicContact CB-SD 4.26Å; L111-M113 PolarHBondContact O-N 3.03Å; M113-L143 HydrophobicContact CG-CB 4.02Å; M113-L143 HydrophobicContact CG-CD2 4.37Å; M113-L143 HydrophobicContact SD-CD2 3.96Å; M113-L144 WeakPolarHBondContact CB-O 3.28Å; M113-L144 PolarHBondContact N-O 3.02Å
114	Q	80.2	Confident	85.6	Confident	102 Å²	102	59.7 Å²	59.7	48%	0.477	30%	0.304	S	S	.	.	S	Bend	trans	-116.6	5.5	-172.3	-68.9	-177.3	-21	0	0	113.6	D112 K116 K146	D112-Q114 PolarHBondContact OD1-N 3.13Å; Q114-K116 PolarHBondContact O-N 3.23Å; Q114-K146 VanDerWaalsContact OE1-CG 3.24Å
115	N	69.2	Low	85.7	Confident	88 Å²	88	59.3 Å²	59.3	47%	0.471	30%	0.298	S	S	.	.			trans	40.8	67.9	179.6	-168.7	22.5	0	0	0	112.2	C95 D112	C95-N115 VanDerWaalsContact CB-OD1 3.27Å; C95-N115 WeakPolarHBondContact CB-OD1 3.1Å; D112-N115 PolarHBondContact OD1-N 3.09Å; D112-N115 WeakPolarHBondContact OD2-CA 3.29Å; D112-N115 PolarHBondContact OD2-N 2.94Å
116	K	64	Low	85.9	Confident	21 Å²	21	49.7 Å²	49.7	9%	0.091	26%	0.262	C	S	.	.			trans	-75.9	134.4	-174.8	-53	-178.4	66.2	179.1	0	110.2	D112 Q114 D118 L119 K146	D112-K116 PolarHBondContact OD2-N 2.77Å; Q114-K116 PolarHBondContact O-N 3.23Å; K116-D118 PolarHBondContact O-N 3.5Å; K116-L119 HydrophobicContact CB-CB 4.34Å; K116-L119 HydrophobicContact CB-CD1 4.42Å; K116-L119 HydrophobicContact CB-CG 4.25Å; K116-L119 HydrophobicContact CD-CD1 3.86Å; K116-L119 HydrophobicContact CD-CG 4.3Å; K116-L119 HydrophobicContact CG-CD1 4.41Å; K116-L119 PolarHBondContact O-N 3.25Å; K116-K146 HydrophobicContact CD-CB 4.09Å; K116-K146 HydrophobicContact CD-CD 4.19Å; K116-K146 HydrophobicContact CD-CG 3.6Å; K116-K146 VanDerWaalsContact CE-CD 3.48Å; K116-K146 HydrophobicContact CG-CD 4.26Å; K116-K146 HydrophobicContact CG-CG 3.9Å; K116-K146 VanDerWaalsContact NZ-CA 3.29Å; K116-K146 PolarHBondContact NZ-O 3.47Å
117	S	61.1	Low	86	Confident	102 Å²	102	47.6 Å²	47.6	71%	0.713	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-32.2	169.4	48.5	0	0	0	0	113.5	L119	S117-L119 VanDerWaalsContact C-N 3.29Å; S117-L119 PolarHBondContact O-N 3.31Å
118	D	70.5	Confident	86.2	Confident	108 Å²	108	41.7 Å²	41.7	58%	0.578	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-18.9	-174.4	-38.8	-28.5	0	0	0	112.2	K116	K116-D118 PolarHBondContact O-N 3.5Å
119	L	79.3	Confident	86.3	Confident	6 Å²	6	41.3 Å²	41.3	3%	0.031	22%	0.222	C	C	.	.	S	Bend	trans	-102.3	96.6	176.2	-63.4	-178.8	0	0	0	107.5	L97 F99 K116 S117 I123 F129 I149 V151	L97-L119 HydrophobicContact CD1-CB 4.16Å; L97-L119 WeakPolarHBondContact CD1-O 3.48Å; F99-L119 HydrophobicContact CE2-CD1 4.44Å; F99-L119 HydrophobicContact CZ-CB 4.16Å; F99-L119 HydrophobicContact CZ-CD1 3.88Å; F99-L119 HydrophobicContact CZ-CD2 4.39Å; F99-L119 HydrophobicContact CZ-CG 4.37Å; K116-L119 HydrophobicContact CB-CB 4.34Å; K116-L119 HydrophobicContact CB-CD1 4.42Å; K116-L119 HydrophobicContact CB-CG 4.25Å; K116-L119 HydrophobicContact CD-CD1 3.86Å; K116-L119 HydrophobicContact CD-CG 4.3Å; K116-L119 HydrophobicContact CG-CD1 4.41Å; K116-L119 PolarHBondContact O-N 3.25Å; S117-L119 VanDerWaalsContact C-N 3.29Å; S117-L119 PolarHBondContact O-N 3.31Å; L119-I123 HydrophobicContact CD2-CD1 4.05Å; L119-F129 HydrophobicContact CD2-CE1 3.99Å; L119-I149 HydrophobicContact CD1-CG2 4.21Å; L119-V151 HydrophobicContact CD2-CG2 3.89Å
120	N	81.6	Confident	86.3	Confident	57 Å²	57	42.3 Å²	42.3	31%	0.305	22%	0.223	S	C	.	.			trans	-108.8	157.4	178.2	-175.1	18.4	0	0	0	110.6	L71 D122 I123	L71-N120 WeakPolarHBondContact CD2-O 3.47Å; N120-D122 PolarHBondContact ND2-OD2 3.31Å; N120-D122 PolarHBondContact O-N 3.04Å; N120-D122 VanDerWaalsContact O-N 3.14Å; N120-I123 VanDerWaalsContact O-CG1 3.3Å; N120-I123 WeakPolarHBondContact O-CG1 3.49Å; N120-I123 PolarHBondContact O-N 2.86Å
121	I	85.5	Confident	86.3	Confident	22 Å²	22	42.3 Å²	42.3	11%	0.113	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.8	174.9	-166.7	159.8	0	0	0	113.5	N73 E81 L97 I123	N73-I121 HydrophobicContact CB-CD1 3.94Å; E81-I121 HydrophobicContact CG-CD1 4.01Å; E81-I121 WeakPolarHBondContact OE1-CD1 3.39Å; L97-I121 HydrophobicContact CD2-CB 4.47Å; I121-I123 PolarHBondContact O-N 3.49Å
122	D	85.6	Confident	86.3	Confident	80 Å²	80	43.6 Å²	43.6	43%	0.428	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-3.6	179.6	-65.6	-39.2	0	0	0	114.5	H91 N120 P124	H91-D122 IonicContact NE2-OD2 3.9Å; N120-D122 PolarHBondContact ND2-OD2 3.31Å; N120-D122 PolarHBondContact O-N 3.04Å; N120-D122 VanDerWaalsContact O-N 3.14Å; D122-P124 WeakPolarHBondContact O-CD 3.16Å
123	I	91.6	Very high	86.3	Confident	23 Å²	23	45 Å²	45	12%	0.118	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-65.6	120.5	175.5	-61	167.9	0	0	0	109.1	L68 L71 L119 N120 I121 T127 F129	L68-I123 HydrophobicContact CD2-CB 4.31Å; L68-I123 HydrophobicContact CD2-CG2 3.72Å; L71-I123 HydrophobicContact CD2-CB 3.98Å; L71-I123 HydrophobicContact CD2-CD1 4.49Å; L119-I123 HydrophobicContact CD2-CD1 4.05Å; N120-I123 VanDerWaalsContact O-CG1 3.3Å; N120-I123 WeakPolarHBondContact O-CG1 3.49Å; N120-I123 PolarHBondContact O-N 2.86Å; I121-I123 PolarHBondContact O-N 3.49Å; I123-T127 HydrophobicContact CG2-CG2 3.92Å; I123-F129 HydrophobicContact CD1-CZ 4.22Å; I123-F129 HydrophobicContact CG2-CE2 4.35Å; I123-F129 HydrophobicContact CG2-CZ 4.08Å
124	P	93.3	Very high	86.6	Confident	37 Å²	37	42 Å²	42	24%	0.24	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-71.9	149.3	-175.5	27.5	-33.3	0	0	0	112.3	D122 T127 I160 W163	D122-P124 WeakPolarHBondContact O-CD 3.16Å; P124-T127 PolarHBondContact O-N 3.48Å; P124-T127 PolarHBondContact O-OG1 3.33Å; P124-I160 HydrophobicContact CB-CD1 4.37Å; P124-I160 HydrophobicContact CB-CG1 4.05Å; P124-W163 HydrophobicContact CB-CE3 4.26Å; P124-W163 HydrophobicContact CB-CH2 4.28Å; P124-W163 HydrophobicContact CB-CZ3 3.9Å
125	P	96.2	Very high	87.3	Confident	9 Å²	9	37.1 Å²	37.1	6%	0.058	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	140.8	164	-30	40.4	0	0	0	112.1	L159 W163	P125-L159 HydrophobicContact CB-CB 4.01Å; P125-W163 VanDerWaalsContact CD-CD2 3.42Å; P125-W163 VanDerWaalsContact CD-CG 3.45Å; P125-W163 HydrophobicContact CG-CB 3.85Å; P125-W163 HydrophobicContact CG-CD2 4.17Å; P125-W163 HydrophobicContact CG-CG 3.65Å
126	G	97.4	Very high	88.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.9	-19.1	-174.8	0	0	0	0	0	114.6	L68 K128	L68-G126 PolarHBondContact O-N 2.86Å; G126-K128 PolarHBondContact O-N 2.81Å; G126-K128 PolarHBondContact O-NZ 3.02Å
127	T	97.6	Very high	89.9	Confident	7 Å²	7	34.5 Å²	34.5	4%	0.043	20%	0.201	C	C	.	.			trans	-58.9	135.1	176.8	-60.6	0	0	0	0	111.5	L68 I123 P124 F129 V151	L68-T127 WeakPolarHBondContact CB-O 3.28Å; L68-T127 PolarHBondContact N-O 3.34Å; I123-T127 HydrophobicContact CG2-CG2 3.92Å; P124-T127 PolarHBondContact O-N 3.48Å; P124-T127 PolarHBondContact O-OG1 3.33Å; T127-F129 HydrophobicContact CG2-CD2 4.21Å; T127-F129 HydrophobicContact CG2-CE2 3.66Å; T127-F129 HydrophobicContact CG2-CZ 4.17Å; T127-F129 WeakPolarHBondContact O-CD2 3.33Å; T127-V151 HydrophobicContact CG2-CG1 3.88Å
128	K	97.6	Very high	91.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	136.2	179.9	-55.1	-64.5	-173.1	-65.5	0	110.2	W11 L37 L38 S40 I42 Y45 I65 V66 Q67 G126 L152 G153	W11-K128 HydrophobicContact CH2-CD 4.32Å; W11-K128 HydrophobicContact CH2-CG 4.05Å; W11-K128 HydrophobicContact CZ3-CD 4.26Å; W11-K128 HydrophobicContact CZ3-CG 4.48Å; L37-K128 WeakPolarHBondContact O-CE 3.44Å; L38-K128 HydrophobicContact CD2-CB 4.02Å; L38-K128 HydrophobicContact CD2-CG 3.99Å; L38-K128 PolarHBondContact O-NZ 3.28Å; S40-K128 WeakPolarHBondContact O-CE 3.3Å; S40-K128 PolarHBondContact O-NZ 3.38Å; I42-K128 HydrophobicContact CD1-CD 3.86Å; I42-K128 HydrophobicContact CG1-CD 3.94Å; Y45-K128 VanDerWaalsContact OH-CE 3.3Å; Y45-K128 WeakPolarHBondContact OH-CE 3.31Å; I65-K128 HydrophobicContact CG2-CB 4.11Å; I65-K128 HydrophobicContact CG2-CD 4.42Å; V66-K128 WeakPolarHBondContact O-CA 3.45Å; Q67-K128 HydrophobicContact CB-CD 4.13Å; Q67-K128 HydrophobicContact CG-CD 4.43Å; G126-K128 PolarHBondContact O-N 2.81Å; G126-K128 PolarHBondContact O-NZ 3.02Å; K128-L152 HydrophobicContact CB-CB 4.14Å; K128-L152 WeakPolarHBondContact O-CB 3.46Å; K128-L152 PolarHBondContact O-N 3.43Å; K128-G153 PolarHBondContact N-O 3.43Å; K128-G153 PolarHBondContact O-N 3.4Å
129	F	96.7	Very high	92.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.9	178.1	-71.3	-99.3	0	0	0	109.6	I65 V66 L68 F99 F101 L119 I123 T127 I149 V150 V151	I65-F129 CarbonylContact C-O 3.58Å; I65-F129 VanDerWaalsContact CA-O 3.3Å; I65-F129 WeakPolarHBondContact CA-O 3.28Å; V66-F129 HydrophobicContact CG2-CB 4.05Å; V66-F129 PolarHBondContact N-O 3.23Å; V66-F129 PolarHBondContact O-N 3.17Å; L68-F129 HydrophobicContact CB-CD2 4.12Å; L68-F129 HydrophobicContact CB-CE2 3.71Å; L68-F129 HydrophobicContact CD2-CE2 3.97Å; L68-F129 HydrophobicContact CD2-CZ 4.38Å; L68-F129 HydrophobicContact CG-CE2 4.36Å; F99-F129 HydrophobicContact CE1-CE1 4.39Å; F99-F129 HydrophobicContact CE1-CZ 4.25Å; F101-F129 HydrophobicContact CD1-CD2 4.49Å; F101-F129 HydrophobicContact CE1-CB 4.19Å; F101-F129 AromaticContact CE1-CD2 3.67Å; F101-F129 HydrophobicContact CE1-CD2 3.67Å; F101-F129 HydrophobicContact CE1-CE2 4.12Å; F101-F129 AromaticContact CE1-CG 3.89Å; F101-F129 HydrophobicContact CE1-CG 3.89Å; F101-F129 HydrophobicContact CZ-CD2 4.49Å; F101-F129 HydrophobicContact CZ-CG 4.34Å; L119-F129 HydrophobicContact CD2-CE1 3.99Å; I123-F129 HydrophobicContact CD1-CZ 4.22Å; I123-F129 HydrophobicContact CG2-CE2 4.35Å; I123-F129 HydrophobicContact CG2-CZ 4.08Å; T127-F129 HydrophobicContact CG2-CD2 4.21Å; T127-F129 HydrophobicContact CG2-CE2 3.66Å; T127-F129 HydrophobicContact CG2-CZ 4.17Å; T127-F129 WeakPolarHBondContact O-CD2 3.33Å; F129-I149 HydrophobicContact CB-CD1 4.38Å; F129-I149 HydrophobicContact CB-CG1 4.33Å; F129-I149 HydrophobicContact CD1-CD1 3.49Å; F129-I149 VanDerWaalsContact CD1-CD1 3.49Å; F129-I149 HydrophobicContact CD1-CG1 3.6Å; F129-I149 HydrophobicContact CE1-CD1 3.98Å; F129-I149 HydrophobicContact CE1-CG1 4.35Å; F129-I149 HydrophobicContact CG-CD1 4.19Å; F129-I149 HydrophobicContact CG-CG1 4.4Å; F129-V150 CarbonylContact C-O 3.59Å; F129-V150 WeakPolarHBondContact CA-O 3.45Å; F129-V151 HydrophobicContact CD1-CG2 4.07Å; F129-V151 HydrophobicContact CE1-CB 4.4Å; F129-V151 HydrophobicContact CE1-CG1 4.44Å; F129-V151 HydrophobicContact CE1-CG2 3.64Å; F129-V151 HydrophobicContact CZ-CG2 4.41Å
130	R	96.2	Very high	92.8	Very high	91 Å²	91	38.3 Å²	38.3	34%	0.343	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	122.3	170.1	-163.7	173.1	70.6	179.1	1.4	109.5	G63 I65 I132 I149 V150 L152	G63-R130 WeakPolarHBondContact O-CD 3.48Å; G63-R130 WeakPolarHBondContact O-CG 3.37Å; I65-R130 HydrophobicContact CG1-CB 4.48Å; I65-R130 HydrophobicContact CG1-CG 4.35Å; R130-I132 HydrophobicContact CG-CG1 4.31Å; R130-I149 WeakPolarHBondContact O-CA 3.39Å; R130-V150 HydrophobicContact CB-CB 4.32Å; R130-V150 PolarHBondContact N-O 3.18Å; R130-V150 PolarHBondContact O-N 2.95Å; R130-L152 HydrophobicContact CB-CD1 4.12Å; R130-L152 HydrophobicContact CB-CD2 4.22Å; R130-L152 HydrophobicContact CB-CG 4.17Å
131	L	95.4	Very high	93.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	128.6	175.4	-62.8	-176.8	0	0	0	109.6	W49 L59 A61 G63 R64 V66 I135 L142 L144 H148 I149	W49-L131 HydrophobicContact CH2-CD1 4.49Å; L59-L131 HydrophobicContact CD2-CD1 4.1Å; A61-L131 HydrophobicContact CB-CB 3.5Å; A61-L131 WeakPolarHBondContact CB-O 3.46Å; G63-L131 CarbonylContact C-O 3.58Å; G63-L131 WeakPolarHBondContact CA-O 3.49Å; G63-L131 PolarHBondContact N-O 3.39Å; G63-L131 VanDerWaalsContact N-O 3.07Å; R64-L131 PolarHBondContact N-O 3.2Å; R64-L131 PolarHBondContact O-N 3.03Å; V66-L131 HydrophobicContact CG1-CD1 3.89Å; V66-L131 HydrophobicContact CG1-CG 4.48Å; V66-L131 HydrophobicContact CG2-CD1 3.99Å; V66-L131 HydrophobicContact CG2-CD2 4.45Å; V66-L131 HydrophobicContact CG2-CG 3.99Å; L131-I135 HydrophobicContact CB-CD1 3.97Å; L131-I135 HydrophobicContact CD1-CD1 4.48Å; L131-I135 HydrophobicContact CD2-CD1 4.21Å; L131-I135 HydrophobicContact CG-CD1 4.44Å; L131-L142 HydrophobicContact CD1-CD1 4.06Å; L131-L144 HydrophobicContact CD2-CD2 4.24Å; L131-H148 CarbonylContact C-O 3.49Å; L131-H148 WeakPolarHBondContact CA-O 3.38Å; L131-I149 HydrophobicContact CD2-CB 4.43Å; L131-I149 HydrophobicContact CD2-CD1 4.22Å; L131-I149 HydrophobicContact CD2-CG1 4.17Å
132	I	94	Very high	93.8	Very high	53 Å²	53	37.3 Å²	37.3	27%	0.272	21%	0.214	S	C	.	.			trans	-123.5	134.4	-169	-54.8	178.8	0	0	0	110.9	R130 H148 V150	R130-I132 HydrophobicContact CG-CG1 4.31Å; I132-H148 PolarHBondContact N-O 3.49Å; I132-H148 WeakPolarHBondContact O-CA 3.46Å; I132-V150 HydrophobicContact CD1-CB 4.35Å; I132-V150 HydrophobicContact CD1-CG2 3.48Å; I132-V150 VanDerWaalsContact CD1-CG2 3.48Å
133	G	91.6	Very high	94.2	Very high	35 Å²	35	35.6 Å²	35.6	36%	0.361	21%	0.205	S	C	.	.	S	Bend	trans	73.4	-161.5	176.6	0	0	0	0	0	113.3	A61	A61-G133 WeakPolarHBondContact CB-O 3.37Å; A61-G133 PolarHBondContact N-O 3.47Å
134	S	93.6	Very high	94.3	Very high	40 Å²	40	34.6 Å²	34.6	28%	0.28	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	121.4	177	-162.6	0	0	0	0	108.7	H58 L59 E60	H58-S134 PolarHBondContact CE1-O 3.32Å; H58-S134 PolarHBondContact CE1-OG 3.44Å; H58-S134 WeakPolarHBondContact ND1-CB 3.5Å; H58-S134 PolarHBondContact ND1-OG 3.08Å; L59-S134 WeakPolarHBondContact O-CA 3.23Å; E60-S134 VanDerWaalsContact OE1-CB 3.24Å; E60-S134 WeakPolarHBondContact OE1-CB 3.5Å; E60-S134 PolarHBondContact OE1-OG 2.95Å; E60-S134 WeakPolarHBondContact OE2-CB 3.36Å; E60-S134 PolarHBondContact OE2-OG 3.26Å
135	I	94.9	Very high	94.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.5	-175.1	-51.9	175.9	0	0	0	110.8	H58 L59 A61 L131 L137 L142 L144 H148	H58-I135 CarbonylContact C-O 3.38Å; H58-I135 WeakPolarHBondContact CA-O 3.39Å; H58-I135 PolarHBondContact CE1-N 3.4Å; H58-I135 PolarHBondContact ND1-N 2.89Å; H58-I135 PolarHBondContact ND1-O 2.97Å; L59-I135 HydrophobicContact CB-CB 4.48Å; L59-I135 PolarHBondContact N-O 3.48Å; L59-I135 PolarHBondContact O-N 3.23Å; A61-I135 HydrophobicContact CB-CD1 4.13Å; L131-I135 HydrophobicContact CB-CD1 3.97Å; L131-I135 HydrophobicContact CD1-CD1 4.48Å; L131-I135 HydrophobicContact CD2-CD1 4.21Å; L131-I135 HydrophobicContact CG-CD1 4.44Å; I135-L137 PolarHBondContact O-N 3.42Å; I135-L142 HydrophobicContact CB-CD2 4.24Å; I135-L142 HydrophobicContact CG2-CB 3.95Å; I135-L142 HydrophobicContact CG2-CD2 3.97Å; I135-L142 HydrophobicContact CG2-CG 4.44Å; I135-L144 HydrophobicContact CD1-CD2 4.25Å; I135-L144 HydrophobicContact CG2-CD2 4.16Å; I135-H148 HydrophobicContact CD1-CB 3.9Å; I135-H148 HydrophobicContact CG1-CB 3.89Å
136	P	94.4	Very high	93.8	Very high	36 Å²	36	38.6 Å²	38.6	23%	0.234	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	134	-179.6	-17.3	25.9	0	0	0	112.1	H58 L142 L143	H58-P136 VanDerWaalsContact CD2-CA 3.48Å; H58-P136 WeakPolarHBondContact CD2-CA 3.44Å; H58-P136 VanDerWaalsContact CE1-CD 3.42Å; H58-P136 WeakPolarHBondContact CE1-CD 3.32Å; H58-P136 WeakPolarHBondContact NE2-CA 3.35Å; H58-P136 WeakPolarHBondContact NE2-CG 3.32Å; P136-L142 WeakPolarHBondContact O-CA 3.3Å; P136-L143 HydrophobicContact CB-CB 4.18Å; P136-L143 HydrophobicContact CB-CD1 4.23Å; P136-L143 HydrophobicContact CB-CG 4.32Å; P136-L143 HydrophobicContact CG-CB 4.4Å; P136-L143 PolarHBondContact O-N 2.91Å
137	L	93.9	Very high	93.4	Very high	18 Å²	18	46.1 Å²	46.1	9%	0.094	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	112.8	177.3	-174.6	67.7	0	0	0	109.3	L53 A56 S57 I108 I135 F141 L142	L53-L137 HydrophobicContact CB-CD2 3.97Å; L53-L137 WeakPolarHBondContact O-CD2 3.21Å; A56-L137 HydrophobicContact CB-CD2 4.31Å; A56-L137 WeakPolarHBondContact O-CD2 3.45Å; S57-L137 PolarHBondContact O-N 2.8Å; I108-L137 HydrophobicContact CD1-CD1 4.26Å; I135-L137 PolarHBondContact O-N 3.42Å; L137-F141 WeakPolarHBondContact CA-O 3.44Å; L137-L142 HydrophobicContact CD1-CD2 3.88Å; L137-L142 HydrophobicContact CD1-CG 4.39Å
138	V	92.6	Very high	93.2	Very high	75 Å²	75	46.4 Å²	46.4	46%	0.455	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.9	-177.9	-179.6	0	0	0	0	109.1	G140 F141 L143	V138-G140 PolarHBondContact O-N 3.09Å; V138-G140 VanDerWaalsContact O-N 3.1Å; V138-F141 PolarHBondContact N-O 3.47Å; V138-F141 WeakPolarHBondContact O-CB 3.29Å; V138-F141 PolarHBondContact O-N 3.01Å; V138-L143 HydrophobicContact CB-CD1 4.49Å; V138-L143 HydrophobicContact CG2-CD1 3.88Å; V138-L143 HydrophobicContact CG2-CG 4.34Å
139	M	89.7	Confident	93	Very high	180 Å²	180	46.7 Å²	46.7	89%	0.887	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	35	-179.8	-57.8	-60.9	171.6	0	0	113.7	F141	M139-F141 WeakPolarHBondContact O-CD2 3.36Å
140	G	89.3	Confident	92.9	Very high	41 Å²	41	49.4 Å²	49.4	42%	0.423	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	3.5	-178.3	0	0	0	0	0	115.7	V138	V138-G140 PolarHBondContact O-N 3.09Å; V138-G140 VanDerWaalsContact O-N 3.1Å
141	F	93.8	Very high	92.8	Very high	58 Å²	58	48.2 Å²	48.2	25%	0.254	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.2	176.7	-66	-85.7	0	0	0	112.2	R98 F109 L111 L137 V138 M139	R98-F141 HydrophobicContact CG-CE1 4.26Å; F109-F141 HydrophobicContact CB-CD1 3.45Å; F109-F141 VanDerWaalsContact CB-CD1 3.45Å; F109-F141 HydrophobicContact CB-CE1 3.58Å; F109-F141 HydrophobicContact CB-CG 4.36Å; F109-F141 HydrophobicContact CG-CD1 4.44Å; F109-F141 HydrophobicContact CG-CE1 4.13Å; F109-F141 CarbonylContact O-C 3.59Å; F109-F141 WeakPolarHBondContact O-CA 3.35Å; L111-F141 HydrophobicContact CD1-CB 3.88Å; L111-F141 HydrophobicContact CD1-CD1 3.86Å; L111-F141 HydrophobicContact CD1-CG 3.84Å; L111-F141 HydrophobicContact CD2-CD1 3.97Å; L111-F141 HydrophobicContact CD2-CE1 4.26Å; L111-F141 HydrophobicContact CG-CB 4.08Å; L111-F141 HydrophobicContact CG-CD1 3.65Å; L111-F141 HydrophobicContact CG-CE1 4.41Å; L111-F141 HydrophobicContact CG-CG 4.08Å; L137-F141 WeakPolarHBondContact CA-O 3.44Å; V138-F141 PolarHBondContact N-O 3.47Å; V138-F141 WeakPolarHBondContact O-CB 3.29Å; V138-F141 PolarHBondContact O-N 3.01Å; M139-F141 WeakPolarHBondContact O-CD2 3.36Å
142	L	94.7	Very high	92.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	123.8	165.4	-64.9	178.5	0	0	0	109.8	L59 I108 F109 G110 L111 L131 I135 P136 L137 L144	L59-L142 HydrophobicContact CB-CD2 3.55Å; L59-L142 HydrophobicContact CD2-CD1 3.68Å; L59-L142 HydrophobicContact CD2-CD2 3.6Å; L59-L142 HydrophobicContact CD2-CG 4.26Å; L59-L142 HydrophobicContact CG-CD2 4.21Å; I108-L142 HydrophobicContact CD1-CD1 3.72Å; I108-L142 HydrophobicContact CD1-CD2 3.73Å; I108-L142 HydrophobicContact CD1-CG 3.55Å; I108-L142 HydrophobicContact CG1-CD1 4.11Å; I108-L142 HydrophobicContact CG1-CG 3.93Å; I108-L142 HydrophobicContact CG2-CD1 4.28Å; F109-L142 PolarHBondContact O-N 2.95Å; G110-L142 CarbonylContact C-O 3.58Å; G110-L142 WeakPolarHBondContact CA-O 3.46Å; L111-L142 PolarHBondContact N-O 3.41Å; L131-L142 HydrophobicContact CD1-CD1 4.06Å; I135-L142 HydrophobicContact CB-CD2 4.24Å; I135-L142 HydrophobicContact CG2-CB 3.95Å; I135-L142 HydrophobicContact CG2-CD2 3.97Å; I135-L142 HydrophobicContact CG2-CG 4.44Å; P136-L142 WeakPolarHBondContact O-CA 3.3Å; L137-L142 HydrophobicContact CD1-CD2 3.88Å; L137-L142 HydrophobicContact CD1-CG 4.39Å; L142-L144 HydrophobicContact CB-CD2 4.06Å; L142-L144 HydrophobicContact CB-CG 4.28Å; L142-L144 HydrophobicContact CD1-CD2 4.44Å; L142-L144 PolarHBondContact O-N 3.42Å
143	L	94.4	Very high	92.8	Very high	45 Å²	45	49.8 Å²	49.8	24%	0.236	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	94.3	173.4	-55.7	-171.1	0	0	0	109.2	M113 P136 V138 H148	M113-L143 HydrophobicContact CG-CB 4.02Å; M113-L143 HydrophobicContact CG-CD2 4.37Å; M113-L143 HydrophobicContact SD-CD2 3.96Å; P136-L143 HydrophobicContact CB-CB 4.18Å; P136-L143 HydrophobicContact CB-CD1 4.23Å; P136-L143 HydrophobicContact CB-CG 4.32Å; P136-L143 HydrophobicContact CG-CB 4.4Å; P136-L143 PolarHBondContact O-N 2.91Å; V138-L143 HydrophobicContact CB-CD1 4.49Å; V138-L143 HydrophobicContact CG2-CD1 3.88Å; V138-L143 HydrophobicContact CG2-CG 4.34Å; L143-H148 PolarHBondContact O-ND1 3.2Å
144	L	93.5	Very high	93	Very high	1 Å²	1	49 Å²	49	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	142.9	-175.5	-57.6	169.5	0	0	0	110.4	F99 F101 L111 M113 L131 I135 L142 H148 I149	F99-L144 HydrophobicContact CD2-CD1 3.99Å; F99-L144 HydrophobicContact CE2-CD1 4.5Å; F99-L144 HydrophobicContact CG-CD1 4.46Å; F101-L144 HydrophobicContact CE2-CD1 3.95Å; F101-L144 HydrophobicContact CZ-CD1 4.49Å; L111-L144 WeakPolarHBondContact O-CA 3.2Å; L111-L144 WeakPolarHBondContact O-CB 3.45Å; L111-L144 PolarHBondContact O-N 3.46Å; M113-L144 WeakPolarHBondContact CB-O 3.28Å; M113-L144 PolarHBondContact N-O 3.02Å; L131-L144 HydrophobicContact CD2-CD2 4.24Å; I135-L144 HydrophobicContact CD1-CD2 4.25Å; I135-L144 HydrophobicContact CG2-CD2 4.16Å; L142-L144 HydrophobicContact CB-CD2 4.06Å; L142-L144 HydrophobicContact CB-CG 4.28Å; L142-L144 HydrophobicContact CD1-CD2 4.44Å; L142-L144 PolarHBondContact O-N 3.42Å; L144-H148 HydrophobicContact CD2-CB 4.37Å; L144-I149 HydrophobicContact CD1-CD1 4.02Å
145	S	90.1	Very high	93.1	Very high	19 Å²	19	50.3 Å²	50.3	13%	0.133	28%	0.281	C	S	.	.			trans	-139.2	170.8	175.5	-68.1	0	0	0	0	108.3	K147 H148	S145-K147 PolarHBondContact O-N 2.82Å; S145-H148 PolarHBondContact N-ND1 2.85Å; S145-H148 PolarHBondContact O-N 2.86Å
146	K	87.5	Confident	93.2	Very high	112 Å²	112	50.5 Å²	50.5	49%	0.487	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-32.6	-174.4	-53	-149.3	167.3	178.2	0	113.9	Q114 K116	Q114-K146 VanDerWaalsContact OE1-CG 3.24Å; K116-K146 HydrophobicContact CD-CB 4.09Å; K116-K146 HydrophobicContact CD-CD 4.19Å; K116-K146 HydrophobicContact CD-CG 3.6Å; K116-K146 VanDerWaalsContact CE-CD 3.48Å; K116-K146 HydrophobicContact CG-CD 4.26Å; K116-K146 HydrophobicContact CG-CG 3.9Å; K116-K146 VanDerWaalsContact NZ-CA 3.29Å; K116-K146 PolarHBondContact NZ-O 3.47Å
147	K	90.6	Very high	93.2	Very high	158 Å²	158	53.9 Å²	53.9	69%	0.687	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-18.8	-179.3	65.9	-177.5	-172.3	178.3	0	114.9	S145	S145-K147 PolarHBondContact O-N 2.82Å
148	H	92.5	Very high	93.2	Very high	13 Å²	13	57.3 Å²	57.3	6%	0.06	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-15.6	-172.5	-62	151.9	0	0	0	113.7	L131 I132 I135 L143 L144 S145	L131-H148 CarbonylContact C-O 3.49Å; L131-H148 WeakPolarHBondContact CA-O 3.38Å; I132-H148 PolarHBondContact N-O 3.49Å; I132-H148 WeakPolarHBondContact O-CA 3.46Å; I135-H148 HydrophobicContact CD1-CB 3.9Å; I135-H148 HydrophobicContact CG1-CB 3.89Å; L143-H148 PolarHBondContact O-ND1 3.2Å; L144-H148 HydrophobicContact CD2-CB 4.37Å; S145-H148 PolarHBondContact N-ND1 2.85Å; S145-H148 PolarHBondContact O-N 2.86Å
149	I	93.5	Very high	93.3	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.026	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	131.2	-167.1	-169	164.5	0	0	0	112.1	F101 L119 F129 R130 L131 L144	F101-I149 HydrophobicContact CE2-CD1 4.31Å; F101-I149 HydrophobicContact CZ-CD1 3.74Å; L119-I149 HydrophobicContact CD1-CG2 4.21Å; F129-I149 HydrophobicContact CB-CD1 4.38Å; F129-I149 HydrophobicContact CB-CG1 4.33Å; F129-I149 HydrophobicContact CD1-CD1 3.49Å; F129-I149 VanDerWaalsContact CD1-CD1 3.49Å; F129-I149 HydrophobicContact CD1-CG1 3.6Å; F129-I149 HydrophobicContact CE1-CD1 3.98Å; F129-I149 HydrophobicContact CE1-CG1 4.35Å; F129-I149 HydrophobicContact CG-CD1 4.19Å; F129-I149 HydrophobicContact CG-CG1 4.4Å; R130-I149 WeakPolarHBondContact O-CA 3.39Å; L131-I149 HydrophobicContact CD2-CB 4.43Å; L131-I149 HydrophobicContact CD2-CD1 4.22Å; L131-I149 HydrophobicContact CD2-CG1 4.17Å; L144-I149 HydrophobicContact CD1-CD1 4.02Å
150	V	93.9	Very high	93.5	Very high	57 Å²	57	47.6 Å²	47.6	35%	0.345	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.8	174.9	175.9	0	0	0	0	109	F129 R130 I132 L152	F129-V150 CarbonylContact C-O 3.59Å; F129-V150 WeakPolarHBondContact CA-O 3.45Å; R130-V150 HydrophobicContact CB-CB 4.32Å; R130-V150 PolarHBondContact N-O 3.18Å; R130-V150 PolarHBondContact O-N 2.95Å; I132-V150 HydrophobicContact CD1-CB 4.35Å; I132-V150 HydrophobicContact CD1-CG2 3.48Å; I132-V150 VanDerWaalsContact CD1-CG2 3.48Å; V150-L152 HydrophobicContact CG1-CD2 4.38Å
151	V	94.5	Very high	93.7	Very high	67 Å²	67	52.3 Å²	52.3	41%	0.406	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	124	175.5	-171.2	0	0	0	0	108.4	L119 T127 F129	L119-V151 HydrophobicContact CD2-CG2 3.89Å; T127-V151 HydrophobicContact CG2-CG1 3.88Å; F129-V151 HydrophobicContact CD1-CG2 4.07Å; F129-V151 HydrophobicContact CE1-CB 4.4Å; F129-V151 HydrophobicContact CE1-CG1 4.44Å; F129-V151 HydrophobicContact CE1-CG2 3.64Å; F129-V151 HydrophobicContact CZ-CG2 4.41Å
152	L	95.4	Very high	93.6	Very high	61 Å²	61	55.1 Å²	55.1	32%	0.319	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	-19.3	174.8	-58.8	-179.2	0	0	0	112.4	L38 I65 K128 R130 V150	L38-L152 HydrophobicContact CD2-CB 3.89Å; I65-L152 HydrophobicContact CD1-CD1 3.52Å; I65-L152 HydrophobicContact CG1-CD1 3.73Å; I65-L152 HydrophobicContact CG2-CD1 4.31Å; K128-L152 HydrophobicContact CB-CB 4.14Å; K128-L152 WeakPolarHBondContact O-CB 3.46Å; K128-L152 PolarHBondContact O-N 3.43Å; R130-L152 HydrophobicContact CB-CD1 4.12Å; R130-L152 HydrophobicContact CB-CD2 4.22Å; R130-L152 HydrophobicContact CB-CG 4.17Å; V150-L152 HydrophobicContact CG1-CD2 4.38Å
153	G	94.9	Very high	93.4	Very high	24 Å²	24	57.8 Å²	57.8	25%	0.247	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	89.2	-143.5	-176.9	0	0	0	0	0	112.2	K128	K128-G153 PolarHBondContact N-O 3.43Å; K128-G153 PolarHBondContact O-N 3.4Å
154	G	95.2	Very high	93.1	Very high	18 Å²	18	58.5 Å²	58.5	19%	0.186	30%	0.299	C	S	.	.			trans	89.3	147.8	-176.6	0	0	0	0	0	113.7	L38	L38-G154 VanDerWaalsContact O-CA 3.29Å; L38-G154 WeakPolarHBondContact O-CA 3.45Å
155	T	95.4	Very high	92.8	Very high	68 Å²	68	64.3 Å²	64.3	42%	0.417	33%	0.327	S	S	.	.			trans	-126.1	123.7	-173.5	55.9	0	0	0	0	110.7	N39 I160	N39-T155 CarbonylContact C-O 3.56Å; N39-T155 WeakPolarHBondContact CA-O 2.97Å; N39-T155 PolarHBondContact OD1-N 2.83Å; N39-T155 PolarHBondContact OD1-OG1 3.08Å; T155-I160 HydrophobicContact CG2-CD1 4.4Å
156	V	97.2	Very high	92.5	Very high	5 Å²	5	66.9 Å²	66.9	3%	0.03	34%	0.339	C	S	.	.			trans	-115.9	96.2	177.2	-177.2	0	0	0	0	108.4	D41 N158 L159 I160	D41-V156 HydrophobicContact CB-CG1 3.94Å; V156-N158 VanDerWaalsContact C-N 3.27Å; V156-N158 PolarHBondContact O-N 2.77Å; V156-N158 VanDerWaalsContact O-N 3.14Å; V156-L159 HydrophobicContact CB-CB 4.35Å; V156-L159 HydrophobicContact CB-CD1 4.21Å; V156-L159 HydrophobicContact CB-CG 4.48Å; V156-L159 HydrophobicContact CG1-CB 4.26Å; V156-L159 HydrophobicContact CG1-CD1 3.97Å; V156-L159 HydrophobicContact CG1-CG 3.99Å; V156-L159 PolarHBondContact O-N 2.83Å; V156-I160 WeakPolarHBondContact O-CG1 3.5Å; V156-I160 PolarHBondContact O-N 3.02Å
157	N	94.4	Very high	92.2	Very high	107 Å²	107	63.5 Å²	63.5	57%	0.572	33%	0.325	S	S	*	.	H	α-helix	trans	-54.4	-38.2	-168.8	-70.6	-29.3	0	0	0	114.2	R161	N157-R161 VanDerWaalsContact O-CB 3.32Å; N157-R161 WeakPolarHBondContact O-CB 3.46Å; N157-R161 WeakPolarHBondContact O-CG 3.28Å; N157-R161 PolarHBondContact O-N 3.26Å
158	N	94.2	Very high	91.3	Very high	89 Å²	89	63 Å²	63	48%	0.476	32%	0.323	S	S	.	.	H	α-helix	trans	-60.9	-48.4	178	-71.2	-25.1	0	0	0	111.7	V156 R161 E162	V156-N158 VanDerWaalsContact C-N 3.27Å; V156-N158 PolarHBondContact O-N 2.77Å; V156-N158 VanDerWaalsContact O-N 3.14Å; N158-R161 PolarHBondContact O-N 3.44Å; N158-R161 VanDerWaalsContact OD1-CZ 3.25Å; N158-R161 PolarHBondContact OD1-NH1 3.18Å; N158-R161 PolarHBondContact OD1-NH2 3.4Å; N158-E162 PolarHBondContact O-N 2.77Å; N158-E162 VanDerWaalsContact O-N 3.09Å
159	L	95.3	Very high	90.4	Very high	17 Å²	17	68 Å²	68	9%	0.089	35%	0.349	C	S	.	.	H	α-helix	trans	-68.8	-39.5	-179.9	-70.2	178.8	0	0	0	112	P125 V156 E162 W163	P125-L159 HydrophobicContact CB-CB 4.01Å; V156-L159 HydrophobicContact CB-CB 4.35Å; V156-L159 HydrophobicContact CB-CD1 4.21Å; V156-L159 HydrophobicContact CB-CG 4.48Å; V156-L159 HydrophobicContact CG1-CB 4.26Å; V156-L159 HydrophobicContact CG1-CD1 3.97Å; V156-L159 HydrophobicContact CG1-CG 3.99Å; V156-L159 PolarHBondContact O-N 2.83Å; L159-E162 PolarHBondContact O-N 3.01Å; L159-W163 WeakPolarHBondContact O-CB 3.26Å; L159-W163 PolarHBondContact O-N 3.11Å
160	I	94.1	Very high	89.4	Confident	34 Å²	34	70.9 Å²	70.9	17%	0.174	36%	0.362	C	S	.	.	H	α-helix	trans	-65	-42.7	176.9	-64.9	172.8	0	0	0	110.6	P124 T155 V156 W163 N164	P124-I160 HydrophobicContact CB-CD1 4.37Å; P124-I160 HydrophobicContact CB-CG1 4.05Å; T155-I160 HydrophobicContact CG2-CD1 4.4Å; V156-I160 WeakPolarHBondContact O-CG1 3.5Å; V156-I160 PolarHBondContact O-N 3.02Å; I160-W163 PolarHBondContact O-N 3.01Å; I160-N164 WeakPolarHBondContact O-CB 3.39Å; I160-N164 VanDerWaalsContact O-CG 3.27Å; I160-N164 PolarHBondContact O-N 3.41Å; I160-N164 PolarHBondContact O-ND2 2.98Å
161	R	93	Very high	87.7	Confident	140 Å²	140	68.9 Å²	68.9	53%	0.528	35%	0.352	S	S	.	.	H	α-helix	trans	-59.7	-50.8	175.9	-82.2	-171.1	-94.4	100.9	-5.5	111.6	N157 N158 W163 N164 M165	N157-R161 VanDerWaalsContact O-CB 3.32Å; N157-R161 WeakPolarHBondContact O-CB 3.46Å; N157-R161 WeakPolarHBondContact O-CG 3.28Å; N157-R161 PolarHBondContact O-N 3.26Å; N158-R161 PolarHBondContact O-N 3.44Å; N158-R161 VanDerWaalsContact OD1-CZ 3.25Å; N158-R161 PolarHBondContact OD1-NH1 3.18Å; N158-R161 PolarHBondContact OD1-NH2 3.4Å; R161-W163 VanDerWaalsContact C-N 3.33Å; R161-W163 PolarHBondContact O-N 2.77Å; R161-N164 PolarHBondContact O-N 3.45Å; R161-M165 WeakPolarHBondContact O-CG 3.48Å; R161-M165 PolarHBondContact O-N 3.07Å
162	E	91.9	Very high	85.6	Confident	117 Å²	117	70.3 Å²	70.3	55%	0.547	36%	0.362	S	S	.	.	H	α-helix	trans	-60.1	-43.2	177.8	-173.3	-176.3	162.3	0	0	111.8	N158 L159 M165 N166	N158-E162 PolarHBondContact O-N 2.77Å; N158-E162 VanDerWaalsContact O-N 3.09Å; L159-E162 PolarHBondContact O-N 3.01Å; E162-M165 PolarHBondContact O-N 2.79Å; E162-N166 WeakPolarHBondContact O-CB 3.41Å; E162-N166 PolarHBondContact O-N 2.82Å; E162-N166 PolarHBondContact O-ND2 3.38Å
163	W	90.7	Very high	83.5	Confident	56 Å²	56	71.3 Å²	71.3	21%	0.212	37%	0.367	C	S	.	.	H	α-helix	trans	-62.6	-47	177.5	179.7	63.9	0	0	0	112.7	P124 P125 L159 I160 R161 N166 K167	P124-W163 HydrophobicContact CB-CE3 4.26Å; P124-W163 HydrophobicContact CB-CH2 4.28Å; P124-W163 HydrophobicContact CB-CZ3 3.9Å; P125-W163 VanDerWaalsContact CD-CD2 3.42Å; P125-W163 VanDerWaalsContact CD-CG 3.45Å; P125-W163 HydrophobicContact CG-CB 3.85Å; P125-W163 HydrophobicContact CG-CD2 4.17Å; P125-W163 HydrophobicContact CG-CG 3.65Å; L159-W163 WeakPolarHBondContact O-CB 3.26Å; L159-W163 PolarHBondContact O-N 3.11Å; I160-W163 PolarHBondContact O-N 3.01Å; R161-W163 VanDerWaalsContact C-N 3.33Å; R161-W163 PolarHBondContact O-N 2.77Å; W163-N166 PolarHBondContact O-N 3.3Å; W163-K167 HydrophobicContact CD2-CD 4.38Å; W163-K167 HydrophobicContact CZ2-CD 4.26Å; W163-K167 WeakPolarHBondContact O-CG 3.36Å; W163-K167 PolarHBondContact O-N 3Å
164	N	88	Confident	81.3	Confident	60 Å²	60	76 Å²	76	32%	0.321	39%	0.387	S	S	.	.	H	α-helix	trans	-61.8	-45.9	176.8	-74.9	-19.4	0	0	0	110.9	I160 R161 N166 K167 F168	I160-N164 WeakPolarHBondContact O-CB 3.39Å; I160-N164 VanDerWaalsContact O-CG 3.27Å; I160-N164 PolarHBondContact O-N 3.41Å; I160-N164 PolarHBondContact O-ND2 2.98Å; R161-N164 PolarHBondContact O-N 3.45Å; N164-N166 VanDerWaalsContact C-N 3.3Å; N164-N166 PolarHBondContact O-N 2.83Å; N164-K167 WeakPolarHBondContact O-CB 3.31Å; N164-K167 PolarHBondContact O-N 3.44Å; N164-K167 VanDerWaalsContact O-N 3.13Å; N164-F168 HydrophobicContact CB-CD2 4.4Å; N164-F168 HydrophobicContact CB-CE2 4.08Å; N164-F168 WeakPolarHBondContact O-CD2 3.28Å; N164-F168 PolarHBondContact O-N 3.4Å
165	M	86	Confident	78.9	Confident	123 Å²	123	84.4 Å²	84.4	61%	0.606	41%	0.413	S	S	*	.	H	α-helix	trans	-56	-45.4	175.1	-75	-171.5	67.7	0	0	111.8	R161 E162 K167 F168 L169	R161-M165 WeakPolarHBondContact O-CG 3.48Å; R161-M165 PolarHBondContact O-N 3.07Å; E162-M165 PolarHBondContact O-N 2.79Å; M165-K167 PolarHBondContact O-N 3.25Å; M165-F168 PolarHBondContact O-N 3.48Å; M165-L169 VanDerWaalsContact O-CG 3.3Å; M165-L169 WeakPolarHBondContact O-CG 3.28Å; M165-L169 PolarHBondContact O-N 2.81Å
166	N	84.2	Confident	76.6	Confident	73 Å²	73	88.7 Å²	88.7	39%	0.39	43%	0.432	S	S	.	.	H	α-helix	trans	-62.4	-42.7	176.5	-74.3	-27.4	0	0	0	112.1	E162 W163 N164 F168 L169 K170	E162-N166 WeakPolarHBondContact O-CB 3.41Å; E162-N166 PolarHBondContact O-N 2.82Å; E162-N166 PolarHBondContact O-ND2 3.38Å; W163-N166 PolarHBondContact O-N 3.3Å; N164-N166 VanDerWaalsContact C-N 3.3Å; N164-N166 PolarHBondContact O-N 2.83Å; N166-F168 PolarHBondContact O-N 3Å; N166-L169 PolarHBondContact O-N 3.42Å; N166-K170 WeakPolarHBondContact O-CB 3.31Å; N166-K170 VanDerWaalsContact O-CD 3.28Å; N166-K170 WeakPolarHBondContact O-CD 3.45Å; N166-K170 VanDerWaalsContact O-CG 3.3Å; N166-K170 WeakPolarHBondContact O-CG 3.35Å; N166-K170 PolarHBondContact O-N 2.93Å
167	K	80.3	Confident	73.8	Confident	42 Å²	42	96.7 Å²	96.7	18%	0.183	47%	0.473	C	S	.	.	H	α-helix	trans	-58.4	-46.6	174.6	-72.8	-168.3	163.8	-178.5	0	111.6	L85 W163 N164 M165 K170 G171	L85-K167 HydrophobicContact CD1-CB 4.34Å; L85-K167 HydrophobicContact CD1-CG 4.03Å; L85-K167 HydrophobicContact CD2-CD 4.38Å; W163-K167 HydrophobicContact CD2-CD 4.38Å; W163-K167 HydrophobicContact CZ2-CD 4.26Å; W163-K167 WeakPolarHBondContact O-CG 3.36Å; W163-K167 PolarHBondContact O-N 3Å; N164-K167 WeakPolarHBondContact O-CB 3.31Å; N164-K167 PolarHBondContact O-N 3.44Å; N164-K167 VanDerWaalsContact O-N 3.13Å; M165-K167 PolarHBondContact O-N 3.25Å; K167-K170 PolarHBondContact O-N 3.06Å; K167-G171 PolarHBondContact O-N 3.09Å
168	F	73.4	Confident	71.5	Confident	148 Å²	148	95.6 Å²	95.6	65%	0.649	49%	0.487	S	S	*	.	H	α-helix	trans	-62.4	-45.3	179.1	-71.6	-63	0	0	0	112	N164 M165 N166 K170 G171 T172	N164-F168 HydrophobicContact CB-CD2 4.4Å; N164-F168 HydrophobicContact CB-CE2 4.08Å; N164-F168 WeakPolarHBondContact O-CD2 3.28Å; N164-F168 PolarHBondContact O-N 3.4Å; M165-F168 PolarHBondContact O-N 3.48Å; N166-F168 PolarHBondContact O-N 3Å; F168-K170 PolarHBondContact O-N 3.39Å; F168-G171 PolarHBondContact O-N 3.47Å; F168-T172 WeakPolarHBondContact O-CG2 3.34Å; F168-T172 PolarHBondContact O-N 3.22Å; F168-T172 VanDerWaalsContact O-N 3.11Å; F168-T172 PolarHBondContact O-OG1 2.95Å; F168-T172 VanDerWaalsContact O-OG1 3.07Å
169	L	73.7	Confident	69.3	Low	117 Å²	117	96.4 Å²	96.4	61%	0.613	50%	0.5	S	S	*	.	H	α-helix	trans	-64.9	-37.3	179.7	-69.9	172.2	0	0	0	112.9	M165 N166 T172	M165-L169 VanDerWaalsContact O-CG 3.3Å; M165-L169 WeakPolarHBondContact O-CG 3.28Å; M165-L169 PolarHBondContact O-N 2.81Å; N166-L169 PolarHBondContact O-N 3.42Å; L169-T172 PolarHBondContact O-OG1 2.86Å
170	K	71.5	Confident	67.1	Low	66 Å²	66	97.4 Å²	97.4	29%	0.287	52%	0.515	S	S	.	.	H	α-helix	trans	-74.6	-36.5	177.1	-75.3	159.5	161.3	-97.8	0	112.4	D82 N166 K167 F168 T172	D82-K170 HydrophobicContact CB-CB 4.11Å; D82-K170 WeakPolarHBondContact OD1-CD 3.45Å; D82-K170 IonicContact OD1-NZ 3.09Å; D82-K170 PolarHBondContact OD1-NZ 3.24Å; D82-K170 IonicContact OD2-NZ 3.52Å; D82-K170 PolarHBondContact OD2-NZ 3.12Å; N166-K170 WeakPolarHBondContact O-CB 3.31Å; N166-K170 VanDerWaalsContact O-CD 3.28Å; N166-K170 WeakPolarHBondContact O-CD 3.45Å; N166-K170 VanDerWaalsContact O-CG 3.3Å; N166-K170 WeakPolarHBondContact O-CG 3.35Å; N166-K170 PolarHBondContact O-N 2.93Å; K167-K170 PolarHBondContact O-N 3.06Å; F168-K170 PolarHBondContact O-N 3.39Å; K170-T172 VanDerWaalsContact C-N 3.29Å; K170-T172 PolarHBondContact O-N 3.45Å
171	G	57.5	Low	65.2	Low	14 Å²	14	100.3 Å²	100.3	14%	0.144	54%	0.543	C	S	.	.	H	α-helix	trans	-72.8	-19.9	178.1	0	0	0	0	0	113.5	N86 K167 F168 D173	N86-G171 VanDerWaalsContact ND2-C 3.31Å; N86-G171 WeakPolarHBondContact ND2-CA 3.27Å; N86-G171 PolarHBondContact ND2-O 3.39Å; K167-G171 PolarHBondContact O-N 3.09Å; F168-G171 PolarHBondContact O-N 3.47Å; G171-D173 PolarHBondContact O-N 3.38Å
172	T	51.6	Low	63.7	Low	98 Å²	98	99.6 Å²	99.6	60%	0.601	56%	0.557	S	S	*	*			trans	-80.6	44.3	174.7	44.7	0	0	0	0	113.1	F168 L169 K170 N174	F168-T172 WeakPolarHBondContact O-CG2 3.34Å; F168-T172 PolarHBondContact O-N 3.22Å; F168-T172 VanDerWaalsContact O-N 3.11Å; F168-T172 PolarHBondContact O-OG1 2.95Å; F168-T172 VanDerWaalsContact O-OG1 3.07Å; L169-T172 PolarHBondContact O-OG1 2.86Å; K170-T172 VanDerWaalsContact C-N 3.29Å; K170-T172 PolarHBondContact O-N 3.45Å; T172-N174 VanDerWaalsContact C-N 3.29Å; T172-N174 PolarHBondContact O-N 3.48Å
173	D	50.9	Low	62.7	Low	81 Å²	81	101.8 Å²	101.8	43%	0.433	57%	0.569	S	S	.	*			trans	-72.7	86.8	165.5	-87.5	-23.1	0	0	0	109.9	G171 R175	G171-D173 PolarHBondContact O-N 3.38Å; D173-R175 VanDerWaalsContact C-N 3.31Å; D173-R175 PolarHBondContact O-N 3.09Å
174	N	48.1	Very low	62	Low	123 Å²	123	106.9 Å²	106.9	66%	0.658	59%	0.593	S	S	*	*	S	Bend	trans	54.5	12.1	131.2	-67	-31.1	0	0	0	121	T172	T172-N174 VanDerWaalsContact C-N 3.29Å; T172-N174 PolarHBondContact O-N 3.48Å
175	R	46.5	Very low	61.6	Low	194 Å²	194	105.7 Å²	105.7	73%	0.732	59%	0.588	S	S	*	*			trans	-114.7	7.3	-169.2	-68.7	-173.5	-171.4	141	4.6	118.2	D173	D173-R175 VanDerWaalsContact C-N 3.31Å; D173-R175 PolarHBondContact O-N 3.09Å
176	L	46	Very low	61.3	Low	158 Å²	158	102.3 Å²	102.3	83%	0.827	58%	0.575	S	S	*	*	S	Bend	trans	-128.4	91.2	170.4	-77.6	155.3	0	0	0	109.1
177	I	38.6	Very low	61	Low	173 Å²	173	108.2 Å²	108.2	89%	0.887	60%	0.597	S	S	*	*	S	Bend	trans	40.2	89.6	156.7	-48.1	175.8	0	0	0	114.5
178	G	45.8	Very low	61	Low	85 Å²	85	109.9 Å²	109.9	88%	0.876	63%	0.627	S	S	*	*	S	Bend	trans	95.3	5.1	153.4	0	0	0	0	0	119
179	S	47.7	Very low	61.5	Low	105 Å²	105	104 Å²	104	73%	0.734	60%	0.604	S	S	*	*			trans	-108.2	37.6	178.1	-170.8	0	0	0	0	113.8
180	G	48.9	Very low	62.1	Low	39 Å²	39	108.8 Å²	108.8	40%	0.402	61%	0.614	S	S	.	*	S	Bend	trans	-69.8	178.5	161.7	0	0	0	0	0	110.5	P182	G180-P182 VanDerWaalsContact O-N 3.13Å
181	A	55.8	Low	62.5	Low	94 Å²	94	111.5 Å²	111.5	78%	0.777	63%	0.628	S	S	*	*	S	Bend	trans	-44.6	129	164.8	0	0	0	0	0	107.9	M183	A181-M183 PolarHBondContact O-N 2.92Å; A181-M183 VanDerWaalsContact O-N 3.08Å
182	P	61.8	Low	63.7	Low	125 Å²	125	111.3 Å²	111.3	81%	0.812	63%	0.625	S	S	*	*			trans	-51.1	127.6	-174	20	-31.6	0	0	0	107.6	G180 F184	G180-P182 VanDerWaalsContact O-N 3.13Å; P182-F184 PolarHBondContact O-N 3.45Å; P182-F184 VanDerWaalsContact O-N 3.13Å
183	M	70.3	Confident	65	Low	163 Å²	163	109.2 Å²	109.2	80%	0.803	61%	0.614	S	S	*	*			trans	-49.3	128.8	-179.5	-81.4	179.5	51.9	0	0	107.9	A181 V185	A181-M183 PolarHBondContact O-N 2.92Å; A181-M183 VanDerWaalsContact O-N 3.08Å; M183-V185 VanDerWaalsContact O-CG2 3.23Å; M183-V185 WeakPolarHBondContact O-CG2 3.49Å; M183-V185 PolarHBondContact O-N 2.9Å
184	F	75.8	Confident	66.4	Low	163 Å²	163	108.5 Å²	108.5	72%	0.715	62%	0.615	S	S	*	*			trans	-59	112.8	178.2	179	-93	0	0	0	108	P182 P186	P182-F184 PolarHBondContact O-N 3.45Å; P182-F184 VanDerWaalsContact O-N 3.13Å; F184-P186 HydrophobicContact CE1-CB 3.9Å; F184-P186 WeakPolarHBondContact O-CD 3.42Å
185	V	79.8	Confident	67.7	Low	35 Å²	35	106.1 Å²	106.1	21%	0.212	60%	0.602	C	S	.	*			trans	-99.8	109	175.9	-171.7	0	0	0	0	107.4	M183 F187 S189 E191 A192 L195	M183-V185 VanDerWaalsContact O-CG2 3.23Å; M183-V185 WeakPolarHBondContact O-CG2 3.49Å; M183-V185 PolarHBondContact O-N 2.9Å; V185-F187 PolarHBondContact O-N 3.05Å; V185-S189 VanDerWaalsContact CG1-OG 3.25Å; V185-S189 WeakPolarHBondContact CG1-OG 3.41Å; V185-E191 HydrophobicContact CG1-CB 3.47Å; V185-E191 VanDerWaalsContact CG1-CB 3.47Å; V185-A192 HydrophobicContact CG1-CB 3.78Å; V185-L195 HydrophobicContact CB-CD1 4.11Å; V185-L195 HydrophobicContact CG1-CD1 4.27Å; V185-L195 HydrophobicContact CG2-CD1 3.53Å
186	P	79.9	Confident	69	Low	52 Å²	52	99.4 Å²	99.4	34%	0.338	58%	0.58	S	S	.	*			trans	-59.6	135.6	-175.4	16.2	-25	0	0	0	111.2	F184 G188 S189	F184-P186 HydrophobicContact CE1-CB 3.9Å; F184-P186 WeakPolarHBondContact O-CD 3.42Å; P186-G188 PolarHBondContact O-N 3.01Å; P186-S189 VanDerWaalsContact O-CB 3.28Å; P186-S189 WeakPolarHBondContact O-CB 3.29Å; P186-S189 PolarHBondContact O-N 2.88Å; P186-S189 PolarHBondContact O-OG 2.82Å; P186-S189 VanDerWaalsContact O-OG 3.13Å
187	F	78.3	Confident	70.2	Confident	197 Å²	197	99.4 Å²	99.4	86%	0.864	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	136.2	176.3	-63.1	-66.5	0	0	0	110.8	V185 S189	V185-F187 PolarHBondContact O-N 3.05Å; F187-S189 VanDerWaalsContact C-N 3.31Å
188	G	79.9	Confident	71.8	Confident	77 Å²	77	96.1 Å²	96.1	79%	0.794	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	83	-2.6	-177	0	0	0	0	0	115.1	P186	P186-G188 PolarHBondContact O-N 3.01Å
189	S	84.4	Confident	72.8	Confident	26 Å²	26	99.1 Å²	99.1	18%	0.182	56%	0.555	C	S	.	*	S	Bend	trans	-71.6	158.4	172.5	81.3	0	0	0	0	111.9	V185 P186 F187 E191 A192 S193	V185-S189 VanDerWaalsContact CG1-OG 3.25Å; V185-S189 WeakPolarHBondContact CG1-OG 3.41Å; P186-S189 VanDerWaalsContact O-CB 3.28Å; P186-S189 WeakPolarHBondContact O-CB 3.29Å; P186-S189 PolarHBondContact O-N 2.88Å; P186-S189 PolarHBondContact O-OG 2.82Å; P186-S189 VanDerWaalsContact O-OG 3.13Å; F187-S189 VanDerWaalsContact C-N 3.31Å; S189-E191 PolarHBondContact O-N 3.29Å; S189-E191 PolarHBondContact OG-N 2.9Å; S189-A192 PolarHBondContact O-N 3Å; S189-A192 PolarHBondContact OG-N 3.47Å; S189-S193 PolarHBondContact O-N 2.88Å; S189-S193 PolarHBondContact O-OG 3.46Å; S189-S193 VanDerWaalsContact O-OG 3.09Å
190	R	84.7	Confident	73.3	Confident	217 Å²	217	94.2 Å²	94.2	82%	0.819	52%	0.521	S	S	*	.	H	α-helix	trans	-61.7	-36.2	172.7	-173.1	-179.8	178.6	-158.4	-0.4	111.1	S193 C194	R190-S193 PolarHBondContact O-N 3Å; R190-C194 VanDerWaalsContact O-CB 3.31Å; R190-C194 WeakPolarHBondContact O-CB 3.31Å; R190-C194 PolarHBondContact O-N 2.94Å
191	E	81.1	Confident	74.2	Confident	122 Å²	122	101.2 Å²	101.2	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-62.6	-43.2	174.5	-67.6	154.4	-168	0	0	111.2	V185 S189 S193 C194 L195	V185-E191 HydrophobicContact CG1-CB 3.47Å; V185-E191 VanDerWaalsContact CG1-CB 3.47Å; S189-E191 PolarHBondContact O-N 3.29Å; S189-E191 PolarHBondContact OG-N 2.9Å; E191-S193 VanDerWaalsContact C-N 3.33Å; E191-S193 PolarHBondContact O-N 2.93Å; E191-C194 PolarHBondContact O-N 3.49Å; E191-L195 WeakPolarHBondContact O-CB 3.25Å; E191-L195 WeakPolarHBondContact O-CG 3.39Å; E191-L195 PolarHBondContact O-N 2.72Å
192	A	81.5	Confident	74.9	Confident	11 Å²	11	103.6 Å²	103.6	9%	0.091	53%	0.534	C	S	.	.	H	α-helix	trans	-63.2	-43.3	176.1	0	0	0	0	0	110.3	V185 S189 C194 L195 I196	V185-A192 HydrophobicContact CG1-CB 3.78Å; S189-A192 PolarHBondContact O-N 3Å; S189-A192 PolarHBondContact OG-N 3.47Å; A192-C194 VanDerWaalsContact C-N 3.33Å; A192-C194 PolarHBondContact O-N 2.85Å; A192-L195 PolarHBondContact O-N 3.45Å; A192-I196 WeakPolarHBondContact O-CB 3.28Å; A192-I196 WeakPolarHBondContact O-CD1 2.94Å; A192-I196 WeakPolarHBondContact O-CG1 3.23Å; A192-I196 PolarHBondContact O-N 3.04Å
193	S	80.5	Confident	75.2	Confident	53 Å²	53	101 Å²	101	37%	0.371	51%	0.513	S	S	.	.	H	α-helix	trans	-64.3	-38.8	177.1	-56.3	0	0	0	0	111.9	S189 R190 E191 Q197	S189-S193 PolarHBondContact O-N 2.88Å; S189-S193 PolarHBondContact O-OG 3.46Å; S189-S193 VanDerWaalsContact O-OG 3.09Å; R190-S193 PolarHBondContact O-N 3Å; E191-S193 VanDerWaalsContact C-N 3.33Å; E191-S193 PolarHBondContact O-N 2.93Å; S193-Q197 WeakPolarHBondContact O-CB 3.46Å; S193-Q197 VanDerWaalsContact O-CG 3.26Å; S193-Q197 WeakPolarHBondContact O-CG 3.49Å; S193-Q197 PolarHBondContact O-N 2.99Å
194	C	79.3	Confident	75	Confident	67 Å²	67	97.5 Å²	97.5	45%	0.453	50%	0.497	S	S	.	.	H	α-helix	trans	-67.2	-47.4	176.9	-155.3	0	0	0	0	110.9	R190 E191 A192 I196 Q197 T198	R190-C194 VanDerWaalsContact O-CB 3.31Å; R190-C194 WeakPolarHBondContact O-CB 3.31Å; R190-C194 PolarHBondContact O-N 2.94Å; E191-C194 PolarHBondContact O-N 3.49Å; A192-C194 VanDerWaalsContact C-N 3.33Å; A192-C194 PolarHBondContact O-N 2.85Å; C194-I196 VanDerWaalsContact C-N 3.33Å; C194-I196 PolarHBondContact O-N 3.37Å; C194-Q197 CarbonylContact O-C 3.55Å; C194-Q197 WeakPolarHBondContact O-CA 3.3Å; C194-Q197 WeakPolarHBondContact O-CB 3.36Å; C194-Q197 PolarHBondContact O-N 3.43Å; C194-T198 PolarHBondContact O-N 2.97Å; C194-T198 PolarHBondContact O-OG1 3.07Å
195	L	76.1	Confident	74.9	Confident	72 Å²	72	95.3 Å²	95.3	38%	0.377	49%	0.489	S	S	.	.	H	α-helix	trans	-58.5	-42.9	175.2	-76.6	171	0	0	0	112	V185 E191 A192 Q197 T198 E199	V185-L195 HydrophobicContact CB-CD1 4.11Å; V185-L195 HydrophobicContact CG1-CD1 4.27Å; V185-L195 HydrophobicContact CG2-CD1 3.53Å; E191-L195 WeakPolarHBondContact O-CB 3.25Å; E191-L195 WeakPolarHBondContact O-CG 3.39Å; E191-L195 PolarHBondContact O-N 2.72Å; A192-L195 PolarHBondContact O-N 3.45Å; L195-Q197 VanDerWaalsContact C-N 3.28Å; L195-Q197 PolarHBondContact O-N 3.01Å; L195-T198 WeakPolarHBondContact CA-OG1 3.36Å; L195-T198 PolarHBondContact O-N 3.46Å; L195-T198 PolarHBondContact O-OG1 3.1Å; L195-E199 WeakPolarHBondContact O-CB 3.44Å; L195-E199 PolarHBondContact O-N 2.83Å
196	I	73	Confident	74.3	Confident	53 Å²	53	97.7 Å²	97.7	27%	0.272	50%	0.5	S	S	.	.	H	α-helix	trans	-63.3	-36	174.7	-66.3	163.6	0	0	0	111	A192 C194 G200 L203	A192-I196 WeakPolarHBondContact O-CB 3.28Å; A192-I196 WeakPolarHBondContact O-CD1 2.94Å; A192-I196 WeakPolarHBondContact O-CG1 3.23Å; A192-I196 PolarHBondContact O-N 3.04Å; C194-I196 VanDerWaalsContact C-N 3.33Å; C194-I196 PolarHBondContact O-N 3.37Å; I196-G200 WeakPolarHBondContact O-CA 3.42Å; I196-G200 PolarHBondContact O-N 3.35Å; I196-G200 VanDerWaalsContact O-N 3.09Å; I196-L203 HydrophobicContact CB-CD1 4.4Å; I196-L203 HydrophobicContact CG1-CD1 3.78Å; I196-L203 HydrophobicContact CG2-CD1 4.16Å
197	Q	71.9	Confident	73.7	Confident	158 Å²	158	102.5 Å²	102.5	74%	0.738	51%	0.512	S	S	*	.	H	α-helix	trans	-74	-39.7	177	-74.4	172.9	13	0	0	112.4	S193 C194 L195	S193-Q197 WeakPolarHBondContact O-CB 3.46Å; S193-Q197 VanDerWaalsContact O-CG 3.26Å; S193-Q197 WeakPolarHBondContact O-CG 3.49Å; S193-Q197 PolarHBondContact O-N 2.99Å; C194-Q197 CarbonylContact O-C 3.55Å; C194-Q197 WeakPolarHBondContact O-CA 3.3Å; C194-Q197 WeakPolarHBondContact O-CB 3.36Å; C194-Q197 PolarHBondContact O-N 3.43Å; L195-Q197 VanDerWaalsContact C-N 3.28Å; L195-Q197 PolarHBondContact O-N 3.01Å
198	T	71.7	Confident	73.4	Confident	104 Å²	104	94.9 Å²	94.9	64%	0.638	48%	0.483	S	S	*	.	H	α-helix	trans	-79.3	-38.3	-177.6	50.3	0	0	0	0	113	C194 L195	C194-T198 PolarHBondContact O-N 2.97Å; C194-T198 PolarHBondContact O-OG1 3.07Å; L195-T198 WeakPolarHBondContact CA-OG1 3.36Å; L195-T198 PolarHBondContact O-N 3.46Å; L195-T198 PolarHBondContact O-OG1 3.1Å
199	E	66.1	Low	72.8	Confident	148 Å²	148	93.8 Å²	93.8	69%	0.692	46%	0.459	S	S	*	.	S	Bend	trans	-105.2	7.7	-177	-58.8	-167.3	155.7	0	0	113	L195 K201	L195-E199 WeakPolarHBondContact O-CB 3.44Å; L195-E199 PolarHBondContact O-N 2.83Å; E199-K201 PolarHBondContact O-N 2.78Å
200	G	59.1	Low	71.9	Confident	3 Å²	3	102 Å²	102	3%	0.031	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	14.1	-167.1	0	0	0	0	0	117.9	I196 N204	I196-G200 WeakPolarHBondContact O-CA 3.42Å; I196-G200 PolarHBondContact O-N 3.35Å; I196-G200 VanDerWaalsContact O-N 3.09Å; G200-N204 WeakPolarHBondContact O-CA 3.47Å; G200-N204 WeakPolarHBondContact O-CB 3.49Å; G200-N204 PolarHBondContact O-N 2.74Å; G200-N204 PolarHBondContact O-ND2 3.3Å; G200-N204 VanDerWaalsContact O-ND2 3.11Å
201	K	67.9	Low	71.1	Confident	186 Å²	186	99.6 Å²	99.6	81%	0.809	48%	0.484	S	S	*	.	H	α-helix	trans	-60.9	-50.5	177.9	-72	-173.3	-179.6	179.5	0	111.2	E199 Q205	E199-K201 PolarHBondContact O-N 2.78Å; K201-Q205 VanDerWaalsContact O-CB 3.3Å; K201-Q205 WeakPolarHBondContact O-CB 3.34Å; K201-Q205 PolarHBondContact O-N 3.29Å
202	F	69.7	Low	70.5	Confident	143 Å²	143	101.3 Å²	101.3	63%	0.627	49%	0.485	S	S	*	.	H	α-helix	trans	-69.3	-43.4	179.2	178.8	-108.6	0	0	0	112.3	Q205 L206	F202-Q205 WeakPolarHBondContact O-CB 3.47Å; F202-Q205 PolarHBondContact O-N 2.88Å; F202-L206 HydrophobicContact CD1-CD1 3.93Å; F202-L206 HydrophobicContact CD1-CG 4.47Å; F202-L206 HydrophobicContact CE1-CD1 3.3Å; F202-L206 HydrophobicContact CE1-CG 4.07Å; F202-L206 HydrophobicContact CE2-CD1 4.27Å; F202-L206 HydrophobicContact CE2-CG 4.23Å; F202-L206 HydrophobicContact CZ-CD1 3.5Å; F202-L206 HydrophobicContact CZ-CD2 4.29Å; F202-L206 HydrophobicContact CZ-CG 3.95Å; F202-L206 WeakPolarHBondContact O-CG 3.5Å; F202-L206 PolarHBondContact O-N 2.96Å
203	L	67.9	Low	69.3	Low	72 Å²	72	105.1 Å²	105.1	38%	0.377	50%	0.504	S	S	.	.	H	α-helix	trans	-71.9	-33.5	-179.6	-69.2	-179.1	0	0	0	113	I196 Q205 L206 R207	I196-L203 HydrophobicContact CB-CD1 4.4Å; I196-L203 HydrophobicContact CG1-CD1 3.78Å; I196-L203 HydrophobicContact CG2-CD1 4.16Å; L203-Q205 VanDerWaalsContact C-N 3.35Å; L203-L206 HydrophobicContact CD2-CD1 4.29Å; L203-L206 PolarHBondContact O-N 2.9Å; L203-R207 WeakPolarHBondContact O-CB 3.33Å; L203-R207 WeakPolarHBondContact O-CG 3.27Å; L203-R207 PolarHBondContact O-N 2.92Å
204	N	67.3	Low	68.1	Low	89 Å²	89	111.3 Å²	111.3	48%	0.476	53%	0.527	S	S	.	.	H	α-helix	trans	-69.7	-36	170.8	-68.5	-23.6	0	0	0	110.5	G200 R207 S208	G200-N204 WeakPolarHBondContact O-CA 3.47Å; G200-N204 WeakPolarHBondContact O-CB 3.49Å; G200-N204 PolarHBondContact O-N 2.74Å; G200-N204 PolarHBondContact O-ND2 3.3Å; G200-N204 VanDerWaalsContact O-ND2 3.11Å; N204-R207 PolarHBondContact O-N 3.18Å; N204-S208 WeakPolarHBondContact O-CB 3.27Å; N204-S208 PolarHBondContact O-N 3.42Å; N204-S208 PolarHBondContact O-OG 2.99Å
205	Q	71.9	Confident	66.9	Low	117 Å²	117	114.3 Å²	114.3	55%	0.547	54%	0.536	S	S	.	.	H	α-helix	trans	-60.9	-50.8	171.8	-161.6	123	16.9	0	0	110.3	K201 F202 L203 R207 S208 D209	K201-Q205 VanDerWaalsContact O-CB 3.3Å; K201-Q205 WeakPolarHBondContact O-CB 3.34Å; K201-Q205 PolarHBondContact O-N 3.29Å; F202-Q205 WeakPolarHBondContact O-CB 3.47Å; F202-Q205 PolarHBondContact O-N 2.88Å; L203-Q205 VanDerWaalsContact C-N 3.35Å; Q205-R207 PolarHBondContact O-N 3.01Å; Q205-S208 WeakPolarHBondContact CA-OG 3.4Å; Q205-S208 PolarHBondContact O-N 3.09Å; Q205-S208 PolarHBondContact O-OG 3.46Å; Q205-D209 WeakPolarHBondContact O-CB 3.47Å; Q205-D209 PolarHBondContact O-N 3.38Å
206	L	68.6	Low	65.8	Low	85 Å²	85	118.5 Å²	118.5	45%	0.445	55%	0.551	S	S	.	*	H	α-helix	trans	-61.2	-40.2	176	-73.6	-178.8	0	0	0	113.5	F202 L203 R210	F202-L206 HydrophobicContact CD1-CD1 3.93Å; F202-L206 HydrophobicContact CD1-CG 4.47Å; F202-L206 HydrophobicContact CE1-CD1 3.3Å; F202-L206 HydrophobicContact CE1-CG 4.07Å; F202-L206 HydrophobicContact CE2-CD1 4.27Å; F202-L206 HydrophobicContact CE2-CG 4.23Å; F202-L206 HydrophobicContact CZ-CD1 3.5Å; F202-L206 HydrophobicContact CZ-CD2 4.29Å; F202-L206 HydrophobicContact CZ-CG 3.95Å; F202-L206 WeakPolarHBondContact O-CG 3.5Å; F202-L206 PolarHBondContact O-N 2.96Å; L203-L206 HydrophobicContact CD2-CD1 4.29Å; L203-L206 PolarHBondContact O-N 2.9Å; L206-R210 VanDerWaalsContact O-CB 3.24Å; L206-R210 WeakPolarHBondContact O-CB 3.3Å; L206-R210 PolarHBondContact O-N 2.94Å
207	R	67.5	Low	64.6	Low	153 Å²	153	123.9 Å²	123.9	58%	0.577	57%	0.573	S	S	*	*	H	α-helix	trans	-65.5	-46	174.5	-80.5	-174.2	-174	-155.7	3.5	111.2	L203 N204 Q205 D209 R210 E211	L203-R207 WeakPolarHBondContact O-CB 3.33Å; L203-R207 WeakPolarHBondContact O-CG 3.27Å; L203-R207 PolarHBondContact O-N 2.92Å; N204-R207 PolarHBondContact O-N 3.18Å; Q205-R207 PolarHBondContact O-N 3.01Å; R207-D209 VanDerWaalsContact C-N 3.3Å; R207-D209 PolarHBondContact O-N 3.25Å; R207-R210 PolarHBondContact O-N 3.3Å; R207-E211 WeakPolarHBondContact O-CB 3.4Å; R207-E211 PolarHBondContact O-N 3.33Å
208	S	70.3	Confident	63.8	Low	37 Å²	37	119.7 Å²	119.7	26%	0.259	56%	0.555	S	S	.	*	H	α-helix	trans	-66.8	-32.2	179.7	73	0	0	0	0	112.3	N204 Q205 R212	N204-S208 WeakPolarHBondContact O-CB 3.27Å; N204-S208 PolarHBondContact O-N 3.42Å; N204-S208 PolarHBondContact O-OG 2.99Å; Q205-S208 WeakPolarHBondContact CA-OG 3.4Å; Q205-S208 PolarHBondContact O-N 3.09Å; Q205-S208 PolarHBondContact O-OG 3.46Å; S208-R212 WeakPolarHBondContact O-CB 3.1Å; S208-R212 VanDerWaalsContact O-CG 3.3Å; S208-R212 WeakPolarHBondContact O-CG 3.21Å; S208-R212 PolarHBondContact O-N 3.39Å; S208-R212 PolarHBondContact O-NE 2.95Å; S208-R212 VanDerWaalsContact O-NE 3.08Å; S208-R212 PolarHBondContact OG-NH2 3.44Å
209	D	68.1	Low	63.2	Low	54 Å²	54	117.4 Å²	117.4	29%	0.289	54%	0.544	S	S	.	.	H	α-helix	trans	-75.5	-34.7	174	-72.9	-17.6	0	0	0	111.1	Q205 R207 R212 N213	Q205-D209 WeakPolarHBondContact O-CB 3.47Å; Q205-D209 PolarHBondContact O-N 3.38Å; R207-D209 VanDerWaalsContact C-N 3.3Å; R207-D209 PolarHBondContact O-N 3.25Å; D209-R212 IonicContact OD1-CZ 3.41Å; D209-R212 IonicContact OD1-NH1 3.87Å; D209-R212 IonicContact OD1-NH2 2.72Å; D209-R212 PolarHBondContact OD1-NH2 3.13Å; D209-N213 WeakPolarHBondContact O-CB 3.04Å; D209-N213 PolarHBondContact O-N 2.91Å
210	R	66	Low	62.5	Low	199 Å²	199	117.4 Å²	117.4	75%	0.751	54%	0.542	S	S	*	.	H	α-helix	trans	-67.3	-39.6	173.4	-168.7	177.6	-175.3	172.8	3.1	112.3	L206 R207	L206-R210 VanDerWaalsContact O-CB 3.24Å; L206-R210 WeakPolarHBondContact O-CB 3.3Å; L206-R210 PolarHBondContact O-N 2.94Å; R207-R210 PolarHBondContact O-N 3.3Å
211	E	68.3	Low	62.5	Low	165 Å²	165	121.9 Å²	121.9	77%	0.771	56%	0.562	S	S	*	*	H	α-helix	trans	-73.9	-39.7	176.4	-77	176.9	178.9	0	0	112.2	R207	R207-E211 WeakPolarHBondContact O-CB 3.4Å; R207-E211 PolarHBondContact O-N 3.33Å
212	R	68	Low	62	Low	159 Å²	159	119.3 Å²	119.3	60%	0.6	55%	0.554	S	S	*	*	H	α-helix	trans	-72.5	-41.1	-179.7	-81.6	-179.6	-76	147.9	0.6	113.4	S208 D209	S208-R212 WeakPolarHBondContact O-CB 3.1Å; S208-R212 VanDerWaalsContact O-CG 3.3Å; S208-R212 WeakPolarHBondContact O-CG 3.21Å; S208-R212 PolarHBondContact O-N 3.39Å; S208-R212 PolarHBondContact O-NE 2.95Å; S208-R212 VanDerWaalsContact O-NE 3.08Å; S208-R212 PolarHBondContact OG-NH2 3.44Å; D209-R212 IonicContact OD1-CZ 3.41Å; D209-R212 IonicContact OD1-NH1 3.87Å; D209-R212 IonicContact OD1-NH2 2.72Å; D209-R212 PolarHBondContact OD1-NH2 3.13Å
213	N	56	Low	61.3	Low	90 Å²	90	117.7 Å²	117.7	48%	0.481	55%	0.551	S	S	.	*	H	α-helix	trans	-102.9	-0.2	-162.9	-63.7	-24.9	0	0	0	114.9	D209 M215	D209-N213 WeakPolarHBondContact O-CB 3.04Å; D209-N213 PolarHBondContact O-N 2.91Å; N213-M215 HydrophobicContact CB-CB 3.82Å; N213-M215 HydrophobicContact CB-CG 3.21Å; N213-M215 PolarHBondContact O-N 3.13Å
214	Q	55.8	Low	60.8	Low	183 Å²	183	117 Å²	117	86%	0.855	55%	0.55	S	S	*	.			trans	43.1	23.7	-164.6	-73.1	-175.2	13.3	0	0	112	K216	Q214-K216 VanDerWaalsContact C-N 3.33Å; Q214-K216 PolarHBondContact O-N 3.29Å
215	M	54.4	Low	60.3	Low	131 Å²	131	119 Å²	119	65%	0.645	56%	0.561	S	S	*	*			trans	-75.8	96.7	-173.3	-80.8	-96.6	155	0	0	104.8	N213 F217	N213-M215 HydrophobicContact CB-CB 3.82Å; N213-M215 HydrophobicContact CB-CG 3.21Å; N213-M215 PolarHBondContact O-N 3.13Å; M215-F217 PolarHBondContact O-N 3.49Å
216	K	51.7	Low	59.3	Low	160 Å²	160	120.4 Å²	120.4	70%	0.696	57%	0.572	S	S	*	*			trans	-58.8	87.4	154.8	-80.2	-178.6	175.2	-179.4	0	106.1	Q214 D218	Q214-K216 VanDerWaalsContact C-N 3.33Å; Q214-K216 PolarHBondContact O-N 3.29Å; K216-D218 PolarHBondContact O-N 2.97Å
217	F	47.9	Very low	58.2	Low	165 Å²	165	123.7 Å²	123.7	72%	0.724	58%	0.578	S	S	*	*			trans	-70.4	78.9	158.3	-172.1	-96	0	0	0	106.6	M215	M215-F217 PolarHBondContact O-N 3.49Å
218	D	55	Low	57.3	Low	70 Å²	70	123.9 Å²	123.9	37%	0.374	59%	0.591	S	S	.	*			trans	-88.6	101.8	162.6	-101.9	-36	0	0	0	105.8	K216 F220 Q221 M222	K216-D218 PolarHBondContact O-N 2.97Å; D218-F220 PolarHBondContact O-N 3.42Å; D218-Q221 HydrophobicContact CB-CB 3.88Å; D218-Q221 HydrophobicContact CB-CG 3.79Å; D218-Q221 PolarHBondContact O-N 3.13Å; D218-M222 PolarHBondContact O-N 2.97Å
219	S	59.1	Low	56.4	Low	56 Å²	56	129.1 Å²	129.1	39%	0.392	61%	0.611	S	S	.	*	H	α-helix	trans	-54.4	-25.2	172	69.9	0	0	0	0	111.3	I223	S219-I223 WeakPolarHBondContact O-CD1 3.24Å; S219-I223 WeakPolarHBondContact O-CG1 3.34Å
220	F	51.4	Low	55.5	Low	148 Å²	148	131.5 Å²	131.5	65%	0.649	62%	0.624	S	S	*	*	H	α-helix	trans	-69.8	-42.6	173.8	-69.2	-80.5	0	0	0	113	D218 M222 I223 T224	D218-F220 PolarHBondContact O-N 3.42Å; F220-M222 VanDerWaalsContact C-N 3.28Å; F220-M222 PolarHBondContact O-N 3.26Å; F220-I223 PolarHBondContact O-N 2.92Å; F220-I223 VanDerWaalsContact O-N 3.11Å; F220-T224 WeakPolarHBondContact O-CG2 3.42Å; F220-T224 PolarHBondContact O-N 2.92Å; F220-T224 VanDerWaalsContact O-N 3.12Å
221	Q	60.7	Low	54.9	Low	98 Å²	98	130.4 Å²	130.4	46%	0.458	63%	0.627	S	S	.	*	H	α-helix	trans	-65.4	-31.9	178	-78.8	-165.9	-8.8	0	0	112.8	D218 I223 T224 N225	D218-Q221 HydrophobicContact CB-CB 3.88Å; D218-Q221 HydrophobicContact CB-CG 3.79Å; D218-Q221 PolarHBondContact O-N 3.13Å; Q221-I223 VanDerWaalsContact C-N 3.28Å; Q221-I223 PolarHBondContact O-N 3.36Å; Q221-T224 WeakPolarHBondContact CA-OG1 3.33Å; Q221-T224 PolarHBondContact O-N 3.41Å; Q221-T224 PolarHBondContact O-OG1 2.88Å; Q221-N225 PolarHBondContact O-N 3.39Å; Q221-N225 PolarHBondContact O-OD1 3.31Å
222	M	55.9	Low	54.4	Low	132 Å²	132	130.4 Å²	130.4	65%	0.65	63%	0.627	S	S	*	*	H	α-helix	trans	-68.5	-28.2	175.1	-98.7	-167.2	51.2	0	0	113.2	D218 F220	D218-M222 PolarHBondContact O-N 2.97Å; F220-M222 VanDerWaalsContact C-N 3.28Å; F220-M222 PolarHBondContact O-N 3.26Å
223	I	55.6	Low	53.8	Low	109 Å²	109	127.3 Å²	127.3	56%	0.559	62%	0.62	S	S	*	*	H	α-helix	trans	-78.6	-36.6	177.4	-64.9	165.2	0	0	0	110	S219 F220 Q221	S219-I223 WeakPolarHBondContact O-CD1 3.24Å; S219-I223 WeakPolarHBondContact O-CG1 3.34Å; F220-I223 PolarHBondContact O-N 2.92Å; F220-I223 VanDerWaalsContact O-N 3.11Å; Q221-I223 VanDerWaalsContact C-N 3.28Å; Q221-I223 PolarHBondContact O-N 3.36Å
224	T	58	Low	54.2	Low	56 Å²	56	128 Å²	128	34%	0.344	62%	0.624	S	S	.	*	H	α-helix	trans	-70.8	-36.6	-179.1	56.9	0	0	0	0	112.7	F220 Q221 N226 R227	F220-T224 WeakPolarHBondContact O-CG2 3.42Å; F220-T224 PolarHBondContact O-N 2.92Å; F220-T224 VanDerWaalsContact O-N 3.12Å; Q221-T224 WeakPolarHBondContact CA-OG1 3.33Å; Q221-T224 PolarHBondContact O-N 3.41Å; Q221-T224 PolarHBondContact O-OG1 2.88Å; T224-N226 PolarHBondContact O-N 3Å; T224-R227 PolarHBondContact O-N 3.41Å
225	N	55.7	Low	55	Low	133 Å²	133	126.2 Å²	126.2	71%	0.711	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-6.6	-177	-73.6	-0.8	0	0	0	115	Q221	Q221-N225 PolarHBondContact O-N 3.39Å; Q221-N225 PolarHBondContact O-OD1 3.31Å
226	N	51.9	Low	56	Low	146 Å²	146	125.9 Å²	125.9	78%	0.781	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	6.6	180	-95.2	-15.8	0	0	0	114.3	T224	T224-N226 PolarHBondContact O-N 3Å
227	R	44.7	Very low	57.1	Low	153 Å²	153	122.4 Å²	122.4	58%	0.577	60%	0.601	S	S	*	*			trans	-130.9	111.7	-178.2	-74.4	-176.1	164.2	178.3	-6.8	111.7	T224 E229	T224-R227 PolarHBondContact O-N 3.41Å; R227-E229 PolarHBondContact O-N 3.5Å
228	N	49.7	Very low	58.5	Low	157 Å²	157	118.2 Å²	118.2	84%	0.84	59%	0.59	S	S	*	*	S	Bend	trans	-71.4	41.2	175.6	-62.1	-32.1	0	0	0	113.3
229	E	51.2	Low	59.7	Low	147 Å²	147	120.1 Å²	120.1	69%	0.687	60%	0.599	S	S	*	*			trans	-113.3	40.4	178.3	-66.6	-173.3	172.5	0	0	111	R227 Q231	R227-E229 PolarHBondContact O-N 3.5Å; E229-Q231 VanDerWaalsContact C-N 3.34Å; E229-Q231 PolarHBondContact O-N 3.47Å
230	D	47.7	Very low	60.6	Low	104 Å²	104	123.4 Å²	123.4	56%	0.556	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	1.1	-157.6	-65.7	-51.7	0	0	0	118.6
231	Q	54.4	Low	62	Low	176 Å²	176	120.2 Å²	120.2	82%	0.822	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-44.9	-174.3	-102.3	168.6	-7.2	0	0	115.2	E229	E229-Q231 VanDerWaalsContact C-N 3.34Å; E229-Q231 PolarHBondContact O-N 3.47Å
232	E	57.7	Low	63	Low	166 Å²	166	122 Å²	122	78%	0.776	61%	0.605	S	S	*	*	H	α-helix	trans	-79.4	-33.5	179.6	-78	-176.8	166.1	0	0	112.7	N234	E232-N234 PolarHBondContact O-N 2.8Å
233	E	55.8	Low	64.4	Low	94 Å²	94	121.1 Å²	121.1	44%	0.439	60%	0.599	S	S	.	*	H	α-helix	trans	-66.3	-26.8	176.2	-89.3	-171.7	157	0	0	112.2	Q237	E233-Q237 WeakPolarHBondContact O-CB 3.42Å; E233-Q237 PolarHBondContact O-N 3.16Å
234	N	64	Low	65.6	Low	105 Å²	105	123.3 Å²	123.3	56%	0.561	60%	0.6	S	S	*	*	H	α-helix	trans	-71	-40.6	-176.7	-140	-17	0	0	0	112.1	E232 Q237 T238	E232-N234 PolarHBondContact O-N 2.8Å; N234-Q237 PolarHBondContact O-N 2.79Å; N234-T238 PolarHBondContact O-N 2.89Å; N234-T238 PolarHBondContact O-OG1 3.47Å; N234-T238 VanDerWaalsContact O-OG1 3.04Å
235	E	73.4	Confident	66.9	Low	145 Å²	145	128.5 Å²	128.5	68%	0.678	62%	0.618	S	S	*	*	H	α-helix	trans	-67	-45	176.7	-77.6	-171.9	170	0	0	112	Q237 T238 L239	E235-Q237 VanDerWaalsContact C-N 3.31Å; E235-Q237 PolarHBondContact O-N 2.78Å; E235-T238 VanDerWaalsContact CA-OG1 3.29Å; E235-T238 WeakPolarHBondContact CA-OG1 3.26Å; E235-T238 PolarHBondContact O-N 2.88Å; E235-T238 PolarHBondContact O-OG1 2.83Å; E235-L239 PolarHBondContact O-N 3.29Å
236	L	73.9	Confident	68.2	Low	123 Å²	123	128.4 Å²	128.4	64%	0.644	61%	0.613	S	S	*	*	H	α-helix	trans	-61.5	-39.8	175	-84.8	161.9	0	0	0	111.8	L239 F240	L236-L239 PolarHBondContact O-N 2.91Å; L236-F240 WeakPolarHBondContact O-CB 3.35Å; L236-F240 PolarHBondContact O-N 2.82Å
237	Q	74.3	Confident	69.4	Low	87 Å²	87	124.1 Å²	124.1	41%	0.407	59%	0.592	S	S	.	*	H	α-helix	trans	-67.8	-38.2	177.3	-167.9	65	54.2	0	0	111.8	E233 N234 E235 N241	E233-Q237 WeakPolarHBondContact O-CB 3.42Å; E233-Q237 PolarHBondContact O-N 3.16Å; N234-Q237 PolarHBondContact O-N 2.79Å; E235-Q237 VanDerWaalsContact C-N 3.31Å; E235-Q237 PolarHBondContact O-N 2.78Å; Q237-N241 WeakPolarHBondContact O-CB 3.3Å; Q237-N241 PolarHBondContact O-N 2.88Å; Q237-N241 PolarHBondContact O-ND2 2.87Å
238	T	78.1	Confident	70.9	Confident	78 Å²	78	120.9 Å²	120.9	48%	0.479	59%	0.586	S	S	.	*	H	α-helix	trans	-64.6	-46.2	173.6	42.4	0	0	0	0	112.1	N234 E235 F240 N241 E242	N234-T238 PolarHBondContact O-N 2.89Å; N234-T238 PolarHBondContact O-OG1 3.47Å; N234-T238 VanDerWaalsContact O-OG1 3.04Å; E235-T238 VanDerWaalsContact CA-OG1 3.29Å; E235-T238 WeakPolarHBondContact CA-OG1 3.26Å; E235-T238 PolarHBondContact O-N 2.88Å; E235-T238 PolarHBondContact O-OG1 2.83Å; T238-F240 PolarHBondContact O-N 3.49Å; T238-N241 PolarHBondContact O-N 2.91Å; T238-E242 WeakPolarHBondContact O-CB 3.49Å; T238-E242 PolarHBondContact O-N 3.36Å
239	L	81.4	Confident	72.4	Confident	109 Å²	109	116 Å²	116	57%	0.571	57%	0.568	S	S	*	*	H	α-helix	trans	-61.2	-42.9	177.1	-78.8	168.1	0	0	0	111.9	E235 L236 N241 E242 H243	E235-L239 PolarHBondContact O-N 3.29Å; L236-L239 PolarHBondContact O-N 2.91Å; L239-N241 PolarHBondContact O-N 2.89Å; L239-E242 PolarHBondContact O-N 3.39Å; L239-H243 WeakPolarHBondContact O-CB 3.41Å; L239-H243 PolarHBondContact O-N 2.81Å
240	F	76.9	Confident	73.5	Confident	125 Å²	125	115 Å²	115	55%	0.548	56%	0.563	S	S	.	*	H	α-helix	trans	-63.7	-42.2	176.6	-178.1	-97.2	0	0	0	112.2	L236 T238 R244	L236-F240 WeakPolarHBondContact O-CB 3.35Å; L236-F240 PolarHBondContact O-N 2.82Å; T238-F240 PolarHBondContact O-N 3.49Å; F240-R244 VanDerWaalsContact O-CB 3.27Å; F240-R244 WeakPolarHBondContact O-CB 3.23Å; F240-R244 PolarHBondContact O-N 2.97Å
241	N	80.8	Confident	74.7	Confident	82 Å²	82	115 Å²	115	44%	0.439	56%	0.562	S	S	.	*	H	α-helix	trans	-68	-37.9	179.1	-76	-23.1	0	0	0	112.2	Q237 T238 L239 K245	Q237-N241 WeakPolarHBondContact O-CB 3.3Å; Q237-N241 PolarHBondContact O-N 2.88Å; Q237-N241 PolarHBondContact O-ND2 2.87Å; T238-N241 PolarHBondContact O-N 2.91Å; L239-N241 PolarHBondContact O-N 2.89Å; N241-K245 WeakPolarHBondContact O-CB 3.27Å; N241-K245 PolarHBondContact O-N 2.87Å
242	E	82.9	Confident	75.7	Confident	135 Å²	135	114.3 Å²	114.3	63%	0.631	56%	0.557	S	S	*	*	H	α-helix	trans	-65.8	-48.8	176.2	-165.2	167.4	-155.7	0	0	110.8	T238 L239 R244 K245 E246	T238-E242 WeakPolarHBondContact O-CB 3.49Å; T238-E242 PolarHBondContact O-N 3.36Å; L239-E242 PolarHBondContact O-N 3.39Å; E242-R244 VanDerWaalsContact C-N 3.35Å; E242-R244 PolarHBondContact O-N 3.47Å; E242-K245 WeakPolarHBondContact O-CB 3.49Å; E242-K245 PolarHBondContact O-N 2.97Å; E242-E246 PolarHBondContact O-N 3.45Å
243	H	83.4	Confident	76.3	Confident	113 Å²	113	109.4 Å²	109.4	52%	0.523	54%	0.541	S	S	.	.	H	α-helix	trans	-61.3	-41.1	175.9	-171.1	53.1	0	0	0	112.3	L239 K245 E246 V247	L239-H243 WeakPolarHBondContact O-CB 3.41Å; L239-H243 PolarHBondContact O-N 2.81Å; H243-K245 VanDerWaalsContact C-N 3.29Å; H243-K245 PolarHBondContact O-N 3.23Å; H243-E246 IonicContact ND1-OE2 2.96Å; H243-E246 WeakPolarHBondContact O-CB 3.31Å; H243-E246 PolarHBondContact O-N 3.07Å; H243-V247 WeakPolarHBondContact O-CG2 3.37Å; H243-V247 PolarHBondContact O-N 3.01Å
244	R	82.1	Confident	76.4	Confident	156 Å²	156	108 Å²	108	59%	0.589	54%	0.541	S	S	*	.	H	α-helix	trans	-60.8	-38.4	173.9	179	179.8	165.6	134.4	-1.3	112	F240 E242 L248	F240-R244 VanDerWaalsContact O-CB 3.27Å; F240-R244 WeakPolarHBondContact O-CB 3.23Å; F240-R244 PolarHBondContact O-N 2.97Å; E242-R244 VanDerWaalsContact C-N 3.35Å; E242-R244 PolarHBondContact O-N 3.47Å; R244-L248 HydrophobicContact CG-CD1 4.15Å; R244-L248 WeakPolarHBondContact O-CB 3.05Å; R244-L248 VanDerWaalsContact O-CG 3.26Å; R244-L248 WeakPolarHBondContact O-CG 3.46Å; R244-L248 PolarHBondContact O-N 2.93Å
245	K	84.8	Confident	75.8	Confident	164 Å²	164	107.5 Å²	107.5	71%	0.713	54%	0.542	S	S	*	.	H	α-helix	trans	-69.6	-37.1	179.6	-155.6	177.5	-175.3	-175.2	0	111.1	N241 E242 H243 A249	N241-K245 WeakPolarHBondContact O-CB 3.27Å; N241-K245 PolarHBondContact O-N 2.87Å; E242-K245 WeakPolarHBondContact O-CB 3.49Å; E242-K245 PolarHBondContact O-N 2.97Å; H243-K245 VanDerWaalsContact C-N 3.29Å; H243-K245 PolarHBondContact O-N 3.23Å; K245-A249 WeakPolarHBondContact O-CB 3.36Å; K245-A249 PolarHBondContact O-N 2.91Å
246	E	83.2	Confident	74.6	Confident	131 Å²	131	104.4 Å²	104.4	61%	0.612	54%	0.536	S	S	*	.	H	α-helix	trans	-64.5	-49.7	174.4	-164	177.7	-155.8	0	0	111.7	E242 H243 L248 A249 E250	E242-E246 PolarHBondContact O-N 3.45Å; H243-E246 IonicContact ND1-OE2 2.96Å; H243-E246 WeakPolarHBondContact O-CB 3.31Å; H243-E246 PolarHBondContact O-N 3.07Å; E246-L248 VanDerWaalsContact C-N 3.32Å; E246-L248 PolarHBondContact O-N 3.46Å; E246-A249 WeakPolarHBondContact O-CB 3.47Å; E246-A249 PolarHBondContact O-N 3.45Å; E246-E250 PolarHBondContact O-N 2.87Å
247	V	78	Confident	73.3	Confident	57 Å²	57	105.3 Å²	105.3	35%	0.345	54%	0.541	S	S	.	.	H	α-helix	trans	-60.8	-39.7	176.4	174.5	0	0	0	0	111.7	H243 A249 E250 L251	H243-V247 WeakPolarHBondContact O-CG2 3.37Å; H243-V247 PolarHBondContact O-N 3.01Å; V247-A249 VanDerWaalsContact C-N 3.34Å; V247-E250 PolarHBondContact O-N 3.27Å; V247-L251 HydrophobicContact CG1-CD1 4.32Å; V247-L251 WeakPolarHBondContact O-CG 3.3Å; V247-L251 PolarHBondContact O-N 3.21Å
248	L	76	Confident	71.6	Confident	84 Å²	84	106.2 Å²	106.2	44%	0.44	56%	0.556	S	S	.	*	H	α-helix	trans	-68.5	-31.9	175.5	-73.8	173	0	0	0	112.7	R244 E246 K252	R244-L248 HydrophobicContact CG-CD1 4.15Å; R244-L248 WeakPolarHBondContact O-CB 3.05Å; R244-L248 VanDerWaalsContact O-CG 3.26Å; R244-L248 WeakPolarHBondContact O-CG 3.46Å; R244-L248 PolarHBondContact O-N 2.93Å; E246-L248 VanDerWaalsContact C-N 3.32Å; E246-L248 PolarHBondContact O-N 3.46Å; L248-K252 WeakPolarHBondContact O-CG 3.28Å; L248-K252 PolarHBondContact O-N 3.15Å
249	A	79.8	Confident	69.7	Low	56 Å²	56	108.5 Å²	108.5	46%	0.463	57%	0.57	S	S	.	*	H	α-helix	trans	-70.7	-40.8	174.1	0	0	0	0	0	111.2	K245 E246 V247 L251 K252 S253	K245-A249 WeakPolarHBondContact O-CB 3.36Å; K245-A249 PolarHBondContact O-N 2.91Å; E246-A249 WeakPolarHBondContact O-CB 3.47Å; E246-A249 PolarHBondContact O-N 3.45Å; V247-A249 VanDerWaalsContact C-N 3.34Å; A249-L251 PolarHBondContact O-N 2.99Å; A249-K252 PolarHBondContact O-N 3.1Å; A249-S253 PolarHBondContact O-N 3.43Å; A249-S253 PolarHBondContact O-OG 3.42Å
250	E	75.7	Confident	67.4	Low	125 Å²	125	107.4 Å²	107.4	58%	0.584	57%	0.572	S	S	*	*	H	α-helix	trans	-62.8	-40.6	176.1	-164.2	-175	-178.1	0	0	112	E246 V247 K252 S253 S254	E246-E250 PolarHBondContact O-N 2.87Å; V247-E250 PolarHBondContact O-N 3.27Å; E250-K252 VanDerWaalsContact C-N 3.33Å; E250-K252 PolarHBondContact O-N 3.03Å; E250-S253 PolarHBondContact O-N 3.48Å; E250-S253 PolarHBondContact O-OG 2.61Å; E250-S254 WeakPolarHBondContact O-CB 3.47Å; E250-S254 PolarHBondContact O-N 3.41Å; E250-S254 PolarHBondContact O-OG 2.95Å
251	L	72.1	Confident	65.5	Low	104 Å²	104	110.8 Å²	110.8	55%	0.545	59%	0.588	S	S	.	*	H	α-helix	trans	-67.7	-31.3	174.7	-71.8	172.9	0	0	0	113	V247 A249 S254 T255	V247-L251 HydrophobicContact CG1-CD1 4.32Å; V247-L251 WeakPolarHBondContact O-CG 3.3Å; V247-L251 PolarHBondContact O-N 3.21Å; A249-L251 PolarHBondContact O-N 2.99Å; L251-S254 WeakPolarHBondContact CA-OG 3.25Å; L251-S254 PolarHBondContact O-OG 3.28Å; L251-T255 PolarHBondContact O-N 3.29Å; L251-T255 PolarHBondContact O-OG1 3.07Å
252	K	74.7	Confident	63.4	Low	162 Å²	162	114.4 Å²	114.4	70%	0.704	61%	0.608	S	S	*	*	H	α-helix	trans	-75.8	-35.1	175.5	-77.6	178.8	179	-175.8	0	112.6	L248 A249 E250 T255	L248-K252 WeakPolarHBondContact O-CG 3.28Å; L248-K252 PolarHBondContact O-N 3.15Å; A249-K252 PolarHBondContact O-N 3.1Å; E250-K252 VanDerWaalsContact C-N 3.33Å; E250-K252 PolarHBondContact O-N 3.03Å; K252-T255 PolarHBondContact O-OG1 3.44Å
253	S	71.5	Confident	60.9	Low	63 Å²	63	116.7 Å²	116.7	44%	0.441	62%	0.618	S	S	.	*	H	α-helix	trans	-73.3	-41.3	176	60.6	0	0	0	0	111.2	A249 E250 T255 S256	A249-S253 PolarHBondContact O-N 3.43Å; A249-S253 PolarHBondContact O-OG 3.42Å; E250-S253 PolarHBondContact O-N 3.48Å; E250-S253 PolarHBondContact O-OG 2.61Å; S253-T255 VanDerWaalsContact C-N 3.27Å; S253-T255 PolarHBondContact O-N 2.94Å; S253-S256 PolarHBondContact O-N 3.07Å; S253-S256 VanDerWaalsContact O-N 3.08Å; S253-S256 PolarHBondContact O-OG 2.85Å
254	S	57.6	Low	58.7	Low	64 Å²	64	119.3 Å²	119.3	45%	0.448	63%	0.634	S	S	.	*	H	α-helix	trans	-68.4	-21	179.7	47.6	0	0	0	0	114.1	E250 L251 S256	E250-S254 WeakPolarHBondContact O-CB 3.47Å; E250-S254 PolarHBondContact O-N 3.41Å; E250-S254 PolarHBondContact O-OG 2.95Å; L251-S254 WeakPolarHBondContact CA-OG 3.25Å; L251-S254 PolarHBondContact O-OG 3.28Å; S254-S256 VanDerWaalsContact C-N 3.29Å; S254-S256 PolarHBondContact O-N 3.44Å
255	T	51.7	Low	56.5	Low	95 Å²	95	117 Å²	117	58%	0.583	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-18.7	171.6	25.7	0	0	0	0	113.7	L251 K252 S253	L251-T255 PolarHBondContact O-N 3.29Å; L251-T255 PolarHBondContact O-OG1 3.07Å; K252-T255 PolarHBondContact O-OG1 3.44Å; S253-T255 VanDerWaalsContact C-N 3.27Å; S253-T255 PolarHBondContact O-N 2.94Å
256	S	47.9	Very low	54.2	Low	80 Å²	80	112.8 Å²	112.8	56%	0.559	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-20.9	176.4	69.5	0	0	0	0	114.2	S253 S254	S253-S256 PolarHBondContact O-N 3.07Å; S253-S256 VanDerWaalsContact O-N 3.08Å; S253-S256 PolarHBondContact O-OG 2.85Å; S254-S256 VanDerWaalsContact C-N 3.29Å; S254-S256 PolarHBondContact O-N 3.44Å
257	L	45.9	Very low	51.8	Low	141 Å²	141	113.3 Å²	113.3	74%	0.738	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-9.5	-176.5	-97.6	88.1	0	0	0	115.1
258	C	38.2	Very low	50	Low	107 Å²	107	117.8 Å²	117.8	72%	0.723	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	13.5	-173.9	54.3	0	0	0	0	115.1
259	T	38.4	Very low	48.6	Very low	126 Å²	126	121.6 Å²	121.6	77%	0.773	69%	0.689	S	S	*	*	S	Bend	trans	-111.2	8.3	-178.5	-22	0	0	0	0	115
260	S	34.8	Very low	47	Very low	86 Å²	86	124.1 Å²	124.1	60%	0.601	70%	0.695	S	S	*	*			trans	-137.1	60.4	-169.3	55.5	0	0	0	0	114.3
261	H	35.3	Very low	45.7	Very low	195 Å²	195	124.4 Å²	124.4	90%	0.903	70%	0.701	S	S	*	*			trans	-151.7	81.4	158.1	-109.4	42.2	0	0	0	110.1
262	N	37.4	Very low	44.5	Very low	159 Å²	159	126.5 Å²	126.5	85%	0.85	71%	0.713	S	S	*	*			trans	-145.7	82.7	161.6	-92.5	-20.1	0	0	0	106.6
263	H	30.9	Very low	43.3	Very low	183 Å²	183	125.1 Å²	125.1	85%	0.847	72%	0.718	S	S	*	*			trans	-160.6	121.6	163.7	-97.5	-66.5	0	0	0	108.2
264	I	37.3	Very low	41.7	Very low	167 Å²	167	127.1 Å²	127.1	86%	0.856	73%	0.729	S	S	*	*			trans	167.8	84.6	154	-80.5	148.2	0	0	0	101.3
265	S	34.5	Very low	40.9	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	75%	0.746	S	S	*	*				53.2	91.5	74.5	-151.1	0	0	0	0	112
266	G	37.2	Very low	40.4	Very low	76 Å²	76	133.3 Å²	133.3	78%	0.784	75%	0.753	S	S	*	*			trans	-143.9	109	164.5	0	0	0	0	0	106.9
267	N	33.6	Very low	40.3	Very low	143 Å²	143	135.5 Å²	135.5	77%	0.765	76%	0.757	S	S	*	*			trans	-59	150	-178.8	-63.3	-35.2	0	0	0	111.7
268	D	40.1	Very low	40	Very low	151 Å²	151	135 Å²	135	81%	0.807	76%	0.756	S	S	*	*				-177.4	129.9	124.4	-85.5	-22.2	0	0	0	110.2
269	H	46.5	Very low	40	Very low	163 Å²	163	136.6 Å²	136.6	76%	0.755	76%	0.757	S	S	*	*			trans	32.7	138	151	-75.6	-37.1	0	0	0	120.1
270	D	45.8	Very low	40	Very low	110 Å²	110	136.2 Å²	136.2	59%	0.588	76%	0.755	S	S	*	*			cis	-173.7	157.5	8.1	-101.5	-23.2	0	0	0	106.8
271	D	48.2	Very low	40.1	Very low	130 Å²	130	139.5 Å²	139.5	70%	0.695	77%	0.766	S	S	*	*			trans	69.8	97.1	148.6	-54.1	-22.4	0	0	0	122.3
272	D	47.9	Very low	40.1	Very low	149 Å²	149	137.2 Å²	137.2	80%	0.797	76%	0.76	S	S	*	*				81.7	127.2	112.4	-77.4	-21.1	0	0	0	124.3
273	V	48.6	Very low	40	Very low	133 Å²	133	137.7 Å²	137.7	81%	0.806	76%	0.757	S	S	*	*			trans	95.1	111.2	152.4	-158.1	0	0	0	0	120.5
274	P	38.6	Very low	40.7	Very low	104 Å²	104	138 Å²	138	68%	0.675	76%	0.759	S	S	*	*			trans	-118	170.9	160.2	38.4	-25.6	0	0	0	114.4
275	N	41	Very low	40.6	Very low	150 Å²	150	141.5 Å²	141.5	80%	0.802	76%	0.761	S	S	*	*			trans	113.8	111.6	157.5	-61.7	-25.3	0	0	0	118.2
276	N	39.3	Very low	40.7	Very low	139 Å²	139	144.3 Å²	144.3	74%	0.743	77%	0.766	S	S	*	*				170.8	103.3	115.6	-123.4	-19.8	0	0	0	109.8
277	I	46.2	Very low	40.6	Very low	126 Å²	126	150.2 Å²	150.2	65%	0.646	77%	0.77	S	S	*	*				48.6	104.5	95.2	-44.1	171.6	0	0	0	114.7
278	N	40.8	Very low	40.7	Very low	132 Å²	132	148.9 Å²	148.9	71%	0.706	77%	0.772	S	S	*	*				159.4	118.7	116.1	-86.7	-45.8	0	0	0	113.7
279	N	37.7	Very low	40.2	Very low	139 Å²	139	145 Å²	145	74%	0.743	77%	0.768	S	S	*	*			trans	64.9	136.4	135.7	-80.9	-16.6	0	0	0	123.5
280	T	37.9	Very low	39.8	Very low	119 Å²	119	145.3 Å²	145.3	73%	0.73	78%	0.775	S	S	*	*			trans	101.3	124.6	153.9	72.6	0	0	0	0	116.9
281	N	38	Very low	39.3	Very low	155 Å²	155	149.2 Å²	149.2	83%	0.829	79%	0.787	S	S	*	*			trans	99	77.9	168.4	-49.2	-26.6	0	0	0	115.4
282	D	33.7	Very low	38.9	Very low	146 Å²	146	148.4 Å²	148.4	78%	0.781	79%	0.789	S	S	*	*			trans	-51	154.3	155.3	-90.8	-47.1	0	0	0	112.6
283	H	37.2	Very low	38.5	Very low	170 Å²	170	153.1 Å²	153.1	79%	0.787	80%	0.796	S	S	*	*	S	Bend	trans	83.6	55	173.6	-43.4	-54.9	0	0	0	117.7
284	Q	44.3	Very low	37.9	Very low	190 Å²	190	157.3 Å²	157.3	89%	0.888	80%	0.797	S	S	*	*	S	Bend	trans	-160.7	13	156.4	-115	163.5	51	0	0	119.8
285	R	36.1	Very low	37.5	Very low	239 Å²	239	161.8 Å²	161.8	90%	0.902	81%	0.806	S	S	*	*			trans	-128.9	22.4	-171.3	-98.3	-170.1	-173	-166.1	4.2	120.2	F287	R285-F287 VanDerWaalsContact C-N 3.3Å; R285-F287 PolarHBondContact O-N 3.21Å
286	I	36.5	Very low	37.4	Very low	167 Å²	167	163.8 Å²	163.8	86%	0.856	80%	0.802	S	S	*	*			trans	-86.7	6.1	173.6	-57.2	177.8	0	0	0	113.2	S288	I286-S288 PolarHBondContact O-N 2.9Å
287	F	34.7	Very low	37.6	Very low	200 Å²	200	163.4 Å²	163.4	88%	0.877	81%	0.807	S	S	*	*			trans	-100.9	74.6	177.6	-69.1	-77.4	0	0	0	112.6	R285	R285-F287 VanDerWaalsContact C-N 3.3Å; R285-F287 PolarHBondContact O-N 3.21Å
288	S	34.6	Very low	37.6	Very low	114 Å²	114	159.9 Å²	159.9	80%	0.797	80%	0.802	S	S	*	*	S	Bend	trans	-151.8	120.6	155	55.6	0	0	0	0	109.9	I286	I286-S288 PolarHBondContact O-N 2.9Å
289	G	31.6	Very low	38.1	Very low	71 Å²	71	160.1 Å²	160.1	73%	0.732	80%	0.803	S	S	*	*			trans	108.2	13.1	154.4	0	0	0	0	0	120	K291	G289-K291 PolarHBondContact O-N 2.87Å
290	N	36.6	Very low	39.2	Very low	168 Å²	168	156.8 Å²	156.8	90%	0.898	79%	0.79	S	S	*	*			trans	-97.1	91	163.5	-80.2	-9.1	0	0	0	109.9
291	K	36.2	Very low	40.8	Very low	193 Å²	193	159.2 Å²	159.2	84%	0.839	79%	0.786	S	S	*	*			trans	-48.8	128.1	168.5	-70.2	174.7	-179.8	173.5	0	108.1	G289 R293	G289-K291 PolarHBondContact O-N 2.87Å; K291-R293 PolarHBondContact O-N 3.42Å; K291-R293 VanDerWaalsContact O-N 3.1Å
292	P	39.7	Very low	41.8	Very low	112 Å²	112	158 Å²	158	73%	0.727	77%	0.773	S	S	*	*			trans	-57	125.2	169.6	24.8	-31.2	0	0	0	106.7	R294	P292-R294 PolarHBondContact O-N 3.48Å
293	R	38.7	Very low	43.3	Very low	249 Å²	249	157.9 Å²	157.9	94%	0.94	76%	0.763	S	S	*	*			trans	-62.5	81.5	164.5	-81.7	-177.2	157.6	-173.9	-5.6	106.6	K291 F295	K291-R293 PolarHBondContact O-N 3.42Å; K291-R293 VanDerWaalsContact O-N 3.1Å; R293-F295 PolarHBondContact O-N 3.05Å
294	R	36.2	Very low	45.1	Very low	220 Å²	220	154.9 Å²	154.9	83%	0.83	75%	0.749	S	S	*	*			trans	-57.5	122.1	165.1	-103.6	-178.1	168.7	178.2	-4.4	105.7	P292 R296	P292-R294 PolarHBondContact O-N 3.48Å; R294-R296 PolarHBondContact O-N 3.15Å
295	F	30.9	Very low	46.6	Very low	199 Å²	199	149.3 Å²	149.3	87%	0.873	73%	0.725	S	S	*	*			trans	-48.2	113.5	163.6	-83.7	-91.6	0	0	0	107	R293 P297	R293-F295 PolarHBondContact O-N 3.05Å; F295-P297 VanDerWaalsContact O-CD 3.25Å; F295-P297 WeakPolarHBondContact O-CD 3.41Å
296	R	38.5	Very low	48.4	Very low	192 Å²	192	143.1 Å²	143.1	73%	0.725	71%	0.706	S	S	*	*			trans	-77.6	109.2	166.7	-73.1	-170.4	176	-166.8	-0.4	105.6	R294 G298 L299	R294-R296 PolarHBondContact O-N 3.15Å; R296-G298 PolarHBondContact O-N 2.84Å; R296-G298 VanDerWaalsContact O-N 3.15Å; R296-L299 HydrophobicContact CB-CD1 4.19Å; R296-L299 PolarHBondContact O-N 3.26Å
297	P	43.3	Very low	50.3	Low	131 Å²	131	138.1 Å²	138.1	85%	0.851	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	121.4	168.2	-5.9	22.7	0	0	0	105.5	F295	F295-P297 VanDerWaalsContact O-CD 3.25Å; F295-P297 WeakPolarHBondContact O-CD 3.41Å
298	G	45.5	Very low	52.6	Low	52 Å²	52	134 Å²	134	54%	0.536	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	117.3	-3.6	179.8	0	0	0	0	0	117.2	R296	R296-G298 PolarHBondContact O-N 2.84Å; R296-G298 VanDerWaalsContact O-N 3.15Å
299	L	51.7	Low	55	Low	137 Å²	137	135 Å²	135	72%	0.717	66%	0.659	S	S	*	*			trans	-117.9	11.3	175	-82.2	160.3	0	0	0	114.2	R296 R301	R296-L299 HydrophobicContact CB-CD1 4.19Å; R296-L299 PolarHBondContact O-N 3.26Å; L299-R301 PolarHBondContact O-N 3.26Å
300	S	60.7	Low	57.4	Low	68 Å²	68	134.8 Å²	134.8	48%	0.476	65%	0.647	S	S	.	*			trans	-74.5	127.4	174.2	179.6	0	0	0	0	109.7	F302 Y303 E304	S300-F302 PolarHBondContact O-N 3.47Å; S300-F302 WeakPolarHBondContact OG-CB 3.47Å; S300-F302 PolarHBondContact OG-N 3.06Å; S300-Y303 WeakPolarHBondContact O-CA 3.36Å; S300-Y303 WeakPolarHBondContact O-CB 3.36Å; S300-Y303 PolarHBondContact O-N 3.43Å; S300-E304 PolarHBondContact O-N 3.41Å; S300-E304 VanDerWaalsContact O-N 3.16Å
301	R	71.2	Confident	59.8	Low	170 Å²	170	132.9 Å²	132.9	64%	0.642	63%	0.634	S	S	*	*	H	α-helix	trans	-48.9	-29.1	169.5	-168.4	65.9	165	-179.3	-4.1	112	L299 E304 I305	L299-R301 PolarHBondContact O-N 3.26Å; R301-E304 WeakPolarHBondContact CD-OE2 3.27Å; R301-E304 IonicContact CZ-OE2 3.94Å; R301-E304 IonicContact NE-OE2 3.1Å; R301-E304 IonicContact NH1-OE2 3.79Å; R301-E304 PolarHBondContact NH1-OE2 3.05Å; R301-E304 PolarHBondContact O-N 3.28Å; R301-I305 HydrophobicContact CG-CD1 4.08Å; R301-I305 WeakPolarHBondContact O-CB 3.3Å; R301-I305 WeakPolarHBondContact O-CD1 3.37Å; R301-I305 WeakPolarHBondContact O-CG1 3.28Å; R301-I305 PolarHBondContact O-N 3.16Å
302	F	60.4	Low	62.3	Low	130 Å²	130	128.6 Å²	128.6	57%	0.57	62%	0.617	S	S	*	*	H	α-helix	trans	-64.3	-41.7	173.3	-178.3	-94.1	0	0	0	113.1	S300 I305 Q306	S300-F302 PolarHBondContact O-N 3.47Å; S300-F302 WeakPolarHBondContact OG-CB 3.47Å; S300-F302 PolarHBondContact OG-N 3.06Å; F302-I305 PolarHBondContact O-N 3.33Å; F302-Q306 HydrophobicContact CD1-CG 4.45Å; F302-Q306 VanDerWaalsContact CE1-CD 3.5Å; F302-Q306 HydrophobicContact CE1-CG 4.02Å; F302-Q306 VanDerWaalsContact CE1-NE2 3.28Å; F302-Q306 HydrophobicContact CZ-CG 4.24Å; F302-Q306 VanDerWaalsContact CZ-NE2 3.31Å; F302-Q306 PolarHBondContact O-N 2.93Å
303	Y	65.4	Low	64.8	Low	144 Å²	144	125.6 Å²	125.6	57%	0.565	59%	0.592	S	S	*	*	H	α-helix	trans	-68.2	-40.6	176.3	-169.8	-91.8	0	0	0	110.8	S300 Q306 S307	S300-Y303 WeakPolarHBondContact O-CA 3.36Å; S300-Y303 WeakPolarHBondContact O-CB 3.36Å; S300-Y303 PolarHBondContact O-N 3.43Å; Y303-Q306 PolarHBondContact O-N 3.4Å; Y303-S307 WeakPolarHBondContact O-CB 3.45Å; Y303-S307 PolarHBondContact O-N 3.45Å
304	E	73.4	Confident	67.3	Low	106 Å²	106	117.9 Å²	117.9	50%	0.495	57%	0.569	S	S	.	*	H	α-helix	trans	-59.9	-45.8	174.2	-164.8	175.1	-151.2	0	0	111.3	S300 R301 S307 Q308	S300-E304 PolarHBondContact O-N 3.41Å; S300-E304 VanDerWaalsContact O-N 3.16Å; R301-E304 WeakPolarHBondContact CD-OE2 3.27Å; R301-E304 IonicContact CZ-OE2 3.94Å; R301-E304 IonicContact NE-OE2 3.1Å; R301-E304 IonicContact NH1-OE2 3.79Å; R301-E304 PolarHBondContact NH1-OE2 3.05Å; R301-E304 PolarHBondContact O-N 3.28Å; E304-S307 PolarHBondContact O-N 2.96Å; E304-Q308 WeakPolarHBondContact O-CB 3.49Å; E304-Q308 PolarHBondContact O-N 3.08Å
305	I	77.3	Confident	70.1	Confident	74 Å²	74	112.1 Å²	112.1	38%	0.379	55%	0.554	S	S	.	*	H	α-helix	trans	-65.4	-40	175.8	-68.7	165.4	0	0	0	111.9	R301 F302 Q308 K309	R301-I305 HydrophobicContact CG-CD1 4.08Å; R301-I305 WeakPolarHBondContact O-CB 3.3Å; R301-I305 WeakPolarHBondContact O-CD1 3.37Å; R301-I305 WeakPolarHBondContact O-CG1 3.28Å; R301-I305 PolarHBondContact O-N 3.16Å; F302-I305 PolarHBondContact O-N 3.33Å; I305-Q308 PolarHBondContact O-N 3.45Å; I305-K309 HydrophobicContact CG2-CD 4.41Å; I305-K309 WeakPolarHBondContact O-CB 3.33Å; I305-K309 WeakPolarHBondContact O-CG 3.49Å; I305-K309 PolarHBondContact O-N 3.43Å
306	Q	72.7	Confident	73	Confident	108 Å²	108	103 Å²	103	51%	0.505	52%	0.515	S	S	.	.	H	α-helix	trans	-65.5	-42.3	175.4	-86.2	-164.3	-10.2	0	0	112	F302 Y303 K309 S310	F302-Q306 HydrophobicContact CD1-CG 4.45Å; F302-Q306 VanDerWaalsContact CE1-CD 3.5Å; F302-Q306 HydrophobicContact CE1-CG 4.02Å; F302-Q306 VanDerWaalsContact CE1-NE2 3.28Å; F302-Q306 HydrophobicContact CZ-CG 4.24Å; F302-Q306 VanDerWaalsContact CZ-NE2 3.31Å; F302-Q306 PolarHBondContact O-N 2.93Å; Y303-Q306 PolarHBondContact O-N 3.4Å; Q306-K309 PolarHBondContact O-N 2.91Å; Q306-S310 PolarHBondContact O-N 3.49Å
307	S	76.2	Confident	75.7	Confident	62 Å²	62	94.5 Å²	94.5	43%	0.434	48%	0.484	S	S	.	.	H	α-helix	trans	-61.4	-46.1	175.2	178	0	0	0	0	110.9	Y303 E304 K309 S310 M311	Y303-S307 WeakPolarHBondContact O-CB 3.45Å; Y303-S307 PolarHBondContact O-N 3.45Å; E304-S307 PolarHBondContact O-N 2.96Å; S307-K309 PolarHBondContact O-N 3.07Å; S307-S310 PolarHBondContact O-N 3.1Å; S307-M311 WeakPolarHBondContact O-CG 3.49Å; S307-M311 PolarHBondContact O-N 2.71Å
308	Q	84.1	Confident	78	Confident	114 Å²	114	91.4 Å²	91.4	53%	0.533	47%	0.466	S	S	.	.	H	α-helix	trans	-60.8	-44.7	176.3	-169.4	172.7	19	0	0	112	E304 I305 S310 M311 E312	E304-Q308 WeakPolarHBondContact O-CB 3.49Å; E304-Q308 PolarHBondContact O-N 3.08Å; I305-Q308 PolarHBondContact O-N 3.45Å; Q308-S310 VanDerWaalsContact C-N 3.33Å; Q308-S310 PolarHBondContact O-N 2.98Å; Q308-M311 PolarHBondContact O-N 3.23Å; Q308-E312 WeakPolarHBondContact O-CG 3.46Å; Q308-E312 PolarHBondContact O-N 3.38Å
309	K	84	Confident	80.4	Confident	134 Å²	134	93.6 Å²	93.6	58%	0.583	46%	0.46	S	S	*	.	H	α-helix	trans	-61.7	-37.7	175.3	-78.6	-176.4	178.1	-174.4	0	113.1	I305 Q306 S307 Y313	I305-K309 HydrophobicContact CG2-CD 4.41Å; I305-K309 WeakPolarHBondContact O-CB 3.33Å; I305-K309 WeakPolarHBondContact O-CG 3.49Å; I305-K309 PolarHBondContact O-N 3.43Å; Q306-K309 PolarHBondContact O-N 2.91Å; S307-K309 PolarHBondContact O-N 3.07Å; K309-Y313 PolarHBondContact O-N 3.47Å; K309-Y313 VanDerWaalsContact O-N 3.1Å
310	S	82.4	Confident	82.3	Confident	67 Å²	67	87.1 Å²	87.1	47%	0.469	43%	0.426	S	S	.	.	H	α-helix	trans	-66.3	-45.5	175.4	-166.2	0	0	0	0	111.2	Q306 S307 Q308 E312 Y313 D314	Q306-S310 PolarHBondContact O-N 3.49Å; S307-S310 PolarHBondContact O-N 3.1Å; Q308-S310 VanDerWaalsContact C-N 3.33Å; Q308-S310 PolarHBondContact O-N 2.98Å; S310-E312 PolarHBondContact O-N 3.49Å; S310-Y313 WeakPolarHBondContact O-CB 3.42Å; S310-Y313 PolarHBondContact O-N 3.01Å; S310-Y313 VanDerWaalsContact O-N 3.15Å; S310-D314 PolarHBondContact O-N 3.42Å
311	M	87.1	Confident	83.9	Confident	128 Å²	128	87.2 Å²	87.2	63%	0.631	42%	0.421	S	S	*	.	H	α-helix	trans	-61.8	-41.3	177.4	-71.3	-73	-69.4	0	0	112.2	S307 Q308 Y313 D314 L315	S307-M311 WeakPolarHBondContact O-CG 3.49Å; S307-M311 PolarHBondContact O-N 2.71Å; Q308-M311 PolarHBondContact O-N 3.23Å; M311-Y313 VanDerWaalsContact C-N 3.31Å; M311-Y313 PolarHBondContact O-N 3.41Å; M311-D314 PolarHBondContact O-N 3.11Å; M311-L315 WeakPolarHBondContact O-CB 3.4Å; M311-L315 PolarHBondContact O-N 2.82Å
312	E	88.3	Confident	84.9	Confident	103 Å²	103	83.9 Å²	83.9	48%	0.481	42%	0.424	S	S	.	.	H	α-helix	trans	-63.8	-36.5	174.7	-75.2	174.5	-175.8	0	0	112.2	Q308 S310 S316	Q308-E312 WeakPolarHBondContact O-CG 3.46Å; Q308-E312 PolarHBondContact O-N 3.38Å; S310-E312 PolarHBondContact O-N 3.49Å; E312-S316 WeakPolarHBondContact O-CB 3.49Å; E312-S316 PolarHBondContact O-N 2.87Å; E312-S316 PolarHBondContact O-OG 2.96Å
313	Y	93.2	Very high	86.4	Confident	49 Å²	49	82.3 Å²	82.3	19%	0.192	42%	0.421	C	S	.	.	H	α-helix	trans	-66.6	-43.9	175.7	-168.5	-85.8	0	0	0	112.7	K309 S310 M311 L315 S316 L317 N331 L334 R335 N339	K309-Y313 PolarHBondContact O-N 3.47Å; K309-Y313 VanDerWaalsContact O-N 3.1Å; S310-Y313 WeakPolarHBondContact O-CB 3.42Å; S310-Y313 PolarHBondContact O-N 3.01Å; S310-Y313 VanDerWaalsContact O-N 3.15Å; M311-Y313 VanDerWaalsContact C-N 3.31Å; M311-Y313 PolarHBondContact O-N 3.41Å; Y313-L315 VanDerWaalsContact C-N 3.29Å; Y313-L315 PolarHBondContact O-N 2.82Å; Y313-S316 PolarHBondContact O-N 3.46Å; Y313-S316 PolarHBondContact O-OG 2.79Å; Y313-L317 HydrophobicContact CE1-CD2 4.32Å; Y313-L317 VanDerWaalsContact O-CB 3.26Å; Y313-L317 WeakPolarHBondContact O-CB 3.35Å; Y313-L317 PolarHBondContact O-N 3.15Å; Y313-N331 PolarHBondContact OH-O 3.27Å; Y313-N331 PolarHBondContact OH-OD1 3.32Å; Y313-L334 HydrophobicContact CE2-CB 3.74Å; Y313-R335 WeakPolarHBondContact OH-CG 3.24Å; Y313-N339 VanDerWaalsContact CA-ND2 3.31Å; Y313-N339 WeakPolarHBondContact CA-ND2 3.49Å; Y313-N339 VanDerWaalsContact CA-OD1 3.28Å; Y313-N339 WeakPolarHBondContact CA-OD1 3.4Å; Y313-N339 HydrophobicContact CD2-CB 3.92Å; Y313-N339 VanDerWaalsContact CD2-CG 3.48Å; Y313-N339 VanDerWaalsContact CD2-OD1 3.28Å; Y313-N339 WeakPolarHBondContact CD2-OD1 3.43Å; Y313-N339 PolarHBondContact N-ND2 3.18Å; Y313-N339 VanDerWaalsContact N-ND2 3.18Å
314	D	90.9	Very high	87.7	Confident	88 Å²	88	78.5 Å²	78.5	47%	0.471	43%	0.425	S	S	.	.	H	α-helix	trans	-67.5	-34.9	178.3	-66.2	-27.4	0	0	0	111.2	S310 M311 S318	S310-D314 PolarHBondContact O-N 3.42Å; M311-D314 PolarHBondContact O-N 3.11Å; D314-S318 VanDerWaalsContact O-CB 3.23Å; D314-S318 WeakPolarHBondContact O-CB 3.08Å; D314-S318 PolarHBondContact O-N 3.33Å
315	L	94.2	Very high	88.5	Confident	99 Å²	99	75.6 Å²	75.6	52%	0.518	41%	0.41	S	S	.	.	H	α-helix	trans	-70.4	-40.4	176.3	-168.3	141.4	0	0	0	112.5	M311 Y313 K319	M311-L315 WeakPolarHBondContact O-CB 3.4Å; M311-L315 PolarHBondContact O-N 2.82Å; Y313-L315 VanDerWaalsContact C-N 3.29Å; Y313-L315 PolarHBondContact O-N 2.82Å; L315-K319 HydrophobicContact CD2-CD 4.05Å; L315-K319 VanDerWaalsContact CD2-CE 3.42Å; L315-K319 WeakPolarHBondContact O-CG 3.11Å; L315-K319 PolarHBondContact O-N 2.86Å
316	S	93.5	Very high	89.2	Confident	6 Å²	6	75.4 Å²	75.4	4%	0.042	41%	0.414	C	S	.	.	H	α-helix	trans	-67.2	-40	174.7	66.9	0	0	0	0	111.4	E312 Y313 K319 L320 L334 N339	E312-S316 WeakPolarHBondContact O-CB 3.49Å; E312-S316 PolarHBondContact O-N 2.87Å; E312-S316 PolarHBondContact O-OG 2.96Å; Y313-S316 PolarHBondContact O-N 3.46Å; Y313-S316 PolarHBondContact O-OG 2.79Å; S316-K319 PolarHBondContact O-N 2.82Å; S316-L320 PolarHBondContact O-N 2.9Å; S316-L320 VanDerWaalsContact O-N 3.09Å; S316-L334 WeakPolarHBondContact OG-CD1 3.22Å; S316-L334 WeakPolarHBondContact OG-CD2 3.5Å; S316-N339 PolarHBondContact OG-OD1 3.39Å
317	L	93.8	Very high	90	Very high	14 Å²	14	76.6 Å²	76.6	7%	0.073	41%	0.414	C	S	.	.	H	α-helix	trans	-66	-44.4	176	-174.3	62.7	0	0	0	111.6	Y313 K319 L320 L321 Y327 A330 N331 L334	Y313-L317 HydrophobicContact CE1-CD2 4.32Å; Y313-L317 VanDerWaalsContact O-CB 3.26Å; Y313-L317 WeakPolarHBondContact O-CB 3.35Å; Y313-L317 PolarHBondContact O-N 3.15Å; L317-K319 VanDerWaalsContact C-N 3.34Å; L317-K319 PolarHBondContact O-N 3.19Å; L317-L320 PolarHBondContact O-N 2.85Å; L317-L321 HydrophobicContact CG-CD1 4.21Å; L317-L321 WeakPolarHBondContact O-CB 3.39Å; L317-L321 VanDerWaalsContact O-CG 3.27Å; L317-L321 WeakPolarHBondContact O-CG 3.31Å; L317-L321 PolarHBondContact O-N 3.24Å; L317-Y327 HydrophobicContact CD2-CD2 4.15Å; L317-Y327 HydrophobicContact CD2-CE2 3.72Å; L317-A330 HydrophobicContact CD1-CB 3.76Å; L317-N331 HydrophobicContact CD1-CB 4.15Å; L317-L334 HydrophobicContact CB-CD1 3.76Å; L317-L334 HydrophobicContact CD1-CD1 3.96Å; L317-L334 HydrophobicContact CG-CD1 4.47Å
318	S	93.1	Very high	90.7	Very high	67 Å²	67	81.3 Å²	81.3	47%	0.469	43%	0.43	S	S	.	.	H	α-helix	trans	-57.4	-45.4	174.4	179.7	0	0	0	0	111.5	D314 L320 L321 S322	D314-S318 VanDerWaalsContact O-CB 3.23Å; D314-S318 WeakPolarHBondContact O-CB 3.08Å; D314-S318 PolarHBondContact O-N 3.33Å; S318-L320 PolarHBondContact O-N 3.1Å; S318-L321 PolarHBondContact O-N 3.4Å; S318-S322 WeakPolarHBondContact O-CB 3.41Å; S318-S322 PolarHBondContact O-N 3.16Å; S318-S322 PolarHBondContact O-OG 3.19Å; S318-S322 VanDerWaalsContact O-OG 3.05Å
319	K	94.5	Very high	91	Very high	98 Å²	98	79.9 Å²	79.9	43%	0.426	43%	0.425	S	S	.	.	H	α-helix	trans	-59.5	-43.4	175.5	-74.4	172.7	176.2	174.3	0	112.7	L315 S316 L317 S322 L323 Y341	L315-K319 HydrophobicContact CD2-CD 4.05Å; L315-K319 VanDerWaalsContact CD2-CE 3.42Å; L315-K319 WeakPolarHBondContact O-CG 3.11Å; L315-K319 PolarHBondContact O-N 2.86Å; S316-K319 PolarHBondContact O-N 2.82Å; L317-K319 VanDerWaalsContact C-N 3.34Å; L317-K319 PolarHBondContact O-N 3.19Å; K319-S322 PolarHBondContact O-N 3.45Å; K319-L323 WeakPolarHBondContact O-CG 3.14Å; K319-L323 PolarHBondContact O-N 3.03Å; K319-L323 VanDerWaalsContact O-N 3.16Å; K319-Y341 HydrophobicContact CB-CD2 3.99Å; K319-Y341 HydrophobicContact CB-CE2 3.39Å; K319-Y341 HydrophobicContact CD-CD1 4.5Å; K319-Y341 HydrophobicContact CD-CD2 4.33Å; K319-Y341 HydrophobicContact CD-CE1 4.34Å; K319-Y341 HydrophobicContact CD-CE2 4.17Å; K319-Y341 HydrophobicContact CD-CG 4.49Å; K319-Y341 HydrophobicContact CG-CE2 4.42Å
320	L	93.2	Very high	91.4	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-67.5	-38.6	177.6	-71.6	177.6	0	0	0	112.2	S316 L317 S318 L323 Y325 A330 L334 Y341 A344 L345 L348	S316-L320 PolarHBondContact O-N 2.9Å; S316-L320 VanDerWaalsContact O-N 3.09Å; L317-L320 PolarHBondContact O-N 2.85Å; S318-L320 PolarHBondContact O-N 3.1Å; L320-L323 PolarHBondContact O-N 3.13Å; L320-Y325 HydrophobicContact CD2-CD2 4.23Å; L320-Y325 PolarHBondContact O-N 3.02Å; L320-A330 HydrophobicContact CB-CB 3.67Å; L320-A330 HydrophobicContact CD1-CB 3.95Å; L320-A330 HydrophobicContact CG-CB 4.47Å; L320-L334 HydrophobicContact CD1-CD1 3.86Å; L320-L334 HydrophobicContact CD1-CD2 4.07Å; L320-L334 HydrophobicContact CD1-CG 3.69Å; L320-Y341 HydrophobicContact CD2-CD2 4.08Å; L320-Y341 HydrophobicContact CD2-CE2 3.7Å; L320-Y341 HydrophobicContact CG-CD2 3.97Å; L320-Y341 HydrophobicContact CG-CE2 3.86Å; L320-A344 HydrophobicContact CD1-CB 4.25Å; L320-L345 HydrophobicContact CD2-CB 4.17Å; L320-L345 HydrophobicContact CD2-CD1 4.32Å; L320-L348 HydrophobicContact CD1-CD1 4.16Å; L320-L348 HydrophobicContact CD2-CD1 3.92Å
321	L	93.3	Very high	91.9	Very high	71 Å²	71	71.1 Å²	71.1	37%	0.372	38%	0.379	S	S	.	.	H	α-helix	trans	-64.3	-41.2	174.1	-70.3	173.8	0	0	0	111.6	L317 S318 L323 G324 Y325 Y327	L317-L321 HydrophobicContact CG-CD1 4.21Å; L317-L321 WeakPolarHBondContact O-CB 3.39Å; L317-L321 VanDerWaalsContact O-CG 3.27Å; L317-L321 WeakPolarHBondContact O-CG 3.31Å; L317-L321 PolarHBondContact O-N 3.24Å; S318-L321 PolarHBondContact O-N 3.4Å; L321-L323 PolarHBondContact O-N 2.79Å; L321-G324 PolarHBondContact O-N 2.95Å; L321-Y325 WeakPolarHBondContact CD2-O 3.18Å; L321-Y327 HydrophobicContact CD1-CD2 4.49Å
322	S	93.3	Very high	92	Very high	100 Å²	100	73.2 Å²	73.2	70%	0.699	38%	0.38	S	S	*	.	H	α-helix	trans	-63.5	-26.9	175.6	-64.3	0	0	0	0	113.2	S318 K319 G324	S318-S322 WeakPolarHBondContact O-CB 3.41Å; S318-S322 PolarHBondContact O-N 3.16Å; S318-S322 PolarHBondContact O-OG 3.19Å; S318-S322 VanDerWaalsContact O-OG 3.05Å; K319-S322 PolarHBondContact O-N 3.45Å; S322-G324 PolarHBondContact O-N 2.53Å
323	L	91.9	Very high	92.2	Very high	97 Å²	97	68.5 Å²	68.5	51%	0.508	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-0.5	172.3	-67.9	174.1	0	0	0	113.6	K319 L320 L321 Y325 Y341 L345	K319-L323 WeakPolarHBondContact O-CG 3.14Å; K319-L323 PolarHBondContact O-N 3.03Å; K319-L323 VanDerWaalsContact O-N 3.16Å; L320-L323 PolarHBondContact O-N 3.13Å; L321-L323 PolarHBondContact O-N 2.79Å; L323-Y325 HydrophobicContact CB-CD2 4.03Å; L323-Y325 HydrophobicContact CB-CE2 4.14Å; L323-Y341 VanDerWaalsContact CD1-OH 3.29Å; L323-Y341 WeakPolarHBondContact CD1-OH 3.34Å; L323-L345 HydrophobicContact CD1-CD1 3.3Å; L323-L345 HydrophobicContact CD1-CG 4.46Å
324	G	90.6	Very high	92.2	Very high	63 Å²	63	66.2 Å²	66.2	65%	0.649	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	5.3	176.1	0	0	0	0	0	114.9	L321 S322	L321-G324 PolarHBondContact O-N 2.95Å; S322-G324 PolarHBondContact O-N 2.53Å
325	Y	90.2	Very high	92.2	Very high	46 Å²	46	69.5 Å²	69.5	18%	0.18	36%	0.356	C	S	.	.			trans	-71.6	134.6	173.5	-67.3	-74.1	0	0	0	110.4	L320 L321 L323 L348 L349	L320-Y325 HydrophobicContact CD2-CD2 4.23Å; L320-Y325 PolarHBondContact O-N 3.02Å; L321-Y325 WeakPolarHBondContact CD2-O 3.18Å; L323-Y325 HydrophobicContact CB-CD2 4.03Å; L323-Y325 HydrophobicContact CB-CE2 4.14Å; Y325-L348 HydrophobicContact CD1-CB 4.29Å; Y325-L348 HydrophobicContact CD1-CD1 4.07Å; Y325-L348 HydrophobicContact CD1-CD2 4.39Å; Y325-L348 HydrophobicContact CD1-CG 4.49Å; Y325-L348 HydrophobicContact CD2-CD1 4.06Å; Y325-L348 HydrophobicContact CE1-CB 3.7Å; Y325-L348 HydrophobicContact CE1-CD1 4.26Å; Y325-L348 HydrophobicContact CE1-CG 4.38Å; Y325-L348 HydrophobicContact CE2-CB 4.36Å; Y325-L348 HydrophobicContact CE2-CD1 4.24Å; Y325-L348 HydrophobicContact CG-CD1 3.97Å; Y325-L349 WeakPolarHBondContact OH-CD2 3.46Å
326	P	92	Very high	92	Very high	70 Å²	70	69.2 Å²	69.2	46%	0.455	35%	0.354	S	S	.	.			trans	-67.4	144.9	177.4	27.1	-32.5	0	0	0	110.5	Q328 I329 A330	P326-Q328 PolarHBondContact O-N 3.02Å; P326-I329 HydrophobicContact CG-CB 3.95Å; P326-I329 HydrophobicContact CG-CD1 3.55Å; P326-I329 HydrophobicContact CG-CG1 3.81Å; P326-I329 PolarHBondContact O-N 2.82Å; P326-A330 PolarHBondContact O-N 3.48Å
327	Y	90	Very high	91.7	Very high	132 Å²	132	70.8 Å²	70.8	52%	0.518	36%	0.362	S	S	.	.	H	α-helix	trans	-46.1	-44.5	-175.5	173.4	-96.4	0	0	0	113.9	L317 L321 I329 A330 N331	L317-Y327 HydrophobicContact CD2-CD2 4.15Å; L317-Y327 HydrophobicContact CD2-CE2 3.72Å; L321-Y327 HydrophobicContact CD1-CD2 4.49Å; Y327-I329 VanDerWaalsContact C-N 3.33Å; Y327-I329 PolarHBondContact O-N 3.1Å; Y327-A330 PolarHBondContact O-N 3.4Å; Y327-N331 WeakPolarHBondContact O-CB 3.44Å; Y327-N331 PolarHBondContact O-N 2.76Å; Y327-N331 PolarHBondContact OH-ND2 3.48Å
328	Q	91.9	Very high	91.5	Very high	162 Å²	162	78.6 Å²	78.6	76%	0.757	40%	0.398	S	S	*	.	H	α-helix	trans	-61.9	-40.7	-178.5	-65.1	177.1	-33.2	0	0	112.5	P326 R332	P326-Q328 PolarHBondContact O-N 3.02Å; Q328-R332 VanDerWaalsContact O-CB 3.31Å; Q328-R332 WeakPolarHBondContact O-CB 3.08Å; Q328-R332 PolarHBondContact O-N 2.75Å; Q328-R332 VanDerWaalsContact O-N 3.15Å
329	I	90.3	Very high	91.1	Very high	84 Å²	84	77.2 Å²	77.2	43%	0.431	39%	0.386	S	S	.	.	H	α-helix	trans	-75.1	-45.1	-178.6	-67.1	-177.1	0	0	0	110.2	P326 Y327 R332 A333 L348	P326-I329 HydrophobicContact CG-CB 3.95Å; P326-I329 HydrophobicContact CG-CD1 3.55Å; P326-I329 HydrophobicContact CG-CG1 3.81Å; P326-I329 PolarHBondContact O-N 2.82Å; Y327-I329 VanDerWaalsContact C-N 3.33Å; Y327-I329 PolarHBondContact O-N 3.1Å; I329-R332 PolarHBondContact O-N 3.42Å; I329-A333 WeakPolarHBondContact O-CB 3.35Å; I329-A333 PolarHBondContact O-N 2.69Å; I329-L348 HydrophobicContact CG2-CD2 3.16Å
330	A	92.4	Very high	91	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-62.8	-46	177.7	0	0	0	0	0	112.3	L317 L320 P326 Y327 R332 A333 L334	L317-A330 HydrophobicContact CD1-CB 3.76Å; L320-A330 HydrophobicContact CB-CB 3.67Å; L320-A330 HydrophobicContact CD1-CB 3.95Å; L320-A330 HydrophobicContact CG-CB 4.47Å; P326-A330 PolarHBondContact O-N 3.48Å; Y327-A330 PolarHBondContact O-N 3.4Å; A330-R332 PolarHBondContact O-N 3.31Å; A330-A333 PolarHBondContact O-N 3.45Å; A330-L334 WeakPolarHBondContact O-CG 3.47Å; A330-L334 PolarHBondContact O-N 2.84Å
331	N	91.3	Very high	90.9	Very high	17 Å²	17	78.4 Å²	78.4	9%	0.091	39%	0.394	C	S	.	.	H	α-helix	trans	-63.7	-41.6	178.5	-168.1	4.2	0	0	0	111.1	Y313 L317 Y327 L334 R335	Y313-N331 PolarHBondContact OH-O 3.27Å; Y313-N331 PolarHBondContact OH-OD1 3.32Å; L317-N331 HydrophobicContact CD1-CB 4.15Å; Y327-N331 WeakPolarHBondContact O-CB 3.44Å; Y327-N331 PolarHBondContact O-N 2.76Å; Y327-N331 PolarHBondContact OH-ND2 3.48Å; N331-L334 PolarHBondContact O-N 3.14Å; N331-R335 WeakPolarHBondContact O-CB 3.41Å; N331-R335 VanDerWaalsContact O-CG 3.3Å; N331-R335 WeakPolarHBondContact O-CG 3.35Å; N331-R335 PolarHBondContact O-N 2.89Å; N331-R335 PolarHBondContact OD1-NE 3.45Å
332	R	91.1	Very high	90.9	Very high	171 Å²	171	80.8 Å²	80.8	65%	0.645	40%	0.403	S	S	*	.	H	α-helix	trans	-63.7	-45.9	174.4	-173.8	173.9	-176.4	165.2	3.8	112	Q328 I329 A330 L334 R335 D336	Q328-R332 VanDerWaalsContact O-CB 3.31Å; Q328-R332 WeakPolarHBondContact O-CB 3.08Å; Q328-R332 PolarHBondContact O-N 2.75Å; Q328-R332 VanDerWaalsContact O-N 3.15Å; I329-R332 PolarHBondContact O-N 3.42Å; A330-R332 PolarHBondContact O-N 3.31Å; R332-L334 VanDerWaalsContact C-N 3.31Å; R332-L334 PolarHBondContact O-N 2.96Å; R332-R335 PolarHBondContact O-N 2.82Å; R332-D336 IonicContact NE-OD2 3.18Å; R332-D336 WeakPolarHBondContact O-CB 3.5Å; R332-D336 VanDerWaalsContact O-CG 3.23Å; R332-D336 PolarHBondContact O-N 3.13Å
333	A	91.4	Very high	90.8	Very high	5 Å²	5	79 Å²	79	4%	0.041	39%	0.388	C	S	.	.	H	α-helix	trans	-61.6	-37.3	179	0	0	0	0	0	112.6	I329 A330 N337 A344 L348	I329-A333 WeakPolarHBondContact O-CB 3.35Å; I329-A333 PolarHBondContact O-N 2.69Å; A330-A333 PolarHBondContact O-N 3.45Å; A333-N337 WeakPolarHBondContact O-CB 3.44Å; A333-N337 PolarHBondContact O-N 3.19Å; A333-N337 PolarHBondContact O-ND2 3Å; A333-A344 HydrophobicContact CB-CB 4.01Å; A333-L348 HydrophobicContact CB-CD1 3.85Å; A333-L348 HydrophobicContact CB-CD2 3.92Å; A333-L348 HydrophobicContact CB-CG 3.79Å
334	L	93.3	Very high	90.8	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-72.3	-38	175.7	-72.8	169.4	0	0	0	113	Y313 S316 L317 L320 A330 N331 R332 N337 H338 N339 A344	Y313-L334 HydrophobicContact CE2-CB 3.74Å; S316-L334 WeakPolarHBondContact OG-CD1 3.22Å; S316-L334 WeakPolarHBondContact OG-CD2 3.5Å; L317-L334 HydrophobicContact CB-CD1 3.76Å; L317-L334 HydrophobicContact CD1-CD1 3.96Å; L317-L334 HydrophobicContact CG-CD1 4.47Å; L320-L334 HydrophobicContact CD1-CD1 3.86Å; L320-L334 HydrophobicContact CD1-CD2 4.07Å; L320-L334 HydrophobicContact CD1-CG 3.69Å; A330-L334 WeakPolarHBondContact O-CG 3.47Å; A330-L334 PolarHBondContact O-N 2.84Å; N331-L334 PolarHBondContact O-N 3.14Å; R332-L334 VanDerWaalsContact C-N 3.31Å; R332-L334 PolarHBondContact O-N 2.96Å; L334-N337 CarbonylContact O-C 3.55Å; L334-N337 PolarHBondContact O-N 3.46Å; L334-H338 PolarHBondContact O-N 2.94Å; L334-N339 PolarHBondContact O-N 2.83Å; L334-A344 HydrophobicContact CD2-CB 3.83Å; L334-A344 HydrophobicContact CG-CB 4.28Å
335	R	90.9	Very high	90.9	Very high	158 Å²	158	73 Å²	73	60%	0.596	34%	0.341	S	S	*	.	H	α-helix	trans	-64	-45.8	174.9	-74.6	-179.2	-179.4	-157	-3	112	Y313 N331 R332 N337	Y313-R335 WeakPolarHBondContact OH-CG 3.24Å; N331-R335 WeakPolarHBondContact O-CB 3.41Å; N331-R335 VanDerWaalsContact O-CG 3.3Å; N331-R335 WeakPolarHBondContact O-CG 3.35Å; N331-R335 PolarHBondContact O-N 2.89Å; N331-R335 PolarHBondContact OD1-NE 3.45Å; R332-R335 PolarHBondContact O-N 2.82Å; R335-N337 VanDerWaalsContact C-N 3.26Å; R335-N337 PolarHBondContact O-N 2.8Å
336	D	89	Confident	91	Very high	92 Å²	92	75.5 Å²	75.5	49%	0.492	36%	0.357	S	S	.	.	H	α-helix	trans	-67.7	-28.1	-178.6	-66.7	-12	0	0	0	111.6	R332	R332-D336 IonicContact NE-OD2 3.18Å; R332-D336 WeakPolarHBondContact O-CB 3.5Å; R332-D336 VanDerWaalsContact O-CG 3.23Å; R332-D336 PolarHBondContact O-N 3.13Å
337	N	89	Confident	90.9	Very high	39 Å²	39	73.7 Å²	73.7	21%	0.209	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	28.3	-176.9	-60.5	-62.3	0	0	0	114.2	A333 L334 R335 N339 N340 V343 A344	A333-N337 WeakPolarHBondContact O-CB 3.44Å; A333-N337 PolarHBondContact O-N 3.19Å; A333-N337 PolarHBondContact O-ND2 3Å; L334-N337 CarbonylContact O-C 3.55Å; L334-N337 PolarHBondContact O-N 3.46Å; R335-N337 VanDerWaalsContact C-N 3.26Å; R335-N337 PolarHBondContact O-N 2.8Å; N337-N339 VanDerWaalsContact C-N 3.32Å; N337-N339 PolarHBondContact O-N 3.12Å; N337-N340 WeakPolarHBondContact O-CB 3.42Å; N337-N340 PolarHBondContact O-N 2.85Å; N337-V343 HydrophobicContact CB-CB 4.3Å; N337-V343 HydrophobicContact CB-CG1 4.06Å; N337-A344 HydrophobicContact CB-CB 4.49Å
338	H	87.9	Confident	91	Very high	178 Å²	178	67.9 Å²	67.9	82%	0.824	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	42.9	173.5	-59.4	-59.6	0	0	0	115.2	L334 N340	L334-H338 PolarHBondContact O-N 2.94Å; H338-N340 PolarHBondContact O-N 2.89Å
339	N	86.3	Confident	90.9	Very high	39 Å²	39	64 Å²	64	21%	0.209	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	15.9	-178.9	-161	26.1	0	0	0	115.8	Y313 S316 L334 N337 Y341	Y313-N339 VanDerWaalsContact CA-ND2 3.31Å; Y313-N339 WeakPolarHBondContact CA-ND2 3.49Å; Y313-N339 VanDerWaalsContact CA-OD1 3.28Å; Y313-N339 WeakPolarHBondContact CA-OD1 3.4Å; Y313-N339 HydrophobicContact CD2-CB 3.92Å; Y313-N339 VanDerWaalsContact CD2-CG 3.48Å; Y313-N339 VanDerWaalsContact CD2-OD1 3.28Å; Y313-N339 WeakPolarHBondContact CD2-OD1 3.43Å; Y313-N339 PolarHBondContact N-ND2 3.18Å; Y313-N339 VanDerWaalsContact N-ND2 3.18Å; S316-N339 PolarHBondContact OG-OD1 3.39Å; L334-N339 PolarHBondContact O-N 2.83Å; N337-N339 VanDerWaalsContact C-N 3.32Å; N337-N339 PolarHBondContact O-N 3.12Å; N339-Y341 PolarHBondContact O-N 3.21Å
340	N	90.9	Very high	90.7	Very high	78 Å²	78	63 Å²	63	42%	0.417	31%	0.308	S	S	.	.			trans	-82	105.9	173.3	-168.8	-26.3	0	0	0	110.4	N337 H338 Q342 V343 A344	N337-N340 WeakPolarHBondContact O-CB 3.42Å; N337-N340 PolarHBondContact O-N 2.85Å; H338-N340 PolarHBondContact O-N 2.89Å; N340-Q342 PolarHBondContact O-N 2.93Å; N340-Q342 PolarHBondContact OD1-N 3.18Å; N340-V343 HydrophobicContact CB-CB 4.24Å; N340-V343 HydrophobicContact CB-CG2 4.19Å; N340-V343 PolarHBondContact O-N 2.79Å; N340-A344 WeakPolarHBondContact O-CB 3.42Å; N340-A344 PolarHBondContact O-N 3.41Å
341	Y	91.8	Very high	90.2	Very high	44 Å²	44	68.4 Å²	68.4	17%	0.173	33%	0.332	C	S	.	.	H	α-helix	trans	-56.8	-46.6	-177.5	169.6	-104.8	0	0	0	113.1	K319 L320 L323 N339 A344 L345	K319-Y341 HydrophobicContact CB-CD2 3.99Å; K319-Y341 HydrophobicContact CB-CE2 3.39Å; K319-Y341 HydrophobicContact CD-CD1 4.5Å; K319-Y341 HydrophobicContact CD-CD2 4.33Å; K319-Y341 HydrophobicContact CD-CE1 4.34Å; K319-Y341 HydrophobicContact CD-CE2 4.17Å; K319-Y341 HydrophobicContact CD-CG 4.49Å; K319-Y341 HydrophobicContact CG-CE2 4.42Å; L320-Y341 HydrophobicContact CD2-CD2 4.08Å; L320-Y341 HydrophobicContact CD2-CE2 3.7Å; L320-Y341 HydrophobicContact CG-CD2 3.97Å; L320-Y341 HydrophobicContact CG-CE2 3.86Å; L323-Y341 VanDerWaalsContact CD1-OH 3.29Å; L323-Y341 WeakPolarHBondContact CD1-OH 3.34Å; N339-Y341 PolarHBondContact O-N 3.21Å; Y341-A344 PolarHBondContact O-N 3.1Å; Y341-L345 HydrophobicContact CE1-CD1 4.12Å; Y341-L345 HydrophobicContact CE2-CD1 4.07Å; Y341-L345 VanDerWaalsContact O-CB 3.31Å; Y341-L345 WeakPolarHBondContact O-CB 3.48Å; Y341-L345 PolarHBondContact O-N 2.88Å; Y341-L345 VanDerWaalsContact OH-CD1 3.29Å; Y341-L345 WeakPolarHBondContact OH-CD1 3.38Å
342	Q	93.2	Very high	89.4	Confident	122 Å²	122	70.2 Å²	70.2	57%	0.57	35%	0.346	S	S	*	.	H	α-helix	trans	-62.3	-47.2	-178.7	-90.9	72.3	11.1	0	0	111.6	N340 A344 L345 D346	N340-Q342 PolarHBondContact O-N 2.93Å; N340-Q342 PolarHBondContact OD1-N 3.18Å; Q342-A344 VanDerWaalsContact C-N 3.35Å; Q342-A344 PolarHBondContact O-N 3.42Å; Q342-L345 PolarHBondContact O-N 3.05Å; Q342-D346 PolarHBondContact O-N 3.5Å
343	V	91.2	Very high	88.1	Confident	63 Å²	63	66.4 Å²	66.4	38%	0.382	34%	0.342	S	S	.	.	H	α-helix	trans	-67.6	-38.4	-179.4	-177.3	0	0	0	0	111.1	N337 N340 L345 D346 C347	N337-V343 HydrophobicContact CB-CB 4.3Å; N337-V343 HydrophobicContact CB-CG1 4.06Å; N340-V343 HydrophobicContact CB-CB 4.24Å; N340-V343 HydrophobicContact CB-CG2 4.19Å; N340-V343 PolarHBondContact O-N 2.79Å; V343-L345 VanDerWaalsContact C-N 3.33Å; V343-L345 PolarHBondContact O-N 3.15Å; V343-D346 PolarHBondContact O-N 3.04Å; V343-C347 VanDerWaalsContact O-CB 3.28Å; V343-C347 WeakPolarHBondContact O-CB 3.46Å; V343-C347 PolarHBondContact O-N 3.38Å
344	A	91.9	Very high	86.5	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-61.5	-42.6	173.4	0	0	0	0	0	111.4	L320 A333 L334 N337 N340 Y341 Q342 C347 L348	L320-A344 HydrophobicContact CD1-CB 4.25Å; A333-A344 HydrophobicContact CB-CB 4.01Å; L334-A344 HydrophobicContact CD2-CB 3.83Å; L334-A344 HydrophobicContact CG-CB 4.28Å; N337-A344 HydrophobicContact CB-CB 4.49Å; N340-A344 WeakPolarHBondContact O-CB 3.42Å; N340-A344 PolarHBondContact O-N 3.41Å; Y341-A344 PolarHBondContact O-N 3.1Å; Q342-A344 VanDerWaalsContact C-N 3.35Å; Q342-A344 PolarHBondContact O-N 3.42Å; A344-C347 PolarHBondContact O-N 3.4Å; A344-L348 WeakPolarHBondContact O-CB 3.42Å; A344-L348 WeakPolarHBondContact O-CG 3.28Å; A344-L348 PolarHBondContact O-N 3.17Å
345	L	93.3	Very high	84.3	Confident	32 Å²	32	76.5 Å²	76.5	17%	0.168	40%	0.4	C	S	.	.	H	α-helix	trans	-66.1	-45	177.4	-171.5	146.1	0	0	0	111.9	L320 L323 Y341 Q342 V343 C347 L348 L349	L320-L345 HydrophobicContact CD2-CB 4.17Å; L320-L345 HydrophobicContact CD2-CD1 4.32Å; L323-L345 HydrophobicContact CD1-CD1 3.3Å; L323-L345 HydrophobicContact CD1-CG 4.46Å; Y341-L345 HydrophobicContact CE1-CD1 4.12Å; Y341-L345 HydrophobicContact CE2-CD1 4.07Å; Y341-L345 VanDerWaalsContact O-CB 3.31Å; Y341-L345 WeakPolarHBondContact O-CB 3.48Å; Y341-L345 PolarHBondContact O-N 2.88Å; Y341-L345 VanDerWaalsContact OH-CD1 3.29Å; Y341-L345 WeakPolarHBondContact OH-CD1 3.38Å; Q342-L345 PolarHBondContact O-N 3.05Å; V343-L345 VanDerWaalsContact C-N 3.33Å; V343-L345 PolarHBondContact O-N 3.15Å; L345-C347 VanDerWaalsContact C-N 3.31Å; L345-C347 PolarHBondContact O-N 2.84Å; L345-L348 CarbonylContact O-C 3.33Å; L345-L348 WeakPolarHBondContact O-CB 3.47Å; L345-L348 PolarHBondContact O-N 3.17Å; L345-L348 VanDerWaalsContact O-N 3.09Å; L345-L349 HydrophobicContact CD2-CD1 3.44Å; L345-L349 VanDerWaalsContact CD2-CD1 3.44Å; L345-L349 HydrophobicContact CD2-CG 4.02Å; L345-L349 WeakPolarHBondContact O-CG 3.11Å; L345-L349 PolarHBondContact O-N 3.2Å
346	D	92.1	Very high	82.1	Confident	99 Å²	99	76.6 Å²	76.6	53%	0.529	41%	0.409	S	S	.	.	H	α-helix	trans	-63.1	-37.4	175.6	-72.9	-14.4	0	0	0	111.9	Q342 V343 L348 L349 S350	Q342-D346 PolarHBondContact O-N 3.5Å; V343-D346 PolarHBondContact O-N 3.04Å; D346-L348 VanDerWaalsContact C-N 3.31Å; D346-L348 PolarHBondContact O-N 2.99Å; D346-L349 PolarHBondContact O-N 3.43Å; D346-S350 VanDerWaalsContact O-CB 3.32Å; D346-S350 WeakPolarHBondContact O-CB 3.3Å; D346-S350 PolarHBondContact O-N 2.84Å; D346-S350 PolarHBondContact O-OG 2.68Å
347	C	90.2	Very high	79.7	Confident	33 Å²	33	80.7 Å²	80.7	22%	0.223	43%	0.425	C	S	.	.	H	α-helix	trans	-64.3	-36.7	173.3	-169.5	0	0	0	0	111.8	V343 A344 L345 S350 K351	V343-C347 VanDerWaalsContact O-CB 3.28Å; V343-C347 WeakPolarHBondContact O-CB 3.46Å; V343-C347 PolarHBondContact O-N 3.38Å; A344-C347 PolarHBondContact O-N 3.4Å; L345-C347 VanDerWaalsContact C-N 3.31Å; L345-C347 PolarHBondContact O-N 2.84Å; C347-S350 WeakPolarHBondContact CA-OG 3.42Å; C347-S350 PolarHBondContact O-OG 2.95Å; C347-K351 WeakPolarHBondContact O-CB 3.4Å; C347-K351 VanDerWaalsContact O-CG 3.28Å; C347-K351 WeakPolarHBondContact O-CG 3.46Å; C347-K351 PolarHBondContact O-N 3.23Å; C347-K351 VanDerWaalsContact O-N 3.11Å
348	L	91.4	Very high	77.2	Confident	10 Å²	10	85.8 Å²	85.8	5%	0.052	45%	0.451	C	S	.	.	H	α-helix	trans	-74.2	-37.5	177.1	-70.1	172.4	0	0	0	112.6	L320 Y325 I329 A333 A344 L345 D346 S352	L320-L348 HydrophobicContact CD1-CD1 4.16Å; L320-L348 HydrophobicContact CD2-CD1 3.92Å; Y325-L348 HydrophobicContact CD1-CB 4.29Å; Y325-L348 HydrophobicContact CD1-CD1 4.07Å; Y325-L348 HydrophobicContact CD1-CD2 4.39Å; Y325-L348 HydrophobicContact CD1-CG 4.49Å; Y325-L348 HydrophobicContact CD2-CD1 4.06Å; Y325-L348 HydrophobicContact CE1-CB 3.7Å; Y325-L348 HydrophobicContact CE1-CD1 4.26Å; Y325-L348 HydrophobicContact CE1-CG 4.38Å; Y325-L348 HydrophobicContact CE2-CB 4.36Å; Y325-L348 HydrophobicContact CE2-CD1 4.24Å; Y325-L348 HydrophobicContact CG-CD1 3.97Å; I329-L348 HydrophobicContact CG2-CD2 3.16Å; A333-L348 HydrophobicContact CB-CD1 3.85Å; A333-L348 HydrophobicContact CB-CD2 3.92Å; A333-L348 HydrophobicContact CB-CG 3.79Å; A344-L348 WeakPolarHBondContact O-CB 3.42Å; A344-L348 WeakPolarHBondContact O-CG 3.28Å; A344-L348 PolarHBondContact O-N 3.17Å; L345-L348 CarbonylContact O-C 3.33Å; L345-L348 WeakPolarHBondContact O-CB 3.47Å; L345-L348 PolarHBondContact O-N 3.17Å; L345-L348 VanDerWaalsContact O-N 3.09Å; D346-L348 VanDerWaalsContact C-N 3.31Å; D346-L348 PolarHBondContact O-N 2.99Å; L348-S352 PolarHBondContact O-N 3.13Å; L348-S352 VanDerWaalsContact O-N 3.08Å; L348-S352 PolarHBondContact O-OG 3.07Å
349	L	90.1	Very high	74.6	Confident	81 Å²	81	85.8 Å²	85.8	42%	0.424	45%	0.451	S	S	.	.	H	α-helix	trans	-67.6	-47	173.6	-71.3	179.2	0	0	0	111.6	Y325 L345 D346 K351 S352 T353	Y325-L349 WeakPolarHBondContact OH-CD2 3.46Å; L345-L349 HydrophobicContact CD2-CD1 3.44Å; L345-L349 VanDerWaalsContact CD2-CD1 3.44Å; L345-L349 HydrophobicContact CD2-CG 4.02Å; L345-L349 WeakPolarHBondContact O-CG 3.11Å; L345-L349 PolarHBondContact O-N 3.2Å; D346-L349 PolarHBondContact O-N 3.43Å; L349-K351 VanDerWaalsContact C-N 3.35Å; L349-K351 PolarHBondContact O-N 3.27Å; L349-S352 VanDerWaalsContact CA-OG 3.31Å; L349-S352 WeakPolarHBondContact CA-OG 3.36Å; L349-S352 PolarHBondContact O-N 3.26Å; L349-S352 PolarHBondContact O-OG 2.99Å; L349-T353 WeakPolarHBondContact O-CG2 3.26Å; L349-T353 PolarHBondContact O-N 3.38Å; L349-T353 PolarHBondContact O-OG1 3.12Å
350	S	86.7	Confident	72.1	Confident	61 Å²	61	91.1 Å²	91.1	43%	0.427	48%	0.48	S	S	.	.	H	α-helix	trans	-60.7	-42.8	177	52.4	0	0	0	0	111.9	D346 C347 S352 T353 S354	D346-S350 VanDerWaalsContact O-CB 3.32Å; D346-S350 WeakPolarHBondContact O-CB 3.3Å; D346-S350 PolarHBondContact O-N 2.84Å; D346-S350 PolarHBondContact O-OG 2.68Å; C347-S350 WeakPolarHBondContact CA-OG 3.42Å; C347-S350 PolarHBondContact O-OG 2.95Å; S350-S352 PolarHBondContact O-N 3.19Å; S350-T353 WeakPolarHBondContact CA-OG1 3.45Å; S350-T353 PolarHBondContact O-N 3.48Å; S350-T353 PolarHBondContact O-OG1 3.35Å; S350-S354 PolarHBondContact O-N 3.06Å
351	K	81.2	Confident	69.3	Low	115 Å²	115	94.8 Å²	94.8	50%	0.5	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-38.1	174.8	-77.7	175.9	-179.3	175.6	0	113.1	C347 L349 S354	C347-K351 WeakPolarHBondContact O-CB 3.4Å; C347-K351 VanDerWaalsContact O-CG 3.28Å; C347-K351 WeakPolarHBondContact O-CG 3.46Å; C347-K351 PolarHBondContact O-N 3.23Å; C347-K351 VanDerWaalsContact O-N 3.11Å; L349-K351 VanDerWaalsContact C-N 3.35Å; L349-K351 PolarHBondContact O-N 3.27Å; K351-S354 PolarHBondContact O-N 3.45Å; K351-S354 PolarHBondContact O-OG 2.74Å
352	S	74.5	Confident	66.6	Low	55 Å²	55	98.6 Å²	98.6	39%	0.385	53%	0.532	S	S	.	.	H	α-helix	trans	-69.3	-35.2	175.7	41.3	0	0	0	0	112.4	L348 L349 S350 L355	L348-S352 PolarHBondContact O-N 3.13Å; L348-S352 VanDerWaalsContact O-N 3.08Å; L348-S352 PolarHBondContact O-OG 3.07Å; L349-S352 VanDerWaalsContact CA-OG 3.31Å; L349-S352 WeakPolarHBondContact CA-OG 3.36Å; L349-S352 PolarHBondContact O-N 3.26Å; L349-S352 PolarHBondContact O-OG 2.99Å; S350-S352 PolarHBondContact O-N 3.19Å; S352-L355 PolarHBondContact O-N 3.45Å
353	T	64.2	Low	63.8	Low	90 Å²	90	100.3 Å²	100.3	55%	0.552	54%	0.543	S	S	*	.	H	α-helix	trans	-69.7	-33.1	173.9	59.4	0	0	0	0	113.6	L349 S350 L355 M356	L349-T353 WeakPolarHBondContact O-CG2 3.26Å; L349-T353 PolarHBondContact O-N 3.38Å; L349-T353 PolarHBondContact O-OG1 3.12Å; S350-T353 WeakPolarHBondContact CA-OG1 3.45Å; S350-T353 PolarHBondContact O-N 3.48Å; S350-T353 PolarHBondContact O-OG1 3.35Å; T353-L355 PolarHBondContact O-N 3.32Å; T353-M356 PolarHBondContact O-N 3.19Å; T353-M356 VanDerWaalsContact O-N 3.07Å
354	S	57	Low	61.1	Low	72 Å²	72	103.8 Å²	103.8	50%	0.503	56%	0.558	S	S	.	*	H	α-helix	trans	-64.7	-20.1	177.4	70.6	0	0	0	0	113.7	S350 K351	S350-S354 PolarHBondContact O-N 3.06Å; K351-S354 PolarHBondContact O-N 3.45Å; K351-S354 PolarHBondContact O-OG 2.74Å
355	L	48.1	Very low	58.3	Low	145 Å²	145	111 Å²	111	76%	0.759	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-13	176.5	-116.1	142.3	0	0	0	113.4	S352 T353	S352-L355 PolarHBondContact O-N 3.45Å; T353-L355 PolarHBondContact O-N 3.32Å
356	M	43.7	Very low	55.6	Low	161 Å²	161	116.3 Å²	116.3	79%	0.793	63%	0.625	S	S	*	*	S	Bend	trans	-99.7	-3.3	-177.3	-60.8	-69	-89.5	0	0	113.7	T353	T353-M356 PolarHBondContact O-N 3.19Å; T353-M356 VanDerWaalsContact O-N 3.07Å
357	H	38.9	Very low	52.7	Low	177 Å²	177	118.8 Å²	118.8	82%	0.819	63%	0.634	S	S	*	*	S	Bend	trans	-112.8	18.7	-175.7	-108.7	-57.3	0	0	0	115
358	I	37.1	Very low	50	Low	147 Å²	147	123.5 Å²	123.5	75%	0.754	66%	0.655	S	S	*	*			trans	-126.8	65.6	174.2	-49.6	176.8	0	0	0	108.5
359	E	32.7	Very low	47.2	Very low	177 Å²	177	128 Å²	128	83%	0.827	68%	0.684	S	S	*	*			trans	-133	91.2	162	-74.1	-167.2	165.9	0	0	107.5
360	D	33.6	Very low	44.5	Very low	152 Å²	152	131.2 Å²	131.2	81%	0.813	70%	0.701	S	S	*	*	S	Bend	trans	-178.9	116.6	138	-89.5	-23.4	0	0	0	108.3
361	N	32.7	Very low	41.8	Very low	155 Å²	155	135.2 Å²	135.2	83%	0.829	72%	0.717	S	S	*	*	S	Bend	trans	91.3	68.6	171.6	-48.3	-47.6	0	0	0	118.7
362	S	35.6	Very low	39.7	Very low	123 Å²	123	135.8 Å²	135.8	86%	0.86	73%	0.731	S	S	*	*				-170.6	109.1	113.9	61.3	0	0	0	0	110.3
363	I	33.1	Very low	37.9	Very low	158 Å²	158	137.3 Å²	137.3	81%	0.81	74%	0.742	S	S	*	*			trans	-65.9	154.3	-179.1	-54.2	169.9	0	0	0	109.3
364	I	35.6	Very low	36.5	Very low	136 Å²	136	144.5 Å²	144.5	70%	0.697	76%	0.759	S	S	*	*			trans	96.1	79.9	161.9	-44	174.7	0	0	0	115.4
365	N	33.1	Very low	35.3	Very low	152 Å²	152	144.4 Å²	144.4	81%	0.813	77%	0.769	S	S	*	*				179.8	82.1	107.9	-87.3	-36.4	0	0	0	112.2
366	N	35.4	Very low	34.9	Very low	143 Å²	143	144.3 Å²	144.3	77%	0.765	77%	0.768	S	S	*	*			trans	-59.1	123.1	158.3	-84.1	-11.6	0	0	0	109.7
367	H	32.4	Very low	34.5	Very low	152 Å²	152	147.3 Å²	147.3	70%	0.704	77%	0.77	S	S	*	*				86.5	135	92.7	-92.9	-61.3	0	0	0	115.4
368	I	34	Very low	34.4	Very low	131 Å²	131	144.5 Å²	144.5	67%	0.672	77%	0.77	S	S	*	*			trans	79.1	103.9	134.4	-65.2	166.4	0	0	0	116.3
369	T	31.5	Very low	34.5	Very low	106 Å²	106	149.3 Å²	149.3	65%	0.65	78%	0.779	S	S	*	*				22.3	118.7	128.8	67.6	0	0	0	0	117.2
370	N	34	Very low	34.7	Very low	147 Å²	147	144.4 Å²	144.4	79%	0.786	78%	0.776	S	S	*	*				171.4	146.6	109.3	-84.3	-31.3	0	0	0	111.4
371	N	30.2	Very low	35.1	Very low	145 Å²	145	143.3 Å²	143.3	78%	0.775	77%	0.774	S	S	*	*			trans	-40.4	137.2	172.1	-63.2	-42.9	0	0	0	113.3
372	T	36.9	Very low	35.2	Very low	128 Å²	128	142.4 Å²	142.4	79%	0.785	78%	0.775	S	S	*	*				171.6	123	110.7	35.8	0	0	0	0	111.1
373	S	36.1	Very low	35.4	Very low	87 Å²	87	140.4 Å²	140.4	61%	0.608	77%	0.774	S	S	*	*			trans	46.8	123.7	141.4	65.3	0	0	0	0	121.7
374	R	35.1	Very low	35.6	Very low	241 Å²	241	145.2 Å²	145.2	91%	0.909	78%	0.781	S	S	*	*			trans	68.5	111.3	139.1	-59.5	164.9	-175.9	160.7	-0.5	114.2
375	G	32.5	Very low	35.6	Very low	70 Å²	70	141.3 Å²	141.3	72%	0.722	77%	0.774	S	S	*	*			cis	116.8	142	43.3	0	0	0	0	0	108.6
376	I	39.5	Very low	36	Very low	143 Å²	143	144.2 Å²	144.2	73%	0.733	78%	0.776	S	S	*	*			trans	96.7	98.2	151	-56	-176.4	0	0	0	118
377	R	35.4	Very low	36.2	Very low	224 Å²	224	143.8 Å²	143.8	85%	0.845	77%	0.769	S	S	*	*				89.4	112.4	128.8	-67.6	174.2	-164.3	-154.4	3.7	121
378	S	36.5	Very low	36.5	Very low	117 Å²	117	147 Å²	147	82%	0.818	78%	0.775	S	S	*	*			trans	-64	151.9	150.7	-39.5	0	0	0	0	112.9
379	R	38.9	Very low	36.5	Very low	249 Å²	249	143.8 Å²	143.8	94%	0.94	77%	0.774	S	S	*	*			trans	-175.4	133	131.2	-108.7	175.6	176.3	140.1	0.6	113.9
380	G	36.1	Very low	37	Very low	73 Å²	73	148.4 Å²	148.4	75%	0.753	79%	0.788	S	S	*	*			trans	91.1	150.4	144.7	0	0	0	0	0	117.1
381	V	42.4	Very low	37	Very low	130 Å²	130	153.5 Å²	153.5	79%	0.788	80%	0.796	S	S	*	*			cis	-170.7	138.1	4.3	140.6	0	0	0	0	106.7
382	T	36	Very low	37.3	Very low	136 Å²	136	150.6 Å²	150.6	83%	0.834	80%	0.8	S	S	*	*			trans	25.2	144.3	151.1	70.3	0	0	0	0	124.3
383	G	37.9	Very low	37.2	Very low	81 Å²	81	150.4 Å²	150.4	84%	0.835	80%	0.804	S	S	*	*			trans	174.5	134.8	149.4	0	0	0	0	0	114.7
384	R	38.1	Very low	37.2	Very low	259 Å²	259	149.6 Å²	149.6	98%	0.977	81%	0.81	S	S	*	*			trans	-98.5	161.8	-164	-65	172.4	169.4	172	-4.1	114.9
385	G	36.6	Very low	37.3	Very low	53 Å²	53	148.8 Å²	148.8	55%	0.546	81%	0.807	S	S	.	*			trans	153.7	111.2	142.9	0	0	0	0	0	115.3
386	Y	41	Very low	37.5	Very low	214 Å²	214	152.8 Å²	152.8	84%	0.839	81%	0.806	S	S	*	*				56.1	139.5	104.7	73.1	-104.2	0	0	0	114.4
387	E	38.3	Very low	37.5	Very low	134 Å²	134	152.1 Å²	152.1	63%	0.626	80%	0.804	S	S	*	*			cis	-169.4	149.2	12.3	-127	-176	156.1	0	0	109.4
388	R	39.3	Very low	37.8	Very low	220 Å²	220	146.2 Å²	146.2	83%	0.83	80%	0.797	S	S	*	*			trans	45.4	121	142.1	-67.7	170.2	-167.5	-175.1	8.8	123.6
389	G	34.3	Very low	37.7	Very low	63 Å²	63	148.3 Å²	148.3	65%	0.649	80%	0.799	S	S	*	*				99	119.8	107.6	0	0	0	0	0	118.9
390	H	41.6	Very low	37.6	Very low	203 Å²	203	140.2 Å²	140.2	94%	0.94	79%	0.793	S	S	*	*				169.3	136.6	112.7	-91.7	-73.5	0	0	0	112.4
391	R	34.9	Very low	37.7	Very low	253 Å²	253	147.6 Å²	147.6	96%	0.955	80%	0.8	S	S	*	*			trans	-84.3	149.7	174.7	-69.2	177.1	171.9	177.2	-3.1	110.7
392	G	36.4	Very low	37.4	Very low	84 Å²	84	145.1 Å²	145.1	87%	0.866	80%	0.801	S	S	*	*			trans	-155.9	129.6	164	0	0	0	0	0	110.9
393	S	33.8	Very low	37.3	Very low	125 Å²	125	147.7 Å²	147.7	87%	0.874	80%	0.801	S	S	*	*			trans	-126.3	144.3	-171.9	151.9	0	0	0	0	109.6
394	G	36.9	Very low	37.1	Very low	70 Å²	70	151.8 Å²	151.8	72%	0.722	80%	0.803	S	S	*	*			trans	166.3	111.5	162	0	0	0	0	0	109.4
395	R	36.9	Very low	36.8	Very low	224 Å²	224	144.2 Å²	144.2	85%	0.845	79%	0.79	S	S	*	*				77.4	124.7	63.5	-84.8	-163.8	-178.1	-174.7	1.7	115.1
396	H	37.4	Very low	36.8	Very low	154 Å²	154	148.8 Å²	148.8	71%	0.713	80%	0.802	S	S	*	*			trans	73.6	143	151.9	-83.1	-99.4	0	0	0	116.6
397	D	39.3	Very low	36.3	Very low	129 Å²	129	148.6 Å²	148.6	69%	0.69	80%	0.8	S	S	*	*			cis	-163.2	141.3	27.6	-92.7	-40.7	0	0	0	108.1
398	S	40.6	Very low	36.1	Very low	99 Å²	99	150.9 Å²	150.9	69%	0.692	81%	0.808	S	S	*	*				99.5	124.3	90	80.7	0	0	0	0	117
399	D	34.6	Very low	35.6	Very low	162 Å²	162	148.9 Å²	148.9	87%	0.866	81%	0.808	S	S	*	*			trans	40.7	131.3	145.6	-52.4	-23.1	0	0	0	124.8
400	G	38	Very low	35.3	Very low	79 Å²	79	151 Å²	151	81%	0.814	81%	0.813	S	S	*	*			trans	-172.5	108.3	160.6	0	0	0	0	0	113.5
401	Y	36.5	Very low	34.8	Very low	228 Å²	228	146.7 Å²	146.7	89%	0.894	81%	0.806	S	S	*	*			trans	-72.2	150.4	177.1	-78.4	-98.7	0	0	0	113.3
402	G	36.8	Very low	34.7	Very low	78 Å²	78	142.8 Å²	142.8	80%	0.804	80%	0.802	S	S	*	*			trans	178.4	101.4	164.3	0	0	0	0	0	114.2
403	F	32.9	Very low	34.4	Very low	190 Å²	190	141.4 Å²	141.4	83%	0.833	79%	0.788	S	S	*	*			trans	-67.8	137.5	169.4	-86.1	-98.7	0	0	0	111.5
404	N	35.4	Very low	34.2	Very low	167 Å²	167	142 Å²	142	89%	0.893	79%	0.786	S	S	*	*				-171.8	126.2	129	-98.5	-25	0	0	0	111.9
405	S	31.7	Very low	34.2	Very low	99 Å²	99	145 Å²	145	69%	0.692	79%	0.791	S	S	*	*			trans	-69.3	134.6	171.3	-49.8	0	0	0	0	111
406	N	35.6	Very low	33.9	Very low	149 Å²	149	141.3 Å²	141.3	80%	0.797	79%	0.788	S	S	*	*				168.9	139	124.9	-88.4	-27	0	0	0	111.6
407	R	31.8	Very low	33.8	Very low	211 Å²	211	140.6 Å²	140.6	80%	0.796	79%	0.789	S	S	*	*			trans	83	114.8	142.9	-85	-174.5	-176	-177.1	2.8	121.1
408	F	32.9	Very low	33.7	Very low	182 Å²	182	141.8 Å²	141.8	80%	0.798	79%	0.79	S	S	*	*			trans	83.3	133.7	136.3	-73.3	-67.9	0	0	0	119.7
409	Q	28.3	Very low	33.2	Very low	177 Å²	177	144.5 Å²	144.5	83%	0.827	80%	0.797	S	S	*	*			trans	-67.4	160	-173.8	-69	172.8	-19.2	0	0	113.9
410	S	28.4	Very low	33.2	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	79%	0.791	S	S	*	*			trans	107.4	147.3	143.4	79	0	0	0	0	117.6
411	S	32	Very low	33	Very low	112 Å²	112	147.2 Å²	147.2	78%	0.783	80%	0.797	S	S	*	*			trans	89.1	137.4	-175.3	82.9	0	0	0	0	113.9
412	I	31.8	Very low	32.9	Very low	170 Å²	170	143.2 Å²	143.2	87%	0.872	79%	0.79	S	S	*	*			cis	-173.6	165.3	-8.4	-144.4	147.3	0	0	0	107.4
413	G	31	Very low	32.7	Very low	56 Å²	56	147.4 Å²	147.4	58%	0.577	79%	0.792	S	S	*	*			trans	102.6	95.1	156.6	0	0	0	0	0	115.7
414	T	30	Very low	32.6	Very low	136 Å²	136	149.5 Å²	149.5	83%	0.834	79%	0.794	S	S	*	*				55.6	102.5	85.5	67.9	0	0	0	0	115
415	T	35.6	Very low	32.4	Very low	135 Å²	135	147 Å²	147	83%	0.828	79%	0.787	S	S	*	*				-164.9	124.4	129	47.1	0	0	0	0	109.5
416	D	32.3	Very low	32.4	Very low	146 Å²	146	147.6 Å²	147.6	78%	0.781	79%	0.791	S	S	*	*			trans	0.1	122.4	147.6	-48.2	-36	0	0	0	117.5
417	D	34.9	Very low	32.4	Very low	138 Å²	138	147.4 Å²	147.4	74%	0.738	80%	0.796	S	S	*	*				155.5	124.7	121.8	-82	-21.2	0	0	0	113.4
418	H	36	Very low	32.6	Very low	154 Å²	154	140.9 Å²	140.9	71%	0.713	79%	0.794	S	S	*	*			trans	52.1	103.8	144.8	-66.1	-62.5	0	0	0	121	T420	H418-T420 PolarHBondContact O-N 2.93Å
419	N	31.4	Very low	33	Very low	157 Å²	157	141.1 Å²	141.1	84%	0.84	80%	0.803	S	S	*	*			trans	36.7	83.1	131.5	-76.1	-7.2	0	0	0	117
420	T	33.7	Very low	33.8	Very low	120 Å²	120	137.8 Å²	137.8	74%	0.736	80%	0.795	S	S	*	*			trans	-139.3	85.3	153.5	-32.1	0	0	0	0	108.9	H418 L422	H418-T420 PolarHBondContact O-N 2.93Å; T420-L422 PolarHBondContact O-N 2.74Å
421	L	33	Very low	34.5	Very low	177 Å²	177	141.6 Å²	141.6	93%	0.927	79%	0.793	S	S	*	*			trans	-73.7	96.1	171.9	-77.8	175.8	0	0	0	109.2
422	L	35.3	Very low	34.6	Very low	145 Å²	145	141.2 Å²	141.2	76%	0.759	78%	0.781	S	S	*	*			trans	-69.2	128.6	162	-73.5	166.4	0	0	0	109.8	T420	T420-L422 PolarHBondContact O-N 2.74Å
423	I	32	Very low	35.6	Very low	165 Å²	165	138.3 Å²	138.3	85%	0.846	77%	0.767	S	S	*	*			trans	-13.4	118.2	158.9	-56.1	165.9	0	0	0	113.6
424	R	31.5	Very low	36.6	Very low	234 Å²	234	141 Å²	141	88%	0.883	77%	0.768	S	S	*	*			trans	-131	131.2	160.9	-143	174.1	-172.1	-176.1	2.3	109.3
425	P	31.9	Very low	37.4	Very low	114 Å²	114	140.5 Å²	140.5	74%	0.74	76%	0.76	S	S	*	*			trans	-74	154.5	-174.4	30.5	-33.5	0	0	0	111.9
426	S	30.5	Very low	37.8	Very low	112 Å²	112	138.4 Å²	138.4	78%	0.783	74%	0.743	S	S	*	*			trans	-48.4	122.1	179.2	51.1	0	0	0	0	115.3
427	T	36.3	Very low	38.5	Very low	146 Å²	146	137.9 Å²	137.9	90%	0.896	75%	0.745	S	S	*	*			trans	-166	112.1	138.8	48.6	0	0	0	0	108.9
428	G	36.1	Very low	38.6	Very low	73 Å²	73	139.9 Å²	139.9	75%	0.753	75%	0.749	S	S	*	*			trans	127.5	117.2	167.6	0	0	0	0	0	114.1	T430	G428-T430 PolarHBondContact O-N 2.86Å
429	L	40.7	Very low	38.8	Very low	187 Å²	187	137.8 Å²	137.8	98%	0.979	75%	0.752	S	S	*	*			trans	-61.1	112	174.9	-66.8	161.5	0	0	0	110.3
430	T	45.2	Very low	38.9	Very low	108 Å²	108	139.7 Å²	139.7	66%	0.663	75%	0.753	S	S	*	*			trans	-84.6	136.3	168	-8.5	0	0	0	0	109.5	G428	G428-T430 PolarHBondContact O-N 2.86Å
431	R	42.3	Very low	38.8	Very low	189 Å²	189	140 Å²	140	71%	0.713	76%	0.757	S	S	*	*			trans	-65.1	136.8	173.9	-76.6	-177.9	132.5	122.3	-3.4	109.3	D433 D434	R431-D433 PolarHBondContact O-N 3.31Å; R431-D433 VanDerWaalsContact O-N 3.16Å; R431-D434 PolarHBondContact O-N 3.05Å; R431-D434 VanDerWaalsContact O-N 3.1Å
432	L	35.9	Very low	38.9	Very low	103 Å²	103	139.2 Å²	139.2	54%	0.539	75%	0.752	S	S	.	*	G	3₁₀ helix	trans	-61.5	-23.9	-177.8	-172.4	62.3	0	0	0	112.8	D434 L435 K542	L432-D434 VanDerWaalsContact C-N 3.25Å; L432-D434 PolarHBondContact O-N 3.44Å; L432-L435 PolarHBondContact O-N 3Å; L432-K542 HydrophobicContact CD2-CD 4.42Å
433	D	51.8	Low	38.5	Very low	110 Å²	110	138.7 Å²	138.7	59%	0.588	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-68.2	-25.9	178.3	-53.4	-37.1	0	0	0	112.4	R431 L435 I436	R431-D433 PolarHBondContact O-N 3.31Å; R431-D433 VanDerWaalsContact O-N 3.16Å; D433-L435 PolarHBondContact O-N 3.37Å; D433-I436 PolarHBondContact O-N 3.38Å
434	D	52.1	Low	38.6	Very low	111 Å²	111	137.3 Å²	137.3	59%	0.594	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-77.1	-8.1	178.1	-62.2	-34.5	0	0	0	112.6	R431 L432	R431-D434 PolarHBondContact O-N 3.05Å; R431-D434 VanDerWaalsContact O-N 3.1Å; L432-D434 VanDerWaalsContact C-N 3.25Å; L432-D434 PolarHBondContact O-N 3.44Å
435	L	47.3	Very low	38.8	Very low	127 Å²	127	131.8 Å²	131.8	67%	0.665	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-102.4	-2.9	178.9	-69.1	170.4	0	0	0	113.5	L432 D433	L432-L435 PolarHBondContact O-N 3Å; D433-L435 PolarHBondContact O-N 3.37Å
436	I	42.9	Very low	38.6	Very low	90 Å²	90	133.7 Å²	133.7	46%	0.462	76%	0.756	S	S	.	*			trans	-102.8	101.4	-177.3	-60.7	173	0	0	0	109	D433 E438	D433-I436 PolarHBondContact O-N 3.38Å; I436-E438 PolarHBondContact O-N 2.86Å
437	V	48.3	Very low	38.7	Very low	136 Å²	136	135.4 Å²	135.4	82%	0.824	76%	0.762	S	S	*	*			trans	-73	104.5	166.8	178.6	0	0	0	0	107.9	S439	V437-S439 PolarHBondContact O-N 3.39Å
438	E	37.4	Very low	38.4	Very low	179 Å²	179	134 Å²	134	84%	0.836	75%	0.753	S	S	*	*			trans	-64.5	102	170.2	-79	-176.5	154.2	0	0	110.4	I436 K440	I436-E438 PolarHBondContact O-N 2.86Å; E438-K440 PolarHBondContact O-N 2.93Å
439	S	38.3	Very low	38.1	Very low	111 Å²	111	138.5 Å²	138.5	78%	0.776	76%	0.759	S	S	*	*			trans	-73.7	113.4	164.8	53.5	0	0	0	0	109.9	V437	V437-S439 PolarHBondContact O-N 3.39Å
440	K	34.9	Very low	37.6	Very low	196 Å²	196	136.5 Å²	136.5	85%	0.852	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-59.2	136.3	171.9	-74.2	174.1	176.8	174	0	111.5	E438	E438-K440 PolarHBondContact O-N 2.93Å
441	P	31.8	Very low	36.9	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-82.6	132	174.6	31	-30.3	0	0	0	111.7
442	I	33.7	Very low	36.4	Very low	161 Å²	161	132.3 Å²	132.3	83%	0.826	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-83.8	124.1	172.3	-64.6	169	0	0	0	108.6
443	T	27.8	Very low	36.1	Very low	134 Å²	134	132.4 Å²	132.4	82%	0.822	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-72.8	128.2	171	32.2	0	0	0	0	112.3
444	T	34.1	Very low	35.2	Very low	137 Å²	137	132 Å²	132	84%	0.84	77%	0.767	S	S	*	*			trans	-143.7	143.7	153.9	36.9	0	0	0	0	111.8
445	S	35.1	Very low	34.1	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	78%	0.775	S	S	*	*			trans	-78.6	152.8	-163	46.3	0	0	0	0	116.2
446	N	27.6	Very low	33.2	Very low	154 Å²	154	131.1 Å²	131.1	82%	0.824	78%	0.78	S	S	*	*			trans	-52	142.1	172.4	-61.3	-29.5	0	0	0	115.2
447	T	33.5	Very low	32.5	Very low	149 Å²	149	131.8 Å²	131.8	91%	0.914	79%	0.793	S	S	*	*			trans	-151.7	133.4	132.7	28	0	0	0	0	110.9
448	V	28.9	Very low	31.6	Very low	116 Å²	116	132.2 Å²	132.2	70%	0.703	79%	0.789	S	S	*	*			trans	-80.1	146.1	179.5	169.2	0	0	0	0	110	L450	V448-L450 HydrophobicContact CG1-CD1 4.29Å
449	L	31.5	Very low	31.2	Very low	168 Å²	168	132 Å²	132	88%	0.88	79%	0.792	S	S	*	*			trans	-175.1	133.6	130.6	-95.6	162.2	0	0	0	112.4
450	L	28.5	Very low	30.9	Very low	145 Å²	145	133.1 Å²	133.1	76%	0.759	79%	0.788	S	S	*	*			trans	-71.9	145.7	-179.7	-71.7	73.7	0	0	0	111.7	V448	V448-L450 HydrophobicContact CG1-CD1 4.29Å
451	S	31.6	Very low	30.8	Very low	108 Å²	108	128.8 Å²	128.8	76%	0.755	78%	0.782	S	S	*	*				160.3	136.9	103.6	60.8	0	0	0	0	113.8
452	S	31.7	Very low	31.3	Very low	100 Å²	100	132.2 Å²	132.2	70%	0.699	79%	0.785	S	S	*	*			trans	68.9	109.6	147.4	60.6	0	0	0	0	121.9
453	S	30.4	Very low	32.3	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	77%	0.773	S	S	*	*				74.5	126.5	128.7	58.8	0	0	0	0	121.4
454	S	31.4	Very low	33.9	Very low	102 Å²	102	127 Å²	127	71%	0.713	76%	0.763	S	S	*	*			trans	96.5	106	151	-25.2	0	0	0	0	117.4
455	S	30	Very low	36.1	Very low	109 Å²	109	125.8 Å²	125.8	76%	0.762	75%	0.75	S	S	*	*			trans	75	130.3	139.2	-47.9	0	0	0	0	119.1
456	S	28.5	Very low	38.2	Very low	110 Å²	110	121.2 Å²	121.2	77%	0.769	72%	0.716	S	S	*	*			trans	73	126.2	163.5	32.7	0	0	0	0	119.5
457	S	27.9	Very low	40.8	Very low	105 Å²	105	118 Å²	118	73%	0.734	70%	0.704	S	S	*	*			trans	62.5	118.9	153.5	51.8	0	0	0	0	119.3
458	I	28.3	Very low	43	Very low	144 Å²	144	114.8 Å²	114.8	74%	0.738	68%	0.684	S	S	*	*			trans	155.3	104.9	138.2	-76.7	153.1	0	0	0	107.2	I460	I458-I460 VanDerWaalsContact C-N 3.34Å; I458-I460 HydrophobicContact CG2-CD1 3.7Å; I458-I460 HydrophobicContact CG2-CG1 3.68Å; I458-I460 PolarHBondContact O-N 3.26Å
459	I	29.9	Very low	45.5	Very low	176 Å²	176	110.5 Å²	110.5	90%	0.903	66%	0.663	S	S	*	*			trans	-77.5	89.1	173.2	-60.4	173.3	0	0	0	107.1
460	I	32.1	Very low	48	Very low	133 Å²	133	103.3 Å²	103.3	68%	0.682	63%	0.627	S	S	*	*			trans	-85.5	119.9	157.7	-71.9	154	0	0	0	106.1	I458 K462	I458-I460 VanDerWaalsContact C-N 3.34Å; I458-I460 HydrophobicContact CG2-CD1 3.7Å; I458-I460 HydrophobicContact CG2-CG1 3.68Å; I458-I460 PolarHBondContact O-N 3.26Å; I460-K462 PolarHBondContact O-N 2.87Å
461	S	32.1	Very low	50.6	Low	105 Å²	105	100.4 Å²	100.4	73%	0.734	62%	0.616	S	S	*	*			trans	-48.9	102.7	177.6	39.3	0	0	0	0	112.1
462	K	42.7	Very low	53.1	Low	199 Å²	199	95.6 Å²	95.6	87%	0.865	58%	0.582	S	S	*	*			trans	-76.8	115.9	162.2	-70.9	-177.4	178	179.5	0	107.5	I460 C464	I460-K462 PolarHBondContact O-N 2.87Å; K462-C464 PolarHBondContact O-N 2.96Å
463	T	54.1	Low	55.6	Low	96 Å²	96	94.3 Å²	94.3	59%	0.589	57%	0.567	S	S	*	*			trans	-58.3	119.9	169.8	41.4	0	0	0	0	108.9	I465	T463-I465 PolarHBondContact O-N 3.01Å
464	C	62.7	Low	58.1	Low	90 Å²	90	89.3 Å²	89.3	61%	0.608	53%	0.532	S	S	*	.			trans	-82	112.9	177.1	-177.9	0	0	0	0	108.2	K462 M556	K462-C464 PolarHBondContact O-N 2.96Å; C464-M556 WeakPolarHBondContact O-CA 3.38Å
465	I	78.9	Confident	60.5	Low	111 Å²	111	88.1 Å²	88.1	57%	0.569	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-89.3	127.9	174.3	-58.4	174.8	0	0	0	108.1	T463 P558	T463-I465 PolarHBondContact O-N 3.01Å; I465-P558 HydrophobicContact CG2-CB 4.14Å
466	L	81	Confident	62.9	Low	21 Å²	21	84.3 Å²	84.3	11%	0.11	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-71.2	142.3	176.1	-64.4	171.7	0	0	0	110.5	C470 L486 I552 M556 P558	L466-C470 HydrophobicContact CB-CB 4.4Å; L466-L486 HydrophobicContact CB-CD2 3.77Å; L466-L486 HydrophobicContact CD1-CD2 3.52Å; L466-L486 HydrophobicContact CG-CD2 4.29Å; L466-I552 HydrophobicContact CD1-CD1 3.78Å; L466-I552 HydrophobicContact CD1-CG1 4.13Å; L466-I552 HydrophobicContact CD1-CG2 3.79Å; L466-M556 WeakPolarHBondContact CB-O 3.3Å; L466-M556 HydrophobicContact CD1-CB 4.33Å; L466-M556 HydrophobicContact CD2-CE 4.41Å; L466-M556 HydrophobicContact CG-CB 4.31Å; L466-M556 HydrophobicContact CG-CE 4.44Å; L466-M556 PolarHBondContact N-O 3.5Å; L466-P558 VanDerWaalsContact O-CD 3.3Å; L466-P558 WeakPolarHBondContact O-CD 3.44Å; L466-P558 WeakPolarHBondContact O-CG 3.42Å
467	P	80.6	Confident	65	Low	87 Å²	87	86.2 Å²	86.2	57%	0.565	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-67.9	147.8	174.2	28.2	-32.5	0	0	0	111	G469 C470	P467-G469 PolarHBondContact O-N 3.36Å; P467-C470 HydrophobicContact CG-CB 4.12Å; P467-C470 WeakPolarHBondContact O-CB 3.42Å; P467-C470 PolarHBondContact O-N 3.12Å; P467-C470 VanDerWaalsContact O-N 3.11Å
468	V	80.3	Confident	67.2	Low	80 Å²	80	86 Å²	86	49%	0.485	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	131.6	168.4	179.8	0	0	0	0	108.4	I487 P558	V468-I487 HydrophobicContact CG1-CD1 4.49Å; V468-P558 HydrophobicContact CG2-CB 4.25Å; V468-P558 HydrophobicContact CG2-CG 3.77Å
469	G	81.8	Confident	69.5	Low	26 Å²	26	80.5 Å²	80.5	27%	0.268	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	7.8	-173.4	0	0	0	0	0	114.4	P467 L486	P467-G469 PolarHBondContact O-N 3.36Å; G469-L486 PolarHBondContact N-O 3.42Å
470	C	83.1	Confident	71.7	Confident	17 Å²	17	77.1 Å²	77.1	12%	0.115	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	126.6	176.4	-172.2	0	0	0	0	110.4	L466 P467 I472 L486	L466-C470 HydrophobicContact CB-CB 4.4Å; P467-C470 HydrophobicContact CG-CB 4.12Å; P467-C470 WeakPolarHBondContact O-CB 3.42Å; P467-C470 PolarHBondContact O-N 3.12Å; P467-C470 VanDerWaalsContact O-N 3.11Å; C470-I472 PolarHBondContact O-N 2.85Å; C470-L486 HydrophobicContact CB-CB 4.29Å; C470-L486 WeakPolarHBondContact O-CB 3.43Å; C470-L486 PolarHBondContact O-N 3.02Å
471	P	84	Confident	74	Confident	84 Å²	84	75.7 Å²	75.7	55%	0.545	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	126.8	178.3	27.5	-33.4	0	0	0	110.4	C547	P471-C547 PolarHBondContact O-SG 2.9Å
472	I	84.6	Confident	76.5	Confident	7 Å²	7	73 Å²	73	4%	0.036	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	162.6	-178	58.9	167.2	0	0	0	109.7	C470 A474 A484 L486 V518 I545 C547 I552	C470-I472 PolarHBondContact O-N 2.85Å; I472-A474 HydrophobicContact CD1-CB 4.41Å; I472-A484 HydrophobicContact CG1-CB 4.35Å; I472-A484 VanDerWaalsContact CG1-O 3.27Å; I472-A484 WeakPolarHBondContact CG1-O 3.27Å; I472-A484 PolarHBondContact N-O 3.5Å; I472-A484 PolarHBondContact O-N 2.91Å; I472-A484 VanDerWaalsContact O-O 3.09Å; I472-L486 HydrophobicContact CD1-CB 3.85Å; I472-L486 HydrophobicContact CD1-CD1 3.9Å; I472-L486 HydrophobicContact CD1-CG 4.49Å; I472-L486 HydrophobicContact CG1-CB 4.22Å; I472-L486 HydrophobicContact CG2-CB 4.07Å; I472-V518 HydrophobicContact CD1-CG1 3.5Å; I472-V518 VanDerWaalsContact CD1-CG1 3.5Å; I472-V518 HydrophobicContact CD1-CG2 4.33Å; I472-V518 HydrophobicContact CG1-CG1 3.97Å; I472-I545 HydrophobicContact CB-CG2 4.09Å; I472-I545 HydrophobicContact CD1-CG2 3.41Å; I472-I545 VanDerWaalsContact CD1-CG2 3.41Å; I472-I545 HydrophobicContact CG1-CG2 4.26Å; I472-I545 HydrophobicContact CG2-CG2 4.49Å; I472-C547 HydrophobicContact CG2-CB 4.06Å; I472-I552 HydrophobicContact CB-CD1 4.3Å; I472-I552 HydrophobicContact CG2-CD1 3.51Å
473	L	83.3	Confident	78.5	Confident	73 Å²	73	70.9 Å²	70.9	38%	0.382	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120	163.5	-74.2	166.7	0	0	0	107.8	Y481 E482 E483 I545 I546	L473-Y481 HydrophobicContact CB-CD1 4.24Å; L473-E482 WeakPolarHBondContact CA-O 3.4Å; L473-E483 HydrophobicContact CD2-CG 4.08Å; L473-I545 WeakPolarHBondContact O-CA 3.21Å; L473-I546 HydrophobicContact CB-CB 4.44Å; L473-I546 PolarHBondContact N-O 2.53Å; L473-I546 PolarHBondContact O-N 3.29Å
474	A	83.3	Confident	79.9	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146.1	178.7	0	0	0	0	0	110.1	I472 N476 Y481 E482 A484 V518 Y520 V538	I472-A474 HydrophobicContact CD1-CB 4.41Å; A474-N476 PolarHBondContact O-N 3.27Å; A474-Y481 WeakPolarHBondContact O-CA 3.29Å; A474-E482 PolarHBondContact N-O 3.35Å; A474-E482 PolarHBondContact O-N 3.38Å; A474-A484 HydrophobicContact CB-CB 4.02Å; A474-V518 HydrophobicContact CB-CG1 4.19Å; A474-V518 HydrophobicContact CB-CG2 4.35Å; A474-Y520 HydrophobicContact CB-CE1 3.98Å; A474-Y520 VanDerWaalsContact CB-OH 3.29Å; A474-Y520 WeakPolarHBondContact CB-OH 3.43Å; A474-Y520 PolarHBondContact O-OH 2.84Å; A474-V538 HydrophobicContact CB-CG2 4.29Å
475	Q	80.9	Confident	81	Confident	77 Å²	77	65.7 Å²	65.7	36%	0.36	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	120	177.1	-166.7	174	28.8	0	0	109.9	G479 D480 Y520 S544	Q475-G479 VanDerWaalsContact CG-C 3.44Å; Q475-G479 WeakPolarHBondContact CG-O 3.41Å; Q475-G479 VanDerWaalsContact NE2-CA 3.28Å; Q475-G479 PolarHBondContact NE2-O 3.42Å; Q475-D480 WeakPolarHBondContact CA-O 3.24Å; Q475-Y520 PolarHBondContact O-OH 2.77Å; Q475-S544 PolarHBondContact N-O 2.54Å
476	N	80	Confident	81.3	Confident	30 Å²	30	60.4 Å²	60.4	16%	0.16	34%	0.337	C	S	.	.			trans	-75.8	174.5	174.6	70.4	18.2	0	0	0	111.5	A474 S478 G479 D480 E482 Y520	A474-N476 PolarHBondContact O-N 3.27Å; N476-S478 PolarHBondContact O-N 3.12Å; N476-S478 WeakPolarHBondContact OD1-CA 3.4Å; N476-S478 VanDerWaalsContact OD1-CB 3.3Å; N476-S478 WeakPolarHBondContact OD1-CB 3.27Å; N476-S478 PolarHBondContact OD1-N 3.27Å; N476-G479 PolarHBondContact O-N 3.33Å; N476-G479 PolarHBondContact OD1-N 2.96Å; N476-D480 PolarHBondContact N-O 3.32Å; N476-D480 PolarHBondContact OD1-N 2.98Å; N476-D480 VanDerWaalsContact OD1-N 3.12Å; N476-D480 PolarHBondContact OD1-O 2.52Å; N476-E482 PolarHBondContact ND2-OE2 2.96Å; N476-Y520 HydrophobicContact CB-CE2 4.5Å; N476-Y520 PolarHBondContact N-OH 3.02Å
477	I	73.6	Confident	81.5	Confident	150 Å²	150	59.6 Å²	59.6	77%	0.769	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-27.7	177.9	-55.7	177	0	0	0	113.3	G479 E536	I477-G479 VanDerWaalsContact C-N 3.3Å; I477-E536 WeakPolarHBondContact CG1-OE1 3.37Å; I477-E536 PolarHBondContact N-OE1 3.02Å
478	S	74.7	Confident	81.6	Confident	99 Å²	99	55.4 Å²	55.4	69%	0.692	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-11.1	179.3	-55.8	0	0	0	0	113.4	N476	N476-S478 PolarHBondContact O-N 3.12Å; N476-S478 WeakPolarHBondContact OD1-CA 3.4Å; N476-S478 VanDerWaalsContact OD1-CB 3.3Å; N476-S478 WeakPolarHBondContact OD1-CB 3.27Å; N476-S478 PolarHBondContact OD1-N 3.27Å
479	G	75.2	Confident	81.7	Confident	29 Å²	29	53.7 Å²	53.7	30%	0.299	29%	0.292	S	S	.	.	S	Bend	trans	91	3.3	-175.4	0	0	0	0	0	114.2	Q475 N476 I477	Q475-G479 VanDerWaalsContact CG-C 3.44Å; Q475-G479 WeakPolarHBondContact CG-O 3.41Å; Q475-G479 VanDerWaalsContact NE2-CA 3.28Å; Q475-G479 PolarHBondContact NE2-O 3.42Å; N476-G479 PolarHBondContact O-N 3.33Å; N476-G479 PolarHBondContact OD1-N 2.96Å; I477-G479 VanDerWaalsContact C-N 3.3Å
480	D	77	Confident	81.1	Confident	106 Å²	106	53.2 Å²	53.2	57%	0.567	28%	0.283	S	S	*	.			trans	-89.7	144.4	179.4	-66.6	-36	0	0	0	110.5	Q475 N476	Q475-D480 WeakPolarHBondContact CA-O 3.24Å; N476-D480 PolarHBondContact N-O 3.32Å; N476-D480 PolarHBondContact OD1-N 2.98Å; N476-D480 VanDerWaalsContact OD1-N 3.12Å; N476-D480 PolarHBondContact OD1-O 2.52Å
481	Y	81.2	Confident	80.1	Confident	103 Å²	103	54.2 Å²	54.2	40%	0.404	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	125.4	174.2	-72.6	-87.5	0	0	0	110.6	L473 A474 D543 I546	L473-Y481 HydrophobicContact CB-CD1 4.24Å; A474-Y481 WeakPolarHBondContact O-CA 3.29Å; Y481-D543 WeakPolarHBondContact CE1-O 3.46Å; Y481-D543 VanDerWaalsContact CZ-O 3.27Å; Y481-D543 PolarHBondContact OH-O 3.41Å; Y481-I546 HydrophobicContact CD1-CD1 4.45Å; Y481-I546 HydrophobicContact CE1-CD1 3.85Å; Y481-I546 HydrophobicContact CE1-CG1 4.26Å
482	E	82.6	Confident	78.9	Confident	48 Å²	48	54 Å²	54	22%	0.224	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	150.3	178.6	-173	165.2	-170.6	0	0	111	L473 A474 N476 A484 Y520 H522	L473-E482 WeakPolarHBondContact CA-O 3.4Å; A474-E482 PolarHBondContact N-O 3.35Å; A474-E482 PolarHBondContact O-N 3.38Å; N476-E482 PolarHBondContact ND2-OE2 2.96Å; E482-A484 PolarHBondContact O-N 3.43Å; E482-Y520 HydrophobicContact CB-CD1 3.75Å; E482-Y520 HydrophobicContact CB-CE1 3.78Å; E482-Y520 HydrophobicContact CG-CD1 3.81Å; E482-Y520 HydrophobicContact CG-CE1 4.37Å; E482-H522 IonicContact OE1-CD2 3.8Å; E482-H522 PolarHBondContact OE1-CD2 3.03Å; E482-H522 IonicContact OE1-CE1 3.13Å; E482-H522 IonicContact OE1-CG 3.98Å; E482-H522 IonicContact OE1-NE2 2.66Å; E482-H522 PolarHBondContact OE1-NE2 3.2Å; E482-H522 VanDerWaalsContact OE1-NE2 3.1Å; E482-H522 IonicContact OE2-NE2 3.91Å; E482-H522 PolarHBondContact OE2-NE2 2.98Å
483	E	84.7	Confident	77.6	Confident	155 Å²	155	61.2 Å²	61.2	72%	0.724	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.7	176.8	-71.9	-172.7	173	0	0	110.1	L473	L473-E483 HydrophobicContact CD2-CG 4.08Å
484	A	85.1	Confident	76.4	Confident	3 Å²	3	58.5 Å²	58.5	3%	0.025	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	156.7	-172.9	0	0	0	0	0	111.1	I472 A474 E482 V518 I519 Y520	I472-A484 HydrophobicContact CG1-CB 4.35Å; I472-A484 VanDerWaalsContact CG1-O 3.27Å; I472-A484 WeakPolarHBondContact CG1-O 3.27Å; I472-A484 PolarHBondContact N-O 3.5Å; I472-A484 PolarHBondContact O-N 2.91Å; I472-A484 VanDerWaalsContact O-O 3.09Å; A474-A484 HydrophobicContact CB-CB 4.02Å; E482-A484 PolarHBondContact O-N 3.43Å; A484-V518 HydrophobicContact CB-CB 4.33Å; A484-V518 HydrophobicContact CB-CG1 3.29Å; A484-I519 CarbonylContact C-O 3.34Å; A484-I519 WeakPolarHBondContact CA-O 3.13Å; A484-I519 WeakPolarHBondContact CB-O 3.43Å; A484-Y520 HydrophobicContact CB-CD1 3.55Å; A484-Y520 HydrophobicContact CB-CE1 3.59Å; A484-Y520 HydrophobicContact CB-CG 4.27Å
485	Q	86	Confident	75	Confident	74 Å²	74	61.8 Å²	61.8	35%	0.346	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	124.6	175.4	-71.8	-171.5	6.2	0	0	111.4	I487 V518 I519 H521	Q485-I487 PolarHBondContact O-N 2.93Å; Q485-V518 WeakPolarHBondContact O-CA 3.39Å; Q485-V518 WeakPolarHBondContact O-CG1 3.19Å; Q485-I519 HydrophobicContact CB-CB 4.48Å; Q485-I519 PolarHBondContact N-O 3.01Å; Q485-I519 PolarHBondContact O-N 2.94Å; Q485-I519 VanDerWaalsContact O-N 3.09Å; Q485-H521 PolarHBondContact NE2-NE2 3.26Å
486	L	85.4	Confident	73.7	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	116.4	176.4	-178.7	70.4	0	0	0	111	L466 G469 C470 I472 V516 V557	L466-L486 HydrophobicContact CB-CD2 3.77Å; L466-L486 HydrophobicContact CD1-CD2 3.52Å; L466-L486 HydrophobicContact CG-CD2 4.29Å; G469-L486 PolarHBondContact N-O 3.42Å; C470-L486 HydrophobicContact CB-CB 4.29Å; C470-L486 WeakPolarHBondContact O-CB 3.43Å; C470-L486 PolarHBondContact O-N 3.02Å; I472-L486 HydrophobicContact CD1-CB 3.85Å; I472-L486 HydrophobicContact CD1-CD1 3.9Å; I472-L486 HydrophobicContact CD1-CG 4.49Å; I472-L486 HydrophobicContact CG1-CB 4.22Å; I472-L486 HydrophobicContact CG2-CB 4.07Å; L486-V516 HydrophobicContact CD1-CG1 3.22Å; L486-V557 HydrophobicContact CD1-CG1 3.96Å; L486-V557 HydrophobicContact CD1-CG2 4.37Å; L486-V557 HydrophobicContact CD2-CG1 4.27Å; L486-V557 HydrophobicContact CD2-CG2 4.32Å; L486-V557 HydrophobicContact CG-CG1 4.33Å
487	I	84.4	Confident	72.5	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.015	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	-48.6	178.2	-56.4	-57.5	0	0	0	111.9	V468 Q485 L517 I519 P561	V468-I487 HydrophobicContact CG1-CD1 4.49Å; Q485-I487 PolarHBondContact O-N 2.93Å; I487-L517 HydrophobicContact CB-CB 4.21Å; I487-L517 HydrophobicContact CB-CD2 4.2Å; I487-L517 HydrophobicContact CB-CG 4.16Å; I487-L517 WeakPolarHBondContact CB-O 3.13Å; I487-L517 HydrophobicContact CG1-CG 4.43Å; I487-L517 HydrophobicContact CG2-CD2 3.95Å; I487-L517 HydrophobicContact CG2-CG 4.46Å; I487-L517 PolarHBondContact N-O 2.85Å; I487-I519 HydrophobicContact CD1-CD1 3.54Å; I487-I519 HydrophobicContact CD1-CG1 3.99Å; I487-I519 HydrophobicContact CG1-CD1 3.82Å; I487-I519 HydrophobicContact CG1-CG1 3.78Å; I487-P561 HydrophobicContact CG2-CG 4.32Å
488	G	82.8	Confident	71.3	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.1	173.1	177.8	0	0	0	0	0	113.8	V516 L517 P558	G488-V516 WeakPolarHBondContact O-CA 3.48Å; G488-L517 PolarHBondContact O-N 2.93Å; G488-P558 CarbonylContact C-O 3.45Å; G488-P558 WeakPolarHBondContact CA-O 2.98Å
489	H	82.7	Confident	69.8	Low	43 Å²	43	62.6 Å²	62.6	20%	0.199	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	150.8	175.8	74.7	-58.2	0	0	0	111.2	V516 I554 V557 P558 A559 A560	H489-V516 HydrophobicContact CB-CG2 4.33Å; H489-I554 HydrophobicContact CB-CD1 4.16Å; H489-I554 HydrophobicContact CB-CG1 4.15Å; H489-V557 HydrophobicContact CB-CG1 4.08Å; H489-V557 PolarHBondContact ND1-O 2.89Å; H489-P558 PolarHBondContact N-O 3.47Å; H489-P558 VanDerWaalsContact ND1-C 3.3Å; H489-P558 PolarHBondContact ND1-O 3.03Å; H489-A559 WeakPolarHBondContact ND1-CA 3.35Å; H489-A559 PolarHBondContact ND1-N 3.29Å; H489-A560 PolarHBondContact O-N 3.08Å
490	F	68.6	Low	68.1	Low	16 Å²	16	64.3 Å²	64.3	7%	0.07	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-87.7	124.2	170.7	-65.7	-70.3	0	0	0	110.2	Q494 F495 F498 V515 L517 I537 A560 I565	F490-Q494 HydrophobicContact CB-CB 4.41Å; F490-Q494 HydrophobicContact CD1-CB 4.24Å; F490-F495 HydrophobicContact CB-CD2 3.69Å; F490-F495 HydrophobicContact CB-CE2 3.63Å; F490-F495 HydrophobicContact CG-CE2 4.45Å; F490-F498 HydrophobicContact CE1-CE2 4.18Å; F490-F498 HydrophobicContact CZ-CE2 4.24Å; F490-V515 HydrophobicContact CD2-CG2 4.08Å; F490-L517 HydrophobicContact CE2-CB 3.95Å; F490-L517 HydrophobicContact CZ-CB 3.99Å; F490-L517 HydrophobicContact CZ-CD1 4.43Å; F490-L517 HydrophobicContact CZ-CD2 4.15Å; F490-L517 HydrophobicContact CZ-CG 4.43Å; F490-I537 HydrophobicContact CE2-CD1 4.19Å; F490-I537 HydrophobicContact CE2-CG1 4.19Å; F490-A560 HydrophobicContact CD1-CB 4.2Å; F490-A560 HydrophobicContact CE1-CB 4.06Å; F490-I565 HydrophobicContact CD1-CG1 4.38Å; F490-I565 HydrophobicContact CE1-CD1 4.38Å; F490-I565 HydrophobicContact CE1-CG1 3.75Å
491	S	63	Low	66	Low	38 Å²	38	64.5 Å²	64.5	27%	0.266	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-67.9	158.5	170.6	65.4	0	0	0	0	111.5	Q493 Q494 F495	S491-Q493 PolarHBondContact O-N 3.08Å; S491-Q494 PolarHBondContact O-N 3.41Å; S491-Q494 WeakPolarHBondContact OG-CG 3.15Å; S491-Q494 PolarHBondContact OG-N 3.18Å; S491-Q494 PolarHBondContact OG-OE1 2.9Å; S491-Q494 VanDerWaalsContact OG-OE1 3.08Å; S491-F495 PolarHBondContact O-N 2.9Å
492	T	57.4	Low	63.8	Low	79 Å²	79	67.2 Å²	67.2	49%	0.485	37%	0.366	S	S	.	.	H	α-helix	trans	-56.7	-24.9	173.2	-36.7	0	0	0	0	112.4	K496 I505	T492-K496 WeakPolarHBondContact O-CG 3.27Å; T492-I505 HydrophobicContact CG2-CD1 4.15Å
493	Q	57.4	Low	61.6	Low	160 Å²	160	70.7 Å²	70.7	75%	0.748	39%	0.385	S	S	*	.	H	α-helix	trans	-75.8	-41.7	173.8	-68.4	-178.6	-1.3	0	0	111.9	S491 F495 K496 T497	S491-Q493 PolarHBondContact O-N 3.08Å; Q493-F495 VanDerWaalsContact C-N 3.32Å; Q493-F495 PolarHBondContact O-N 2.84Å; Q493-K496 PolarHBondContact O-N 2.71Å; Q493-T497 PolarHBondContact O-OG1 3.08Å
494	Q	57.9	Low	59.1	Low	15 Å²	15	69.8 Å²	69.8	7%	0.07	39%	0.39	C	S	.	.	H	α-helix	trans	-66.4	-33.5	177.2	-73.9	165.9	-45.3	0	0	112.3	F490 S491 K496 T497 F498 A560 L562 I565	F490-Q494 HydrophobicContact CB-CB 4.41Å; F490-Q494 HydrophobicContact CD1-CB 4.24Å; S491-Q494 PolarHBondContact O-N 3.41Å; S491-Q494 WeakPolarHBondContact OG-CG 3.15Å; S491-Q494 PolarHBondContact OG-N 3.18Å; S491-Q494 PolarHBondContact OG-OE1 2.9Å; S491-Q494 VanDerWaalsContact OG-OE1 3.08Å; Q494-K496 PolarHBondContact O-N 3.45Å; Q494-T497 PolarHBondContact O-N 3.27Å; Q494-T497 PolarHBondContact O-OG1 3.1Å; Q494-F498 PolarHBondContact O-N 2.88Å; Q494-A560 PolarHBondContact NE2-O 3.18Å; Q494-L562 HydrophobicContact CG-CD2 4.16Å; Q494-I565 HydrophobicContact CB-CD1 4.22Å; Q494-I565 HydrophobicContact CG-CD1 3.98Å
495	F	54.9	Low	56.9	Low	69 Å²	69	73.6 Å²	73.6	30%	0.303	41%	0.41	S	S	.	.	H	α-helix	trans	-64.9	-35.3	173.8	-102.2	-76.8	0	0	0	114	F490 S491 Q493 T497 F498 N499 V515	F490-F495 HydrophobicContact CB-CD2 3.69Å; F490-F495 HydrophobicContact CB-CE2 3.63Å; F490-F495 HydrophobicContact CG-CE2 4.45Å; S491-F495 PolarHBondContact O-N 2.9Å; Q493-F495 VanDerWaalsContact C-N 3.32Å; Q493-F495 PolarHBondContact O-N 2.84Å; F495-T497 PolarHBondContact O-N 3.1Å; F495-F498 PolarHBondContact O-N 2.55Å; F495-F498 VanDerWaalsContact O-N 3.17Å; F495-N499 PolarHBondContact O-N 3.5Å; F495-N499 VanDerWaalsContact O-N 3.14Å; F495-V515 HydrophobicContact CE2-CG2 3.33Å; F495-V515 HydrophobicContact CZ-CG2 3.27Å
496	K	53.5	Low	54.6	Low	118 Å²	118	76.7 Å²	76.7	51%	0.513	43%	0.428	S	S	.	.	H	α-helix	trans	-66.1	-25.4	176.6	-74.5	178.3	-179.7	-177.1	0	112.4	T492 Q493 Q494	T492-K496 WeakPolarHBondContact O-CG 3.27Å; Q493-K496 PolarHBondContact O-N 2.71Å; Q494-K496 PolarHBondContact O-N 3.45Å
497	T	53.9	Low	52.2	Low	113 Å²	113	82.9 Å²	82.9	69%	0.693	46%	0.461	S	S	*	.	H	α-helix	trans	-83.1	-27.1	174.2	-10.3	0	0	0	0	112.4	Q493 Q494 F495	Q493-T497 PolarHBondContact O-OG1 3.08Å; Q494-T497 PolarHBondContact O-N 3.27Å; Q494-T497 PolarHBondContact O-OG1 3.1Å; F495-T497 PolarHBondContact O-N 3.1Å
498	F	49.3	Very low	50	Low	47 Å²	47	90.3 Å²	90.3	21%	0.206	50%	0.501	C	S	.	.	H	α-helix	trans	-77.6	-37.2	-178.8	-129.6	-81.2	0	0	0	113	F490 Q494 F495 I565 R566	F490-F498 HydrophobicContact CE1-CE2 4.18Å; F490-F498 HydrophobicContact CZ-CE2 4.24Å; Q494-F498 PolarHBondContact O-N 2.88Å; F495-F498 PolarHBondContact O-N 2.55Å; F495-F498 VanDerWaalsContact O-N 3.17Å; F498-I565 HydrophobicContact CD2-CB 4.42Å; F498-I565 HydrophobicContact CD2-CG1 4.44Å; F498-I565 HydrophobicContact CD2-CG2 3.43Å; F498-I565 VanDerWaalsContact CD2-CG2 3.43Å; F498-I565 HydrophobicContact CE2-CB 4.03Å; F498-I565 HydrophobicContact CE2-CG1 4.14Å; F498-I565 HydrophobicContact CE2-CG2 3.38Å; F498-I565 HydrophobicContact CZ-CG2 4.39Å; F498-R566 VanDerWaalsContact CZ-O 3.29Å; F498-R566 WeakPolarHBondContact CZ-O 3.48Å
499	N	43.3	Very low	47.6	Very low	96 Å²	96	99.6 Å²	99.6	51%	0.513	54%	0.541	S	S	.	.	S	Bend	trans	-115.1	97.6	178.7	-75.4	-14.1	0	0	0	109.2	F495 S501	F495-N499 PolarHBondContact O-N 3.5Å; F495-N499 VanDerWaalsContact O-N 3.14Å; N499-S501 PolarHBondContact O-N 3.41Å
500	G	38.6	Very low	45.2	Very low	65 Å²	65	101.5 Å²	101.5	67%	0.67	57%	0.573	S	S	*	*			trans	-38.4	125.2	178.2	0	0	0	0	0	112.6	N502	G500-N502 PolarHBondContact O-N 3.04Å
501	S	33.3	Very low	43.7	Very low	109 Å²	109	106.3 Å²	106.3	76%	0.762	61%	0.609	S	S	*	*	S	Bend	trans	-2.3	88	171.7	57.2	0	0	0	0	115.8	N499	N499-S501 PolarHBondContact O-N 3.41Å
502	N	34.7	Very low	43.1	Very low	160 Å²	160	107.1 Å²	107.1	86%	0.856	62%	0.623	S	S	*	*			trans	-165.8	13.6	160.9	-92.2	-23.6	0	0	0	116.5	G500	G500-N502 PolarHBondContact O-N 3.04Å
503	I	36.9	Very low	42.9	Very low	122 Å²	122	111.5 Å²	111.5	63%	0.626	64%	0.638	S	S	*	*			trans	-124.6	103.6	175.9	-55.6	177.3	0	0	0	110.3	I505	I503-I505 HydrophobicContact CG2-CG1 3.95Å; I503-I505 PolarHBondContact O-N 2.8Å
504	T	33	Very low	43.3	Very low	135 Å²	135	109.2 Å²	109.2	83%	0.828	63%	0.626	S	S	*	*			trans	-69.9	101.1	163.2	35.1	0	0	0	0	108.7	D506	T504-D506 PolarHBondContact O-N 3.09Å
505	I	38.7	Very low	44	Very low	84 Å²	84	109.3 Å²	109.3	43%	0.431	63%	0.627	S	S	.	*			trans	-83.1	112.1	168.8	-57	175.6	0	0	0	107	T492 I503 N507	T492-I505 HydrophobicContact CG2-CD1 4.15Å; I503-I505 HydrophobicContact CG2-CG1 3.95Å; I503-I505 PolarHBondContact O-N 2.8Å; I505-N507 PolarHBondContact O-N 3.1Å; I505-N507 PolarHBondContact O-OD1 3.18Å
506	D	36.8	Very low	45.2	Very low	138 Å²	138	106 Å²	106	74%	0.738	61%	0.613	S	S	*	*			trans	-62	105.6	173.6	-77.2	-23	0	0	0	109.9	T504 N508	T504-D506 PolarHBondContact O-N 3.09Å; D506-N508 PolarHBondContact O-N 2.88Å
507	N	35.6	Very low	46.6	Very low	130 Å²	130	100.8 Å²	100.8	70%	0.695	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	14.9	-172.7	-71.1	-36.8	0	0	0	115.6	I505	I505-N507 PolarHBondContact O-N 3.1Å; I505-N507 PolarHBondContact O-OD1 3.18Å
508	N	36.9	Very low	48.1	Very low	160 Å²	160	95.4 Å²	95.4	86%	0.856	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	7.2	-172.3	-85.9	-20.8	0	0	0	115.9	D506	D506-N508 PolarHBondContact O-N 2.88Å
509	K	33.3	Very low	49.8	Very low	194 Å²	194	93.3 Å²	93.3	84%	0.843	55%	0.548	S	S	*	.	S	Bend	trans	-148.4	70.3	171.4	-69.2	-175.8	-179.3	172.3	0	110.8	S511	K509-S511 PolarHBondContact O-N 2.8Å
510	G	32.2	Very low	51.7	Low	84 Å²	84	88.8 Å²	88.8	87%	0.866	52%	0.524	S	S	*	.			trans	-77.8	73.8	-168.8	0	0	0	0	0	115.6	G512	G510-G512 PolarHBondContact O-N 3.42Å
511	S	37.9	Very low	53.6	Low	116 Å²	116	88.9 Å²	88.9	81%	0.811	51%	0.507	S	S	*	.			trans	-81.9	32.9	159.9	70.2	0	0	0	0	111.8	K509 E513	K509-S511 PolarHBondContact O-N 2.8Å; S511-E513 PolarHBondContact O-N 2.84Å
512	G	49.1	Very low	55.6	Low	56 Å²	56	86.2 Å²	86.2	58%	0.577	48%	0.482	S	S	*	.			trans	-66.4	123.9	-176.5	0	0	0	0	0	110.6	G510 K514	G510-G512 PolarHBondContact O-N 3.42Å; G512-K514 PolarHBondContact O-N 3.49Å; G512-K514 VanDerWaalsContact O-N 3.1Å
513	E	53.4	Low	57.1	Low	171 Å²	171	85.4 Å²	85.4	80%	0.799	47%	0.474	S	S	*	.			trans	-53.2	115.9	175.9	-68.5	175.8	164.1	0	0	109.6	S511 V515	S511-E513 PolarHBondContact O-N 2.84Å; E513-V515 PolarHBondContact O-N 3.32Å
514	K	67	Low	58.4	Low	111 Å²	111	83.5 Å²	83.5	48%	0.483	46%	0.462	S	S	.	.			trans	-81.7	99.9	-176.5	-74.3	177.1	172.8	-174.2	0	107.5	G512 I540 I554	G512-K514 PolarHBondContact O-N 3.49Å; G512-K514 VanDerWaalsContact O-N 3.1Å; K514-I540 HydrophobicContact CB-CB 4.15Å; K514-I540 HydrophobicContact CB-CD1 4.15Å; K514-I540 WeakPolarHBondContact O-CA 3.47Å; K514-I540 VanDerWaalsContact O-CB 3.27Å; K514-I540 WeakPolarHBondContact O-CB 3.44Å; K514-I540 WeakPolarHBondContact O-CG1 3.22Å; K514-I540 PolarHBondContact O-N 2.78Å; K514-I554 HydrophobicContact CB-CD1 3.68Å; K514-I554 HydrophobicContact CD-CB 3.84Å; K514-I554 HydrophobicContact CD-CD1 3.91Å; K514-I554 HydrophobicContact CD-CG1 4.49Å; K514-I554 HydrophobicContact CD-CG2 3.57Å; K514-I554 HydrophobicContact CG-CB 4.43Å; K514-I554 HydrophobicContact CG-CD1 3.56Å; K514-I554 HydrophobicContact CG-CG2 4.46Å; K514-I554 VanDerWaalsContact NZ-CG2 3.28Å
515	V	71.6	Confident	59.7	Low	17 Å²	17	86.9 Å²	86.9	10%	0.103	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	155.9	179	-60	0	0	0	0	112.7	F490 F495 E513 I537 P539	F490-V515 HydrophobicContact CD2-CG2 4.08Å; F495-V515 HydrophobicContact CE2-CG2 3.33Å; F495-V515 HydrophobicContact CZ-CG2 3.27Å; E513-V515 PolarHBondContact O-N 3.32Å; V515-I537 HydrophobicContact CB-CG2 3.6Å; V515-I537 HydrophobicContact CG1-CG2 4.01Å; V515-I537 HydrophobicContact CG2-CG2 3.85Å; V515-P539 HydrophobicContact CG1-CB 4.35Å
516	V	79.9	Confident	61	Low	0 Å²	0	89.5 Å²	89.5	0%	0	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	142.2	-178.7	174.6	0	0	0	0	109.6	L486 G488 H489 V518 I537 V538 I540 I545 V557	L486-V516 HydrophobicContact CD1-CG1 3.22Å; G488-V516 WeakPolarHBondContact O-CA 3.48Å; H489-V516 HydrophobicContact CB-CG2 4.33Å; V516-V518 HydrophobicContact CG1-CG2 4.17Å; V516-I537 WeakPolarHBondContact O-CA 3.42Å; V516-V538 PolarHBondContact N-O 2.98Å; V516-V538 PolarHBondContact O-N 3.33Å; V516-I540 HydrophobicContact CB-CG1 4.45Å; V516-I540 HydrophobicContact CG2-CD1 3.24Å; V516-I540 HydrophobicContact CG2-CG1 3.46Å; V516-I540 VanDerWaalsContact CG2-CG1 3.46Å; V516-I545 HydrophobicContact CB-CD1 4.01Å; V516-I545 HydrophobicContact CG1-CD1 4.27Å; V516-I545 HydrophobicContact CG2-CD1 4.24Å; V516-V557 HydrophobicContact CG1-CG1 4.23Å; V516-V557 HydrophobicContact CG2-CG1 4.1Å; V516-V557 HydrophobicContact CG2-CG2 4.34Å
517	L	82.9	Confident	62.5	Low	8 Å²	8	87 Å²	87	4%	0.042	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	128.2	170.4	-176.5	65.1	0	0	0	109.8	I487 G488 F490 E535 R564	I487-L517 HydrophobicContact CB-CB 4.21Å; I487-L517 HydrophobicContact CB-CD2 4.2Å; I487-L517 HydrophobicContact CB-CG 4.16Å; I487-L517 WeakPolarHBondContact CB-O 3.13Å; I487-L517 HydrophobicContact CG1-CG 4.43Å; I487-L517 HydrophobicContact CG2-CD2 3.95Å; I487-L517 HydrophobicContact CG2-CG 4.46Å; I487-L517 PolarHBondContact N-O 2.85Å; G488-L517 PolarHBondContact O-N 2.93Å; F490-L517 HydrophobicContact CE2-CB 3.95Å; F490-L517 HydrophobicContact CZ-CB 3.99Å; F490-L517 HydrophobicContact CZ-CD1 4.43Å; F490-L517 HydrophobicContact CZ-CD2 4.15Å; F490-L517 HydrophobicContact CZ-CG 4.43Å; L517-E535 HydrophobicContact CD1-CB 4.33Å; L517-R564 HydrophobicContact CD2-CB 4.37Å
518	V	85.3	Confident	63.8	Low	0 Å²	0	85.2 Å²	85.2	0%	0	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.2	-179.7	-147.2	0	0	0	0	110.1	I472 A474 A484 Q485 V516 E535 E536 V538	I472-V518 HydrophobicContact CD1-CG1 3.5Å; I472-V518 VanDerWaalsContact CD1-CG1 3.5Å; I472-V518 HydrophobicContact CD1-CG2 4.33Å; I472-V518 HydrophobicContact CG1-CG1 3.97Å; A474-V518 HydrophobicContact CB-CG1 4.19Å; A474-V518 HydrophobicContact CB-CG2 4.35Å; A484-V518 HydrophobicContact CB-CB 4.33Å; A484-V518 HydrophobicContact CB-CG1 3.29Å; Q485-V518 WeakPolarHBondContact O-CA 3.39Å; Q485-V518 WeakPolarHBondContact O-CG1 3.19Å; V516-V518 HydrophobicContact CG1-CG2 4.17Å; V518-E535 WeakPolarHBondContact O-CA 3.49Å; V518-E536 PolarHBondContact N-O 3.09Å; V518-E536 PolarHBondContact O-N 2.96Å; V518-V538 HydrophobicContact CB-CG2 4.38Å; V518-V538 HydrophobicContact CG2-CB 3.89Å; V518-V538 HydrophobicContact CG2-CG2 3.63Å
519	I	86	Confident	65.3	Low	3 Å²	3	86.2 Å²	86.2	2%	0.015	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.7	175.6	-57	176.8	0	0	0	109.5	A484 Q485 I487 D533 E534 E535	A484-I519 CarbonylContact C-O 3.34Å; A484-I519 WeakPolarHBondContact CA-O 3.13Å; A484-I519 WeakPolarHBondContact CB-O 3.43Å; Q485-I519 HydrophobicContact CB-CB 4.48Å; Q485-I519 PolarHBondContact N-O 3.01Å; Q485-I519 PolarHBondContact O-N 2.94Å; Q485-I519 VanDerWaalsContact O-N 3.09Å; I487-I519 HydrophobicContact CD1-CD1 3.54Å; I487-I519 HydrophobicContact CD1-CG1 3.99Å; I487-I519 HydrophobicContact CG1-CD1 3.82Å; I487-I519 HydrophobicContact CG1-CG1 3.78Å; I519-D533 HydrophobicContact CG2-CB 3.73Å; I519-E534 CarbonylContact C-O 3.57Å; I519-E534 WeakPolarHBondContact CA-O 3.36Å; I519-E535 HydrophobicContact CD1-CG 4.31Å; I519-E535 HydrophobicContact CG1-CG 3.79Å
520	Y	83.6	Confident	66.6	Low	1 Å²	1	81.4 Å²	81.4	0%	0.004	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	137.6	169.5	-61.7	-77	0	0	0	110.3	A474 Q475 N476 E482 A484 D533 E534 E536	A474-Y520 HydrophobicContact CB-CE1 3.98Å; A474-Y520 VanDerWaalsContact CB-OH 3.29Å; A474-Y520 WeakPolarHBondContact CB-OH 3.43Å; A474-Y520 PolarHBondContact O-OH 2.84Å; Q475-Y520 PolarHBondContact O-OH 2.77Å; N476-Y520 HydrophobicContact CB-CE2 4.5Å; N476-Y520 PolarHBondContact N-OH 3.02Å; E482-Y520 HydrophobicContact CB-CD1 3.75Å; E482-Y520 HydrophobicContact CB-CE1 3.78Å; E482-Y520 HydrophobicContact CG-CD1 3.81Å; E482-Y520 HydrophobicContact CG-CE1 4.37Å; A484-Y520 HydrophobicContact CB-CD1 3.55Å; A484-Y520 HydrophobicContact CB-CE1 3.59Å; A484-Y520 HydrophobicContact CB-CG 4.27Å; Y520-D533 WeakPolarHBondContact O-CA 3.42Å; Y520-E534 PolarHBondContact N-O 3.4Å; Y520-E534 PolarHBondContact O-N 2.82Å; Y520-E536 HydrophobicContact CD2-CB 4.13Å; Y520-E536 HydrophobicContact CE2-CB 3.68Å; Y520-E536 HydrophobicContact CE2-CG 4.37Å; Y520-E536 WeakPolarHBondContact CE2-OE2 3.48Å
521	H	78.2	Confident	68.2	Low	68 Å²	68	82 Å²	82	32%	0.315	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	97.6	177.3	-69.5	-61.3	0	0	0	110.1	Q485 I531 D533	Q485-H521 PolarHBondContact NE2-NE2 3.26Å; H521-I531 HydrophobicContact CB-CG2 3.81Å; H521-D533 IonicContact CE1-OD1 3.26Å; H521-D533 PolarHBondContact CE1-OD1 2.93Å; H521-D533 VanDerWaalsContact CE1-OD1 3.26Å; H521-D533 IonicContact CE1-OD2 2.69Å; H521-D533 IonicContact CG-OD1 2.75Å; H521-D533 IonicContact ND1-OD1 3.84Å; H521-D533 PolarHBondContact ND1-OD1 3.28Å; H521-D533 IonicContact ND1-OD2 3.71Å
522	H	74.7	Confident	69.8	Low	52 Å²	52	79 Å²	79	24%	0.241	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	132.6	178.6	-63.9	98.8	0	0	0	111.3	E482 I531 V532 E534	E482-H522 IonicContact OE1-CD2 3.8Å; E482-H522 PolarHBondContact OE1-CD2 3.03Å; E482-H522 IonicContact OE1-CE1 3.13Å; E482-H522 IonicContact OE1-CG 3.98Å; E482-H522 IonicContact OE1-NE2 2.66Å; E482-H522 PolarHBondContact OE1-NE2 3.2Å; E482-H522 VanDerWaalsContact OE1-NE2 3.1Å; E482-H522 IonicContact OE2-NE2 3.91Å; E482-H522 PolarHBondContact OE2-NE2 2.98Å; H522-I531 WeakPolarHBondContact O-CA 3.44Å; H522-V532 PolarHBondContact N-O 2.68Å; H522-V532 PolarHBondContact O-N 3.04Å; H522-E534 IonicContact CE1-OE2 3.27Å; H522-E534 PolarHBondContact CE1-OE2 3.04Å; H522-E534 IonicContact ND1-OE1 3.72Å; H522-E534 IonicContact ND1-OE2 2.88Å
523	Q	66.7	Low	71.1	Confident	144 Å²	144	80.8 Å²	80.8	67%	0.673	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	126.4	168.8	-71.2	-176.8	-14.3	0	0	110.2	K525	Q523-K525 PolarHBondContact O-N 3.44Å
524	H	63.4	Low	72.3	Confident	82 Å²	82	77.3 Å²	77.3	38%	0.38	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	123.6	179	-173.5	-98.7	0	0	0	110.9	N526 N527 L530 V532	H524-N526 PolarHBondContact ND1-N 3.25Å; H524-N526 PolarHBondContact O-N 2.93Å; H524-N527 CarbonylContact O-C 3.58Å; H524-N527 PolarHBondContact O-N 2.96Å; H524-L530 HydrophobicContact CB-CB 4.1Å; H524-L530 HydrophobicContact CB-CD2 4.38Å; H524-L530 WeakPolarHBondContact CB-O 3.29Å; H524-L530 PolarHBondContact N-O 2.94Å; H524-V532 HydrophobicContact CB-CG2 4.27Å
525	K	61.5	Low	72.9	Confident	205 Å²	205	74.4 Å²	74.4	89%	0.891	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-28.5	-174	-72.9	179.7	179.3	171.7	0	114.9	Q523	Q523-K525 PolarHBondContact O-N 3.44Å
526	N	65.9	Low	73.2	Confident	140 Å²	140	75.6 Å²	75.6	75%	0.749	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-8.2	-177.7	-60.1	-15	0	0	0	113.9	H524	H524-N526 PolarHBondContact ND1-N 3.25Å; H524-N526 PolarHBondContact O-N 2.93Å
527	N	66.8	Low	73.1	Confident	86 Å²	86	78.9 Å²	78.9	46%	0.46	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	91.1	-178	-143.7	4.8	0	0	0	109.6	H524 E529 L530	H524-N527 CarbonylContact O-C 3.58Å; H524-N527 PolarHBondContact O-N 2.96Å; N527-E529 PolarHBondContact O-N 2.93Å; N527-L530 HydrophobicContact CB-CB 4.35Å; N527-L530 PolarHBondContact O-N 2.8Å
528	P	64.6	Low	72.6	Confident	91 Å²	91	78.6 Å²	78.6	59%	0.591	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	-11.2	-172	25.1	-33.5	0	0	0	114.3	L530	P528-L530 VanDerWaalsContact C-N 3.33Å
529	E	67.4	Low	72	Confident	181 Å²	181	81 Å²	81	85%	0.846	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	-14.8	170.8	-67.8	-173.1	166.9	0	0	113.4	N527	N527-E529 PolarHBondContact O-N 2.93Å
530	L	61	Low	71.1	Confident	93 Å²	93	82.3 Å²	82.3	49%	0.487	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	108	-178.2	-148.8	117.7	0	0	0	109.6	H524 N527 P528 V532	H524-L530 HydrophobicContact CB-CB 4.1Å; H524-L530 HydrophobicContact CB-CD2 4.38Å; H524-L530 WeakPolarHBondContact CB-O 3.29Å; H524-L530 PolarHBondContact N-O 2.94Å; N527-L530 HydrophobicContact CB-CB 4.35Å; N527-L530 PolarHBondContact O-N 2.8Å; P528-L530 VanDerWaalsContact C-N 3.33Å; L530-V532 HydrophobicContact CD2-CG2 4.31Å
531	I	64.7	Low	70.2	Confident	98 Å²	98	87.7 Å²	87.7	50%	0.503	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.2	173.1	-57.7	173.3	0	0	0	107.8	H521 H522	H521-I531 HydrophobicContact CB-CG2 3.81Å; H522-I531 WeakPolarHBondContact O-CA 3.44Å
532	V	71.7	Confident	69.2	Low	51 Å²	51	89.2 Å²	89.2	31%	0.309	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.9	174.1	-177.9	0	0	0	0	107.6	H522 H524 L530 E534	H522-V532 PolarHBondContact N-O 2.68Å; H522-V532 PolarHBondContact O-N 3.04Å; H524-V532 HydrophobicContact CB-CG2 4.27Å; L530-V532 HydrophobicContact CD2-CG2 4.31Å; V532-E534 HydrophobicContact CG1-CG 4.32Å
533	D	77.5	Confident	68.5	Low	94 Å²	94	91 Å²	91	50%	0.503	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	119.1	178	-69.7	2.1	0	0	0	109.2	I519 Y520 H521	I519-D533 HydrophobicContact CG2-CB 3.73Å; Y520-D533 WeakPolarHBondContact O-CA 3.42Å; H521-D533 IonicContact CE1-OD1 3.26Å; H521-D533 PolarHBondContact CE1-OD1 2.93Å; H521-D533 VanDerWaalsContact CE1-OD1 3.26Å; H521-D533 IonicContact CE1-OD2 2.69Å; H521-D533 IonicContact CG-OD1 2.75Å; H521-D533 IonicContact ND1-OD1 3.84Å; H521-D533 PolarHBondContact ND1-OD1 3.28Å; H521-D533 IonicContact ND1-OD2 3.71Å
534	E	78	Confident	68.1	Low	98 Å²	98	84.4 Å²	84.4	46%	0.458	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.3	177.1	-63.6	-169.9	174.7	0	0	110.1	I519 Y520 H522 V532	I519-E534 CarbonylContact C-O 3.57Å; I519-E534 WeakPolarHBondContact CA-O 3.36Å; Y520-E534 PolarHBondContact N-O 3.4Å; Y520-E534 PolarHBondContact O-N 2.82Å; H522-E534 IonicContact CE1-OE2 3.27Å; H522-E534 PolarHBondContact CE1-OE2 3.04Å; H522-E534 IonicContact ND1-OE1 3.72Å; H522-E534 IonicContact ND1-OE2 2.88Å; V532-E534 HydrophobicContact CG1-CG 4.32Å
535	E	80.4	Confident	67.9	Low	50 Å²	50	80.6 Å²	80.6	23%	0.234	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	120	177.8	-83.4	179.7	178.4	0	0	110.8	L517 V518 I519 R564 Y568	L517-E535 HydrophobicContact CD1-CB 4.33Å; V518-E535 WeakPolarHBondContact O-CA 3.49Å; I519-E535 HydrophobicContact CD1-CG 4.31Å; I519-E535 HydrophobicContact CG1-CG 3.79Å; E535-R564 IonicContact OE1-CZ 3.85Å; E535-R564 IonicContact OE1-NH1 2.82Å; E535-R564 PolarHBondContact OE1-NH1 3.07Å; E535-Y568 PolarHBondContact O-OH 3.41Å
536	E	76.7	Confident	67.9	Low	43 Å²	43	73.5 Å²	73.5	20%	0.201	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147.7	179.2	-162.5	179.9	154.8	0	0	111.9	I477 V518 Y520	I477-E536 WeakPolarHBondContact CG1-OE1 3.37Å; I477-E536 PolarHBondContact N-OE1 3.02Å; V518-E536 PolarHBondContact N-O 3.09Å; V518-E536 PolarHBondContact O-N 2.96Å; Y520-E536 HydrophobicContact CD2-CB 4.13Å; Y520-E536 HydrophobicContact CE2-CB 3.68Å; Y520-E536 HydrophobicContact CE2-CG 4.37Å; Y520-E536 WeakPolarHBondContact CE2-OE2 3.48Å
537	I	77.2	Confident	67.5	Low	68 Å²	68	67.9 Å²	67.9	35%	0.349	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	112.3	172.7	-58	179.3	0	0	0	108.6	F490 V515 V516	F490-I537 HydrophobicContact CE2-CD1 4.19Å; F490-I537 HydrophobicContact CE2-CG1 4.19Å; V515-I537 HydrophobicContact CB-CG2 3.6Å; V515-I537 HydrophobicContact CG1-CG2 4.01Å; V515-I537 HydrophobicContact CG2-CG2 3.85Å; V516-I537 WeakPolarHBondContact O-CA 3.42Å
538	V	74.2	Confident	66.9	Low	2 Å²	2	70.3 Å²	70.3	1%	0.012	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.3	-178	-177.2	0	0	0	0	109.6	A474 V516 V518 I545	A474-V538 HydrophobicContact CB-CG2 4.29Å; V516-V538 PolarHBondContact N-O 2.98Å; V516-V538 PolarHBondContact O-N 3.33Å; V518-V538 HydrophobicContact CB-CG2 4.38Å; V518-V538 HydrophobicContact CG2-CB 3.89Å; V518-V538 HydrophobicContact CG2-CG2 3.63Å; V538-I545 HydrophobicContact CB-CD1 4.42Å; V538-I545 HydrophobicContact CG1-CD1 4.19Å; V538-I545 HydrophobicContact CG1-CG1 3.94Å
539	P	71.6	Confident	66.3	Low	50 Å²	50	73.4 Å²	73.4	33%	0.325	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	136.9	174.7	29.1	-33.3	0	0	0	110.4	V515 I541 S544	V515-P539 HydrophobicContact CG1-CB 4.35Å; P539-I541 VanDerWaalsContact C-N 3.3Å; P539-I541 HydrophobicContact CB-CD1 3.89Å; P539-I541 HydrophobicContact CB-CG1 4.08Å; P539-I541 HydrophobicContact CG-CD1 3.93Å; P539-I541 PolarHBondContact O-N 2.9Å; P539-I541 VanDerWaalsContact O-N 3.12Å; P539-S544 VanDerWaalsContact O-CB 3.24Å; P539-S544 WeakPolarHBondContact O-CB 3.29Å; P539-S544 PolarHBondContact O-OG 2.94Å
540	I	67.1	Low	65.8	Low	32 Å²	32	72.4 Å²	72.4	16%	0.164	37%	0.369	C	S	.	.			trans	-82	80.5	167.4	-54.7	163.2	0	0	0	107.4	K514 V516 I545 I554	K514-I540 HydrophobicContact CB-CB 4.15Å; K514-I540 HydrophobicContact CB-CD1 4.15Å; K514-I540 WeakPolarHBondContact O-CA 3.47Å; K514-I540 VanDerWaalsContact O-CB 3.27Å; K514-I540 WeakPolarHBondContact O-CB 3.44Å; K514-I540 WeakPolarHBondContact O-CG1 3.22Å; K514-I540 PolarHBondContact O-N 2.78Å; V516-I540 HydrophobicContact CB-CG1 4.45Å; V516-I540 HydrophobicContact CG2-CD1 3.24Å; V516-I540 HydrophobicContact CG2-CG1 3.46Å; V516-I540 VanDerWaalsContact CG2-CG1 3.46Å; I540-I545 HydrophobicContact CG1-CD1 4.09Å; I540-I554 HydrophobicContact CD1-CB 3.88Å; I540-I554 HydrophobicContact CD1-CD1 4.42Å; I540-I554 HydrophobicContact CD1-CG1 4.12Å
541	I	64.5	Low	66	Low	114 Å²	114	71.8 Å²	71.8	59%	0.585	36%	0.363	S	S	*	.			trans	-97.3	163.8	164.6	-62.1	161.6	0	0	0	105.9	P539 D543 S544	P539-I541 VanDerWaalsContact C-N 3.3Å; P539-I541 HydrophobicContact CB-CD1 3.89Å; P539-I541 HydrophobicContact CB-CG1 4.08Å; P539-I541 HydrophobicContact CG-CD1 3.93Å; P539-I541 PolarHBondContact O-N 2.9Å; P539-I541 VanDerWaalsContact O-N 3.12Å; I541-D543 PolarHBondContact O-N 3.11Å; I541-S544 PolarHBondContact N-OG 3.49Å; I541-S544 PolarHBondContact O-N 3.47Å; I541-S544 PolarHBondContact O-OG 2.85Å
542	K	56.8	Low	66.1	Low	100 Å²	100	67.3 Å²	67.3	44%	0.435	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	123.3	170.4	-83.2	178.6	-179.8	165.3	0	108.9	L432	L432-K542 HydrophobicContact CD2-CD 4.42Å
543	D	60.9	Low	66	Low	89 Å²	89	67.9 Å²	67.9	48%	0.476	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	-4.2	173.1	-51.4	-32.9	0	0	0	117.2	Y481 I541 I545 Q551	Y481-D543 WeakPolarHBondContact CE1-O 3.46Å; Y481-D543 VanDerWaalsContact CZ-O 3.27Å; Y481-D543 PolarHBondContact OH-O 3.41Å; I541-D543 PolarHBondContact O-N 3.11Å; D543-I545 VanDerWaalsContact C-N 3.3Å; D543-I545 PolarHBondContact O-N 3.24Å; D543-Q551 VanDerWaalsContact CA-NE2 3.29Å; D543-Q551 PolarHBondContact OD1-NE2 3.21Å
544	S	58.5	Low	65.9	Low	5 Å²	5	65.1 Å²	65.1	4%	0.035	33%	0.329	C	S	.	.	S	Bend	trans	-72.9	-17.1	-176.8	47.9	0	0	0	0	115.4	Q475 P539 I541	Q475-S544 PolarHBondContact N-O 2.54Å; P539-S544 VanDerWaalsContact O-CB 3.24Å; P539-S544 WeakPolarHBondContact O-CB 3.29Å; P539-S544 PolarHBondContact O-OG 2.94Å; I541-S544 PolarHBondContact N-OG 3.49Å; I541-S544 PolarHBondContact O-N 3.47Å; I541-S544 PolarHBondContact O-OG 2.85Å
545	I	58.7	Low	65.8	Low	3 Å²	3	64.7 Å²	64.7	2%	0.015	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	124.1	175.2	-50.3	-179.7	0	0	0	110.7	I472 L473 V516 V538 I540 D543 I552	I472-I545 HydrophobicContact CB-CG2 4.09Å; I472-I545 HydrophobicContact CD1-CG2 3.41Å; I472-I545 VanDerWaalsContact CD1-CG2 3.41Å; I472-I545 HydrophobicContact CG1-CG2 4.26Å; I472-I545 HydrophobicContact CG2-CG2 4.49Å; L473-I545 WeakPolarHBondContact O-CA 3.21Å; V516-I545 HydrophobicContact CB-CD1 4.01Å; V516-I545 HydrophobicContact CG1-CD1 4.27Å; V516-I545 HydrophobicContact CG2-CD1 4.24Å; V538-I545 HydrophobicContact CB-CD1 4.42Å; V538-I545 HydrophobicContact CG1-CD1 4.19Å; V538-I545 HydrophobicContact CG1-CG1 3.94Å; I540-I545 HydrophobicContact CG1-CD1 4.09Å; D543-I545 VanDerWaalsContact C-N 3.3Å; D543-I545 PolarHBondContact O-N 3.24Å; I545-I552 HydrophobicContact CB-CD1 4.46Å; I545-I552 HydrophobicContact CG2-CB 4.41Å; I545-I552 HydrophobicContact CG2-CD1 3.42Å; I545-I552 VanDerWaalsContact CG2-CD1 3.42Å; I545-I552 HydrophobicContact CG2-CG1 4.13Å
546	I	61.2	Low	65.6	Low	56 Å²	56	64.4 Å²	64.4	29%	0.287	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.2	-179	-55.6	171	0	0	0	109	L473 Y481	L473-I546 HydrophobicContact CB-CB 4.44Å; L473-I546 PolarHBondContact N-O 2.53Å; L473-I546 PolarHBondContact O-N 3.29Å; Y481-I546 HydrophobicContact CD1-CD1 4.45Å; Y481-I546 HydrophobicContact CE1-CD1 3.85Å; Y481-I546 HydrophobicContact CE1-CG1 4.26Å
547	C	57.8	Low	65.7	Low	21 Å²	21	62.7 Å²	62.7	14%	0.142	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	111.4	168.8	-162.8	0	0	0	0	108.9	P471 I472 L549 F550 I552	P471-C547 PolarHBondContact O-SG 2.9Å; I472-C547 HydrophobicContact CG2-CB 4.06Å; C547-L549 VanDerWaalsContact C-N 3.26Å; C547-L549 PolarHBondContact O-N 3.24Å; C547-F550 PolarHBondContact N-O 2.88Å; C547-F550 VanDerWaalsContact N-O 3.1Å; C547-F550 PolarHBondContact O-N 3.24Å; C547-I552 HydrophobicContact CB-CD1 3.69Å; C547-I552 HydrophobicContact CB-CG1 3.85Å
548	I	54.2	Low	65.9	Low	137 Å²	137	60.6 Å²	60.6	70%	0.703	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	32.1	52.9	166.8	-43.6	179.1	0	0	0	113.9
549	L	51.8	Low	65.9	Low	156 Å²	156	63.4 Å²	63.4	82%	0.817	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.8	3	176.5	-49.9	158.6	0	0	0	118.1	C547	C547-L549 VanDerWaalsContact C-N 3.26Å; C547-L549 PolarHBondContact O-N 3.24Å
550	F	57.9	Low	66	Low	160 Å²	160	61.2 Å²	61.2	70%	0.702	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.6	147.9	172.9	-66.1	-81.9	0	0	0	113.5	C547	C547-F550 PolarHBondContact N-O 2.88Å; C547-F550 VanDerWaalsContact N-O 3.1Å; C547-F550 PolarHBondContact O-N 3.24Å
551	Q	64.4	Low	66.1	Low	81 Å²	81	62 Å²	62	38%	0.379	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	125.3	171.7	-173.9	137.6	68.4	0	0	109.5	D543 T553	D543-Q551 VanDerWaalsContact CA-NE2 3.29Å; D543-Q551 PolarHBondContact OD1-NE2 3.21Å; Q551-T553 PolarHBondContact O-N 3.14Å
552	I	67.5	Low	65.8	Low	3 Å²	3	62.5 Å²	62.5	2%	0.015	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-79.8	119	178.4	-53.3	-177.2	0	0	0	108.6	L466 I472 I545 C547 M556 V557	L466-I552 HydrophobicContact CD1-CD1 3.78Å; L466-I552 HydrophobicContact CD1-CG1 4.13Å; L466-I552 HydrophobicContact CD1-CG2 3.79Å; I472-I552 HydrophobicContact CB-CD1 4.3Å; I472-I552 HydrophobicContact CG2-CD1 3.51Å; I545-I552 HydrophobicContact CB-CD1 4.46Å; I545-I552 HydrophobicContact CG2-CB 4.41Å; I545-I552 HydrophobicContact CG2-CD1 3.42Å; I545-I552 VanDerWaalsContact CG2-CD1 3.42Å; I545-I552 HydrophobicContact CG2-CG1 4.13Å; C547-I552 HydrophobicContact CB-CD1 3.69Å; C547-I552 HydrophobicContact CB-CG1 3.85Å; I552-M556 HydrophobicContact CG2-CB 4.2Å; I552-V557 HydrophobicContact CG2-CG2 3.44Å; I552-V557 VanDerWaalsContact CG2-CG2 3.44Å
553	T	70	Confident	65.9	Low	63 Å²	63	65.3 Å²	65.3	39%	0.387	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-95.1	152.6	169.8	54.1	0	0	0	0	109.8	Q551 D555 M556	Q551-T553 PolarHBondContact O-N 3.14Å; T553-D555 WeakPolarHBondContact CB-OD1 3.36Å; T553-D555 PolarHBondContact O-N 3.17Å; T553-D555 VanDerWaalsContact O-N 3.08Å; T553-D555 PolarHBondContact OG1-OD1 3.27Å; T553-M556 VanDerWaalsContact O-CB 3.29Å; T553-M556 WeakPolarHBondContact O-CB 3.06Å; T553-M556 PolarHBondContact O-N 3.21Å
554	I	73.7	Confident	65.7	Low	36 Å²	36	66.1 Å²	66.1	19%	0.185	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-57.7	-28.5	-173.4	-167.2	160.5	0	0	0	114.1	H489 K514 I540 M556 V557	H489-I554 HydrophobicContact CB-CD1 4.16Å; H489-I554 HydrophobicContact CB-CG1 4.15Å; K514-I554 HydrophobicContact CB-CD1 3.68Å; K514-I554 HydrophobicContact CD-CB 3.84Å; K514-I554 HydrophobicContact CD-CD1 3.91Å; K514-I554 HydrophobicContact CD-CG1 4.49Å; K514-I554 HydrophobicContact CD-CG2 3.57Å; K514-I554 HydrophobicContact CG-CB 4.43Å; K514-I554 HydrophobicContact CG-CD1 3.56Å; K514-I554 HydrophobicContact CG-CG2 4.46Å; K514-I554 VanDerWaalsContact NZ-CG2 3.28Å; I540-I554 HydrophobicContact CD1-CB 3.88Å; I540-I554 HydrophobicContact CD1-CD1 4.42Å; I540-I554 HydrophobicContact CD1-CG1 4.12Å; I554-M556 PolarHBondContact O-N 3.34Å; I554-V557 PolarHBondContact O-N 3.28Å
555	D	76.3	Confident	65.2	Low	89 Å²	89	68 Å²	68	48%	0.476	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-67.7	-15.2	176.4	56.8	-49.7	0	0	0	113	T553	T553-D555 WeakPolarHBondContact CB-OD1 3.36Å; T553-D555 PolarHBondContact O-N 3.17Å; T553-D555 VanDerWaalsContact O-N 3.08Å; T553-D555 PolarHBondContact OG1-OD1 3.27Å
556	M	77.8	Confident	64.5	Low	44 Å²	44	77.1 Å²	77.1	22%	0.217	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-88.1	-12	170.9	-55.8	177.2	65.1	0	0	112.8	C464 L466 I552 T553 I554	C464-M556 WeakPolarHBondContact O-CA 3.38Å; L466-M556 WeakPolarHBondContact CB-O 3.3Å; L466-M556 HydrophobicContact CD1-CB 4.33Å; L466-M556 HydrophobicContact CD2-CE 4.41Å; L466-M556 HydrophobicContact CG-CB 4.31Å; L466-M556 HydrophobicContact CG-CE 4.44Å; L466-M556 PolarHBondContact N-O 3.5Å; I552-M556 HydrophobicContact CG2-CB 4.2Å; T553-M556 VanDerWaalsContact O-CB 3.29Å; T553-M556 WeakPolarHBondContact O-CB 3.06Å; T553-M556 PolarHBondContact O-N 3.21Å; I554-M556 PolarHBondContact O-N 3.34Å
557	V	78.1	Confident	63.2	Low	7 Å²	7	79.7 Å²	79.7	4%	0.042	41%	0.412	C	S	.	.	S	Bend	trans	-100.4	125.4	-170.8	-176.2	0	0	0	0	110.7	L486 H489 V516 I552 I554	L486-V557 HydrophobicContact CD1-CG1 3.96Å; L486-V557 HydrophobicContact CD1-CG2 4.37Å; L486-V557 HydrophobicContact CD2-CG1 4.27Å; L486-V557 HydrophobicContact CD2-CG2 4.32Å; L486-V557 HydrophobicContact CG-CG1 4.33Å; H489-V557 HydrophobicContact CB-CG1 4.08Å; H489-V557 PolarHBondContact ND1-O 2.89Å; V516-V557 HydrophobicContact CG1-CG1 4.23Å; V516-V557 HydrophobicContact CG2-CG1 4.1Å; V516-V557 HydrophobicContact CG2-CG2 4.34Å; I552-V557 HydrophobicContact CG2-CG2 3.44Å; I552-V557 VanDerWaalsContact CG2-CG2 3.44Å; I554-V557 PolarHBondContact O-N 3.28Å
558	P	80.1	Confident	62	Low	24 Å²	24	86.3 Å²	86.3	16%	0.156	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-65.9	161.8	176.4	28.7	-34.7	0	0	0	111.5	I465 L466 V468 G488 H489	I465-P558 HydrophobicContact CG2-CB 4.14Å; L466-P558 VanDerWaalsContact O-CD 3.3Å; L466-P558 WeakPolarHBondContact O-CD 3.44Å; L466-P558 WeakPolarHBondContact O-CG 3.42Å; V468-P558 HydrophobicContact CG2-CB 4.25Å; V468-P558 HydrophobicContact CG2-CG 3.77Å; G488-P558 CarbonylContact C-O 3.45Å; G488-P558 WeakPolarHBondContact CA-O 2.98Å; H489-P558 PolarHBondContact N-O 3.47Å; H489-P558 VanDerWaalsContact ND1-C 3.3Å; H489-P558 PolarHBondContact ND1-O 3.03Å
559	A	75.8	Confident	60.6	Low	61 Å²	61	84.8 Å²	84.8	50%	0.504	44%	0.435	S	S	.	.	B	Isolated β-bridge	trans	-67	137.6	172.5	0	0	0	0	0	110.6	H489	H489-A559 WeakPolarHBondContact ND1-CA 3.35Å; H489-A559 PolarHBondContact ND1-N 3.29Å
560	A	72.4	Confident	59.4	Low	4 Å²	4	83.7 Å²	83.7	3%	0.033	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-62.8	136.5	177.8	0	0	0	0	0	110.8	H489 F490 Q494 L562	H489-A560 PolarHBondContact O-N 3.08Å; F490-A560 HydrophobicContact CD1-CB 4.2Å; F490-A560 HydrophobicContact CE1-CB 4.06Å; Q494-A560 PolarHBondContact NE2-O 3.18Å; A560-L562 PolarHBondContact O-N 3.07Å
561	P	69.4	Low	57.9	Low	49 Å²	49	84.3 Å²	84.3	32%	0.318	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-57.4	134.5	174.8	-20.8	31.2	0	0	0	111.4	I487 D563 R564	I487-P561 HydrophobicContact CG2-CG 4.32Å; P561-D563 PolarHBondContact O-N 2.96Å; P561-R564 PolarHBondContact O-N 3.05Å
562	L	58.9	Low	56.2	Low	125 Å²	125	85.1 Å²	85.1	65%	0.654	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-61.2	-28.2	-177.1	-70.6	165.5	0	0	0	113	Q494 A560 R564 I565	Q494-L562 HydrophobicContact CG-CD2 4.16Å; A560-L562 PolarHBondContact O-N 3.07Å; L562-R564 PolarHBondContact O-N 2.91Å; L562-I565 HydrophobicContact CD2-CD1 4.13Å; L562-I565 PolarHBondContact O-N 3.26Å
563	D	59.6	Low	54.2	Low	158 Å²	158	94.6 Å²	94.6	85%	0.845	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-73	-12	-174	-55.9	-24.4	0	0	0	114.1	P561	P561-D563 PolarHBondContact O-N 2.96Å
564	R	56	Low	52.2	Low	106 Å²	106	96.4 Å²	96.4	40%	0.4	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-101.4	1.8	179.3	-70.9	-169.5	-174.5	-131.8	12.2	114.5	L517 E535 P561 L562 R566	L517-R564 HydrophobicContact CD2-CB 4.37Å; E535-R564 IonicContact OE1-CZ 3.85Å; E535-R564 IonicContact OE1-NH1 2.82Å; E535-R564 PolarHBondContact OE1-NH1 3.07Å; P561-R564 PolarHBondContact O-N 3.05Å; L562-R564 PolarHBondContact O-N 2.91Å; R564-R566 PolarHBondContact O-N 2.82Å
565	I	48	Very low	49.9	Very low	45 Å²	45	103.4 Å²	103.4	23%	0.231	55%	0.546	C	S	.	.			trans	-74	90.1	175.4	-69	163.6	0	0	0	109	F490 Q494 F498 L562	F490-I565 HydrophobicContact CD1-CG1 4.38Å; F490-I565 HydrophobicContact CE1-CD1 4.38Å; F490-I565 HydrophobicContact CE1-CG1 3.75Å; Q494-I565 HydrophobicContact CB-CD1 4.22Å; Q494-I565 HydrophobicContact CG-CD1 3.98Å; F498-I565 HydrophobicContact CD2-CB 4.42Å; F498-I565 HydrophobicContact CD2-CG1 4.44Å; F498-I565 HydrophobicContact CD2-CG2 3.43Å; F498-I565 VanDerWaalsContact CD2-CG2 3.43Å; F498-I565 HydrophobicContact CE2-CB 4.03Å; F498-I565 HydrophobicContact CE2-CG1 4.14Å; F498-I565 HydrophobicContact CE2-CG2 3.38Å; F498-I565 HydrophobicContact CZ-CG2 4.39Å; L562-I565 HydrophobicContact CD2-CD1 4.13Å; L562-I565 PolarHBondContact O-N 3.26Å
566	R	43.4	Very low	47.8	Very low	195 Å²	195	110.3 Å²	110.3	74%	0.736	57%	0.567	S	S	*	*			trans	-105.6	129.3	169.4	-67.3	-172.7	179.2	-170.8	1.9	110	F498 R564 Y568	F498-R566 VanDerWaalsContact CZ-O 3.29Å; F498-R566 WeakPolarHBondContact CZ-O 3.48Å; R564-R566 PolarHBondContact O-N 2.82Å; R566-Y568 PolarHBondContact O-N 2.94Å
567	P	35	Very low	45.6	Very low	109 Å²	109	117 Å²	117	71%	0.708	60%	0.595	S	S	*	*			trans	-67.2	116.1	174.4	26.1	-30.9	0	0	0	109.7	C569	P567-C569 PolarHBondContact O-N 3.26Å
568	Y	31.8	Very low	43.2	Very low	161 Å²	161	123.9 Å²	123.9	63%	0.631	63%	0.631	S	S	*	*			trans	-70.7	110.4	168.5	-93.5	-82.9	0	0	0	109.1	E535 R566 V570	E535-Y568 PolarHBondContact O-OH 3.41Å; R566-Y568 PolarHBondContact O-N 2.94Å; Y568-V570 PolarHBondContact O-N 3.36Å
569	C	24.8	Very low	40.9	Very low	104 Å²	104	128.4 Å²	128.4	70%	0.703	66%	0.658	S	S	*	*			trans	-81.8	103.3	166.2	-171.4	0	0	0	0	108.2	P567 Q571	P567-C569 PolarHBondContact O-N 3.26Å; C569-Q571 VanDerWaalsContact C-N 3.31Å; C569-Q571 PolarHBondContact O-N 3.46Å
570	V	27.2	Very low	38.8	Very low	133 Å²	133	132.1 Å²	132.1	81%	0.806	67%	0.67	S	S	*	*			trans	-74	88.4	169.7	-177.4	0	0	0	0	107.6	Y568 S572	Y568-V570 PolarHBondContact O-N 3.36Å; V570-S572 PolarHBondContact O-N 3.2Å
571	Q	26.7	Very low	36.7	Very low	173 Å²	173	142 Å²	142	81%	0.808	71%	0.706	S	S	*	*			trans	-79.1	104.7	162.6	-82.1	178.2	-21.8	0	0	107.8	C569 Q573	C569-Q571 VanDerWaalsContact C-N 3.31Å; C569-Q571 PolarHBondContact O-N 3.46Å; Q571-Q573 PolarHBondContact O-N 3.05Å
572	S	28.2	Very low	34.9	Very low	99 Å²	99	148.5 Å²	148.5	69%	0.692	73%	0.726	S	S	*	*			trans	-49	127	171.7	44.5	0	0	0	0	111.5	V570 S574	V570-S572 PolarHBondContact O-N 3.2Å; S572-S574 PolarHBondContact O-N 3.16Å; S572-S574 VanDerWaalsContact O-N 3.08Å
573	Q	24.8	Very low	33.7	Very low	201 Å²	201	148.9 Å²	148.9	94%	0.939	73%	0.729	S	S	*	*			trans	-61.9	105.3	163.9	-67.6	177.8	-2	0	0	109.1	Q571	Q571-Q573 PolarHBondContact O-N 3.05Å
574	S	28.8	Very low	32.3	Very low	102 Å²	102	150.8 Å²	150.8	71%	0.713	73%	0.732	S	S	*	*			trans	-128.7	115.9	152.5	58.7	0	0	0	0	107	S572	S572-S574 PolarHBondContact O-N 3.16Å; S572-S574 VanDerWaalsContact O-N 3.08Å
575	E	25.8	Very low	31.2	Very low	182 Å²	182	152.2 Å²	152.2	85%	0.85	75%	0.747	S	S	*	*			trans	-37.6	131.9	164.9	-61.2	166.6	136.2	0	0	111.5
576	Y	30.9	Very low	30.4	Very low	234 Å²	234	156.1 Å²	156.1	92%	0.918	78%	0.775	S	S	*	*			trans	-167.2	143.5	130.3	-105.5	-77.7	0	0	0	109.7
577	K	32.6	Very low	30	Very low	185 Å²	185	151.6 Å²	151.6	80%	0.804	77%	0.773	S	S	*	*			trans	-67.7	160	-165.9	-62.5	173.1	175.6	178.2	0	113.5
578	D	27.5	Very low	29.8	Very low	151 Å²	151	152.7 Å²	152.7	81%	0.807	78%	0.778	S	S	*	*			trans	14.3	132.7	148	-72.6	-43.4	0	0	0	117.7
579	V	31.2	Very low	29.9	Very low	119 Å²	119	152.2 Å²	152.2	72%	0.721	79%	0.786	S	S	*	*				172.3	118.4	114.2	167.7	0	0	0	0	108.3
580	N	31.3	Very low	30.2	Very low	140 Å²	140	158.4 Å²	158.4	75%	0.749	80%	0.797	S	S	*	*			trans	58	114.3	150.8	-55.3	-20.6	0	0	0	118.3
581	R	30	Very low	30.5	Very low	210 Å²	210	155.2 Å²	155.2	79%	0.792	79%	0.79	S	S	*	*				56.6	123.5	69.7	-147.9	-177.4	-136	178.4	5	111.2
582	Y	29.9	Very low	30.9	Very low	186 Å²	186	154.3 Å²	154.3	73%	0.729	79%	0.79	S	S	*	*			trans	111	107.2	169	-65.3	-76.5	0	0	0	116.6
583	D	34	Very low	31.4	Very low	134 Å²	134	154.8 Å²	154.8	72%	0.717	79%	0.789	S	S	*	*			trans	90.2	97.9	133.6	-56	-19.1	0	0	0	120	I585	D583-I585 PolarHBondContact O-N 3.26Å
584	E	31.5	Very low	31.9	Very low	198 Å²	198	152.6 Å²	152.6	93%	0.925	78%	0.784	S	S	*	*			trans	-50.5	108.2	141.8	-68.5	178.3	152.7	0	0	110.6
585	I	32	Very low	32.2	Very low	136 Å²	136	158.7 Å²	158.7	70%	0.697	79%	0.791	S	S	*	*			trans	-146.8	125	146.2	-56.1	-176.6	0	0	0	108.4	D583	D583-I585 PolarHBondContact O-N 3.26Å
586	P	31.3	Very low	32.9	Very low	127 Å²	127	155 Å²	155	83%	0.825	78%	0.783	S	S	*	*			trans	-79.8	130.8	177.8	31.9	-30.5	0	0	0	110.3
587	S	33.9	Very low	33.1	Very low	100 Å²	100	153.8 Å²	153.8	70%	0.699	78%	0.778	S	S	*	*			trans	-153.2	106.2	168.4	38.1	0	0	0	0	112.3
588	T	32.8	Very low	33.4	Very low	132 Å²	132	152.8 Å²	152.8	81%	0.81	78%	0.776	S	S	*	*			trans	27.8	112	133.8	50.1	0	0	0	0	119.5
589	D	32.2	Very low	33.9	Very low	151 Å²	151	150.7 Å²	150.7	81%	0.807	77%	0.774	S	S	*	*			trans	-24.1	128.4	147.8	-152.1	3.9	0	0	0	116.7
590	Y	32.3	Very low	34.4	Very low	234 Å²	234	149.9 Å²	149.9	92%	0.918	77%	0.773	S	S	*	*			trans	-169.6	130.4	146.7	-86.1	-61.6	0	0	0	112.1
591	G	33.4	Very low	34.8	Very low	65 Å²	65	155.2 Å²	155.2	67%	0.67	78%	0.783	S	S	*	*			trans	117.5	110	157.2	0	0	0	0	0	112.3
592	L	35.1	Very low	35.2	Very low	154 Å²	154	148.7 Å²	148.7	81%	0.806	78%	0.781	S	S	*	*				-163	144.8	52.7	-118.2	79.8	0	0	0	110.7
593	T	37.5	Very low	35.8	Very low	109 Å²	109	150.8 Å²	150.8	67%	0.669	79%	0.788	S	S	*	*			trans	59.6	120.8	147.8	61.3	0	0	0	0	117.7
594	D	37.2	Very low	36	Very low	156 Å²	156	156 Å²	156	83%	0.834	80%	0.797	S	S	*	*			cis	-157.4	156.1	37.6	-94.5	-43.6	0	0	0	113
595	R	35	Very low	36.4	Very low	230 Å²	230	150.3 Å²	150.3	87%	0.868	79%	0.792	S	S	*	*			trans	-57.9	168.5	-177.7	-70.6	-176.3	180	-163.5	2.1	114.2
596	P	38.9	Very low	36.9	Very low	105 Å²	105	151.5 Å²	151.5	68%	0.682	81%	0.805	S	S	*	*			cis	-152.3	167.4	29.1	43.6	-21.9	0	0	0	121.4
597	Y	35.5	Very low	37.3	Very low	207 Å²	207	149.1 Å²	149.1	81%	0.812	80%	0.804	S	S	*	*			trans	79.2	113.5	146.9	-79.3	-61.5	0	0	0	124
598	Q	39.8	Very low	37.7	Very low	164 Å²	164	148.3 Å²	148.3	77%	0.766	81%	0.811	S	S	*	*			trans	94.4	105.5	136.7	-65.2	-166.1	-7.1	0	0	123.1
599	S	38	Very low	38	Very low	108 Å²	108	146.3 Å²	146.3	76%	0.755	82%	0.817	S	S	*	*			trans	69.3	139.3	133.9	81.2	0	0	0	0	118.8
600	S	40.8	Very low	38.4	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	82%	0.817	S	S	*	*			cis	-168	136.5	2.8	-94.9	0	0	0	0	109.4
601	R	38.9	Very low	38.8	Very low	252 Å²	252	135.8 Å²	135.8	95%	0.951	82%	0.815	S	S	*	*			trans	42.5	136.5	140.7	-56.9	177	175.7	174.3	-1.2	120.3
602	G	39.5	Very low	39.3	Very low	73 Å²	73	137.4 Å²	137.4	75%	0.753	82%	0.816	S	S	*	*			cis	154.9	165.4	0.5	0	0	0	0	0	113.2
603	R	42.2	Very low	39.7	Very low	230 Å²	230	140.7 Å²	140.7	87%	0.868	82%	0.818	S	S	*	*			trans	82.5	119.2	163.4	-61.2	-151.8	-165.1	-108.6	6.9	118.8
604	R	38.6	Very low	40	Very low	244 Å²	244	143 Å²	143	92%	0.921	83%	0.827	S	S	*	*				89.7	125.7	57	-87.7	-162.6	-171.2	-172.2	3.2	114.6
605	G	40.5	Very low	40.4	Very low	79 Å²	79	141.3 Å²	141.3	81%	0.814	82%	0.824	S	S	*	*			trans	174.5	132.6	159.1	0	0	0	0	0	113.5
606	V	41.7	Very low	40.6	Very low	160 Å²	160	141.7 Å²	141.7	97%	0.97	83%	0.825	S	S	*	*			trans	-127.2	154.9	-162.3	169.8	0	0	0	0	111.3
607	G	40.1	Very low	40.7	Very low	78 Å²	78	144.6 Å²	144.6	80%	0.804	83%	0.832	S	S	*	*			trans	141.9	142.4	155.2	0	0	0	0	0	113.3
608	G	40.8	Very low	41	Very low	82 Å²	82	144 Å²	144	85%	0.845	83%	0.834	S	S	*	*			cis	163.3	147.7	-0.3	0	0	0	0	0	110.7
609	G	40.3	Very low	41	Very low	91 Å²	91	141.9 Å²	141.9	94%	0.938	84%	0.837	S	S	*	*			trans	75.3	146.6	157.7	0	0	0	0	0	119.4
610	G	40.8	Very low	41	Very low	79 Å²	79	141.4 Å²	141.4	81%	0.814	84%	0.84	S	S	*	*			cis	163.1	144.6	-1	0	0	0	0	0	112.3
611	G	39.6	Very low	41	Very low	85 Å²	85	140.5 Å²	140.5	88%	0.876	85%	0.846	S	S	*	*			trans	81.1	156.7	155.1	0	0	0	0	0	119.8
612	S	44.4	Very low	41	Very low	99 Å²	99	141 Å²	141	69%	0.692	85%	0.848	S	S	*	*			cis	-177.9	147.2	-21.3	-153	0	0	0	0	109.1
613	R	42.8	Very low	41	Very low	223 Å²	223	141.5 Å²	141.5	84%	0.842	85%	0.853	S	S	*	*			trans	81.7	111.6	145.5	-72.3	162.5	-173.6	-161.2	1.2	124.6
614	N	43.9	Very low	41	Very low	158 Å²	158	136.7 Å²	136.7	85%	0.845	86%	0.855	S	S	*	*				68.7	141.6	123	-76.6	2.5	0	0	0	126
615	P	46.9	Very low	41.1	Very low	120 Å²	120	128.2 Å²	128.2	78%	0.779	84%	0.843	S	S	*	*			trans	-112.2	165.3	176.3	42.1	-31.9	0	0	0	115.9
616	R	38.8	Very low	41.2	Very low	237 Å²	237	131.4 Å²	131.4	89%	0.894	85%	0.847	S	S	*	*			trans	-157.7	119.7	165.2	-86.2	-172.1	-179	164	-0.7	109
617	M	41.7	Very low	41.1	Very low	166 Å²	166	127.3 Å²	127.3	82%	0.818	84%	0.837	S	S	*	*				84.7	151.3	89.1	-79.7	-75.6	171.9	0	0	116.5
618	F	40.5	Very low	41.1	Very low	196 Å²	196	133.6 Å²	133.6	86%	0.86	84%	0.837	S	S	*	*			trans	96.1	138.7	171.5	-58.4	-69.7	0	0	0	116.6
619	S	40.1	Very low	40.9	Very low	119 Å²	119	140.1 Å²	140.1	83%	0.832	84%	0.836	S	S	*	*			cis	-170.4	168.7	-12.3	-166.1	0	0	0	0	109
620	A	38.6	Very low	40.8	Very low	98 Å²	98	140.4 Å²	140.4	81%	0.81	82%	0.824	S	S	*	*			trans	-66.8	162.9	-172.1	0	0	0	0	0	118.3
621	G	39.8	Very low	40.7	Very low	82 Å²	82	146.4 Å²	146.4	85%	0.845	82%	0.822	S	S	*	*			trans	-162.9	109.1	158.1	0	0	0	0	0	112.7
622	R	39	Very low	40.6	Very low	261 Å²	261	150.5 Å²	150.5	99%	0.985	81%	0.812	S	S	*	*			trans	-89.8	153.4	177.2	-73	-177.5	171.8	-142.9	-0.7	111.1
623	G	40	Very low	40.4	Very low	84 Å²	84	155.6 Å²	155.6	87%	0.866	82%	0.816	S	S	*	*			trans	-167.5	128.5	163.2	0	0	0	0	0	112.2
624	S	41.4	Very low	40.2	Very low	129 Å²	129	150.7 Å²	150.7	90%	0.902	81%	0.806	S	S	*	*			trans	-119.6	158.6	-165.6	-171	0	0	0	0	111
625	G	41.8	Very low	39.8	Very low	66 Å²	66	149 Å²	149	68%	0.68	80%	0.797	S	S	*	*			trans	148.8	90.2	168	0	0	0	0	0	113.3
626	V	42.9	Very low	39.4	Very low	147 Å²	147	150.9 Å²	150.9	89%	0.891	80%	0.795	S	S	*	*				58.5	113.5	87.5	-172.4	0	0	0	0	114.6
627	G	39.6	Very low	39.2	Very low	74 Å²	74	153 Å²	153	76%	0.763	81%	0.812	S	S	*	*			trans	-178.4	133.8	166	0	0	0	0	0	112.6
628	R	39.5	Very low	39.1	Very low	209 Å²	209	152.4 Å²	152.4	79%	0.789	81%	0.811	S	S	*	*			trans	-102.7	153.5	-154.4	-67.4	-178.3	175	-165	-0.2	114.5
629	R	36.5	Very low	39	Very low	219 Å²	219	150.1 Å²	150.1	83%	0.826	81%	0.809	S	S	*	*			trans	48	128.2	135.9	-66.6	176.8	177.7	-174.2	-1.3	119.7
630	S	39	Very low	39	Very low	98 Å²	98	151.8 Å²	151.8	69%	0.685	81%	0.808	S	S	*	*				168.8	124.2	96.1	-178.9	0	0	0	0	113.1
631	R	38.7	Very low	39	Very low	205 Å²	205	155 Å²	155	77%	0.774	81%	0.807	S	S	*	*			trans	23	133.7	137.9	-53.8	176.1	-177.8	163.9	-0.3	118.7
632	Y	37.7	Very low	38.9	Very low	171 Å²	171	159.6 Å²	159.6	67%	0.671	81%	0.805	S	S	*	*				174.9	137.4	95	-100.5	-76.5	0	0	0	111.3
633	R	38.6	Very low	38.9	Very low	205 Å²	205	152.8 Å²	152.8	77%	0.774	79%	0.793	S	S	*	*			trans	46.6	151	137	-81.9	174.6	-177.7	-174.8	-1	119.5
634	N	38.5	Very low	38.9	Very low	120 Å²	120	157.7 Å²	157.7	64%	0.642	79%	0.788	S	S	*	*			cis	-177.6	152.8	-10.3	-115.5	11.3	0	0	0	103.9
635	N	37.2	Very low	38.7	Very low	122 Å²	122	159.9 Å²	159.9	65%	0.652	78%	0.779	S	S	*	*			trans	72.2	119.5	145.4	-64.1	3.5	0	0	0	121.3
636	H	37	Very low	38.4	Very low	160 Å²	160	167.8 Å²	167.8	74%	0.741	79%	0.787	S	S	*	*			trans	65.9	109.8	133.3	-65.3	-46.6	0	0	0	119.1
637	F	36	Very low	38	Very low	283 Å²	283	169.6 Å²	169.6	100%	1.241	78%	0.778	S	S	*	*				-132.4	0	107.6	-95.6	-82.1	0	0	0	110

Retrieved 637 of 637 residues in 1332.4 ms (Link to these results)

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