A0A087YCZ2_POEFO Loading...

Ribosome maturation protein SBDS

Required for the assembly of mature ribosomes and ribosome biogenesis. Together with EFL1, triggers the GTP-dependent release of EIF6 from 60S pre-ribosomes in the cytoplasm, thereby activating ribosomes for translation competence by allowing 80S ribosome assembly and facilitating EIF6 recycling to the nucleus, where it is required for 60S rRNA processing and nuclear export. Required for normal levels of protein synthesis. May play a role in cellular stress resistance. May play a role in cellular response to DNA damage. May play a role in cell proliferation.

AlphaFold DB , UniProt , Accession A0A087YCZ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 249 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.7	Very low	54.8	Low	243 Å²	243	152.7 Å²	152.7	100%	1.197	80%	0.795	S	S	*	*				0	105.9	0	-70.2	-177.6	-166.2	0	0	108.2
2	S	45.7	Very low	55.3	Low	116 Å²	116	145.8 Å²	145.8	81%	0.811	76%	0.76	S	S	*	*			trans	-86.5	115	177.6	40.1	0	0	0	0	109	F4	S2-F4 PolarHBondContact O-N 3.12Å; S2-F4 VanDerWaalsContact O-N 3.12Å
3	I	54.2	Low	55.4	Low	149 Å²	149	143.1 Å²	143.1	76%	0.764	75%	0.753	S	S	*	*			trans	-67.7	108.3	178.3	-63.8	165.1	0	0	0	107.9	T5	I3-T5 VanDerWaalsContact C-N 3.29Å; I3-T5 VanDerWaalsContact CG2-OG1 3.3Å; I3-T5 WeakPolarHBondContact CG2-OG1 3.3Å; I3-T5 PolarHBondContact O-N 3.15Å
4	F	55.9	Low	56	Low	209 Å²	209	142.2 Å²	142.2	92%	0.917	75%	0.749	S	S	*	*			trans	-93.8	55.2	177.5	-161.3	-94.8	0	0	0	109.7	S2	S2-F4 PolarHBondContact O-N 3.12Å; S2-F4 VanDerWaalsContact O-N 3.12Å
5	T	60.7	Low	57.3	Low	92 Å²	92	134.5 Å²	134.5	56%	0.564	71%	0.71	S	S	*	*	S	Bend	trans	-120	140.3	163.9	53.1	0	0	0	0	107.1	I3 T7	I3-T5 VanDerWaalsContact C-N 3.29Å; I3-T5 VanDerWaalsContact CG2-OG1 3.3Å; I3-T5 WeakPolarHBondContact CG2-OG1 3.3Å; I3-T5 PolarHBondContact O-N 3.15Å; T5-T7 PolarHBondContact O-N 2.61Å
6	P	54.3	Low	58.8	Low	127 Å²	127	126.5 Å²	126.5	83%	0.825	67%	0.669	S	S	*	*			trans	-54.6	118.3	169.9	24	-31	0	0	0	106.3	N8	P6-N8 PolarHBondContact O-N 2.71Å
7	T	59.3	Low	60.5	Low	131 Å²	131	119.9 Å²	119.9	80%	0.804	64%	0.635	S	S	*	*			trans	-51.6	122.9	-179.3	-36.2	0	0	0	0	106.3	T5 Q9	T5-T7 PolarHBondContact O-N 2.61Å; T7-Q9 PolarHBondContact O-N 3.37Å
8	N	58.9	Low	62.1	Low	153 Å²	153	113.2 Å²	113.2	82%	0.818	60%	0.599	S	S	*	*			trans	-67.5	73.5	-171.3	-152.5	3.3	0	0	0	109.5	P6 I10	P6-N8 PolarHBondContact O-N 2.71Å; N8-I10 PolarHBondContact O-N 3.45Å
9	Q	56.6	Low	63.6	Low	133 Å²	133	111.2 Å²	111.2	62%	0.621	58%	0.583	S	S	*	*			trans	-87.1	89.7	-175.4	-165.8	178.6	43.4	0	0	106.7	T7 R11	T7-Q9 PolarHBondContact O-N 3.37Å; Q9-R11 VanDerWaalsContact C-N 3.33Å; Q9-R11 HydrophobicContact CG-CG 4.21Å; Q9-R11 PolarHBondContact O-N 3.13Å
10	I	58.6	Low	65	Low	142 Å²	142	106.9 Å²	106.9	73%	0.728	56%	0.56	S	S	*	*			trans	-66	97.6	172	-57	170.7	0	0	0	106.8	N8	N8-I10 PolarHBondContact O-N 3.45Å
11	R	57	Low	66.2	Low	185 Å²	185	109 Å²	109	70%	0.698	57%	0.565	S	S	*	*			trans	-86.7	112.4	171.1	-67.8	-172.8	-176.8	-170.1	1.6	107.3	Q9 T13	Q9-R11 VanDerWaalsContact C-N 3.33Å; Q9-R11 HydrophobicContact CG-CG 4.21Å; Q9-R11 PolarHBondContact O-N 3.13Å; R11-T13 PolarHBondContact O-N 3.27Å
12	L	60.3	Low	68.4	Low	70 Å²	70	100.9 Å²	100.9	37%	0.366	52%	0.522	S	S	.	.			trans	-63.5	107.1	169.1	-66.1	167.2	0	0	0	108.3	V15 A30 V60	L12-V15 HydrophobicContact CB-CG2 3.48Å; L12-V15 VanDerWaalsContact CB-CG2 3.48Å; L12-V15 HydrophobicContact CG-CG2 4.48Å; L12-A30 HydrophobicContact CD1-CB 4.3Å; L12-V60 HydrophobicContact CD1-CG1 4.23Å
13	T	57.4	Low	70	Confident	110 Å²	110	98.7 Å²	98.7	68%	0.675	52%	0.518	S	S	*	.			trans	-87.2	140.7	178	42.5	0	0	0	0	110.1	R11 V15	R11-T13 PolarHBondContact O-N 3.27Å; T13-V15 PolarHBondContact O-N 3.16Å
14	N	63.3	Low	71.5	Confident	131 Å²	131	94.9 Å²	94.9	70%	0.701	52%	0.516	S	S	*	.	S	Bend	trans	59.3	39.6	176.6	-65.5	-25	0	0	0	116.8
15	V	75.9	Confident	73.1	Confident	27 Å²	27	89.4 Å²	89.4	16%	0.164	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	140.5	179.3	-174.7	0	0	0	0	112.4	L12 T13 A30 V60	L12-V15 HydrophobicContact CB-CG2 3.48Å; L12-V15 VanDerWaalsContact CB-CG2 3.48Å; L12-V15 HydrophobicContact CG-CG2 4.48Å; T13-V15 PolarHBondContact O-N 3.16Å; V15-A30 HydrophobicContact CG1-CB 3.57Å; V15-V60 HydrophobicContact CG1-CG1 4.32Å
16	A	81.3	Confident	74.4	Confident	6 Å²	6	91.4 Å²	91.4	5%	0.05	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132	164.5	0	0	0	0	0	109.3	C31 K33 L93	A16-C31 WeakPolarHBondContact CB-O 3.27Å; A16-C31 PolarHBondContact N-O 3.27Å; A16-C31 PolarHBondContact O-N 3.05Å; A16-K33 HydrophobicContact CB-CB 4.28Å; A16-K33 HydrophobicContact CB-CG 3.75Å; A16-L93 HydrophobicContact CB-CD1 4.06Å
17	V	87.6	Confident	76.2	Confident	14 Å²	14	85.3 Å²	85.3	9%	0.085	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.2	-179.1	-177.6	0	0	0	0	108.6	E28 I29 V60 Q94	V17-E28 HydrophobicContact CG1-CB 3.82Å; V17-E28 HydrophobicContact CG1-CG 3.96Å; V17-I29 WeakPolarHBondContact CA-O 3.47Å; V17-V60 HydrophobicContact CG1-CB 4.37Å; V17-V60 HydrophobicContact CG1-CG2 4.1Å; V17-V60 HydrophobicContact CG2-CB 3.95Å; V17-V60 HydrophobicContact CG2-CG1 4.04Å; V17-V60 HydrophobicContact CG2-CG2 4.34Å; V17-Q94 HydrophobicContact CB-CB 4.33Å; V17-Q94 VanDerWaalsContact O-CB 3.28Å; V17-Q94 WeakPolarHBondContact O-CB 3.34Å; V17-Q94 PolarHBondContact O-N 3.23Å
18	V	89.5	Confident	77.7	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.6	168.2	-175.8	0	0	0	0	108.1	E28 I29 V36 I87 L88 E92 L93	V18-E28 VanDerWaalsContact O-CA 3.28Å; V18-E28 WeakPolarHBondContact O-CA 3.47Å; V18-I29 HydrophobicContact CB-CD1 4.01Å; V18-I29 HydrophobicContact CB-CG1 3.68Å; V18-I29 HydrophobicContact CG2-CD1 4.49Å; V18-I29 HydrophobicContact CG2-CG1 4.39Å; V18-I29 PolarHBondContact N-O 3.19Å; V18-I29 PolarHBondContact O-N 3.19Å; V18-V36 HydrophobicContact CG2-CG1 3.8Å; V18-V36 HydrophobicContact CG2-CG2 4.1Å; V18-I87 HydrophobicContact CB-CG2 4.4Å; V18-I87 HydrophobicContact CG1-CG2 4.02Å; V18-I87 WeakPolarHBondContact CG1-O 3.45Å; V18-L88 HydrophobicContact CG2-CD1 4.3Å; V18-E92 WeakPolarHBondContact CA-O 3.23Å; V18-L93 HydrophobicContact CG2-CD1 3.84Å
19	R	89.9	Confident	79.2	Confident	75 Å²	75	72 Å²	72	28%	0.283	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	138.5	-176	164.8	176.9	-73.2	170.5	3.9	110.6	F27 E28 G91 E92	R19-F27 CarbonylContact C-O 3.58Å; R19-F27 WeakPolarHBondContact CA-O 3.48Å; R19-E28 HydrophobicContact CB-CG 4.33Å; R19-E28 IonicContact CZ-OE1 3.87Å; R19-E28 IonicContact NE-OE1 2.61Å; R19-E28 PolarHBondContact NE-OE1 3.05Å; R19-E28 IonicContact NH2-OE1 2.97Å; R19-E28 PolarHBondContact NH2-OE1 2.95Å; R19-G91 CarbonylContact O-C 3.48Å; R19-G91 VanDerWaalsContact O-CA 3.23Å; R19-G91 WeakPolarHBondContact O-CA 3.49Å; R19-E92 PolarHBondContact N-O 3.1Å; R19-E92 PolarHBondContact O-N 3.28Å
20	M	91.4	Very high	80.8	Confident	25 Å²	25	65.7 Å²	65.7	12%	0.123	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.8	167.5	-169.9	179.1	-173.5	0	0	110.2	K22 F27 F75 I87 K90	M20-K22 HydrophobicContact CE-CD 4.06Å; M20-F27 PolarHBondContact N-O 2.76Å; M20-F27 PolarHBondContact O-N 2.99Å; M20-F75 HydrophobicContact CE-CE1 4.47Å; M20-F75 HydrophobicContact SD-CE1 3.78Å; M20-F75 HydrophobicContact SD-CZ 4.09Å; M20-I87 HydrophobicContact CB-CB 4.46Å; M20-I87 HydrophobicContact CB-CG1 4.06Å; M20-I87 HydrophobicContact CB-CG2 4.06Å; M20-I87 HydrophobicContact SD-CG1 3.97Å; M20-K90 HydrophobicContact CE-CB 3.94Å; M20-K90 HydrophobicContact CE-CD 4.34Å; M20-K90 HydrophobicContact SD-CB 4.47Å
21	K	90.6	Very high	82.2	Confident	152 Å²	152	58.9 Å²	58.9	66%	0.661	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	117.5	173.1	-167.6	-178.5	-179.6	-172.3	0	108.9	K25 R26	K21-K25 WeakPolarHBondContact CA-O 3.44Å; K21-R26 HydrophobicContact CG-CG 4.42Å
22	K	87	Confident	83.5	Confident	72 Å²	72	55.3 Å²	55.3	31%	0.313	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	138.6	-179.1	-158.9	177.3	-177.1	-157.9	0	110.1	M20 G24 K25 A74 F75	M20-K22 HydrophobicContact CE-CD 4.06Å; K22-G24 VanDerWaalsContact C-N 3.27Å; K22-G24 PolarHBondContact O-N 2.75Å; K22-K25 PolarHBondContact N-O 2.94Å; K22-K25 PolarHBondContact O-N 3.27Å; K22-K25 VanDerWaalsContact O-N 3.16Å; K22-A74 HydrophobicContact CB-CB 4.45Å; K22-A74 WeakPolarHBondContact CD-O 3.31Å; K22-A74 WeakPolarHBondContact CE-O 3.49Å; K22-A74 PolarHBondContact NZ-O 3.02Å; K22-F75 HydrophobicContact CD-CD1 4.04Å; K22-F75 HydrophobicContact CD-CE1 3.88Å; K22-F75 HydrophobicContact CD-CZ 4.31Å
23	G	80.8	Confident	84.2	Confident	69 Å²	69	55.3 Å²	55.3	71%	0.711	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	33.9	179.3	0	0	0	0	0	114.2	K25	G23-K25 PolarHBondContact O-N 3.2Å; G23-K25 VanDerWaalsContact O-N 3.15Å
24	G	85.3	Confident	85.2	Confident	70 Å²	70	56.8 Å²	56.8	72%	0.722	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-6.2	-178.9	0	0	0	0	0	115.3	K22	K22-G24 VanDerWaalsContact C-N 3.27Å; K22-G24 PolarHBondContact O-N 2.75Å
25	K	88.3	Confident	86	Confident	93 Å²	93	52.4 Å²	52.4	40%	0.404	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	157	177.9	-66	-175.9	178.3	-172.8	0	111.5	K21 K22 G23 F27 D70	K21-K25 WeakPolarHBondContact CA-O 3.44Å; K22-K25 PolarHBondContact N-O 2.94Å; K22-K25 PolarHBondContact O-N 3.27Å; K22-K25 VanDerWaalsContact O-N 3.16Å; G23-K25 PolarHBondContact O-N 3.2Å; G23-K25 VanDerWaalsContact O-N 3.15Å; K25-F27 HydrophobicContact CB-CE2 3.9Å; K25-F27 HydrophobicContact CB-CZ 3.95Å; K25-D70 HydrophobicContact CD-CB 4.06Å; K25-D70 IonicContact NZ-OD1 2.78Å; K25-D70 PolarHBondContact NZ-OD1 3.29Å; K25-D70 IonicContact NZ-OD2 3.31Å; K25-D70 PolarHBondContact NZ-OD2 3.32Å
26	R	89.9	Confident	86.3	Confident	134 Å²	134	51.1 Å²	51.1	51%	0.506	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	134.5	174.1	-65.6	-179.2	179.6	176.7	0.5	108.3	K21	K21-R26 HydrophobicContact CG-CG 4.42Å
27	F	91.4	Very high	86.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.9	174.8	-59.6	-81.1	0	0	0	108.3	R19 M20 K25 V56 F57 A66 D70 L71 A74 F75 I87	R19-F27 CarbonylContact C-O 3.58Å; R19-F27 WeakPolarHBondContact CA-O 3.48Å; M20-F27 PolarHBondContact N-O 2.76Å; M20-F27 PolarHBondContact O-N 2.99Å; K25-F27 HydrophobicContact CB-CE2 3.9Å; K25-F27 HydrophobicContact CB-CZ 3.95Å; F27-V56 HydrophobicContact CB-CG1 3.91Å; F27-V56 HydrophobicContact CD1-CG1 3.91Å; F27-V56 HydrophobicContact CG-CG1 4.34Å; F27-F57 CarbonylContact C-O 3.5Å; F27-F57 WeakPolarHBondContact CA-O 3.34Å; F27-A66 HydrophobicContact CD1-CB 4Å; F27-A66 HydrophobicContact CE1-CB 4.01Å; F27-D70 HydrophobicContact CE1-CB 4.47Å; F27-D70 HydrophobicContact CZ-CB 4.45Å; F27-L71 HydrophobicContact CD1-CD2 3.89Å; F27-L71 HydrophobicContact CE1-CD2 3.75Å; F27-A74 HydrophobicContact CE2-CB 3.51Å; F27-A74 HydrophobicContact CZ-CB 3.68Å; F27-F75 HydrophobicContact CB-CE2 4.45Å; F27-F75 HydrophobicContact CB-CZ 4.47Å; F27-F75 HydrophobicContact CD1-CE2 4.23Å; F27-F75 AromaticContact CD2-CE2 3.58Å; F27-F75 HydrophobicContact CD2-CE2 3.58Å; F27-F75 AromaticContact CD2-CZ 3.95Å; F27-F75 HydrophobicContact CD2-CZ 3.95Å; F27-F75 HydrophobicContact CE1-CE2 4.37Å; F27-F75 AromaticContact CE2-CE2 3.75Å; F27-F75 HydrophobicContact CE2-CE2 3.75Å; F27-F75 HydrophobicContact CE2-CZ 4.45Å; F27-F75 AromaticContact CG-CE2 3.82Å; F27-F75 HydrophobicContact CG-CE2 3.82Å; F27-F75 HydrophobicContact CG-CZ 4.25Å; F27-F75 HydrophobicContact CZ-CE2 4.14Å; F27-I87 HydrophobicContact CB-CD1 3.84Å
28	E	91	Very high	86	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.019	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	142.1	-174.4	-66.1	-176.5	174.8	0	0	109	V17 V18 R19 F57 N59 V60	V17-E28 HydrophobicContact CG1-CB 3.82Å; V17-E28 HydrophobicContact CG1-CG 3.96Å; V18-E28 VanDerWaalsContact O-CA 3.28Å; V18-E28 WeakPolarHBondContact O-CA 3.47Å; R19-E28 HydrophobicContact CB-CG 4.33Å; R19-E28 IonicContact CZ-OE1 3.87Å; R19-E28 IonicContact NE-OE1 2.61Å; R19-E28 PolarHBondContact NE-OE1 3.05Å; R19-E28 IonicContact NH2-OE1 2.97Å; R19-E28 PolarHBondContact NH2-OE1 2.95Å; E28-F57 PolarHBondContact N-O 2.78Å; E28-F57 WeakPolarHBondContact O-CA 3.43Å; E28-F57 PolarHBondContact O-N 3.05Å; E28-N59 VanDerWaalsContact OE2-CA 3.31Å; E28-N59 WeakPolarHBondContact OE2-CA 3.35Å; E28-V60 HydrophobicContact CB-CG2 3.69Å; E28-V60 PolarHBondContact OE2-N 2.89Å
29	I	90.8	Very high	85.8	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	148.5	175.3	58.1	172.7	0	0	0	110.1	V17 V18 L51 V56 I87 L88	V17-I29 WeakPolarHBondContact CA-O 3.47Å; V18-I29 HydrophobicContact CB-CD1 4.01Å; V18-I29 HydrophobicContact CB-CG1 3.68Å; V18-I29 HydrophobicContact CG2-CD1 4.49Å; V18-I29 HydrophobicContact CG2-CG1 4.39Å; V18-I29 PolarHBondContact N-O 3.19Å; V18-I29 PolarHBondContact O-N 3.19Å; I29-L51 HydrophobicContact CD1-CD2 4.05Å; I29-V56 HydrophobicContact CG2-CG2 4.35Å; I29-I87 HydrophobicContact CD1-CB 4.1Å; I29-I87 HydrophobicContact CD1-CG2 3.74Å; I29-I87 HydrophobicContact CG1-CG2 3.74Å; I29-I87 HydrophobicContact CG2-CB 4.35Å; I29-I87 HydrophobicContact CG2-CD1 3.94Å; I29-I87 HydrophobicContact CG2-CG2 4.12Å; I29-L88 HydrophobicContact CD1-CB 4.17Å; I29-L88 HydrophobicContact CD1-CD1 3.69Å
30	A	88.8	Confident	85.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.5	178.2	0	0	0	0	0	109.9	L12 V15 Q52 V60	L12-A30 HydrophobicContact CD1-CB 4.3Å; V15-A30 HydrophobicContact CG1-CB 3.57Å; A30-Q52 HydrophobicContact CB-CB 4.44Å; A30-Q52 PolarHBondContact O-N 3.13Å; A30-V60 HydrophobicContact CB-CG1 4.16Å
31	C	88	Confident	84.8	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	161	-178	-50.7	0	0	0	0	111.5	A16 V36 V50 L51	A16-C31 WeakPolarHBondContact CB-O 3.27Å; A16-C31 PolarHBondContact N-O 3.27Å; A16-C31 PolarHBondContact O-N 3.05Å; C31-V36 HydrophobicContact CB-CG2 3.39Å; C31-V50 CarbonylContact C-O 3.47Å; C31-V50 VanDerWaalsContact CA-O 3.31Å; C31-V50 WeakPolarHBondContact CA-O 3.28Å; C31-V50 WeakPolarHBondContact CB-O 3.28Å; C31-L51 VanDerWaalsContact SG-CD2 3.5Å
32	Y	85	Confident	84.3	Confident	110 Å²	110	58.8 Å²	58.8	43%	0.431	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.3	166.9	-68.1	-77.4	0	0	0	110.9	N34 K35 E49 V50 Q52	Y32-N34 PolarHBondContact O-N 3.03Å; Y32-K35 PolarHBondContact O-N 3.45Å; Y32-E49 VanDerWaalsContact CD2-O 3.23Å; Y32-E49 WeakPolarHBondContact CD2-O 3.48Å; Y32-V50 PolarHBondContact N-O 3.32Å; Y32-Q52 HydrophobicContact CD1-CG 4.05Å; Y32-Q52 HydrophobicContact CD2-CG 3.92Å; Y32-Q52 HydrophobicContact CE1-CG 3.77Å; Y32-Q52 VanDerWaalsContact CE1-NE2 3.28Å; Y32-Q52 HydrophobicContact CE2-CB 4.5Å; Y32-Q52 HydrophobicContact CE2-CG 3.65Å; Y32-Q52 HydrophobicContact CG-CG 4.13Å
33	K	75.3	Confident	83.9	Confident	69 Å²	69	60.8 Å²	60.8	30%	0.3	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-45.4	-171.9	-68.9	173.2	165.4	-145.4	0	115.3	A16 K35 E99	A16-K33 HydrophobicContact CB-CB 4.28Å; A16-K33 HydrophobicContact CB-CG 3.75Å; K33-K35 VanDerWaalsContact C-N 3.3Å; K33-K35 PolarHBondContact O-N 3.28Å; K33-E99 WeakPolarHBondContact CD-OE1 3.48Å; K33-E99 WeakPolarHBondContact CE-OE1 3.34Å; K33-E99 IonicContact NZ-OE1 3.26Å; K33-E99 PolarHBondContact NZ-OE1 3.49Å
34	N	77.9	Confident	83.6	Confident	142 Å²	142	59.5 Å²	59.5	76%	0.759	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-14.1	-174.2	-63.1	-13.8	0	0	0	113	Y32 S38	Y32-N34 PolarHBondContact O-N 3.03Å; N34-S38 PolarHBondContact O-OG 3.38Å
35	K	81	Confident	83.1	Confident	39 Å²	39	64.2 Å²	64.2	17%	0.17	32%	0.315	C	S	.	.	H	α-helix	trans	-98.1	-22.7	-168.5	-68.1	-169.8	161.8	-174.4	0	114.5	Y32 K33 M37 S38 W39 E44 E49 V50	Y32-K35 PolarHBondContact O-N 3.45Å; K33-K35 VanDerWaalsContact C-N 3.3Å; K33-K35 PolarHBondContact O-N 3.28Å; K35-M37 VanDerWaalsContact C-N 3.26Å; K35-M37 PolarHBondContact O-N 3.24Å; K35-S38 PolarHBondContact O-N 3.07Å; K35-W39 PolarHBondContact O-N 2.96Å; K35-E44 WeakPolarHBondContact CB-OE2 3.31Å; K35-E44 VanDerWaalsContact CD-OE2 3.27Å; K35-E44 WeakPolarHBondContact CD-OE2 3.21Å; K35-E44 WeakPolarHBondContact CE-OE1 3.45Å; K35-E44 VanDerWaalsContact CG-OE2 3.31Å; K35-E44 WeakPolarHBondContact CG-OE2 3.4Å; K35-E49 HydrophobicContact CD-CB 4.36Å; K35-E49 WeakPolarHBondContact CD-O 3.28Å; K35-E49 VanDerWaalsContact NZ-CB 3.27Å; K35-E49 PolarHBondContact NZ-O 2.9Å; K35-E49 IonicContact NZ-OE1 3.06Å; K35-E49 PolarHBondContact NZ-OE1 3.17Å; K35-E49 IonicContact NZ-OE2 3.33Å; K35-V50 HydrophobicContact CB-CB 4.36Å; K35-V50 HydrophobicContact CB-CG1 4.16Å; K35-V50 HydrophobicContact CB-CG2 4.17Å
36	V	81.2	Confident	82.9	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.7	-37.5	176	-176.2	0	0	0	0	111.4	V18 C31 R40 L88 L93	V18-V36 HydrophobicContact CG2-CG1 3.8Å; V18-V36 HydrophobicContact CG2-CG2 4.1Å; C31-V36 HydrophobicContact CB-CG2 3.39Å; V36-R40 WeakPolarHBondContact O-CG 3.16Å; V36-R40 PolarHBondContact O-N 3.2Å; V36-L88 HydrophobicContact CG1-CD1 4.28Å; V36-L88 HydrophobicContact CG2-CD1 4.41Å; V36-L93 HydrophobicContact CB-CD1 4.25Å; V36-L93 HydrophobicContact CB-CD2 4.43Å; V36-L93 HydrophobicContact CG1-CD1 4.1Å; V36-L93 HydrophobicContact CG1-CD2 4.34Å; V36-L93 HydrophobicContact CG2-CD1 4.2Å
37	M	79.8	Confident	82.5	Confident	102 Å²	102	59.3 Å²	59.3	50%	0.502	30%	0.303	S	S	.	.	H	α-helix	trans	-69	-44.5	174.1	-73.1	-159.6	-161.9	0	0	111.9	K35 W39 R40 S41	K35-M37 VanDerWaalsContact C-N 3.26Å; K35-M37 PolarHBondContact O-N 3.24Å; M37-W39 VanDerWaalsContact C-N 3.26Å; M37-W39 PolarHBondContact O-N 3.05Å; M37-R40 WeakPolarHBondContact O-CB 3.02Å; M37-R40 PolarHBondContact O-N 3.46Å; M37-S41 PolarHBondContact O-N 2.8Å; M37-S41 PolarHBondContact O-OG 2.64Å
38	S	83.3	Confident	82.1	Confident	31 Å²	31	65 Å²	65	22%	0.217	33%	0.334	C	S	.	.	H	α-helix	trans	-58.7	-36.4	177.3	-54.9	0	0	0	0	113	N34 K35 S41 G42 T43 E44	N34-S38 PolarHBondContact O-OG 3.38Å; K35-S38 PolarHBondContact O-N 3.07Å; S38-S41 VanDerWaalsContact CA-OG 3.31Å; S38-S41 WeakPolarHBondContact CA-OG 3.42Å; S38-S41 PolarHBondContact O-OG 2.85Å; S38-G42 PolarHBondContact O-N 2.8Å; S38-G42 VanDerWaalsContact O-N 3.11Å; S38-T43 PolarHBondContact O-N 2.78Å; S38-E44 PolarHBondContact O-N 2.81Å
39	W	84.8	Confident	81.7	Confident	51 Å²	51	69.3 Å²	69.3	19%	0.193	35%	0.354	C	S	.	.	H	α-helix	trans	-65.1	-41.5	173.2	-175.4	-90.6	0	0	0	112.1	K35 M37 G42 K45 L47 V50 L88	K35-W39 PolarHBondContact O-N 2.96Å; M37-W39 VanDerWaalsContact C-N 3.26Å; M37-W39 PolarHBondContact O-N 3.05Å; W39-G42 PolarHBondContact O-N 2.88Å; W39-G42 VanDerWaalsContact O-N 3.17Å; W39-K45 WeakPolarHBondContact CH2-O 3.41Å; W39-K45 VanDerWaalsContact CZ3-O 3.22Å; W39-K45 WeakPolarHBondContact CZ3-O 3.36Å; W39-L47 HydrophobicContact CH2-CD1 3.71Å; W39-L47 HydrophobicContact CH2-CG 3.88Å; W39-L47 HydrophobicContact CZ2-CD1 4.41Å; W39-L47 HydrophobicContact CZ3-CD1 4.41Å; W39-L47 HydrophobicContact CZ3-CG 4.23Å; W39-V50 HydrophobicContact CB-CG2 4.35Å; W39-V50 HydrophobicContact CD2-CG2 4.46Å; W39-V50 HydrophobicContact CE3-CG2 3.74Å; W39-V50 HydrophobicContact CZ3-CG2 4.42Å; W39-L88 HydrophobicContact CB-CD2 4.06Å; W39-L88 HydrophobicContact CD2-CD2 3.55Å; W39-L88 HydrophobicContact CE3-CD2 4.33Å; W39-L88 HydrophobicContact CG-CD2 3.35Å; W39-L88 HydrophobicContact CG-CG 4.14Å; W39-L88 HydrophobicContact CZ2-CD2 4.46Å
40	R	81.6	Confident	81.4	Confident	123 Å²	123	69.3 Å²	69.3	46%	0.464	35%	0.354	S	S	.	.	H	α-helix	trans	-70.8	-32.9	178.3	-71.9	-178.4	-178	-160	-3.5	112.9	V36 M37 G42 G91	V36-R40 WeakPolarHBondContact O-CG 3.16Å; V36-R40 PolarHBondContact O-N 3.2Å; M37-R40 WeakPolarHBondContact O-CB 3.02Å; M37-R40 PolarHBondContact O-N 3.46Å; R40-G42 PolarHBondContact O-N 2.93Å; R40-G91 PolarHBondContact NH2-O 3.14Å
41	S	79.1	Confident	81.3	Confident	82 Å²	82	69.5 Å²	69.5	57%	0.573	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-9	172	61	0	0	0	0	112.9	M37 S38 T43	M37-S41 PolarHBondContact O-N 2.8Å; M37-S41 PolarHBondContact O-OG 2.64Å; S38-S41 VanDerWaalsContact CA-OG 3.31Å; S38-S41 WeakPolarHBondContact CA-OG 3.42Å; S38-S41 PolarHBondContact O-OG 2.85Å; S41-T43 VanDerWaalsContact C-N 3.33Å; S41-T43 PolarHBondContact OG-OG1 2.73Å
42	G	79.9	Confident	81.1	Confident	44 Å²	44	71.9 Å²	71.9	45%	0.454	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	14.8	178.9	0	0	0	0	0	114.5	S38 W39 R40	S38-G42 PolarHBondContact O-N 2.8Å; S38-G42 VanDerWaalsContact O-N 3.11Å; W39-G42 PolarHBondContact O-N 2.88Å; W39-G42 VanDerWaalsContact O-N 3.17Å; R40-G42 PolarHBondContact O-N 2.93Å
43	T	79.3	Confident	81.2	Confident	113 Å²	113	69 Å²	69	69%	0.693	36%	0.36	S	S	*	.	S	Bend	trans	-78.1	-40	-178.3	-49.5	0	0	0	0	111.8	S38 S41	S38-T43 PolarHBondContact O-N 2.78Å; S41-T43 VanDerWaalsContact C-N 3.33Å; S41-T43 PolarHBondContact OG-OG1 2.73Å
44	E	73.3	Confident	81.7	Confident	42 Å²	42	68.8 Å²	68.8	20%	0.196	36%	0.36	C	S	.	.			trans	-106	136.6	175.5	-72.4	-179.8	-168.9	0	0	110.4	K35 S38	K35-E44 WeakPolarHBondContact CB-OE2 3.31Å; K35-E44 VanDerWaalsContact CD-OE2 3.27Å; K35-E44 WeakPolarHBondContact CD-OE2 3.21Å; K35-E44 WeakPolarHBondContact CE-OE1 3.45Å; K35-E44 VanDerWaalsContact CG-OE2 3.31Å; K35-E44 WeakPolarHBondContact CG-OE2 3.4Å; S38-E44 PolarHBondContact O-N 2.81Å
45	K	76.6	Confident	82.1	Confident	169 Å²	169	63.2 Å²	63.2	74%	0.735	33%	0.332	S	S	*	.			trans	-118.7	-7.5	-178.6	-65.9	-177.5	-177.6	175.5	0	114.2	W39	W39-K45 WeakPolarHBondContact CH2-O 3.41Å; W39-K45 VanDerWaalsContact CZ3-O 3.22Å; W39-K45 WeakPolarHBondContact CZ3-O 3.36Å
46	D	82.6	Confident	82.5	Confident	104 Å²	104	61.4 Å²	61.4	56%	0.556	32%	0.324	S	S	*	.			trans	-93.1	122.8	-178.9	-64.4	-61.3	0	0	0	111.6	E49 V50	D46-E49 HydrophobicContact CB-CB 4.46Å; D46-E49 PolarHBondContact O-N 3Å; D46-V50 WeakPolarHBondContact O-CG2 3.39Å
47	L	81	Confident	82.9	Confident	21 Å²	21	62.3 Å²	62.3	11%	0.11	33%	0.328	C	S	.	.	H	α-helix	trans	-72.3	-32.7	-177.9	-87.1	111.9	0	0	0	113.7	W39 E49 V50 L51 K85	W39-L47 HydrophobicContact CH2-CD1 3.71Å; W39-L47 HydrophobicContact CH2-CG 3.88Å; W39-L47 HydrophobicContact CZ2-CD1 4.41Å; W39-L47 HydrophobicContact CZ3-CD1 4.41Å; W39-L47 HydrophobicContact CZ3-CG 4.23Å; L47-E49 PolarHBondContact O-N 3.39Å; L47-V50 PolarHBondContact O-N 2.7Å; L47-V50 VanDerWaalsContact O-N 3.17Å; L47-L51 HydrophobicContact CB-CD1 4.47Å; L47-L51 HydrophobicContact CD2-CD1 3.69Å; L47-L51 HydrophobicContact CD2-CG 4.36Å; L47-L51 WeakPolarHBondContact O-CB 3.19Å; L47-L51 PolarHBondContact O-N 3.17Å; L47-K85 HydrophobicContact CD1-CD 4.08Å; L47-K85 HydrophobicContact CD1-CG 3.85Å; L47-K85 HydrophobicContact CD2-CG 3.68Å; L47-K85 HydrophobicContact CG-CG 4.34Å
48	D	83.3	Confident	83.5	Confident	120 Å²	120	60 Å²	60	64%	0.642	32%	0.319	S	S	*	.	H	α-helix	trans	-62.3	-30.2	177.5	-68.8	-69	0	0	0	111.8	H54	D48-H54 IonicContact OD1-CE1 3.84Å; D48-H54 PolarHBondContact OD1-CE1 3.4Å; D48-H54 IonicContact OD1-NE2 3.66Å; D48-H54 PolarHBondContact OD1-NE2 3.4Å
49	E	83.4	Confident	83.6	Confident	93 Å²	93	60.4 Å²	60.4	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-75.3	-35	176.6	-107.1	-158.4	121.3	0	0	112.1	Y32 K35 D46 L47	Y32-E49 VanDerWaalsContact CD2-O 3.23Å; Y32-E49 WeakPolarHBondContact CD2-O 3.48Å; K35-E49 HydrophobicContact CD-CB 4.36Å; K35-E49 WeakPolarHBondContact CD-O 3.28Å; K35-E49 VanDerWaalsContact NZ-CB 3.27Å; K35-E49 PolarHBondContact NZ-O 2.9Å; K35-E49 IonicContact NZ-OE1 3.06Å; K35-E49 PolarHBondContact NZ-OE1 3.17Å; K35-E49 IonicContact NZ-OE2 3.33Å; D46-E49 HydrophobicContact CB-CB 4.46Å; D46-E49 PolarHBondContact O-N 3Å; L47-E49 PolarHBondContact O-N 3.39Å
50	V	85.3	Confident	83.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-86.1	-40.2	-174.7	-176.4	0	0	0	0	112	C31 Y32 K35 W39 D46 L47 L88	C31-V50 CarbonylContact C-O 3.47Å; C31-V50 VanDerWaalsContact CA-O 3.31Å; C31-V50 WeakPolarHBondContact CA-O 3.28Å; C31-V50 WeakPolarHBondContact CB-O 3.28Å; Y32-V50 PolarHBondContact N-O 3.32Å; K35-V50 HydrophobicContact CB-CB 4.36Å; K35-V50 HydrophobicContact CB-CG1 4.16Å; K35-V50 HydrophobicContact CB-CG2 4.17Å; W39-V50 HydrophobicContact CB-CG2 4.35Å; W39-V50 HydrophobicContact CD2-CG2 4.46Å; W39-V50 HydrophobicContact CE3-CG2 3.74Å; W39-V50 HydrophobicContact CZ3-CG2 4.42Å; D46-V50 WeakPolarHBondContact O-CG2 3.39Å; L47-V50 PolarHBondContact O-N 2.7Å; L47-V50 VanDerWaalsContact O-N 3.17Å; V50-L88 HydrophobicContact CG1-CD1 4.08Å; V50-L88 HydrophobicContact CG1-CD2 3.87Å
51	L	86.4	Confident	83.5	Confident	5 Å²	5	57.9 Å²	57.9	3%	0.026	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-91.2	138.9	-177.5	-59.6	-177.9	0	0	0	110.8	I29 C31 L47 C84 L88	I29-L51 HydrophobicContact CD1-CD2 4.05Å; C31-L51 VanDerWaalsContact SG-CD2 3.5Å; L47-L51 HydrophobicContact CB-CD1 4.47Å; L47-L51 HydrophobicContact CD2-CD1 3.69Å; L47-L51 HydrophobicContact CD2-CG 4.36Å; L47-L51 WeakPolarHBondContact O-CB 3.19Å; L47-L51 PolarHBondContact O-N 3.17Å; L51-C84 HydrophobicContact CD1-CB 3.7Å; L51-L88 HydrophobicContact CD2-CD1 4.36Å
52	Q	84.2	Confident	83.6	Confident	49 Å²	49	61.3 Å²	61.3	23%	0.229	33%	0.332	C	S	.	.	S	Bend	trans	-80.3	-28.2	168.2	-71.6	-164.6	-11	0	0	112.1	A30 Y32	A30-Q52 HydrophobicContact CB-CB 4.44Å; A30-Q52 PolarHBondContact O-N 3.13Å; Y32-Q52 HydrophobicContact CD1-CG 4.05Å; Y32-Q52 HydrophobicContact CD2-CG 3.92Å; Y32-Q52 HydrophobicContact CE1-CG 3.77Å; Y32-Q52 VanDerWaalsContact CE1-NE2 3.28Å; Y32-Q52 HydrophobicContact CE2-CB 4.5Å; Y32-Q52 HydrophobicContact CE2-CG 3.65Å; Y32-Q52 HydrophobicContact CG-CG 4.13Å
53	T	85.2	Confident	83.7	Confident	49 Å²	49	61.4 Å²	61.4	30%	0.301	33%	0.333	S	S	.	.			trans	-150.6	137.4	-178.5	-51	0	0	0	0	108.9	S55	T53-S55 PolarHBondContact O-N 3.4Å
54	H	85.8	Confident	84.1	Confident	66 Å²	66	61 Å²	61	31%	0.306	32%	0.324	S	S	.	.	S	Bend	trans	-76.2	19.9	177.4	-65.6	167.6	0	0	0	114.4	D48 Q80	D48-H54 IonicContact OD1-CE1 3.84Å; D48-H54 PolarHBondContact OD1-CE1 3.4Å; D48-H54 IonicContact OD1-NE2 3.66Å; D48-H54 PolarHBondContact OD1-NE2 3.4Å; H54-Q80 WeakPolarHBondContact O-CB 3.46Å; H54-Q80 PolarHBondContact O-OE1 3.25Å
55	S	87.4	Confident	84.8	Confident	24 Å²	24	64.1 Å²	64.1	17%	0.168	34%	0.34	C	S	.	.			trans	-110.7	139	-177.4	-65	0	0	0	0	111.7	T53 F57 Q80	T53-S55 PolarHBondContact O-N 3.4Å; S55-F57 VanDerWaalsContact O-CD2 3.3Å; S55-F57 WeakPolarHBondContact O-CD2 3.23Å; S55-F57 VanDerWaalsContact O-CE2 3.24Å; S55-F57 WeakPolarHBondContact O-CE2 3.1Å; S55-Q80 PolarHBondContact OG-OE1 3.47Å
56	V	89.7	Confident	85.4	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.006	31%	0.308	C	S	.	.			trans	-90	130	176.2	-175.4	0	0	0	0	109.4	F27 I29 A66 L71 I83 I87	F27-V56 HydrophobicContact CB-CG1 3.91Å; F27-V56 HydrophobicContact CD1-CG1 3.91Å; F27-V56 HydrophobicContact CG-CG1 4.34Å; I29-V56 HydrophobicContact CG2-CG2 4.35Å; V56-A66 HydrophobicContact CB-CB 4.5Å; V56-A66 HydrophobicContact CG1-CB 4.32Å; V56-A66 WeakPolarHBondContact O-CB 3.47Å; V56-A66 PolarHBondContact O-N 3.36Å; V56-L71 HydrophobicContact CB-CD2 4.05Å; V56-L71 HydrophobicContact CG1-CD2 3.93Å; V56-L71 HydrophobicContact CG2-CD2 4.39Å; V56-I83 HydrophobicContact CG2-CB 4.23Å; V56-I83 HydrophobicContact CG2-CG2 3.8Å; V56-I87 HydrophobicContact CG1-CD1 3.84Å; V56-I87 HydrophobicContact CG2-CD1 4.37Å
57	F	90.2	Very high	85.7	Confident	19 Å²	19	58.6 Å²	58.6	8%	0.083	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	154	178.9	-61.3	-86.9	0	0	0	110.7	F27 E28 S55 V60 Q64 M65	F27-F57 CarbonylContact C-O 3.5Å; F27-F57 WeakPolarHBondContact CA-O 3.34Å; E28-F57 PolarHBondContact N-O 2.78Å; E28-F57 WeakPolarHBondContact O-CA 3.43Å; E28-F57 PolarHBondContact O-N 3.05Å; S55-F57 VanDerWaalsContact O-CD2 3.3Å; S55-F57 WeakPolarHBondContact O-CD2 3.23Å; S55-F57 VanDerWaalsContact O-CE2 3.24Å; S55-F57 WeakPolarHBondContact O-CE2 3.1Å; F57-V60 HydrophobicContact CB-CG2 3.9Å; F57-V60 HydrophobicContact CD2-CG2 3.96Å; F57-V60 HydrophobicContact CG-CG2 4.13Å; F57-Q64 CarbonylContact C-O 3.55Å; F57-Q64 VanDerWaalsContact CA-O 3.28Å; F57-Q64 WeakPolarHBondContact CA-O 3.44Å; F57-Q64 WeakPolarHBondContact CB-O 3.33Å; F57-M65 HydrophobicContact CD1-CG 3.92Å; F57-M65 HydrophobicContact CE1-CG 3.69Å
58	V	90.6	Very high	86	Confident	53 Å²	53	64.7 Å²	64.7	32%	0.321	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-34.2	161.5	179.1	0	0	0	0	109.7	Q64 A66	V58-Q64 PolarHBondContact N-O 3.46Å; V58-A66 HydrophobicContact CG2-CB 4.13Å
59	N	85.4	Confident	86.2	Confident	40 Å²	40	64.4 Å²	64.4	21%	0.214	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	114.3	176.1	-170.5	-57.3	0	0	0	110.2	E28 S61 K62 G63 Q64	E28-N59 VanDerWaalsContact OE2-CA 3.31Å; E28-N59 WeakPolarHBondContact OE2-CA 3.35Å; N59-S61 WeakPolarHBondContact OD1-CB 3.48Å; N59-S61 PolarHBondContact OD1-N 3.07Å; N59-K62 HydrophobicContact CB-CB 4.2Å; N59-K62 PolarHBondContact OD1-N 3.29Å; N59-G63 PolarHBondContact O-N 2.86Å; N59-G63 VanDerWaalsContact O-N 3.13Å; N59-Q64 PolarHBondContact N-O 3.27Å; N59-Q64 PolarHBondContact O-N 2.93Å
60	V	84.6	Confident	86.4	Confident	11 Å²	11	61.3 Å²	61.3	7%	0.067	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-41.4	-178.7	174.1	0	0	0	0	111.1	L12 V15 V17 E28 A30 F57 K62 G63	L12-V60 HydrophobicContact CD1-CG1 4.23Å; V15-V60 HydrophobicContact CG1-CG1 4.32Å; V17-V60 HydrophobicContact CG1-CB 4.37Å; V17-V60 HydrophobicContact CG1-CG2 4.1Å; V17-V60 HydrophobicContact CG2-CB 3.95Å; V17-V60 HydrophobicContact CG2-CG1 4.04Å; V17-V60 HydrophobicContact CG2-CG2 4.34Å; E28-V60 HydrophobicContact CB-CG2 3.69Å; E28-V60 PolarHBondContact OE2-N 2.89Å; A30-V60 HydrophobicContact CB-CG1 4.16Å; F57-V60 HydrophobicContact CB-CG2 3.9Å; F57-V60 HydrophobicContact CD2-CG2 3.96Å; F57-V60 HydrophobicContact CG-CG2 4.13Å; V60-K62 PolarHBondContact O-N 3.12Å; V60-G63 PolarHBondContact O-N 3.41Å
61	S	80.1	Confident	86.4	Confident	111 Å²	111	61.3 Å²	61.3	78%	0.776	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-30	-179.7	-51.1	0	0	0	0	113.3	N59	N59-S61 WeakPolarHBondContact OD1-CB 3.48Å; N59-S61 PolarHBondContact OD1-N 3.07Å
62	K	81.4	Confident	86.6	Confident	153 Å²	153	64.6 Å²	64.6	67%	0.665	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-3.9	176.6	-63.2	-175.8	179.8	-175.7	0	113.5	N59 V60 Q64	N59-K62 HydrophobicContact CB-CB 4.2Å; N59-K62 PolarHBondContact OD1-N 3.29Å; V60-K62 PolarHBondContact O-N 3.12Å; K62-Q64 HydrophobicContact CB-CG 3.96Å; K62-Q64 PolarHBondContact O-N 3.16Å
63	G	82.3	Confident	86.8	Confident	46 Å²	46	70.6 Å²	70.6	47%	0.474	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	24.3	-175	0	0	0	0	0	114.2	N59 V60 M65	N59-G63 PolarHBondContact O-N 2.86Å; N59-G63 VanDerWaalsContact O-N 3.13Å; V60-G63 PolarHBondContact O-N 3.41Å; G63-M65 PolarHBondContact O-N 2.88Å
64	Q	87	Confident	86.8	Confident	104 Å²	104	68.8 Å²	68.8	49%	0.486	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	109.5	-177	-72	-177	-8.4	0	0	110.3	F57 V58 N59 K62	F57-Q64 CarbonylContact C-O 3.55Å; F57-Q64 VanDerWaalsContact CA-O 3.28Å; F57-Q64 WeakPolarHBondContact CA-O 3.44Å; F57-Q64 WeakPolarHBondContact CB-O 3.33Å; V58-Q64 PolarHBondContact N-O 3.46Å; N59-Q64 PolarHBondContact N-O 3.27Å; N59-Q64 PolarHBondContact O-N 2.93Å; K62-Q64 HydrophobicContact CB-CG 3.96Å; K62-Q64 PolarHBondContact O-N 3.16Å
65	M	88.6	Confident	86.8	Confident	108 Å²	108	66.5 Å²	66.5	53%	0.532	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	146.9	178.4	-65.5	179.2	72.8	0	0	112.4	F57 G63	F57-M65 HydrophobicContact CD1-CG 3.92Å; F57-M65 HydrophobicContact CE1-CG 3.69Å; G63-M65 PolarHBondContact O-N 2.88Å
66	A	88.2	Confident	86.7	Confident	9 Å²	9	68.5 Å²	68.5	7%	0.074	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-74.6	137.6	173.1	0	0	0	0	0	111.3	F27 V56 V58 L71	F27-A66 HydrophobicContact CD1-CB 4Å; F27-A66 HydrophobicContact CE1-CB 4.01Å; V56-A66 HydrophobicContact CB-CB 4.5Å; V56-A66 HydrophobicContact CG1-CB 4.32Å; V56-A66 WeakPolarHBondContact O-CB 3.47Å; V56-A66 PolarHBondContact O-N 3.36Å; V58-A66 HydrophobicContact CG2-CB 4.13Å; A66-L71 HydrophobicContact CB-CD1 4.36Å; A66-L71 HydrophobicContact CB-CD2 3.91Å; A66-L71 HydrophobicContact CB-CG 4.08Å
67	K	90.4	Very high	86.5	Confident	148 Å²	148	70 Å²	70	64%	0.643	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-72.3	145.3	174.1	-66.7	-174.4	179.1	-175.4	0	110.2	D69 D70 L71	K67-D69 VanDerWaalsContact C-N 3.26Å; K67-D69 PolarHBondContact O-N 2.67Å; K67-D70 WeakPolarHBondContact O-CB 3.3Å; K67-D70 PolarHBondContact O-N 3.01Å; K67-L71 PolarHBondContact O-N 2.8Å
68	K	86.6	Confident	86.1	Confident	150 Å²	150	71.1 Å²	71.1	65%	0.652	40%	0.398	S	S	*	.	H	α-helix	trans	-56.2	-39.9	178.6	-68.3	-174.7	178.2	-178.7	0	112.3	D70 L71 V72	K68-D70 PolarHBondContact O-N 3.03Å; K68-L71 WeakPolarHBondContact O-CB 3.24Å; K68-L71 PolarHBondContact O-N 3.1Å; K68-V72 WeakPolarHBondContact O-CG2 3.47Å; K68-V72 PolarHBondContact O-N 2.83Å
69	D	88.4	Confident	85.9	Confident	113 Å²	113	72.1 Å²	72.1	60%	0.604	40%	0.402	S	S	*	.	H	α-helix	trans	-60.7	-34.6	178.3	-55.5	-22	0	0	0	113	K67 K73	K67-D69 VanDerWaalsContact C-N 3.26Å; K67-D69 PolarHBondContact O-N 2.67Å; D69-K73 WeakPolarHBondContact O-CB 3.25Å; D69-K73 VanDerWaalsContact O-CG 3.27Å; D69-K73 WeakPolarHBondContact O-CG 3.47Å; D69-K73 PolarHBondContact O-N 2.9Å; D69-K73 VanDerWaalsContact O-N 3.13Å
70	D	87.2	Confident	85.9	Confident	28 Å²	28	72.4 Å²	72.4	15%	0.15	40%	0.402	C	S	.	.	H	α-helix	trans	-77.1	-34.7	-179.7	-69	-20.1	0	0	0	111.7	K25 F27 K67 K68 A74	K25-D70 HydrophobicContact CD-CB 4.06Å; K25-D70 IonicContact NZ-OD1 2.78Å; K25-D70 PolarHBondContact NZ-OD1 3.29Å; K25-D70 IonicContact NZ-OD2 3.31Å; K25-D70 PolarHBondContact NZ-OD2 3.32Å; F27-D70 HydrophobicContact CE1-CB 4.47Å; F27-D70 HydrophobicContact CZ-CB 4.45Å; K67-D70 WeakPolarHBondContact O-CB 3.3Å; K67-D70 PolarHBondContact O-N 3.01Å; K68-D70 PolarHBondContact O-N 3.03Å; D70-A74 VanDerWaalsContact O-CB 3.31Å; D70-A74 WeakPolarHBondContact O-CB 3.46Å; D70-A74 PolarHBondContact O-N 2.96Å
71	L	85.9	Confident	86.1	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.005	41%	0.413	C	S	.	.	H	α-helix	trans	-65.2	-46.7	174.1	-66.9	172.8	0	0	0	110.7	F27 V56 A66 K67 K68 K73 A74 F75 Q80 I83	F27-L71 HydrophobicContact CD1-CD2 3.89Å; F27-L71 HydrophobicContact CE1-CD2 3.75Å; V56-L71 HydrophobicContact CB-CD2 4.05Å; V56-L71 HydrophobicContact CG1-CD2 3.93Å; V56-L71 HydrophobicContact CG2-CD2 4.39Å; A66-L71 HydrophobicContact CB-CD1 4.36Å; A66-L71 HydrophobicContact CB-CD2 3.91Å; A66-L71 HydrophobicContact CB-CG 4.08Å; K67-L71 PolarHBondContact O-N 2.8Å; K68-L71 WeakPolarHBondContact O-CB 3.24Å; K68-L71 PolarHBondContact O-N 3.1Å; L71-K73 PolarHBondContact O-N 3.36Å; L71-A74 PolarHBondContact O-N 3.39Å; L71-F75 HydrophobicContact CD2-CD2 4.33Å; L71-F75 HydrophobicContact CD2-CE2 4.4Å; L71-F75 WeakPolarHBondContact O-CB 3.46Å; L71-F75 PolarHBondContact O-N 3.44Å; L71-Q80 HydrophobicContact CD1-CG 4.31Å; L71-I83 HydrophobicContact CB-CD1 3.75Å; L71-I83 HydrophobicContact CD1-CD1 4.29Å; L71-I83 HydrophobicContact CD2-CD1 3.85Å; L71-I83 HydrophobicContact CD2-CG2 4.33Å; L71-I83 HydrophobicContact CG-CD1 4.16Å
72	V	88.7	Confident	86.4	Confident	74 Å²	74	73.5 Å²	73.5	45%	0.448	40%	0.398	S	S	.	.	H	α-helix	trans	-62.8	-42.7	178	175.5	0	0	0	0	111.1	K68 A74 G76	K68-V72 WeakPolarHBondContact O-CG2 3.47Å; K68-V72 PolarHBondContact O-N 2.83Å; V72-A74 PolarHBondContact O-N 3.2Å; V72-G76 WeakPolarHBondContact O-CA 3.48Å; V72-G76 PolarHBondContact O-N 3.28Å
73	K	88.3	Confident	86.8	Confident	174 Å²	174	66.2 Å²	66.2	76%	0.757	37%	0.366	S	S	*	.	H	α-helix	trans	-65.1	-35.9	177.1	-75	174.7	-177.1	178.5	0	113.6	D69 L71	D69-K73 WeakPolarHBondContact O-CB 3.25Å; D69-K73 VanDerWaalsContact O-CG 3.27Å; D69-K73 WeakPolarHBondContact O-CG 3.47Å; D69-K73 PolarHBondContact O-N 2.9Å; D69-K73 VanDerWaalsContact O-N 3.13Å; L71-K73 PolarHBondContact O-N 3.36Å
74	A	86.8	Confident	87.1	Confident	12 Å²	12	64 Å²	64	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-88	-37.6	-176.6	0	0	0	0	0	113.3	K22 F27 D70 L71 V72	K22-A74 HydrophobicContact CB-CB 4.45Å; K22-A74 WeakPolarHBondContact CD-O 3.31Å; K22-A74 WeakPolarHBondContact CE-O 3.49Å; K22-A74 PolarHBondContact NZ-O 3.02Å; F27-A74 HydrophobicContact CE2-CB 3.51Å; F27-A74 HydrophobicContact CZ-CB 3.68Å; D70-A74 VanDerWaalsContact O-CB 3.31Å; D70-A74 WeakPolarHBondContact O-CB 3.46Å; D70-A74 PolarHBondContact O-N 2.96Å; L71-A74 PolarHBondContact O-N 3.39Å; V72-A74 PolarHBondContact O-N 3.2Å
75	F	84.9	Confident	87.1	Confident	17 Å²	17	63.9 Å²	63.9	8%	0.075	34%	0.341	C	S	.	.	H	α-helix	trans	-112	-13.2	-171.3	-64.5	-85	0	0	0	113.9	M20 K22 F27 L71 T77 I83 I87	M20-F75 HydrophobicContact CE-CE1 4.47Å; M20-F75 HydrophobicContact SD-CE1 3.78Å; M20-F75 HydrophobicContact SD-CZ 4.09Å; K22-F75 HydrophobicContact CD-CD1 4.04Å; K22-F75 HydrophobicContact CD-CE1 3.88Å; K22-F75 HydrophobicContact CD-CZ 4.31Å; F27-F75 HydrophobicContact CB-CE2 4.45Å; F27-F75 HydrophobicContact CB-CZ 4.47Å; F27-F75 HydrophobicContact CD1-CE2 4.23Å; F27-F75 AromaticContact CD2-CE2 3.58Å; F27-F75 HydrophobicContact CD2-CE2 3.58Å; F27-F75 AromaticContact CD2-CZ 3.95Å; F27-F75 HydrophobicContact CD2-CZ 3.95Å; F27-F75 HydrophobicContact CE1-CE2 4.37Å; F27-F75 AromaticContact CE2-CE2 3.75Å; F27-F75 HydrophobicContact CE2-CE2 3.75Å; F27-F75 HydrophobicContact CE2-CZ 4.45Å; F27-F75 AromaticContact CG-CE2 3.82Å; F27-F75 HydrophobicContact CG-CE2 3.82Å; F27-F75 HydrophobicContact CG-CZ 4.25Å; F27-F75 HydrophobicContact CZ-CE2 4.14Å; L71-F75 HydrophobicContact CD2-CD2 4.33Å; L71-F75 HydrophobicContact CD2-CE2 4.4Å; L71-F75 WeakPolarHBondContact O-CB 3.46Å; L71-F75 PolarHBondContact O-N 3.44Å; F75-T77 HydrophobicContact CB-CG2 4.21Å; F75-T77 PolarHBondContact O-N 2.87Å; F75-I83 HydrophobicContact CB-CD1 4.04Å; F75-I83 HydrophobicContact CB-CG1 3.83Å; F75-I83 HydrophobicContact CD1-CG1 4.38Å; F75-I83 HydrophobicContact CD1-CG2 4Å; F75-I83 HydrophobicContact CD2-CD1 4.12Å; F75-I83 HydrophobicContact CD2-CG1 4.21Å; F75-I83 HydrophobicContact CD2-CG2 3.75Å; F75-I83 HydrophobicContact CE1-CG2 3.95Å; F75-I83 HydrophobicContact CE2-CG2 3.69Å; F75-I83 HydrophobicContact CG-CB 4.5Å; F75-I83 HydrophobicContact CG-CD1 4.2Å; F75-I83 HydrophobicContact CG-CG1 3.89Å; F75-I83 HydrophobicContact CG-CG2 3.91Å; F75-I83 HydrophobicContact CZ-CG2 3.8Å; F75-I87 HydrophobicContact CE1-CG1 4.17Å; F75-I87 HydrophobicContact CZ-CD1 4.03Å; F75-I87 HydrophobicContact CZ-CG1 3.93Å
76	G	84.7	Confident	87.1	Confident	67 Å²	67	61.2 Å²	61.2	69%	0.691	33%	0.327	S	S	*	.	S	Bend	trans	73.2	-3.7	-177.2	0	0	0	0	0	113.9	V72	V72-G76 WeakPolarHBondContact O-CA 3.48Å; V72-G76 PolarHBondContact O-N 3.28Å
77	T	86.8	Confident	87.2	Confident	32 Å²	32	60.8 Å²	60.8	20%	0.196	32%	0.324	C	S	.	.			trans	-126.2	150.7	177.2	-174.2	0	0	0	0	110	F75 D79 I83	F75-T77 HydrophobicContact CB-CG2 4.21Å; F75-T77 PolarHBondContact O-N 2.87Å; T77-D79 PolarHBondContact OG1-N 2.87Å; T77-I83 HydrophobicContact CG2-CD1 4.1Å; T77-I83 HydrophobicContact CG2-CG1 3.65Å
78	G	81.3	Confident	87.1	Confident	42 Å²	42	53.7 Å²	53.7	43%	0.433	29%	0.293	S	S	.	.			trans	-98.1	-5.7	173.7	0	0	0	0	0	113.4	Q80	G78-Q80 PolarHBondContact O-N 3.44Å
79	D	87.4	Confident	87	Confident	74 Å²	74	50 Å²	50	40%	0.396	29%	0.286	S	S	.	.			trans	-76.6	117.2	178.6	-179.9	26	0	0	0	110.7	T77 T81 E82 I83	T77-D79 PolarHBondContact OG1-N 2.87Å; D79-T81 VanDerWaalsContact C-N 3.26Å; D79-T81 PolarHBondContact O-N 3.27Å; D79-T81 PolarHBondContact OD1-N 3.08Å; D79-T81 VanDerWaalsContact OD1-N 3.13Å; D79-T81 PolarHBondContact OD1-OG1 3.33Å; D79-E82 HydrophobicContact CB-CB 4.31Å; D79-E82 PolarHBondContact OD2-N 3.05Å; D79-I83 WeakPolarHBondContact O-CD1 3.47Å; D79-I83 WeakPolarHBondContact O-CG1 3.38Å; D79-I83 PolarHBondContact O-N 3.44Å
80	Q	85.4	Confident	87	Confident	47 Å²	47	52.1 Å²	52.1	22%	0.22	29%	0.29	C	S	.	.	H	α-helix	trans	-66.3	-31.8	-179.6	-62.2	-176.6	0.3	0	0	111.4	H54 S55 L71 G78 I83 C84	H54-Q80 WeakPolarHBondContact O-CB 3.46Å; H54-Q80 PolarHBondContact O-OE1 3.25Å; S55-Q80 PolarHBondContact OG-OE1 3.47Å; L71-Q80 HydrophobicContact CD1-CG 4.31Å; G78-Q80 PolarHBondContact O-N 3.44Å; Q80-I83 PolarHBondContact O-N 3.05Å; Q80-C84 WeakPolarHBondContact O-CB 3.28Å; Q80-C84 PolarHBondContact O-N 3.04Å; Q80-C84 PolarHBondContact O-SG 3.03Å
81	T	87.3	Confident	86.9	Confident	49 Å²	49	51 Å²	51	30%	0.301	29%	0.285	S	S	.	.	H	α-helix	trans	-67.5	-47	-176.9	-41.5	0	0	0	0	111.3	D79 I83 C84 K85	D79-T81 VanDerWaalsContact C-N 3.26Å; D79-T81 PolarHBondContact O-N 3.27Å; D79-T81 PolarHBondContact OD1-N 3.08Å; D79-T81 VanDerWaalsContact OD1-N 3.13Å; D79-T81 PolarHBondContact OD1-OG1 3.33Å; T81-I83 VanDerWaalsContact C-N 3.34Å; T81-C84 WeakPolarHBondContact O-CB 3.42Å; T81-C84 PolarHBondContact O-N 2.9Å; T81-K85 PolarHBondContact O-N 3.06Å; T81-K85 VanDerWaalsContact O-N 3.11Å
82	E	86.9	Confident	86.9	Confident	96 Å²	96	58.1 Å²	58.1	45%	0.449	32%	0.318	S	S	.	.	H	α-helix	trans	-65.2	-37.9	176.4	-168.3	167.5	-151	0	0	112.3	D79 K85 Q86	D79-E82 HydrophobicContact CB-CB 4.31Å; D79-E82 PolarHBondContact OD2-N 3.05Å; E82-K85 WeakPolarHBondContact O-CB 3.46Å; E82-K85 PolarHBondContact O-N 3.43Å; E82-Q86 PolarHBondContact O-N 3Å
83	I	88.9	Confident	86.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-42.2	174.5	-64.1	168.9	0	0	0	110.7	V56 L71 F75 T77 D79 Q80 T81 K85 Q86 I87	V56-I83 HydrophobicContact CG2-CB 4.23Å; V56-I83 HydrophobicContact CG2-CG2 3.8Å; L71-I83 HydrophobicContact CB-CD1 3.75Å; L71-I83 HydrophobicContact CD1-CD1 4.29Å; L71-I83 HydrophobicContact CD2-CD1 3.85Å; L71-I83 HydrophobicContact CD2-CG2 4.33Å; L71-I83 HydrophobicContact CG-CD1 4.16Å; F75-I83 HydrophobicContact CB-CD1 4.04Å; F75-I83 HydrophobicContact CB-CG1 3.83Å; F75-I83 HydrophobicContact CD1-CG1 4.38Å; F75-I83 HydrophobicContact CD1-CG2 4Å; F75-I83 HydrophobicContact CD2-CD1 4.12Å; F75-I83 HydrophobicContact CD2-CG1 4.21Å; F75-I83 HydrophobicContact CD2-CG2 3.75Å; F75-I83 HydrophobicContact CE1-CG2 3.95Å; F75-I83 HydrophobicContact CE2-CG2 3.69Å; F75-I83 HydrophobicContact CG-CB 4.5Å; F75-I83 HydrophobicContact CG-CD1 4.2Å; F75-I83 HydrophobicContact CG-CG1 3.89Å; F75-I83 HydrophobicContact CG-CG2 3.91Å; F75-I83 HydrophobicContact CZ-CG2 3.8Å; T77-I83 HydrophobicContact CG2-CD1 4.1Å; T77-I83 HydrophobicContact CG2-CG1 3.65Å; D79-I83 WeakPolarHBondContact O-CD1 3.47Å; D79-I83 WeakPolarHBondContact O-CG1 3.38Å; D79-I83 PolarHBondContact O-N 3.44Å; Q80-I83 PolarHBondContact O-N 3.05Å; T81-I83 VanDerWaalsContact C-N 3.34Å; I83-K85 VanDerWaalsContact C-N 3.32Å; I83-K85 PolarHBondContact O-N 2.99Å; I83-Q86 PolarHBondContact O-N 3.27Å; I83-Q86 VanDerWaalsContact O-N 3.12Å; I83-I87 HydrophobicContact CG2-CD1 3.66Å; I83-I87 HydrophobicContact CG2-CG1 4.16Å; I83-I87 WeakPolarHBondContact O-CG1 3.31Å; I83-I87 PolarHBondContact O-N 3.13Å
84	C	88.8	Confident	86.1	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.1	-43.8	175	-72.2	0	0	0	0	111.6	L51 Q80 T81 Q86 I87 L88	L51-C84 HydrophobicContact CD1-CB 3.7Å; Q80-C84 WeakPolarHBondContact O-CB 3.28Å; Q80-C84 PolarHBondContact O-N 3.04Å; Q80-C84 PolarHBondContact O-SG 3.03Å; T81-C84 WeakPolarHBondContact O-CB 3.42Å; T81-C84 PolarHBondContact O-N 2.9Å; C84-Q86 VanDerWaalsContact C-N 3.33Å; C84-Q86 PolarHBondContact O-N 3.27Å; C84-I87 PolarHBondContact O-N 2.84Å; C84-L88 VanDerWaalsContact O-CB 3.28Å; C84-L88 WeakPolarHBondContact O-CB 3.49Å; C84-L88 PolarHBondContact O-N 3.49Å
85	K	88.8	Confident	85.5	Confident	101 Å²	101	53.6 Å²	53.6	44%	0.439	30%	0.296	S	S	.	.	H	α-helix	trans	-58.4	-42.6	173.9	-70.8	175.9	178.1	172.1	0	112.3	L47 T81 E82 I83 L88 S89	L47-K85 HydrophobicContact CD1-CD 4.08Å; L47-K85 HydrophobicContact CD1-CG 3.85Å; L47-K85 HydrophobicContact CD2-CG 3.68Å; L47-K85 HydrophobicContact CG-CG 4.34Å; T81-K85 PolarHBondContact O-N 3.06Å; T81-K85 VanDerWaalsContact O-N 3.11Å; E82-K85 WeakPolarHBondContact O-CB 3.46Å; E82-K85 PolarHBondContact O-N 3.43Å; I83-K85 VanDerWaalsContact C-N 3.32Å; I83-K85 PolarHBondContact O-N 2.99Å; K85-L88 PolarHBondContact O-N 2.85Å; K85-S89 PolarHBondContact O-N 3.4Å; K85-S89 VanDerWaalsContact O-N 3.15Å; K85-S89 PolarHBondContact O-OG 3.11Å
86	Q	88.4	Confident	84.9	Confident	51 Å²	51	55.4 Å²	55.4	24%	0.238	31%	0.311	C	S	.	.	H	α-helix	trans	-66.3	-42	177.5	-69.5	-171.4	23.1	0	0	112.4	E82 I83 C84 S89 K90	E82-Q86 PolarHBondContact O-N 3Å; I83-Q86 PolarHBondContact O-N 3.27Å; I83-Q86 VanDerWaalsContact O-N 3.12Å; C84-Q86 VanDerWaalsContact C-N 3.33Å; C84-Q86 PolarHBondContact O-N 3.27Å; Q86-S89 PolarHBondContact O-OG 3.22Å; Q86-S89 VanDerWaalsContact O-OG 3.07Å; Q86-K90 WeakPolarHBondContact O-CB 3.31Å; Q86-K90 PolarHBondContact O-N 3.25Å
87	I	89.6	Confident	84.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-68	-38.5	177.9	-65.5	172.1	0	0	0	110.5	V18 M20 F27 I29 V56 F75 I83 C84 S89 G91	V18-I87 HydrophobicContact CB-CG2 4.4Å; V18-I87 HydrophobicContact CG1-CG2 4.02Å; V18-I87 WeakPolarHBondContact CG1-O 3.45Å; M20-I87 HydrophobicContact CB-CB 4.46Å; M20-I87 HydrophobicContact CB-CG1 4.06Å; M20-I87 HydrophobicContact CB-CG2 4.06Å; M20-I87 HydrophobicContact SD-CG1 3.97Å; F27-I87 HydrophobicContact CB-CD1 3.84Å; I29-I87 HydrophobicContact CD1-CB 4.1Å; I29-I87 HydrophobicContact CD1-CG2 3.74Å; I29-I87 HydrophobicContact CG1-CG2 3.74Å; I29-I87 HydrophobicContact CG2-CB 4.35Å; I29-I87 HydrophobicContact CG2-CD1 3.94Å; I29-I87 HydrophobicContact CG2-CG2 4.12Å; V56-I87 HydrophobicContact CG1-CD1 3.84Å; V56-I87 HydrophobicContact CG2-CD1 4.37Å; F75-I87 HydrophobicContact CE1-CG1 4.17Å; F75-I87 HydrophobicContact CZ-CD1 4.03Å; F75-I87 HydrophobicContact CZ-CG1 3.93Å; I83-I87 HydrophobicContact CG2-CD1 3.66Å; I83-I87 HydrophobicContact CG2-CG1 4.16Å; I83-I87 WeakPolarHBondContact O-CG1 3.31Å; I83-I87 PolarHBondContact O-N 3.13Å; C84-I87 PolarHBondContact O-N 2.84Å; I87-S89 VanDerWaalsContact C-N 3.34Å; I87-S89 PolarHBondContact O-N 3.15Å; I87-G91 WeakPolarHBondContact O-CA 3.32Å; I87-G91 PolarHBondContact O-N 2.9Å
88	L	87.5	Confident	84	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.5	-39	-179.9	-156.5	73.2	0	0	0	111.8	V18 I29 V36 W39 V50 L51 C84 K85	V18-L88 HydrophobicContact CG2-CD1 4.3Å; I29-L88 HydrophobicContact CD1-CB 4.17Å; I29-L88 HydrophobicContact CD1-CD1 3.69Å; V36-L88 HydrophobicContact CG1-CD1 4.28Å; V36-L88 HydrophobicContact CG2-CD1 4.41Å; W39-L88 HydrophobicContact CB-CD2 4.06Å; W39-L88 HydrophobicContact CD2-CD2 3.55Å; W39-L88 HydrophobicContact CE3-CD2 4.33Å; W39-L88 HydrophobicContact CG-CD2 3.35Å; W39-L88 HydrophobicContact CG-CG 4.14Å; W39-L88 HydrophobicContact CZ2-CD2 4.46Å; V50-L88 HydrophobicContact CG1-CD1 4.08Å; V50-L88 HydrophobicContact CG1-CD2 3.87Å; L51-L88 HydrophobicContact CD2-CD1 4.36Å; C84-L88 VanDerWaalsContact O-CB 3.28Å; C84-L88 WeakPolarHBondContact O-CB 3.49Å; C84-L88 PolarHBondContact O-N 3.49Å; K85-L88 PolarHBondContact O-N 2.85Å
89	S	85.8	Confident	83.7	Confident	72 Å²	72	65.3 Å²	65.3	50%	0.503	33%	0.326	S	S	.	.	H	α-helix	trans	-79.8	-45	179.7	53.5	0	0	0	0	114	K85 Q86 I87	K85-S89 PolarHBondContact O-N 3.4Å; K85-S89 VanDerWaalsContact O-N 3.15Å; K85-S89 PolarHBondContact O-OG 3.11Å; Q86-S89 PolarHBondContact O-OG 3.22Å; Q86-S89 VanDerWaalsContact O-OG 3.07Å; I87-S89 VanDerWaalsContact C-N 3.34Å; I87-S89 PolarHBondContact O-N 3.15Å
90	K	86.9	Confident	83.4	Confident	157 Å²	157	67 Å²	67	68%	0.683	33%	0.327	S	S	*	.	H	α-helix	trans	-101.4	-12.7	-174.8	-63.8	-176.8	179.1	178.8	0	114.4	M20 Q86	M20-K90 HydrophobicContact CE-CB 3.94Å; M20-K90 HydrophobicContact CE-CD 4.34Å; M20-K90 HydrophobicContact SD-CB 4.47Å; Q86-K90 WeakPolarHBondContact O-CB 3.31Å; Q86-K90 PolarHBondContact O-N 3.25Å
91	G	86.3	Confident	83.4	Confident	6 Å²	6	71.3 Å²	71.3	6%	0.062	35%	0.347	C	S	.	.	S	Bend	trans	-76.2	168.8	-178.6	0	0	0	0	0	112.9	R19 R40 I87	R19-G91 CarbonylContact O-C 3.48Å; R19-G91 VanDerWaalsContact O-CA 3.23Å; R19-G91 WeakPolarHBondContact O-CA 3.49Å; R40-G91 PolarHBondContact NH2-O 3.14Å; I87-G91 WeakPolarHBondContact O-CA 3.32Å; I87-G91 PolarHBondContact O-N 2.9Å
92	E	85.1	Confident	83.3	Confident	149 Å²	149	72.1 Å²	72.1	70%	0.696	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.6	172.7	-68.7	178.9	167.5	0	0	109.1	V18 R19 Q94	V18-E92 WeakPolarHBondContact CA-O 3.23Å; R19-E92 PolarHBondContact N-O 3.1Å; R19-E92 PolarHBondContact O-N 3.28Å; E92-Q94 PolarHBondContact O-N 3.25Å
93	L	84.6	Confident	83.1	Confident	40 Å²	40	70.6 Å²	70.6	21%	0.209	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	118.9	173	176.1	64.6	0	0	0	108.6	A16 V18 V36 V95	A16-L93 HydrophobicContact CB-CD1 4.06Å; V18-L93 HydrophobicContact CG2-CD1 3.84Å; V36-L93 HydrophobicContact CB-CD1 4.25Å; V36-L93 HydrophobicContact CB-CD2 4.43Å; V36-L93 HydrophobicContact CG1-CD1 4.1Å; V36-L93 HydrophobicContact CG1-CD2 4.34Å; V36-L93 HydrophobicContact CG2-CD1 4.2Å; L93-V95 HydrophobicContact CD2-CG1 4Å; L93-V95 HydrophobicContact CG-CG1 4.09Å; L93-V95 PolarHBondContact O-N 2.9Å; L93-V95 VanDerWaalsContact O-N 3.1Å
94	Q	77.2	Confident	83	Confident	101 Å²	101	73.5 Å²	73.5	47%	0.472	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	94.2	170.3	-170.2	177.8	3.7	0	0	108.6	V17 E92	V17-Q94 HydrophobicContact CB-CB 4.33Å; V17-Q94 VanDerWaalsContact O-CB 3.28Å; V17-Q94 WeakPolarHBondContact O-CB 3.34Å; V17-Q94 PolarHBondContact O-N 3.23Å; E92-Q94 PolarHBondContact O-N 3.25Å
95	V	73.1	Confident	83	Confident	24 Å²	24	78.6 Å²	78.6	15%	0.145	39%	0.387	C	S	.	.			trans	-71.5	141.4	170.1	-66.7	0	0	0	0	110.2	L93 E99 R100	L93-V95 HydrophobicContact CD2-CG1 4Å; L93-V95 HydrophobicContact CG-CG1 4.09Å; L93-V95 PolarHBondContact O-N 2.9Å; L93-V95 VanDerWaalsContact O-N 3.1Å; V95-E99 HydrophobicContact CB-CB 4.43Å; V95-R100 HydrophobicContact CG2-CB 3.96Å; V95-R100 HydrophobicContact CG2-CG 4.36Å; V95-R100 PolarHBondContact O-NH2 2.91Å
96	S	72.2	Confident	83	Confident	56 Å²	56	77.3 Å²	77.3	39%	0.392	39%	0.387	S	S	.	.			trans	-63.7	153.5	170.3	-177.3	0	0	0	0	110.4	K98 E99 R100	S96-K98 PolarHBondContact O-N 3.46Å; S96-E99 PolarHBondContact N-OE2 3.21Å; S96-E99 PolarHBondContact O-N 2.89Å; S96-R100 PolarHBondContact O-N 3.21Å
97	D	74.3	Confident	83	Confident	112 Å²	112	77 Å²	77	60%	0.599	39%	0.387	S	S	*	.	H	α-helix	trans	-58.2	-38.1	178.8	-65.5	-52.2	0	0	0	112	R100 Q101	D97-R100 PolarHBondContact O-N 3.35Å; D97-R100 IonicContact OD1-CZ 2.71Å; D97-R100 IonicContact OD1-NH1 3.42Å; D97-R100 PolarHBondContact OD1-NH1 3.31Å; D97-R100 IonicContact OD1-NH2 3.2Å; D97-Q101 WeakPolarHBondContact O-CB 3.46Å; D97-Q101 PolarHBondContact O-N 2.98Å
98	K	79	Confident	83.1	Confident	176 Å²	176	78.5 Å²	78.5	77%	0.765	39%	0.393	S	S	*	.	H	α-helix	trans	-63.5	-40.6	174.5	-69.9	-171.6	177	-174.7	0	112.9	S96 Q101 S102	S96-K98 PolarHBondContact O-N 3.46Å; K98-Q101 PolarHBondContact O-N 3.27Å; K98-S102 PolarHBondContact O-N 3.47Å
99	E	74.6	Confident	83.2	Confident	60 Å²	60	84.6 Å²	84.6	28%	0.28	42%	0.416	S	S	.	.	H	α-helix	trans	-71.7	-39.2	179.4	-74.3	165.7	-172.3	0	0	111	K33 V95 S96 Q101 S102 Q103	K33-E99 WeakPolarHBondContact CD-OE1 3.48Å; K33-E99 WeakPolarHBondContact CE-OE1 3.34Å; K33-E99 IonicContact NZ-OE1 3.26Å; K33-E99 PolarHBondContact NZ-OE1 3.49Å; V95-E99 HydrophobicContact CB-CB 4.43Å; S96-E99 PolarHBondContact N-OE2 3.21Å; S96-E99 PolarHBondContact O-N 2.89Å; E99-Q101 VanDerWaalsContact C-N 3.29Å; E99-Q101 PolarHBondContact O-N 3.12Å; E99-S102 PolarHBondContact O-N 3.1Å; E99-Q103 WeakPolarHBondContact O-CB 3.3Å; E99-Q103 WeakPolarHBondContact O-CG 3.3Å; E99-Q103 PolarHBondContact O-N 2.84Å
100	R	80.8	Confident	83.5	Confident	110 Å²	110	84.7 Å²	84.7	42%	0.415	41%	0.411	S	S	.	.	H	α-helix	trans	-58.8	-44.7	172.8	-169	-176.3	-58.6	118.4	11	110.6	V95 S96 D97 Q103 L104	V95-R100 HydrophobicContact CG2-CB 3.96Å; V95-R100 HydrophobicContact CG2-CG 4.36Å; V95-R100 PolarHBondContact O-NH2 2.91Å; S96-R100 PolarHBondContact O-N 3.21Å; D97-R100 PolarHBondContact O-N 3.35Å; D97-R100 IonicContact OD1-CZ 2.71Å; D97-R100 IonicContact OD1-NH1 3.42Å; D97-R100 PolarHBondContact OD1-NH1 3.31Å; D97-R100 IonicContact OD1-NH2 3.2Å; R100-Q103 PolarHBondContact O-N 2.74Å; R100-L104 HydrophobicContact CG-CD1 4.19Å; R100-L104 WeakPolarHBondContact O-CB 3.45Å; R100-L104 VanDerWaalsContact O-CG 3.25Å; R100-L104 WeakPolarHBondContact O-CG 3.44Å; R100-L104 PolarHBondContact O-N 3.19Å
101	Q	84.9	Confident	83.6	Confident	137 Å²	137	77.2 Å²	77.2	64%	0.64	38%	0.379	S	S	*	.	H	α-helix	trans	-64.8	-44	178.9	-169.5	159.3	10.9	0	0	112	D97 K98 E99 Q103 L104 E105	D97-Q101 WeakPolarHBondContact O-CB 3.46Å; D97-Q101 PolarHBondContact O-N 2.98Å; K98-Q101 PolarHBondContact O-N 3.27Å; E99-Q101 VanDerWaalsContact C-N 3.29Å; E99-Q101 PolarHBondContact O-N 3.12Å; Q101-Q103 PolarHBondContact O-N 3.29Å; Q101-L104 PolarHBondContact O-N 3.32Å; Q101-E105 WeakPolarHBondContact O-CB 3.41Å; Q101-E105 PolarHBondContact O-N 3.45Å
102	S	85.2	Confident	83.8	Confident	67 Å²	67	77 Å²	77	47%	0.469	38%	0.376	S	S	.	.	H	α-helix	trans	-62.5	-41.7	175	176.4	0	0	0	0	112.4	K98 E99 E105 T106	K98-S102 PolarHBondContact O-N 3.47Å; E99-S102 PolarHBondContact O-N 3.1Å; S102-E105 PolarHBondContact O-N 3Å; S102-T106 PolarHBondContact O-N 2.79Å; S102-T106 PolarHBondContact O-OG1 3.21Å
103	Q	83.1	Confident	84	Confident	63 Å²	63	72.1 Å²	72.1	29%	0.294	36%	0.358	S	S	.	.	H	α-helix	trans	-62.9	-43	175.7	-76	176.1	7.5	0	0	112.2	E99 R100 Q101 E105 T106 M107	E99-Q103 WeakPolarHBondContact O-CB 3.3Å; E99-Q103 WeakPolarHBondContact O-CG 3.3Å; E99-Q103 PolarHBondContact O-N 2.84Å; R100-Q103 PolarHBondContact O-N 2.74Å; Q101-Q103 PolarHBondContact O-N 3.29Å; Q103-E105 VanDerWaalsContact C-N 3.33Å; Q103-T106 PolarHBondContact O-N 2.85Å; Q103-M107 WeakPolarHBondContact O-CB 3.43Å; Q103-M107 WeakPolarHBondContact O-CG 3.25Å; Q103-M107 PolarHBondContact O-N 3.49Å
104	L	86.8	Confident	84.1	Confident	61 Å²	61	71.7 Å²	71.7	32%	0.319	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-40.1	176.6	-71.3	170.9	0	0	0	111.2	R100 Q101 M107 F108 V144	R100-L104 HydrophobicContact CG-CD1 4.19Å; R100-L104 WeakPolarHBondContact O-CB 3.45Å; R100-L104 VanDerWaalsContact O-CG 3.25Å; R100-L104 WeakPolarHBondContact O-CG 3.44Å; R100-L104 PolarHBondContact O-N 3.19Å; Q101-L104 PolarHBondContact O-N 3.32Å; L104-M107 PolarHBondContact O-N 2.93Å; L104-F108 VanDerWaalsContact O-CB 3.23Å; L104-F108 WeakPolarHBondContact O-CB 3.45Å; L104-F108 PolarHBondContact O-N 3.45Å; L104-V144 HydrophobicContact CD2-CB 4.44Å
105	E	88.9	Confident	84.5	Confident	108 Å²	108	66.9 Å²	66.9	51%	0.505	33%	0.334	S	S	.	.	H	α-helix	trans	-66.8	-42.7	177.2	-167	-178.5	158.9	0	0	112	Q101 S102 Q103 F108 R109	Q101-E105 WeakPolarHBondContact O-CB 3.41Å; Q101-E105 PolarHBondContact O-N 3.45Å; S102-E105 PolarHBondContact O-N 3Å; Q103-E105 VanDerWaalsContact C-N 3.33Å; E105-F108 WeakPolarHBondContact O-CB 3.45Å; E105-F108 PolarHBondContact O-N 2.78Å; E105-R109 PolarHBondContact O-N 3.27Å; E105-R109 IonicContact OE1-NH2 3.29Å
106	T	89.3	Confident	85	Confident	73 Å²	73	66.2 Å²	66.2	45%	0.448	33%	0.33	S	S	.	.	H	α-helix	trans	-61.1	-49.3	173.9	-58.4	0	0	0	0	110.9	S102 Q103 F108 R109 D110	S102-T106 PolarHBondContact O-N 2.79Å; S102-T106 PolarHBondContact O-OG1 3.21Å; Q103-T106 PolarHBondContact O-N 2.85Å; T106-F108 VanDerWaalsContact C-N 3.27Å; T106-F108 PolarHBondContact O-N 3.32Å; T106-R109 PolarHBondContact O-N 3.1Å; T106-D110 VanDerWaalsContact O-CG 3.22Å; T106-D110 PolarHBondContact O-N 3.3Å
107	M	88.6	Confident	85.5	Confident	46 Å²	46	68.8 Å²	68.8	23%	0.227	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-37.2	176.9	-71.7	-172.4	-161.9	0	0	112.1	Q103 L104 D110 I111 V144 P146	Q103-M107 WeakPolarHBondContact O-CB 3.43Å; Q103-M107 WeakPolarHBondContact O-CG 3.25Å; Q103-M107 PolarHBondContact O-N 3.49Å; L104-M107 PolarHBondContact O-N 2.93Å; M107-D110 PolarHBondContact O-N 2.9Å; M107-I111 WeakPolarHBondContact O-CB 3.38Å; M107-I111 WeakPolarHBondContact O-CD1 3.36Å; M107-I111 WeakPolarHBondContact O-CG1 3.39Å; M107-I111 PolarHBondContact O-N 2.88Å; M107-V144 HydrophobicContact CB-CG1 3.78Å; M107-V144 HydrophobicContact SD-CG1 4.31Å; M107-P146 HydrophobicContact CE-CB 4.02Å; M107-P146 HydrophobicContact SD-CB 4.21Å
108	F	90.9	Very high	85.7	Confident	30 Å²	30	67.5 Å²	67.5	13%	0.132	33%	0.325	C	S	.	.	H	α-helix	trans	-61.5	-47.1	176.1	-175.5	-88.5	0	0	0	111.1	L104 E105 T106 I111 A112 E134 M137 K138 V144	L104-F108 VanDerWaalsContact O-CB 3.23Å; L104-F108 WeakPolarHBondContact O-CB 3.45Å; L104-F108 PolarHBondContact O-N 3.45Å; E105-F108 WeakPolarHBondContact O-CB 3.45Å; E105-F108 PolarHBondContact O-N 2.78Å; T106-F108 VanDerWaalsContact C-N 3.27Å; T106-F108 PolarHBondContact O-N 3.32Å; F108-I111 PolarHBondContact O-N 3.49Å; F108-A112 WeakPolarHBondContact O-CB 3.4Å; F108-A112 PolarHBondContact O-N 2.91Å; F108-E134 HydrophobicContact CD1-CG 4.39Å; F108-E134 HydrophobicContact CE1-CB 3.97Å; F108-E134 HydrophobicContact CE1-CG 3.93Å; F108-M137 HydrophobicContact CD2-CE 3.86Å; F108-M137 HydrophobicContact CE1-CB 4.41Å; F108-M137 HydrophobicContact CE2-CB 3.74Å; F108-M137 HydrophobicContact CE2-CE 3.69Å; F108-M137 HydrophobicContact CE2-SD 4.45Å; F108-M137 HydrophobicContact CG-CE 4.5Å; F108-M137 HydrophobicContact CZ-CB 3.44Å; F108-M137 VanDerWaalsContact CZ-CB 3.44Å; F108-M137 HydrophobicContact CZ-CE 4.19Å; F108-M137 HydrophobicContact CZ-CG 4.48Å; F108-M137 HydrophobicContact CZ-SD 4.37Å; F108-K138 HydrophobicContact CZ-CG 3.98Å; F108-V144 HydrophobicContact CB-CG2 4.05Å; F108-V144 HydrophobicContact CD2-CG2 3.76Å; F108-V144 HydrophobicContact CG-CG2 4.4Å
109	R	90.6	Very high	85.7	Confident	129 Å²	129	59.2 Å²	59.2	49%	0.487	29%	0.289	S	S	.	.	H	α-helix	trans	-64.7	-40.2	176.4	-170.7	178	-61.7	162.2	9.1	112.2	E105 T106 A112 S113 E134	E105-R109 PolarHBondContact O-N 3.27Å; E105-R109 IonicContact OE1-NH2 3.29Å; T106-R109 PolarHBondContact O-N 3.1Å; R109-A112 PolarHBondContact O-N 3.48Å; R109-S113 WeakPolarHBondContact O-CB 3.42Å; R109-S113 PolarHBondContact O-N 3.5Å; R109-S113 PolarHBondContact O-OG 3.23Å; R109-E134 IonicContact NE-OE1 3.58Å
110	D	90.1	Very high	86.1	Confident	74 Å²	74	56.9 Å²	56.9	40%	0.396	28%	0.279	S	S	.	.	H	α-helix	trans	-62.2	-44.1	175.9	-69.8	-19	0	0	0	111.1	T106 M107 S113 I114	T106-D110 VanDerWaalsContact O-CG 3.22Å; T106-D110 PolarHBondContact O-N 3.3Å; M107-D110 PolarHBondContact O-N 2.9Å; D110-S113 PolarHBondContact O-N 3.03Å; D110-I114 VanDerWaalsContact O-CG1 3.25Å; D110-I114 WeakPolarHBondContact O-CG1 3.46Å; D110-I114 PolarHBondContact O-N 3.11Å
111	I	90.1	Very high	86.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-47.5	176.2	-67.5	161.1	0	0	0	110.1	M107 F108 S113 I114 V115 M137 V144 T150 Q153 A154 V157	M107-I111 WeakPolarHBondContact O-CB 3.38Å; M107-I111 WeakPolarHBondContact O-CD1 3.36Å; M107-I111 WeakPolarHBondContact O-CG1 3.39Å; M107-I111 PolarHBondContact O-N 2.88Å; F108-I111 PolarHBondContact O-N 3.49Å; I111-S113 VanDerWaalsContact C-N 3.27Å; I111-S113 PolarHBondContact O-N 2.86Å; I111-I114 PolarHBondContact O-N 3.34Å; I111-V115 HydrophobicContact CG2-CG2 4.32Å; I111-V115 VanDerWaalsContact O-CG2 3.27Å; I111-V115 WeakPolarHBondContact O-CG2 3.49Å; I111-V115 PolarHBondContact O-N 2.79Å; I111-M137 HydrophobicContact CB-CE 4.26Å; I111-M137 HydrophobicContact CG2-CE 3.74Å; I111-M137 HydrophobicContact CG2-SD 4.23Å; I111-V144 HydrophobicContact CD1-CG1 3.81Å; I111-V144 HydrophobicContact CD1-CG2 4.02Å; I111-T150 HydrophobicContact CG1-CG2 4.38Å; I111-Q153 HydrophobicContact CD1-CB 3.83Å; I111-Q153 HydrophobicContact CG1-CB 4.3Å; I111-A154 HydrophobicContact CG2-CB 4.32Å; I111-V157 HydrophobicContact CG2-CB 4.46Å; I111-V157 HydrophobicContact CG2-CG2 3.99Å
112	A	89.8	Confident	85.5	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.9	-39.9	177.5	0	0	0	0	0	111.9	F108 R109 V115 A116 V130 I133 E134 M137	F108-A112 WeakPolarHBondContact O-CB 3.4Å; F108-A112 PolarHBondContact O-N 2.91Å; R109-A112 PolarHBondContact O-N 3.48Å; A112-V115 PolarHBondContact O-N 3.09Å; A112-A116 VanDerWaalsContact O-CB 3.32Å; A112-A116 WeakPolarHBondContact O-CB 3.49Å; A112-A116 PolarHBondContact O-N 3.29Å; A112-V130 HydrophobicContact CB-CG1 3.99Å; A112-I133 HydrophobicContact CB-CG2 4.04Å; A112-E134 HydrophobicContact CB-CG 3.67Å; A112-M137 HydrophobicContact CB-SD 4.01Å
113	S	89.3	Confident	85.1	Confident	47 Å²	47	51.8 Å²	51.8	33%	0.329	26%	0.262	S	S	.	.	H	α-helix	trans	-65	-43.9	177.4	-57.5	0	0	0	0	111.7	R109 D110 I111 V115 A116 E117	R109-S113 WeakPolarHBondContact O-CB 3.42Å; R109-S113 PolarHBondContact O-N 3.5Å; R109-S113 PolarHBondContact O-OG 3.23Å; D110-S113 PolarHBondContact O-N 3.03Å; I111-S113 VanDerWaalsContact C-N 3.27Å; I111-S113 PolarHBondContact O-N 2.86Å; S113-V115 VanDerWaalsContact C-N 3.32Å; S113-V115 PolarHBondContact O-N 3.25Å; S113-A116 PolarHBondContact O-N 3.31Å; S113-E117 WeakPolarHBondContact O-CB 3.5Å; S113-E117 PolarHBondContact O-N 3.28Å
114	I	86.7	Confident	84.8	Confident	31 Å²	31	51.7 Å²	51.7	16%	0.159	27%	0.266	C	S	.	.	H	α-helix	trans	-64	-39	176.1	-67.8	164.8	0	0	0	111.2	D110 I111 K118 A154	D110-I114 VanDerWaalsContact O-CG1 3.25Å; D110-I114 WeakPolarHBondContact O-CG1 3.46Å; D110-I114 PolarHBondContact O-N 3.11Å; I111-I114 PolarHBondContact O-N 3.34Å; I114-K118 HydrophobicContact CG2-CD 4.1Å; I114-K118 WeakPolarHBondContact O-CB 3.16Å; I114-K118 VanDerWaalsContact O-CG 3.29Å; I114-K118 WeakPolarHBondContact O-CG 3.4Å; I114-K118 PolarHBondContact O-N 3.49Å; I114-A154 HydrophobicContact CB-CB 4.27Å; I114-A154 HydrophobicContact CG2-CB 3.69Å
115	V	85.9	Confident	84	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-68.7	-43.4	177.9	173.8	0	0	0	0	110.2	I111 A112 S113 E117 K118 C119 I133 A154 V157 I158 L161	I111-V115 HydrophobicContact CG2-CG2 4.32Å; I111-V115 VanDerWaalsContact O-CG2 3.27Å; I111-V115 WeakPolarHBondContact O-CG2 3.49Å; I111-V115 PolarHBondContact O-N 2.79Å; A112-V115 PolarHBondContact O-N 3.09Å; S113-V115 VanDerWaalsContact C-N 3.32Å; S113-V115 PolarHBondContact O-N 3.25Å; V115-E117 VanDerWaalsContact C-N 3.31Å; V115-E117 PolarHBondContact O-N 2.9Å; V115-K118 PolarHBondContact O-N 3.01Å; V115-K118 VanDerWaalsContact O-N 3.14Å; V115-C119 HydrophobicContact CG1-CB 4.49Å; V115-C119 VanDerWaalsContact O-CB 3.24Å; V115-C119 WeakPolarHBondContact O-CB 3.46Å; V115-C119 PolarHBondContact O-N 3.17Å; V115-C119 PolarHBondContact O-SG 2.9Å; V115-I133 HydrophobicContact CB-CD1 4.41Å; V115-I133 HydrophobicContact CB-CG2 4.03Å; V115-I133 HydrophobicContact CG1-CD1 3.95Å; V115-I133 HydrophobicContact CG1-CG1 4.36Å; V115-I133 HydrophobicContact CG1-CG2 3.83Å; V115-A154 HydrophobicContact CG2-CB 3.95Å; V115-V157 HydrophobicContact CG2-CB 4.42Å; V115-V157 HydrophobicContact CG2-CG1 4.11Å; V115-I158 HydrophobicContact CG1-CG1 3.99Å; V115-I158 HydrophobicContact CG2-CD1 4.4Å; V115-I158 HydrophobicContact CG2-CG1 4.02Å; V115-L161 HydrophobicContact CG1-CD1 4.13Å
116	A	84.9	Confident	83.3	Confident	9 Å²	9	55.7 Å²	55.7	7%	0.074	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-41.9	177.3	0	0	0	0	0	112	A112 S113 K118 V130 I133	A112-A116 VanDerWaalsContact O-CB 3.32Å; A112-A116 WeakPolarHBondContact O-CB 3.49Å; A112-A116 PolarHBondContact O-N 3.29Å; S113-A116 PolarHBondContact O-N 3.31Å; A116-K118 PolarHBondContact O-N 3.32Å; A116-V130 HydrophobicContact CB-CG2 3.9Å; A116-I133 HydrophobicContact CB-CD1 3.47Å; A116-I133 VanDerWaalsContact CB-CD1 3.47Å; A116-I133 VanDerWaalsContact N-CD1 3.32Å
117	E	81.3	Confident	82.7	Confident	111 Å²	111	55.5 Å²	55.5	52%	0.519	27%	0.274	S	S	.	.	H	α-helix	trans	-65.2	-29.7	178.7	-168.6	-175.8	-178	0	0	112.9	S113 V115 K240	S113-E117 WeakPolarHBondContact O-CB 3.5Å; S113-E117 PolarHBondContact O-N 3.28Å; V115-E117 VanDerWaalsContact C-N 3.31Å; V115-E117 PolarHBondContact O-N 2.9Å; E117-K240 IonicContact OE1-NZ 2.9Å; E117-K240 PolarHBondContact OE1-NZ 3.35Å
118	K	78.6	Confident	82.5	Confident	85 Å²	85	54.9 Å²	54.9	37%	0.37	27%	0.269	S	S	.	.	H	α-helix	trans	-105.8	-10.1	-171	-68.1	-176.5	179.5	-167.7	0	114.4	I114 V115 A116 R169 A170	I114-K118 HydrophobicContact CG2-CD 4.1Å; I114-K118 WeakPolarHBondContact O-CB 3.16Å; I114-K118 VanDerWaalsContact O-CG 3.29Å; I114-K118 WeakPolarHBondContact O-CG 3.4Å; I114-K118 PolarHBondContact O-N 3.49Å; V115-K118 PolarHBondContact O-N 3.01Å; V115-K118 VanDerWaalsContact O-N 3.14Å; A116-K118 PolarHBondContact O-N 3.32Å; K118-R169 CarbonylContact O-C 3.57Å; K118-R169 VanDerWaalsContact O-CA 3.32Å; K118-R169 WeakPolarHBondContact O-CA 3.45Å; K118-A170 PolarHBondContact O-N 3.33Å
119	C	79.5	Confident	82.3	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.007	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.3	-174.8	-56.9	0	0	0	0	111	V115 Y128 Q168	V115-C119 HydrophobicContact CG1-CB 4.49Å; V115-C119 VanDerWaalsContact O-CB 3.24Å; V115-C119 WeakPolarHBondContact O-CB 3.46Å; V115-C119 PolarHBondContact O-N 3.17Å; V115-C119 PolarHBondContact O-SG 2.9Å; C119-Y128 HydrophobicContact CB-CD2 4.47Å; C119-Q168 CarbonylContact C-O 3.42Å; C119-Q168 VanDerWaalsContact CA-O 3.29Å; C119-Q168 WeakPolarHBondContact CA-O 3.16Å
120	V	81.7	Confident	82.2	Confident	12 Å²	12	54.1 Å²	54.1	7%	0.073	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	156.2	175.1	-65	0	0	0	0	109	R126 Q168 A170 V242	V120-R126 WeakPolarHBondContact CA-O 2.94Å; V120-Q168 PolarHBondContact N-O 2.73Å; V120-Q168 PolarHBondContact O-N 3.05Å; V120-A170 HydrophobicContact CG1-CB 4.19Å; V120-V242 HydrophobicContact CG1-CG2 4.37Å
121	N	81.4	Confident	82.2	Confident	33 Å²	33	54.6 Å²	54.6	18%	0.176	29%	0.291	C	S	.	.			trans	-74.5	127.7	169.4	-177.8	-34.4	0	0	0	108.8	D123 T124 K125 R126 Y128	N121-D123 VanDerWaalsContact C-N 3.3Å; N121-D123 PolarHBondContact O-N 2.86Å; N121-D123 PolarHBondContact OD1-N 3.17Å; N121-T124 VanDerWaalsContact CB-OG1 3.31Å; N121-T124 WeakPolarHBondContact CB-OG1 3.33Å; N121-T124 VanDerWaalsContact CG-OG1 3.32Å; N121-T124 PolarHBondContact ND2-OG1 3.32Å; N121-K125 WeakPolarHBondContact O-CA 3.44Å; N121-K125 PolarHBondContact O-N 3.3Å; N121-R126 PolarHBondContact N-O 3.46Å; N121-Y128 WeakPolarHBondContact CA-OH 3.27Å; N121-Y128 HydrophobicContact CB-CE1 4.08Å; N121-Y128 HydrophobicContact CB-CE2 4.03Å; N121-Y128 WeakPolarHBondContact CB-OH 3.31Å
122	P	73.7	Confident	82.1	Confident	47 Å²	47	58 Å²	58	31%	0.305	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-31.7	-178.4	25.7	-33.6	0	0	0	113.7	E166 Q168	P122-E166 WeakPolarHBondContact CD-O 3.41Å; P122-E166 HydrophobicContact CG-CB 3.95Å; P122-Q168 HydrophobicContact CB-CB 4.4Å
123	D	76	Confident	82	Confident	126 Å²	126	58.3 Å²	58.3	67%	0.674	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-39.4	-176.8	-63	-47.3	0	0	0	112.6	N121	N121-D123 VanDerWaalsContact C-N 3.3Å; N121-D123 PolarHBondContact O-N 2.86Å; N121-D123 PolarHBondContact OD1-N 3.17Å
124	T	76	Confident	82	Confident	62 Å²	62	58.1 Å²	58.1	38%	0.38	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-8.6	-174	57.5	0	0	0	0	113.3	N121 R126	N121-T124 VanDerWaalsContact CB-OG1 3.31Å; N121-T124 WeakPolarHBondContact CB-OG1 3.33Å; N121-T124 VanDerWaalsContact CG-OG1 3.32Å; N121-T124 PolarHBondContact ND2-OG1 3.32Å; T124-R126 WeakPolarHBondContact O-CG 3.23Å; T124-R126 PolarHBondContact O-N 3.31Å
125	K	70.3	Confident	82.2	Confident	82 Å²	82	64.8 Å²	64.8	36%	0.357	33%	0.327	S	S	.	.			trans	51.3	15	-172.3	-59.1	-176.2	179.1	-177.2	0	114.8	N121 E243	N121-K125 WeakPolarHBondContact O-CA 3.44Å; N121-K125 PolarHBondContact O-N 3.3Å; K125-E243 HydrophobicContact CB-CG 4.44Å; K125-E243 HydrophobicContact CD-CG 4.35Å
126	R	74.6	Confident	82.3	Confident	171 Å²	171	65 Å²	65	65%	0.645	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-87.6	142.6	-179.7	-72.9	174.6	-171.2	-163.2	0.1	110.6	V120 N121 T124	V120-R126 WeakPolarHBondContact CA-O 2.94Å; N121-R126 PolarHBondContact N-O 3.46Å; T124-R126 WeakPolarHBondContact O-CG 3.23Å; T124-R126 PolarHBondContact O-N 3.31Å
127	P	77.1	Confident	82.5	Confident	68 Å²	68	64.6 Å²	64.6	44%	0.442	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-68.7	146.1	173	29.6	-34.1	0	0	0	110.1	V242	P127-V242 HydrophobicContact CG-CG1 4.18Å
128	Y	83.1	Confident	82.9	Confident	33 Å²	33	65.4 Å²	65.4	13%	0.129	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-78.2	148.1	173	-69.2	-69.6	0	0	0	111.2	C119 N121 L132 M165 E166 I167	C119-Y128 HydrophobicContact CB-CD2 4.47Å; N121-Y128 WeakPolarHBondContact CA-OH 3.27Å; N121-Y128 HydrophobicContact CB-CE1 4.08Å; N121-Y128 HydrophobicContact CB-CE2 4.03Å; N121-Y128 WeakPolarHBondContact CB-OH 3.31Å; Y128-L132 HydrophobicContact CD1-CD2 3.31Å; Y128-L132 HydrophobicContact CE1-CD2 3.79Å; Y128-L132 HydrophobicContact CG-CD2 4.23Å; Y128-M165 HydrophobicContact CE1-CE 4.33Å; Y128-E166 PolarHBondContact OH-O 2.92Å; Y128-I167 HydrophobicContact CD2-CG2 4.22Å; Y128-I167 HydrophobicContact CE2-CB 4.21Å; Y128-I167 HydrophobicContact CE2-CG2 3.53Å
129	T	86.7	Confident	83.4	Confident	92 Å²	92	66.2 Å²	66.2	56%	0.564	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-74.8	148.5	171.4	60.8	0	0	0	0	110.4	S131 L132 I133	T129-S131 PolarHBondContact O-N 2.97Å; T129-L132 PolarHBondContact O-N 3.08Å; T129-L132 VanDerWaalsContact O-N 3.09Å; T129-I133 PolarHBondContact O-N 3.35Å
130	V	88.6	Confident	83.8	Confident	52 Å²	52	68.1 Å²	68.1	32%	0.315	35%	0.346	S	S	.	.	H	α-helix	trans	-55.3	-41.5	178.2	-176.4	0	0	0	0	110.8	A112 A116 L132 I133 E134	A112-V130 HydrophobicContact CB-CG1 3.99Å; A116-V130 HydrophobicContact CB-CG2 3.9Å; V130-L132 VanDerWaalsContact C-N 3.33Å; V130-L132 PolarHBondContact O-N 3.31Å; V130-I133 PolarHBondContact O-N 3.4Å; V130-E134 HydrophobicContact CG1-CG 4.29Å; V130-E134 WeakPolarHBondContact O-CG 3.42Å; V130-E134 PolarHBondContact O-N 3.2Å
131	S	90.3	Very high	84	Confident	84 Å²	84	75.6 Å²	75.6	59%	0.587	38%	0.38	S	S	*	.	H	α-helix	trans	-62.2	-35.2	179.5	-47.6	0	0	0	0	113.7	T129 R135	T129-S131 PolarHBondContact O-N 2.97Å; S131-R135 PolarHBondContact O-N 3.34Å; S131-R135 VanDerWaalsContact O-N 3.1Å
132	L	88.4	Confident	84.2	Confident	70 Å²	70	75.1 Å²	75.1	37%	0.366	38%	0.375	S	S	.	.	H	α-helix	trans	-68.2	-42	177.1	-168.4	78.9	0	0	0	110.5	Y128 T129 V130 R135 A136 M165	Y128-L132 HydrophobicContact CD1-CD2 3.31Å; Y128-L132 HydrophobicContact CE1-CD2 3.79Å; Y128-L132 HydrophobicContact CG-CD2 4.23Å; T129-L132 PolarHBondContact O-N 3.08Å; T129-L132 VanDerWaalsContact O-N 3.09Å; V130-L132 VanDerWaalsContact C-N 3.33Å; V130-L132 PolarHBondContact O-N 3.31Å; L132-R135 PolarHBondContact O-N 3.44Å; L132-A136 WeakPolarHBondContact O-CB 3.27Å; L132-A136 PolarHBondContact O-N 3.3Å; L132-M165 HydrophobicContact CD2-CE 3.91Å; L132-M165 HydrophobicContact CG-CE 4.38Å
133	I	88.4	Confident	84.8	Confident	7 Å²	7	77.2 Å²	77.2	4%	0.036	39%	0.391	C	S	.	.	H	α-helix	trans	-69.4	-39	177.8	-69.7	160	0	0	0	111.1	A112 V115 A116 T129 V130 R135 A136 M137 L161	A112-I133 HydrophobicContact CB-CG2 4.04Å; V115-I133 HydrophobicContact CB-CD1 4.41Å; V115-I133 HydrophobicContact CB-CG2 4.03Å; V115-I133 HydrophobicContact CG1-CD1 3.95Å; V115-I133 HydrophobicContact CG1-CG1 4.36Å; V115-I133 HydrophobicContact CG1-CG2 3.83Å; A116-I133 HydrophobicContact CB-CD1 3.47Å; A116-I133 VanDerWaalsContact CB-CD1 3.47Å; A116-I133 VanDerWaalsContact N-CD1 3.32Å; T129-I133 PolarHBondContact O-N 3.35Å; V130-I133 PolarHBondContact O-N 3.4Å; I133-R135 VanDerWaalsContact C-N 3.27Å; I133-R135 PolarHBondContact O-N 2.89Å; I133-A136 PolarHBondContact O-N 3.38Å; I133-M137 HydrophobicContact CG2-CG 4.14Å; I133-M137 HydrophobicContact CG2-SD 3.97Å; I133-M137 VanDerWaalsContact O-CB 3.3Å; I133-M137 WeakPolarHBondContact O-CB 3.15Å; I133-M137 VanDerWaalsContact O-CG 3.25Å; I133-M137 WeakPolarHBondContact O-CG 3.46Å; I133-M137 PolarHBondContact O-N 2.85Å; I133-L161 HydrophobicContact CG2-CD1 4.22Å
134	E	89.9	Confident	85.3	Confident	43 Å²	43	72 Å²	72	20%	0.201	36%	0.364	C	S	.	.	H	α-helix	trans	-58.4	-41.5	173.3	-76.4	-172	156.3	0	0	111.8	F108 R109 A112 V130 K138	F108-E134 HydrophobicContact CD1-CG 4.39Å; F108-E134 HydrophobicContact CE1-CB 3.97Å; F108-E134 HydrophobicContact CE1-CG 3.93Å; R109-E134 IonicContact NE-OE1 3.58Å; A112-E134 HydrophobicContact CB-CG 3.67Å; V130-E134 HydrophobicContact CG1-CG 4.29Å; V130-E134 WeakPolarHBondContact O-CG 3.42Å; V130-E134 PolarHBondContact O-N 3.2Å; E134-K138 WeakPolarHBondContact O-CG 3.48Å; E134-K138 PolarHBondContact O-N 2.93Å; E134-K138 VanDerWaalsContact O-N 3.1Å
135	R	89.6	Confident	85.8	Confident	171 Å²	171	74 Å²	74	65%	0.645	37%	0.367	S	S	*	.	H	α-helix	trans	-65.3	-49.1	174.8	-176.2	178.1	176.8	176.4	0.4	111	S131 L132 I133 M137 K138 D139	S131-R135 PolarHBondContact O-N 3.34Å; S131-R135 VanDerWaalsContact O-N 3.1Å; L132-R135 PolarHBondContact O-N 3.44Å; I133-R135 VanDerWaalsContact C-N 3.27Å; I133-R135 PolarHBondContact O-N 2.89Å; R135-M137 VanDerWaalsContact C-N 3.28Å; R135-M137 PolarHBondContact O-N 3.34Å; R135-K138 WeakPolarHBondContact O-CA 3.35Å; R135-K138 WeakPolarHBondContact O-CB 3.28Å; R135-K138 PolarHBondContact O-N 2.92Å; R135-D139 VanDerWaalsContact O-CG 3.27Å; R135-D139 PolarHBondContact O-N 3.35Å
136	A	89.1	Confident	86.3	Confident	6 Å²	6	73.7 Å²	73.7	5%	0.05	37%	0.374	C	S	.	.	H	α-helix	trans	-60.3	-39	179.2	0	0	0	0	0	112.1	L132 I133 K138 D139 I140 L161 M165	L132-A136 WeakPolarHBondContact O-CB 3.27Å; L132-A136 PolarHBondContact O-N 3.3Å; I133-A136 PolarHBondContact O-N 3.38Å; A136-K138 VanDerWaalsContact C-N 3.32Å; A136-K138 PolarHBondContact O-N 3.22Å; A136-D139 PolarHBondContact O-N 3.18Å; A136-I140 WeakPolarHBondContact O-CG1 3.42Å; A136-I140 PolarHBondContact O-N 2.92Å; A136-L161 HydrophobicContact CB-CD2 3.47Å; A136-L161 VanDerWaalsContact CB-CD2 3.47Å; A136-M165 HydrophobicContact CB-SD 3.53Å; A136-M165 VanDerWaalsContact CB-SD 3.53Å
137	M	88.9	Confident	86.7	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-64.4	-33.4	173.8	-76	-178.7	68.4	0	0	113	F108 I111 A112 I133 R135 I140 H141 Y142 V157 L161	F108-M137 HydrophobicContact CD2-CE 3.86Å; F108-M137 HydrophobicContact CE1-CB 4.41Å; F108-M137 HydrophobicContact CE2-CB 3.74Å; F108-M137 HydrophobicContact CE2-CE 3.69Å; F108-M137 HydrophobicContact CE2-SD 4.45Å; F108-M137 HydrophobicContact CG-CE 4.5Å; F108-M137 HydrophobicContact CZ-CB 3.44Å; F108-M137 VanDerWaalsContact CZ-CB 3.44Å; F108-M137 HydrophobicContact CZ-CE 4.19Å; F108-M137 HydrophobicContact CZ-CG 4.48Å; F108-M137 HydrophobicContact CZ-SD 4.37Å; I111-M137 HydrophobicContact CB-CE 4.26Å; I111-M137 HydrophobicContact CG2-CE 3.74Å; I111-M137 HydrophobicContact CG2-SD 4.23Å; A112-M137 HydrophobicContact CB-SD 4.01Å; I133-M137 HydrophobicContact CG2-CG 4.14Å; I133-M137 HydrophobicContact CG2-SD 3.97Å; I133-M137 VanDerWaalsContact O-CB 3.3Å; I133-M137 WeakPolarHBondContact O-CB 3.15Å; I133-M137 VanDerWaalsContact O-CG 3.25Å; I133-M137 WeakPolarHBondContact O-CG 3.46Å; I133-M137 PolarHBondContact O-N 2.85Å; R135-M137 VanDerWaalsContact C-N 3.28Å; R135-M137 PolarHBondContact O-N 3.34Å; M137-I140 VanDerWaalsContact O-CG1 3.3Å; M137-I140 WeakPolarHBondContact O-CG1 3.22Å; M137-H141 PolarHBondContact O-N 3.35Å; M137-Y142 HydrophobicContact CE-CD1 3.87Å; M137-Y142 HydrophobicContact CE-CE1 4.48Å; M137-Y142 PolarHBondContact O-N 3.28Å; M137-Y142 VanDerWaalsContact O-N 3.08Å; M137-V157 HydrophobicContact CE-CG1 4.19Å; M137-V157 HydrophobicContact CE-CG2 3.93Å; M137-V157 HydrophobicContact CG-CG1 3.71Å; M137-V157 HydrophobicContact SD-CG1 3.89Å; M137-L161 HydrophobicContact CG-CD1 4.39Å
138	K	89	Confident	87	Confident	129 Å²	129	73.7 Å²	73.7	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-72.7	-38.4	173.2	-75.2	172.7	-177.3	173.5	0	111.8	F108 E134 R135 A136 H141	F108-K138 HydrophobicContact CZ-CG 3.98Å; E134-K138 WeakPolarHBondContact O-CG 3.48Å; E134-K138 PolarHBondContact O-N 2.93Å; E134-K138 VanDerWaalsContact O-N 3.1Å; R135-K138 WeakPolarHBondContact O-CA 3.35Å; R135-K138 WeakPolarHBondContact O-CB 3.28Å; R135-K138 PolarHBondContact O-N 2.92Å; A136-K138 VanDerWaalsContact C-N 3.32Å; A136-K138 PolarHBondContact O-N 3.22Å; K138-H141 WeakPolarHBondContact O-CA 3.31Å; K138-H141 PolarHBondContact O-N 3.42Å; K138-H141 PolarHBondContact O-ND1 3.34Å
139	D	88.8	Confident	87.2	Confident	101 Å²	101	75 Å²	75	54%	0.54	39%	0.394	S	S	.	.	H	α-helix	trans	-66.6	-38.1	-179.9	-66.2	-19.2	0	0	0	111.3	R135 A136 H141	R135-D139 VanDerWaalsContact O-CG 3.27Å; R135-D139 PolarHBondContact O-N 3.35Å; A136-D139 PolarHBondContact O-N 3.18Å; D139-H141 PolarHBondContact O-N 2.86Å
140	I	87.4	Confident	87.2	Confident	42 Å²	42	72.6 Å²	72.6	22%	0.215	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-0	171.9	67.8	174.6	0	0	0	113.5	A136 M137 Y142 Q160 L161	A136-I140 WeakPolarHBondContact O-CG1 3.42Å; A136-I140 PolarHBondContact O-N 2.92Å; M137-I140 VanDerWaalsContact O-CG1 3.3Å; M137-I140 WeakPolarHBondContact O-CG1 3.22Å; I140-Y142 VanDerWaalsContact C-N 3.28Å; I140-Y142 PolarHBondContact O-N 3.2Å; I140-Q160 HydrophobicContact CD1-CB 4.02Å; I140-L161 HydrophobicContact CD1-CD2 3.95Å; I140-L161 HydrophobicContact CD1-CG 4.19Å; I140-L161 HydrophobicContact CG2-CD2 4.35Å
141	H	86.8	Confident	87	Confident	169 Å²	169	76.9 Å²	76.9	78%	0.782	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	42.7	-175.8	-63.2	-57.5	0	0	0	114	M137 K138 D139 S143	M137-H141 PolarHBondContact O-N 3.35Å; K138-H141 WeakPolarHBondContact O-CA 3.31Å; K138-H141 PolarHBondContact O-N 3.42Å; K138-H141 PolarHBondContact O-ND1 3.34Å; D139-H141 PolarHBondContact O-N 2.86Å; H141-S143 PolarHBondContact O-N 3.38Å
142	Y	86.4	Confident	86.9	Confident	22 Å²	22	78.7 Å²	78.7	9%	0.086	39%	0.392	C	S	.	.			trans	-68.2	126.9	-178.8	-176.7	-99.6	0	0	0	111.7	M137 I140 V144 Q153 E156 V157 Q160	M137-Y142 HydrophobicContact CE-CD1 3.87Å; M137-Y142 HydrophobicContact CE-CE1 4.48Å; M137-Y142 PolarHBondContact O-N 3.28Å; M137-Y142 VanDerWaalsContact O-N 3.08Å; I140-Y142 VanDerWaalsContact C-N 3.28Å; I140-Y142 PolarHBondContact O-N 3.2Å; Y142-V144 HydrophobicContact CD1-CG2 4.18Å; Y142-V144 HydrophobicContact CE1-CG2 4.14Å; Y142-Q153 WeakPolarHBondContact OH-CB 3.47Å; Y142-Q153 PolarHBondContact OH-OE1 2.85Å; Y142-E156 HydrophobicContact CE2-CG 4.44Å; Y142-V157 HydrophobicContact CD1-CG2 3.69Å; Y142-V157 HydrophobicContact CD2-CG2 3.94Å; Y142-V157 HydrophobicContact CE1-CG2 3.52Å; Y142-V157 HydrophobicContact CE2-CG2 3.77Å; Y142-V157 HydrophobicContact CG-CG2 3.89Å; Y142-Q160 VanDerWaalsContact CD2-OE1 3.26Å
143	S	86.1	Confident	86.8	Confident	92 Å²	92	75.4 Å²	75.4	64%	0.643	38%	0.375	S	S	*	.			trans	-100	113.5	178.7	-165.5	0	0	0	0	111.3	H141	H141-S143 PolarHBondContact O-N 3.38Å
144	V	86.7	Confident	86.8	Confident	15 Å²	15	75.1 Å²	75.1	9%	0.091	37%	0.374	C	S	.	.			trans	-69.5	130.6	180	-179.4	0	0	0	0	110.7	L104 M107 F108 I111 Y142	L104-V144 HydrophobicContact CD2-CB 4.44Å; M107-V144 HydrophobicContact CB-CG1 3.78Å; M107-V144 HydrophobicContact SD-CG1 4.31Å; F108-V144 HydrophobicContact CB-CG2 4.05Å; F108-V144 HydrophobicContact CD2-CG2 3.76Å; F108-V144 HydrophobicContact CG-CG2 4.4Å; I111-V144 HydrophobicContact CD1-CG1 3.81Å; I111-V144 HydrophobicContact CD1-CG2 4.02Å; Y142-V144 HydrophobicContact CD1-CG2 4.18Å; Y142-V144 HydrophobicContact CE1-CG2 4.14Å
145	K	85.3	Confident	86.6	Confident	104 Å²	104	76.5 Å²	76.5	45%	0.452	38%	0.382	S	S	.	.			trans	-104.8	111.8	-179.3	-68.7	178	-179.2	169.1	0	110.3	N147 K148 Q153	K145-N147 PolarHBondContact O-N 3.24Å; K145-N147 VanDerWaalsContact O-N 3.1Å; K145-K148 HydrophobicContact CB-CG 4.44Å; K145-K148 HydrophobicContact CD-CD 4.37Å; K145-K148 PolarHBondContact O-N 2.94Å; K145-K148 VanDerWaalsContact O-N 3.14Å; K145-Q153 PolarHBondContact O-NE2 2.91Å
146	P	81.1	Confident	86.4	Confident	76 Å²	76	71.2 Å²	71.2	49%	0.494	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-18.5	-177.1	25.8	-34.2	0	0	0	113.7	M107 K148	M107-P146 HydrophobicContact CE-CB 4.02Å; M107-P146 HydrophobicContact SD-CB 4.21Å; P146-K148 VanDerWaalsContact C-N 3.33Å
147	N	82.8	Confident	86.3	Confident	162 Å²	162	70.9 Å²	70.9	87%	0.866	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.6	179.1	-63.6	-10.8	0	0	0	113.5	K145	K145-N147 PolarHBondContact O-N 3.24Å; K145-N147 VanDerWaalsContact O-N 3.1Å
148	K	83.6	Confident	86.2	Confident	77 Å²	77	71.6 Å²	71.6	34%	0.335	37%	0.366	S	S	.	.	S	Bend	trans	-104.4	146.4	-179.8	-71.2	-173.4	177.3	-174.6	0	110.3	K145 P146 Q153 E156	K145-K148 HydrophobicContact CB-CG 4.44Å; K145-K148 HydrophobicContact CD-CD 4.37Å; K145-K148 PolarHBondContact O-N 2.94Å; K145-K148 VanDerWaalsContact O-N 3.14Å; P146-K148 VanDerWaalsContact C-N 3.33Å; K148-Q153 HydrophobicContact CB-CG 3.81Å; K148-Q153 HydrophobicContact CD-CG 4.32Å; K148-Q153 PolarHBondContact O-NE2 3.33Å; K148-E156 IonicContact NZ-OE2 2.76Å; K148-E156 PolarHBondContact NZ-OE2 3.1Å
149	S	87.1	Confident	86	Confident	62 Å²	62	74.6 Å²	74.6	43%	0.434	37%	0.374	S	S	.	.			trans	-60.6	141.3	173	178.3	0	0	0	0	111.5	K151 Q152 Q153	S149-K151 PolarHBondContact O-N 3.3Å; S149-K151 PolarHBondContact OG-N 3.09Å; S149-Q152 PolarHBondContact O-N 3.35Å; S149-Q152 VanDerWaalsContact O-N 3.11Å; S149-Q153 WeakPolarHBondContact O-CG 3.32Å; S149-Q153 PolarHBondContact O-N 3.2Å; S149-Q153 VanDerWaalsContact O-N 3.09Å
150	T	86.6	Confident	85.9	Confident	41 Å²	41	73 Å²	73	25%	0.252	36%	0.363	S	S	.	.	H	α-helix	trans	-54.5	-37.4	175.5	51.2	0	0	0	0	112.2	I111 Q153 A154	I111-T150 HydrophobicContact CG1-CG2 4.38Å; T150-Q153 PolarHBondContact O-N 3.45Å; T150-A154 WeakPolarHBondContact O-CB 3.24Å; T150-A154 PolarHBondContact O-N 2.59Å
151	K	84.5	Confident	85.8	Confident	142 Å²	142	71.2 Å²	71.2	62%	0.617	35%	0.354	S	S	*	.	H	α-helix	trans	-63.3	-44.1	177	-69.4	-176.7	-179.4	179.3	0	112.5	S149 A154 L155	S149-K151 PolarHBondContact O-N 3.3Å; S149-K151 PolarHBondContact OG-N 3.09Å; K151-A154 PolarHBondContact O-N 3.06Å; K151-L155 WeakPolarHBondContact O-CG 3.38Å; K151-L155 PolarHBondContact O-N 2.87Å
152	Q	87.4	Confident	85.6	Confident	122 Å²	122	70.1 Å²	70.1	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-66.4	-41.7	178.9	-71.5	178.5	-17.7	0	0	110.9	S149 A154 L155 E156	S149-Q152 PolarHBondContact O-N 3.35Å; S149-Q152 VanDerWaalsContact O-N 3.11Å; Q152-A154 VanDerWaalsContact C-N 3.34Å; Q152-A154 PolarHBondContact O-N 3Å; Q152-L155 PolarHBondContact O-N 3.11Å; Q152-E156 PolarHBondContact O-N 2.97Å
153	Q	88.1	Confident	85.3	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-63.6	-39.1	176.4	-68.5	-171.9	72.6	0	0	112	I111 Y142 K145 K148 S149 T150 L155 E156 V157	I111-Q153 HydrophobicContact CD1-CB 3.83Å; I111-Q153 HydrophobicContact CG1-CB 4.3Å; Y142-Q153 WeakPolarHBondContact OH-CB 3.47Å; Y142-Q153 PolarHBondContact OH-OE1 2.85Å; K145-Q153 PolarHBondContact O-NE2 2.91Å; K148-Q153 HydrophobicContact CB-CG 3.81Å; K148-Q153 HydrophobicContact CD-CG 4.32Å; K148-Q153 PolarHBondContact O-NE2 3.33Å; S149-Q153 WeakPolarHBondContact O-CG 3.32Å; S149-Q153 PolarHBondContact O-N 3.2Å; S149-Q153 VanDerWaalsContact O-N 3.09Å; T150-Q153 PolarHBondContact O-N 3.45Å; Q153-L155 VanDerWaalsContact C-N 3.28Å; Q153-L155 PolarHBondContact O-N 3.16Å; Q153-E156 WeakPolarHBondContact O-CB 2.97Å; Q153-E156 PolarHBondContact O-N 2.9Å; Q153-E156 VanDerWaalsContact O-N 3.08Å; Q153-V157 WeakPolarHBondContact O-CG2 3.29Å; Q153-V157 PolarHBondContact O-N 3.14Å
154	A	87.3	Confident	84.9	Confident	2 Å²	2	77.4 Å²	77.4	2%	0.017	38%	0.378	C	S	.	.	H	α-helix	trans	-58.9	-37.7	174.8	0	0	0	0	0	112.6	I111 I114 V115 T150 K151 Q152 E156 V157 I158	I111-A154 HydrophobicContact CG2-CB 4.32Å; I114-A154 HydrophobicContact CB-CB 4.27Å; I114-A154 HydrophobicContact CG2-CB 3.69Å; V115-A154 HydrophobicContact CG2-CB 3.95Å; T150-A154 WeakPolarHBondContact O-CB 3.24Å; T150-A154 PolarHBondContact O-N 2.59Å; K151-A154 PolarHBondContact O-N 3.06Å; Q152-A154 VanDerWaalsContact C-N 3.34Å; Q152-A154 PolarHBondContact O-N 3Å; A154-E156 VanDerWaalsContact C-N 3.35Å; A154-V157 PolarHBondContact O-N 3.42Å; A154-I158 WeakPolarHBondContact O-CD1 3.25Å; A154-I158 WeakPolarHBondContact O-CG1 3.48Å; A154-I158 PolarHBondContact O-N 3.3Å
155	L	85.3	Confident	84.4	Confident	71 Å²	71	79.3 Å²	79.3	37%	0.372	39%	0.387	S	S	.	.	H	α-helix	trans	-67.3	-36.4	175.8	-47.9	176.9	0	0	0	112.2	K151 Q152 Q153 R159	K151-L155 WeakPolarHBondContact O-CG 3.38Å; K151-L155 PolarHBondContact O-N 2.87Å; Q152-L155 PolarHBondContact O-N 3.11Å; Q153-L155 VanDerWaalsContact C-N 3.28Å; Q153-L155 PolarHBondContact O-N 3.16Å; L155-R159 PolarHBondContact O-N 3.46Å
156	E	86.3	Confident	83.8	Confident	60 Å²	60	81.1 Å²	81.1	28%	0.28	40%	0.397	S	S	.	.	H	α-helix	trans	-66.2	-45.6	176.8	-163.3	172.3	112.4	0	0	110.2	Y142 K148 Q152 Q153 A154 I158 R159 Q160	Y142-E156 HydrophobicContact CE2-CG 4.44Å; K148-E156 IonicContact NZ-OE2 2.76Å; K148-E156 PolarHBondContact NZ-OE2 3.1Å; Q152-E156 PolarHBondContact O-N 2.97Å; Q153-E156 WeakPolarHBondContact O-CB 2.97Å; Q153-E156 PolarHBondContact O-N 2.9Å; Q153-E156 VanDerWaalsContact O-N 3.08Å; A154-E156 VanDerWaalsContact C-N 3.35Å; E156-I158 PolarHBondContact O-N 2.85Å; E156-R159 PolarHBondContact O-N 3.36Å; E156-Q160 PolarHBondContact O-N 2.96Å
157	V	87.9	Confident	83.8	Confident	0 Å²	0	78 Å²	78	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-61.5	-43.9	176.3	171.3	0	0	0	0	111.6	I111 V115 M137 Y142 Q153 A154 R159 Q160 L161	I111-V157 HydrophobicContact CG2-CB 4.46Å; I111-V157 HydrophobicContact CG2-CG2 3.99Å; V115-V157 HydrophobicContact CG2-CB 4.42Å; V115-V157 HydrophobicContact CG2-CG1 4.11Å; M137-V157 HydrophobicContact CE-CG1 4.19Å; M137-V157 HydrophobicContact CE-CG2 3.93Å; M137-V157 HydrophobicContact CG-CG1 3.71Å; M137-V157 HydrophobicContact SD-CG1 3.89Å; Y142-V157 HydrophobicContact CD1-CG2 3.69Å; Y142-V157 HydrophobicContact CD2-CG2 3.94Å; Y142-V157 HydrophobicContact CE1-CG2 3.52Å; Y142-V157 HydrophobicContact CE2-CG2 3.77Å; Y142-V157 HydrophobicContact CG-CG2 3.89Å; Q153-V157 WeakPolarHBondContact O-CG2 3.29Å; Q153-V157 PolarHBondContact O-N 3.14Å; A154-V157 PolarHBondContact O-N 3.42Å; V157-R159 VanDerWaalsContact C-N 3.26Å; V157-R159 PolarHBondContact O-N 3.34Å; V157-Q160 PolarHBondContact O-N 3.34Å; V157-L161 HydrophobicContact CG1-CD1 3.49Å; V157-L161 VanDerWaalsContact CG1-CD1 3.49Å; V157-L161 HydrophobicContact CG1-CG 3.94Å; V157-L161 WeakPolarHBondContact O-CB 3.35Å; V157-L161 VanDerWaalsContact O-CG 3.31Å; V157-L161 WeakPolarHBondContact O-CG 3.37Å; V157-L161 PolarHBondContact O-N 3.01Å
158	I	85.9	Confident	83.3	Confident	14 Å²	14	73.5 Å²	73.5	7%	0.072	35%	0.349	C	S	.	.	H	α-helix	trans	-59.6	-37.6	177.5	-69.4	164.3	0	0	0	111.6	V115 A154 E156 K162 I167	V115-I158 HydrophobicContact CG1-CG1 3.99Å; V115-I158 HydrophobicContact CG2-CD1 4.4Å; V115-I158 HydrophobicContact CG2-CG1 4.02Å; A154-I158 WeakPolarHBondContact O-CD1 3.25Å; A154-I158 WeakPolarHBondContact O-CG1 3.48Å; A154-I158 PolarHBondContact O-N 3.3Å; E156-I158 PolarHBondContact O-N 2.85Å; I158-K162 WeakPolarHBondContact O-CB 3.29Å; I158-K162 PolarHBondContact O-N 2.75Å; I158-K162 VanDerWaalsContact O-N 3.1Å; I158-I167 HydrophobicContact CB-CD1 4.39Å; I158-I167 HydrophobicContact CG2-CD1 4.04Å
159	R	85.4	Confident	82.8	Confident	193 Å²	193	74.2 Å²	74.2	73%	0.728	35%	0.35	S	S	*	.	H	α-helix	trans	-67.2	-42.9	178.6	-74	176.8	175.2	167.3	-2	112.1	L155 E156 V157 K162	L155-R159 PolarHBondContact O-N 3.46Å; E156-R159 PolarHBondContact O-N 3.36Å; V157-R159 VanDerWaalsContact C-N 3.26Å; V157-R159 PolarHBondContact O-N 3.34Å; R159-K162 WeakPolarHBondContact O-CB 3.31Å; R159-K162 PolarHBondContact O-N 2.97Å
160	Q	86	Confident	82	Confident	68 Å²	68	71.7 Å²	71.7	32%	0.318	33%	0.333	S	S	.	.	H	α-helix	trans	-71.2	-42.1	179.4	-68.5	179.5	-7.6	0	0	111.8	I140 Y142 E156 V157 K162 E163	I140-Q160 HydrophobicContact CD1-CB 4.02Å; Y142-Q160 VanDerWaalsContact CD2-OE1 3.26Å; E156-Q160 PolarHBondContact O-N 2.96Å; V157-Q160 PolarHBondContact O-N 3.34Å; Q160-K162 PolarHBondContact O-N 3.48Å; Q160-E163 PolarHBondContact O-N 3.25Å; Q160-E163 VanDerWaalsContact O-N 3.12Å
161	L	84.9	Confident	81.2	Confident	3 Å²	3	70.9 Å²	70.9	2%	0.016	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-29.4	176.7	-73.9	177.3	0	0	0	112	V115 I133 A136 M137 I140 V157 E163 T164 M165 I167	V115-L161 HydrophobicContact CG1-CD1 4.13Å; I133-L161 HydrophobicContact CG2-CD1 4.22Å; A136-L161 HydrophobicContact CB-CD2 3.47Å; A136-L161 VanDerWaalsContact CB-CD2 3.47Å; M137-L161 HydrophobicContact CG-CD1 4.39Å; I140-L161 HydrophobicContact CD1-CD2 3.95Å; I140-L161 HydrophobicContact CD1-CG 4.19Å; I140-L161 HydrophobicContact CG2-CD2 4.35Å; V157-L161 HydrophobicContact CG1-CD1 3.49Å; V157-L161 VanDerWaalsContact CG1-CD1 3.49Å; V157-L161 HydrophobicContact CG1-CG 3.94Å; V157-L161 WeakPolarHBondContact O-CB 3.35Å; V157-L161 VanDerWaalsContact O-CG 3.31Å; V157-L161 WeakPolarHBondContact O-CG 3.37Å; V157-L161 PolarHBondContact O-N 3.01Å; L161-E163 PolarHBondContact O-N 2.8Å; L161-T164 PolarHBondContact O-N 2.93Å; L161-M165 CarbonylContact O-C 3.59Å; L161-M165 WeakPolarHBondContact O-CA 3.32Å; L161-M165 PolarHBondContact O-N 2.86Å; L161-I167 HydrophobicContact CB-CD1 3.39Å; L161-I167 HydrophobicContact CB-CG1 4.18Å; L161-I167 HydrophobicContact CD1-CD1 4.22Å; L161-I167 HydrophobicContact CG-CD1 4.47Å
162	K	82.4	Confident	80.8	Confident	147 Å²	147	65 Å²	65	64%	0.639	30%	0.301	S	S	*	.	H	α-helix	trans	-61.9	-25.4	175.3	-168.2	174.8	-178.2	-179.9	0	113.7	I158 R159 Q160 M165 I167	I158-K162 WeakPolarHBondContact O-CB 3.29Å; I158-K162 PolarHBondContact O-N 2.75Å; I158-K162 VanDerWaalsContact O-N 3.1Å; R159-K162 WeakPolarHBondContact O-CB 3.31Å; R159-K162 PolarHBondContact O-N 2.97Å; Q160-K162 PolarHBondContact O-N 3.48Å; K162-M165 CarbonylContact C-O 3.58Å; K162-M165 VanDerWaalsContact CA-O 3.28Å; K162-M165 WeakPolarHBondContact CA-O 3.43Å; K162-I167 HydrophobicContact CB-CG1 4.24Å
163	E	80.5	Confident	80.3	Confident	170 Å²	170	62.7 Å²	62.7	79%	0.794	29%	0.287	S	S	*	.	H	α-helix	trans	-80.1	-28.1	178.5	-63.1	-177.7	110.2	0	0	112.4	Q160 L161	Q160-E163 PolarHBondContact O-N 3.25Å; Q160-E163 VanDerWaalsContact O-N 3.12Å; L161-E163 PolarHBondContact O-N 2.8Å
164	T	77.5	Confident	79.8	Confident	97 Å²	97	62.7 Å²	62.7	60%	0.595	29%	0.287	S	S	*	.	H	α-helix	trans	-99.2	-31.7	-177.7	-53.9	0	0	0	0	112.3	L161	L161-T164 PolarHBondContact O-N 2.93Å
165	M	76.5	Confident	79.5	Confident	55 Å²	55	66.1 Å²	66.1	27%	0.271	30%	0.3	S	S	.	.	S	Bend	trans	-134.9	142.2	-177.8	-63.3	-178.1	69.3	0	0	109.5	Y128 L132 A136 L161 K162 I167	Y128-M165 HydrophobicContact CE1-CE 4.33Å; L132-M165 HydrophobicContact CD2-CE 3.91Å; L132-M165 HydrophobicContact CG-CE 4.38Å; A136-M165 HydrophobicContact CB-SD 3.53Å; A136-M165 VanDerWaalsContact CB-SD 3.53Å; L161-M165 CarbonylContact O-C 3.59Å; L161-M165 WeakPolarHBondContact O-CA 3.32Å; L161-M165 PolarHBondContact O-N 2.86Å; K162-M165 CarbonylContact C-O 3.58Å; K162-M165 VanDerWaalsContact CA-O 3.28Å; K162-M165 WeakPolarHBondContact CA-O 3.43Å; M165-I167 VanDerWaalsContact C-N 3.28Å; M165-I167 HydrophobicContact CB-CG2 3.99Å; M165-I167 PolarHBondContact O-N 2.99Å
166	E	73.6	Confident	79.1	Confident	141 Å²	141	62.8 Å²	62.8	66%	0.659	28%	0.282	S	S	*	.			trans	-73.2	85.9	173.1	-69	177	128.5	0	0	109.3	P122 Y128	P122-E166 WeakPolarHBondContact CD-O 3.41Å; P122-E166 HydrophobicContact CG-CB 3.95Å; Y128-E166 PolarHBondContact OH-O 2.92Å
167	I	79.4	Confident	78.7	Confident	12 Å²	12	60.7 Å²	60.7	6%	0.062	28%	0.276	C	S	.	.			trans	-108.3	135	174.3	65.2	161.6	0	0	0	110.2	Y128 I158 L161 K162 M165	Y128-I167 HydrophobicContact CD2-CG2 4.22Å; Y128-I167 HydrophobicContact CE2-CB 4.21Å; Y128-I167 HydrophobicContact CE2-CG2 3.53Å; I158-I167 HydrophobicContact CB-CD1 4.39Å; I158-I167 HydrophobicContact CG2-CD1 4.04Å; L161-I167 HydrophobicContact CB-CD1 3.39Å; L161-I167 HydrophobicContact CB-CG1 4.18Å; L161-I167 HydrophobicContact CD1-CD1 4.22Å; L161-I167 HydrophobicContact CG-CD1 4.47Å; K162-I167 HydrophobicContact CB-CG1 4.24Å; M165-I167 VanDerWaalsContact C-N 3.28Å; M165-I167 HydrophobicContact CB-CG2 3.99Å; M165-I167 PolarHBondContact O-N 2.99Å
168	Q	72.8	Confident	78.3	Confident	66 Å²	66	60.7 Å²	60.7	31%	0.308	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	148.1	174.8	-169.4	158.9	-15.4	0	0	109.4	C119 V120 P122 H171 Q195	C119-Q168 CarbonylContact C-O 3.42Å; C119-Q168 VanDerWaalsContact CA-O 3.29Å; C119-Q168 WeakPolarHBondContact CA-O 3.16Å; V120-Q168 PolarHBondContact N-O 2.73Å; V120-Q168 PolarHBondContact O-N 3.05Å; P122-Q168 HydrophobicContact CB-CB 4.4Å; Q168-H171 PolarHBondContact NE2-CE1 3.15Å; Q168-H171 VanDerWaalsContact NE2-CE1 3.33Å; Q168-H171 PolarHBondContact NE2-NE2 2.85Å; Q168-Q195 VanDerWaalsContact NE2-NE2 3.16Å
169	R	73.8	Confident	78	Confident	92 Å²	92	61.6 Å²	61.6	35%	0.347	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	142.5	172.5	-83.1	-169.9	-175.8	158.7	16.1	109.6	K118 H171	K118-R169 CarbonylContact O-C 3.57Å; K118-R169 VanDerWaalsContact O-CA 3.32Å; K118-R169 WeakPolarHBondContact O-CA 3.45Å; R169-H171 PolarHBondContact O-N 3.37Å
170	A	69.6	Low	77.2	Confident	9 Å²	9	54.1 Å²	54.1	7%	0.074	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-57.8	131.3	172.5	0	0	0	0	0	110	K118 V120	K118-A170 PolarHBondContact O-N 3.33Å; V120-A170 HydrophobicContact CG1-CB 4.19Å
171	H	70.3	Confident	76.5	Confident	24 Å²	24	60.4 Å²	60.4	11%	0.111	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-80.7	154	174.5	-59.9	-57.8	0	0	0	110.2	Q168 R169 Q195 L211 D213 D241	Q168-H171 PolarHBondContact NE2-CE1 3.15Å; Q168-H171 VanDerWaalsContact NE2-CE1 3.33Å; Q168-H171 PolarHBondContact NE2-NE2 2.85Å; R169-H171 PolarHBondContact O-N 3.37Å; H171-Q195 PolarHBondContact CE1-OE1 2.95Å; H171-Q195 PolarHBondContact ND1-OE1 3.01Å; H171-Q195 VanDerWaalsContact ND1-OE1 3.15Å; H171-Q195 PolarHBondContact NE2-OE1 3.4Å; H171-L211 HydrophobicContact CB-CB 4.32Å; H171-L211 HydrophobicContact CB-CD2 4.28Å; H171-D213 IonicContact CE1-OD1 3.78Å; H171-D213 PolarHBondContact CE1-OD1 3.42Å; H171-D213 IonicContact ND1-OD1 3.92Å; H171-D213 PolarHBondContact ND1-OD1 2.91Å; H171-D241 PolarHBondContact O-N 3.37Å
172	M	76.4	Confident	75.7	Confident	18 Å²	18	63 Å²	63	9%	0.089	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	136.7	170.6	-67.7	-177.5	54.3	0	0	109	L174 L211 V212 P214 F217 V236 L239	M172-L174 HydrophobicContact CE-CD2 4.04Å; M172-L211 WeakPolarHBondContact O-CA 3.17Å; M172-V212 PolarHBondContact N-O 3.41Å; M172-V212 PolarHBondContact O-N 3.35Å; M172-P214 HydrophobicContact CG-CB 4.15Å; M172-P214 HydrophobicContact SD-CB 3.63Å; M172-F217 HydrophobicContact CE-CD2 4.13Å; M172-F217 HydrophobicContact CE-CE2 4.44Å; M172-V236 HydrophobicContact CE-CG1 3.73Å; M172-V236 HydrophobicContact CE-CG2 4.28Å; M172-L239 HydrophobicContact CE-CD2 3.74Å; M172-L239 HydrophobicContact SD-CD2 4.49Å
173	R	76.3	Confident	75	Confident	75 Å²	75	56.1 Å²	56.1	28%	0.283	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	115.8	165.5	-85.3	-175.4	166.1	130.6	18.9	108.9	E198 V210 L211 L237 S238 D241	R173-E198 IonicContact CZ-OE1 2.74Å; R173-E198 IonicContact CZ-OE2 3.49Å; R173-E198 IonicContact NE-OE1 3.15Å; R173-E198 PolarHBondContact NE-OE1 2.89Å; R173-E198 IonicContact NE-OE2 3.46Å; R173-E198 PolarHBondContact NE-OE2 2.78Å; R173-E198 IonicContact NH2-OE1 3.12Å; R173-E198 PolarHBondContact NH2-OE1 3.1Å; R173-E198 IonicContact NH2-OE2 2.71Å; R173-E198 PolarHBondContact NH2-OE2 2.84Å; R173-V210 WeakPolarHBondContact CA-O 3.22Å; R173-L211 HydrophobicContact CB-CD2 4.41Å; R173-L211 HydrophobicContact CG-CD2 3.36Å; R173-L211 HydrophobicContact CG-CG 4.43Å; R173-L237 HydrophobicContact CB-CB 4.29Å; R173-L237 PolarHBondContact O-N 2.83Å; R173-S238 PolarHBondContact N-O 2.9Å; R173-S238 PolarHBondContact O-N 2.82Å; R173-D241 WeakPolarHBondContact CD-OD2 3.47Å; R173-D241 WeakPolarHBondContact CG-OD2 3.43Å; R173-D241 IonicContact CZ-OD2 2.83Å; R173-D241 IonicContact NE-OD2 3.64Å; R173-D241 PolarHBondContact NE-OD2 3.18Å; R173-D241 IonicContact NH1-OD2 2.72Å; R173-D241 PolarHBondContact NH1-OD2 2.93Å; R173-D241 VanDerWaalsContact NH1-OD2 3.15Å; R173-D241 IonicContact NH2-OD1 3.47Å; R173-D241 IonicContact NH2-OD2 2.89Å; R173-D241 PolarHBondContact NH2-OD2 3.47Å; R173-D241 VanDerWaalsContact NH2-OD2 3.12Å
174	L	78.4	Confident	74.5	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	137	173.1	-59	-176.2	0	0	0	109.5	M172 V209 V210 V212 F217 L234 V236	M172-L174 HydrophobicContact CE-CD2 4.04Å; L174-V209 CarbonylContact O-C 3.55Å; L174-V209 WeakPolarHBondContact O-CA 3.3Å; L174-V210 HydrophobicContact CB-CG2 3.94Å; L174-V210 PolarHBondContact N-O 2.97Å; L174-V210 PolarHBondContact O-N 2.86Å; L174-V212 HydrophobicContact CB-CG2 4.42Å; L174-V212 HydrophobicContact CD1-CG2 3.29Å; L174-V212 HydrophobicContact CG-CG2 3.61Å; L174-F217 HydrophobicContact CD1-CD2 3.71Å; L174-F217 HydrophobicContact CD1-CE2 4.05Å; L174-F217 HydrophobicContact CD2-CD2 3.96Å; L174-F217 HydrophobicContact CD2-CE2 3.78Å; L174-F217 HydrophobicContact CG-CD2 4.49Å; L174-L234 HydrophobicContact CB-CD1 4.18Å; L174-L234 HydrophobicContact CD1-CD1 4.02Å; L174-V236 HydrophobicContact CD2-CB 4.17Å; L174-V236 HydrophobicContact CD2-CG1 4.15Å; L174-V236 HydrophobicContact CD2-CG2 3.74Å
175	R	80.2	Confident	74.3	Confident	73 Å²	73	59 Å²	59	28%	0.275	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	126.3	164.2	-176.8	179.9	-174.5	-156	8.4	108.5	E207 M208 V209 E235 L237	R175-E207 IonicContact CZ-OE1 2.88Å; R175-E207 IonicContact CZ-OE2 2.66Å; R175-E207 IonicContact NE-OE1 3.23Å; R175-E207 IonicContact NE-OE2 3.64Å; R175-E207 PolarHBondContact NE-OE2 3.21Å; R175-E207 IonicContact NH2-OE1 3.97Å; R175-E207 PolarHBondContact NH2-OE1 2.96Å; R175-E207 IonicContact NH2-OE2 3.22Å; R175-E207 PolarHBondContact NH2-OE2 3.14Å; R175-M208 WeakPolarHBondContact CA-O 3.48Å; R175-V209 HydrophobicContact CG-CG2 4.48Å; R175-E235 HydrophobicContact CB-CB 4.23Å; R175-E235 PolarHBondContact N-O 3.37Å; R175-E235 IonicContact NH1-OE2 3.62Å; R175-E235 PolarHBondContact NH1-OE2 2.87Å; R175-E235 PolarHBondContact O-N 2.91Å; R175-L237 HydrophobicContact CB-CD1 3.63Å; R175-L237 HydrophobicContact CB-CD2 4.24Å; R175-L237 HydrophobicContact CB-CG 3.64Å; R175-L237 HydrophobicContact CG-CD1 4.44Å
176	L	76.8	Confident	74.1	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.1	179.1	-66.5	150.8	0	0	0	106.9	L190 E207 M208 V210 I224 L234	L176-L190 HydrophobicContact CD1-CD1 4.34Å; L176-E207 CarbonylContact O-C 3.6Å; L176-E207 VanDerWaalsContact O-CA 3.29Å; L176-E207 WeakPolarHBondContact O-CA 3.35Å; L176-M208 HydrophobicContact CB-CB 4.41Å; L176-M208 HydrophobicContact CD1-CE 3.5Å; L176-M208 VanDerWaalsContact CD1-CE 3.5Å; L176-M208 PolarHBondContact N-O 3.46Å; L176-M208 PolarHBondContact O-N 3.33Å; L176-V210 HydrophobicContact CD1-CB 4.32Å; L176-V210 HydrophobicContact CD1-CG1 3.82Å; L176-V210 HydrophobicContact CD1-CG2 3.49Å; L176-V210 VanDerWaalsContact CD1-CG2 3.49Å; L176-V210 HydrophobicContact CG-CG2 4.44Å; L176-I224 HydrophobicContact CD2-CD1 3.15Å; L176-I224 HydrophobicContact CD2-CG1 4.02Å; L176-L234 HydrophobicContact CD2-CD1 3.27Å; L176-L234 HydrophobicContact CG-CD1 3.95Å
177	A	78.6	Confident	73.9	Confident	17 Å²	17	55.3 Å²	55.3	14%	0.14	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	115.6	170.7	0	0	0	0	0	108.7	L206 G232 S233	A177-L206 CarbonylContact C-O 3.58Å; A177-L206 WeakPolarHBondContact CA-O 3.34Å; A177-G232 CarbonylContact O-C 3.57Å; A177-G232 WeakPolarHBondContact O-CA 3.32Å; A177-S233 PolarHBondContact N-O 2.87Å; A177-S233 PolarHBondContact O-N 2.72Å
178	V	79.6	Confident	73.5	Confident	0 Å²	0	62 Å²	62	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.9	-170.2	177.6	0	0	0	0	110.7	A180 A183 L186 L206 T228	V178-A180 PolarHBondContact O-N 2.9Å; V178-A183 HydrophobicContact CG1-CB 4.48Å; V178-L186 HydrophobicContact CG1-CD2 4.27Å; V178-L186 HydrophobicContact CG2-CD2 3.71Å; V178-L206 HydrophobicContact CB-CB 4.47Å; V178-L206 PolarHBondContact N-O 3.39Å; V178-L206 WeakPolarHBondContact O-CA 3.36Å; V178-L206 WeakPolarHBondContact O-CB 3.21Å; V178-L206 PolarHBondContact O-N 3.38Å; V178-T228 HydrophobicContact CG1-CG2 3.57Å; V178-T228 HydrophobicContact CG2-CG2 4.44Å
179	P	78.4	Confident	73.5	Confident	32 Å²	32	63.1 Å²	63.1	21%	0.208	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	137.8	176.3	-24.6	33.9	0	0	0	113.5	K181 E182 A183 R231	P179-K181 PolarHBondContact O-N 2.83Å; P179-E182 PolarHBondContact O-N 2.97Å; P179-E182 VanDerWaalsContact O-N 3.14Å; P179-A183 PolarHBondContact O-N 2.74Å; P179-R231 HydrophobicContact CG-CB 4.12Å
180	A	69.3	Low	73.3	Confident	36 Å²	36	58.7 Å²	58.7	30%	0.298	26%	0.263	S	S	.	.	H	α-helix	trans	-55.6	-22.8	-172.5	0	0	0	0	0	115.7	V178 E182 F202	V178-A180 PolarHBondContact O-N 2.9Å; A180-E182 PolarHBondContact O-N 2.81Å; A180-F202 HydrophobicContact CB-CE1 3.91Å; A180-F202 HydrophobicContact CB-CZ 3.83Å
181	K	70.3	Confident	73.3	Confident	200 Å²	200	65.6 Å²	65.6	87%	0.87	29%	0.291	S	S	*	.	H	α-helix	trans	-68.7	-29.3	-179.2	-69	-178.2	-179.7	176.5	0	113.8	P179	P179-K181 PolarHBondContact O-N 2.83Å
182	E	69.6	Low	73.3	Confident	59 Å²	59	69.7 Å²	69.7	28%	0.276	32%	0.32	S	S	.	.	H	α-helix	trans	-116.7	-13	-174.5	-70.6	164.3	-177.7	0	0	112.4	P179 A180 K184 R185 L186 E227 T228	P179-E182 PolarHBondContact O-N 2.97Å; P179-E182 VanDerWaalsContact O-N 3.14Å; A180-E182 PolarHBondContact O-N 2.81Å; E182-K184 VanDerWaalsContact C-N 3.33Å; E182-K184 PolarHBondContact O-N 3.17Å; E182-R185 PolarHBondContact O-N 2.81Å; E182-L186 PolarHBondContact O-N 3.22Å; E182-L186 VanDerWaalsContact O-N 3.13Å; E182-E227 VanDerWaalsContact OE2-O 3.1Å; E182-T228 VanDerWaalsContact OE2-CA 3.25Å; E182-T228 WeakPolarHBondContact OE2-CA 3.38Å
183	A	66.4	Low	72.8	Confident	2 Å²	2	71.3 Å²	71.3	2%	0.017	33%	0.328	C	S	.	.	H	α-helix	trans	-45.8	-45.9	175.1	0	0	0	0	0	114.7	V178 P179 R185 L186 R187 F202 L206	V178-A183 HydrophobicContact CG1-CB 4.48Å; P179-A183 PolarHBondContact O-N 2.74Å; A183-R185 PolarHBondContact O-N 3.42Å; A183-L186 PolarHBondContact O-N 3.29Å; A183-R187 WeakPolarHBondContact O-CB 3.42Å; A183-R187 PolarHBondContact O-N 3.49Å; A183-F202 HydrophobicContact CB-CE2 4.15Å; A183-L206 HydrophobicContact CB-CB 3.72Å; A183-L206 HydrophobicContact CB-CD2 3.6Å; A183-L206 HydrophobicContact CB-CG 4.18Å
184	K	70.9	Confident	72.3	Confident	158 Å²	158	68.8 Å²	68.8	69%	0.687	32%	0.321	S	S	*	.	H	α-helix	trans	-66	-38.2	-177.4	-70.9	-176.2	179.5	179.1	0	113.3	E182 E188	E182-K184 VanDerWaalsContact C-N 3.33Å; E182-K184 PolarHBondContact O-N 3.17Å; K184-E188 PolarHBondContact O-N 3.27Å
185	R	72.9	Confident	71.5	Confident	170 Å²	170	73.5 Å²	73.5	64%	0.642	34%	0.343	S	S	*	.	H	α-helix	trans	-72.5	-40.8	178	-69.3	-177.9	177.9	-178.7	-0.3	111.4	E182 A183 R187 E188 K189	E182-R185 PolarHBondContact O-N 2.81Å; A183-R185 PolarHBondContact O-N 3.42Å; R185-R187 VanDerWaalsContact C-N 3.31Å; R185-E188 PolarHBondContact O-N 2.94Å; R185-K189 PolarHBondContact O-N 2.98Å
186	L	72.2	Confident	70.9	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-62.8	-41.9	176.2	-164.4	85	0	0	0	110.5	V178 E182 A183 E188 K189 L190 L223 I224 E227	V178-L186 HydrophobicContact CG1-CD2 4.27Å; V178-L186 HydrophobicContact CG2-CD2 3.71Å; E182-L186 PolarHBondContact O-N 3.22Å; E182-L186 VanDerWaalsContact O-N 3.13Å; A183-L186 PolarHBondContact O-N 3.29Å; L186-E188 PolarHBondContact O-N 3.48Å; L186-K189 PolarHBondContact O-N 3.36Å; L186-L190 HydrophobicContact CD2-CD1 3.62Å; L186-L190 HydrophobicContact CG-CD1 3.62Å; L186-L190 HydrophobicContact CG-CG 4.07Å; L186-L190 VanDerWaalsContact O-CB 3.3Å; L186-L190 WeakPolarHBondContact O-CB 3.17Å; L186-L190 VanDerWaalsContact O-CG 3.24Å; L186-L190 WeakPolarHBondContact O-CG 3.5Å; L186-L190 PolarHBondContact O-N 2.92Å; L186-L223 HydrophobicContact CD1-CD2 4.14Å; L186-I224 HydrophobicContact CD1-CG1 4.23Å; L186-I224 HydrophobicContact CD2-CG1 4.13Å; L186-E227 HydrophobicContact CD1-CB 3.75Å; L186-E227 HydrophobicContact CD1-CG 4.32Å
187	R	68.7	Low	70.6	Confident	116 Å²	116	76.9 Å²	76.9	44%	0.438	37%	0.371	S	S	.	.	H	α-helix	trans	-57.5	-44.8	176.6	-176.2	178.8	178.6	166.5	5.7	112.9	A183 R185 K189 L190 K191 E200	A183-R187 WeakPolarHBondContact O-CB 3.42Å; A183-R187 PolarHBondContact O-N 3.49Å; R185-R187 VanDerWaalsContact C-N 3.31Å; R187-K189 VanDerWaalsContact C-N 3.34Å; R187-K189 PolarHBondContact O-N 3.02Å; R187-L190 PolarHBondContact O-N 2.9Å; R187-K191 WeakPolarHBondContact O-CB 3.39Å; R187-K191 PolarHBondContact O-N 3.25Å; R187-E200 IonicContact CZ-OE1 2.59Å; R187-E200 IonicContact CZ-OE2 3.93Å; R187-E200 IonicContact NE-OE1 3.37Å; R187-E200 IonicContact NE-OE2 3.37Å; R187-E200 IonicContact NH1-OE1 3.27Å; R187-E200 PolarHBondContact NH1-OE1 2.91Å; R187-E200 IonicContact NH1-OE2 2.74Å; R187-E200 PolarHBondContact NH1-OE2 3.48Å; R187-E200 IonicContact NH2-OE2 2.81Å; R187-E200 PolarHBondContact NH2-OE2 3.28Å
188	E	72.9	Confident	69.9	Low	152 Å²	152	79.7 Å²	79.7	71%	0.71	38%	0.381	S	S	*	.	H	α-helix	trans	-64	-38.9	178.3	-73.3	-169.8	112.8	0	0	112.6	K184 R185 L186 P192	K184-E188 PolarHBondContact O-N 3.27Å; R185-E188 PolarHBondContact O-N 2.94Å; L186-E188 PolarHBondContact O-N 3.48Å; E188-P192 WeakPolarHBondContact O-CD 3.44Å
189	K	71.3	Confident	69.1	Low	90 Å²	90	82.2 Å²	82.2	39%	0.391	40%	0.399	S	S	.	.	H	α-helix	trans	-76.4	-29.9	178.1	-69.1	-178.5	177.2	174.1	0	113.4	R185 L186 R187 P192 L223 E227	R185-K189 PolarHBondContact O-N 2.98Å; L186-K189 PolarHBondContact O-N 3.36Å; R187-K189 VanDerWaalsContact C-N 3.34Å; R187-K189 PolarHBondContact O-N 3.02Å; K189-P192 VanDerWaalsContact O-CD 3.3Å; K189-P192 WeakPolarHBondContact O-CD 3.5Å; K189-P192 WeakPolarHBondContact O-CG 3.28Å; K189-L223 HydrophobicContact CB-CD1 4.47Å; K189-L223 HydrophobicContact CB-CD2 3.79Å; K189-L223 HydrophobicContact CD-CD1 4.24Å; K189-E227 IonicContact NZ-OE1 2.88Å; K189-E227 PolarHBondContact NZ-OE1 3.49Å; K189-E227 IonicContact NZ-OE2 3.25Å; K189-E227 PolarHBondContact NZ-OE2 3.16Å
190	L	70	Confident	68.5	Low	0 Å²	0	84 Å²	84	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-79.3	-32.4	176.7	-72.2	175.1	0	0	0	111.9	L176 L186 R187 P192 L193 L194 M208 I220 L223	L176-L190 HydrophobicContact CD1-CD1 4.34Å; L186-L190 HydrophobicContact CD2-CD1 3.62Å; L186-L190 HydrophobicContact CG-CD1 3.62Å; L186-L190 HydrophobicContact CG-CG 4.07Å; L186-L190 VanDerWaalsContact O-CB 3.3Å; L186-L190 WeakPolarHBondContact O-CB 3.17Å; L186-L190 VanDerWaalsContact O-CG 3.24Å; L186-L190 WeakPolarHBondContact O-CG 3.5Å; L186-L190 PolarHBondContact O-N 2.92Å; R187-L190 PolarHBondContact O-N 2.9Å; L190-P192 VanDerWaalsContact C-CD 3.41Å; L190-P192 VanDerWaalsContact C-N 3.31Å; L190-P192 VanDerWaalsContact O-N 3.07Å; L190-L193 CarbonylContact O-C 3.58Å; L190-L193 WeakPolarHBondContact O-CA 3.35Å; L190-L193 PolarHBondContact O-N 2.84Å; L190-L194 HydrophobicContact CB-CD1 3.58Å; L190-L194 HydrophobicContact CB-CG 3.89Å; L190-L194 WeakPolarHBondContact O-CB 3.43Å; L190-L194 WeakPolarHBondContact O-CG 3.44Å; L190-L194 PolarHBondContact O-N 3.21Å; L190-M208 HydrophobicContact CD1-CE 4.08Å; L190-I220 HydrophobicContact CD2-CG1 4.15Å; L190-I220 HydrophobicContact CD2-CG2 4.01Å; L190-L223 HydrophobicContact CD2-CD2 3.72Å; L190-L223 HydrophobicContact CG-CD2 3.99Å
191	K	70.3	Confident	68.6	Low	154 Å²	154	88.9 Å²	88.9	67%	0.67	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.9	-40.7	179.3	-140.1	177	-177.4	-177.3	0	116.1	R187	R187-K191 WeakPolarHBondContact O-CB 3.39Å; R187-K191 PolarHBondContact O-N 3.25Å
192	P	70.6	Confident	68.3	Low	109 Å²	109	84.6 Å²	84.6	71%	0.708	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-20.3	175.1	29	-37	0	0	0	114.9	E188 K189 L190	E188-P192 WeakPolarHBondContact O-CD 3.44Å; K189-P192 VanDerWaalsContact O-CD 3.3Å; K189-P192 WeakPolarHBondContact O-CD 3.5Å; K189-P192 WeakPolarHBondContact O-CG 3.28Å; L190-P192 VanDerWaalsContact C-CD 3.41Å; L190-P192 VanDerWaalsContact C-N 3.31Å; L190-P192 VanDerWaalsContact O-N 3.07Å
193	L	65.8	Low	68.2	Low	52 Å²	52	88.7 Å²	88.7	27%	0.272	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-17.5	-178.3	-69.3	158.8	0	0	0	112.6	L190	L190-L193 CarbonylContact O-C 3.58Å; L190-L193 WeakPolarHBondContact O-CA 3.35Å; L190-L193 PolarHBondContact O-N 2.84Å
194	L	65.8	Low	68.3	Low	23 Å²	23	96.8 Å²	96.8	12%	0.12	46%	0.464	C	S	.	.			trans	-92.1	136.4	179.7	-63.6	174.5	0	0	0	110.4	L190 V197 M208 V210 V212	L190-L194 HydrophobicContact CB-CD1 3.58Å; L190-L194 HydrophobicContact CB-CG 3.89Å; L190-L194 WeakPolarHBondContact O-CB 3.43Å; L190-L194 WeakPolarHBondContact O-CG 3.44Å; L190-L194 PolarHBondContact O-N 3.21Å; L194-V197 HydrophobicContact CD1-CG2 4.08Å; L194-M208 HydrophobicContact CD1-CE 4.16Å; L194-V210 HydrophobicContact CD1-CG1 3.88Å; L194-V210 HydrophobicContact CD2-CB 3.56Å; L194-V210 HydrophobicContact CD2-CG1 3.74Å; L194-V210 HydrophobicContact CD2-CG2 3.59Å; L194-V210 HydrophobicContact CG-CG1 4.38Å; L194-V212 HydrophobicContact CD2-CG1 3.36Å
195	Q	61.9	Low	68.2	Low	99 Å²	99	94.6 Å²	94.6	46%	0.463	46%	0.456	S	S	.	.	S	Bend	trans	-91.9	-42.8	177.9	-127.4	178	0.1	0	0	112.1	Q168 H171 L211	Q168-Q195 VanDerWaalsContact NE2-NE2 3.16Å; H171-Q195 PolarHBondContact CE1-OE1 2.95Å; H171-Q195 PolarHBondContact ND1-OE1 3.01Å; H171-Q195 VanDerWaalsContact ND1-OE1 3.15Å; H171-Q195 PolarHBondContact NE2-OE1 3.4Å; Q195-L211 PolarHBondContact N-O 3.26Å
196	V	66.8	Low	68.2	Low	75 Å²	75	86.7 Å²	86.7	46%	0.455	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	138.4	177.6	-179.5	0	0	0	0	109	E198 L211	V196-E198 HydrophobicContact CG1-CG 4.36Å; V196-L211 HydrophobicContact CB-CB 4.24Å; V196-L211 HydrophobicContact CB-CD1 4.02Å; V196-L211 HydrophobicContact CG1-CD1 4.35Å; V196-L211 PolarHBondContact O-N 3.16Å
197	V	69.6	Low	68.3	Low	69 Å²	69	89.5 Å²	89.5	42%	0.418	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.5	170	-178	0	0	0	0	107	L194 M208 V210	L194-V197 HydrophobicContact CD1-CG2 4.08Å; V197-M208 HydrophobicContact CG1-CG 3.73Å; V197-M208 HydrophobicContact CG1-SD 3.81Å; V197-M208 HydrophobicContact CG2-SD 4.28Å; V197-V210 HydrophobicContact CG2-CG1 4.28Å
198	E	64.5	Low	68.5	Low	76 Å²	76	84.1 Å²	84.1	36%	0.355	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-42.3	-173.8	-69.9	-173.3	131.2	0	0	112.5	R173 V196 V209 L211	R173-E198 IonicContact CZ-OE1 2.74Å; R173-E198 IonicContact CZ-OE2 3.49Å; R173-E198 IonicContact NE-OE1 3.15Å; R173-E198 PolarHBondContact NE-OE1 2.89Å; R173-E198 IonicContact NE-OE2 3.46Å; R173-E198 PolarHBondContact NE-OE2 2.78Å; R173-E198 IonicContact NH2-OE1 3.12Å; R173-E198 PolarHBondContact NH2-OE1 3.1Å; R173-E198 IonicContact NH2-OE2 2.71Å; R173-E198 PolarHBondContact NH2-OE2 2.84Å; V196-E198 HydrophobicContact CG1-CG 4.36Å; E198-V209 HydrophobicContact CB-CG1 4.5Å; E198-V209 PolarHBondContact N-O 2.56Å; E198-L211 HydrophobicContact CG-CD1 4.18Å; E198-L211 HydrophobicContact CG-CG 4.34Å
199	S	62.1	Low	68.8	Low	54 Å²	54	77.9 Å²	77.9	38%	0.378	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	140.3	177	56.6	0	0	0	0	110.5	M208 V209	S199-M208 WeakPolarHBondContact O-CA 3.31Å; S199-V209 PolarHBondContact O-N 2.98Å; S199-V209 WeakPolarHBondContact OG-CB 3.24Å; S199-V209 VanDerWaalsContact OG-CG2 3.31Å; S199-V209 WeakPolarHBondContact OG-CG2 3.3Å
200	E	65.8	Low	69.1	Low	70 Å²	70	73.6 Å²	73.6	33%	0.327	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	107.2	174.6	-167.3	179.5	-174.2	0	0	106.6	R187 L206	R187-E200 IonicContact CZ-OE1 2.59Å; R187-E200 IonicContact CZ-OE2 3.93Å; R187-E200 IonicContact NE-OE1 3.37Å; R187-E200 IonicContact NE-OE2 3.37Å; R187-E200 IonicContact NH1-OE1 3.27Å; R187-E200 PolarHBondContact NH1-OE1 2.91Å; R187-E200 IonicContact NH1-OE2 2.74Å; R187-E200 PolarHBondContact NH1-OE2 3.48Å; R187-E200 IonicContact NH2-OE2 2.81Å; R187-E200 PolarHBondContact NH2-OE2 3.28Å; E200-L206 HydrophobicContact CG-CD1 3.72Å
201	E	72.2	Confident	69.4	Low	138 Å²	138	74 Å²	74	65%	0.645	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	129.9	172	-77.2	-177.9	-173.4	0	0	108.9	E207	E201-E207 PolarHBondContact N-O 3.43Å; E201-E207 PolarHBondContact O-N 2.95Å
202	F	64.9	Low	69.5	Low	109 Å²	109	66.7 Å²	66.7	48%	0.478	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	97	-175	-151.9	-77.8	0	0	0	108.5	A180 A183 L206	A180-F202 HydrophobicContact CB-CE1 3.91Å; A180-F202 HydrophobicContact CB-CZ 3.83Å; A183-F202 HydrophobicContact CB-CE2 4.15Å; F202-L206 HydrophobicContact CD2-CB 4.42Å; F202-L206 HydrophobicContact CD2-CD1 3.47Å; F202-L206 VanDerWaalsContact CD2-CD1 3.47Å; F202-L206 HydrophobicContact CE2-CB 4.3Å; F202-L206 HydrophobicContact CE2-CD1 3.85Å
203	D	67.6	Low	69.5	Low	145 Å²	145	64.2 Å²	64.2	78%	0.775	32%	0.324	S	S	*	.	S	Bend	trans	-123.2	-108.7	175.2	-147.5	5.7	0	0	0	109.2
204	E	66.6	Low	69.6	Low	173 Å²	173	64.6 Å²	64.6	81%	0.808	33%	0.33	S	S	*	.	S	Bend	trans	-86.8	-30.2	173.4	-62.8	-170.6	149.6	0	0	113
205	E	69.7	Low	69.6	Low	112 Å²	112	66.7 Å²	66.7	52%	0.523	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.6	172.1	-60.3	-172.2	142.2	0	0	108.5	E207	E205-E207 PolarHBondContact O-N 3.4Å
206	L	72.4	Confident	69.8	Low	3 Å²	3	63.6 Å²	63.6	2%	0.016	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	112	169.2	173.5	77.5	0	0	0	107.2	A177 V178 A183 E200 F202	A177-L206 CarbonylContact C-O 3.58Å; A177-L206 WeakPolarHBondContact CA-O 3.34Å; V178-L206 HydrophobicContact CB-CB 4.47Å; V178-L206 PolarHBondContact N-O 3.39Å; V178-L206 WeakPolarHBondContact O-CA 3.36Å; V178-L206 WeakPolarHBondContact O-CB 3.21Å; V178-L206 PolarHBondContact O-N 3.38Å; A183-L206 HydrophobicContact CB-CB 3.72Å; A183-L206 HydrophobicContact CB-CD2 3.6Å; A183-L206 HydrophobicContact CB-CG 4.18Å; E200-L206 HydrophobicContact CG-CD1 3.72Å; F202-L206 HydrophobicContact CD2-CB 4.42Å; F202-L206 HydrophobicContact CD2-CD1 3.47Å; F202-L206 VanDerWaalsContact CD2-CD1 3.47Å; F202-L206 HydrophobicContact CE2-CB 4.3Å; F202-L206 HydrophobicContact CE2-CD1 3.85Å
207	E	74.9	Confident	70.1	Confident	60 Å²	60	63 Å²	63	28%	0.28	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.7	165.1	-68.3	-162.9	173.1	0	0	109.8	R175 L176 E201 E205	R175-E207 IonicContact CZ-OE1 2.88Å; R175-E207 IonicContact CZ-OE2 2.66Å; R175-E207 IonicContact NE-OE1 3.23Å; R175-E207 IonicContact NE-OE2 3.64Å; R175-E207 PolarHBondContact NE-OE2 3.21Å; R175-E207 IonicContact NH2-OE1 3.97Å; R175-E207 PolarHBondContact NH2-OE1 2.96Å; R175-E207 IonicContact NH2-OE2 3.22Å; R175-E207 PolarHBondContact NH2-OE2 3.14Å; L176-E207 CarbonylContact O-C 3.6Å; L176-E207 VanDerWaalsContact O-CA 3.29Å; L176-E207 WeakPolarHBondContact O-CA 3.35Å; E201-E207 PolarHBondContact N-O 3.43Å; E201-E207 PolarHBondContact O-N 2.95Å; E205-E207 PolarHBondContact O-N 3.4Å
208	M	73.4	Confident	70.3	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.015	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	127.5	179.7	-171.5	178.2	51	0	0	110.4	R175 L176 L190 L194 V197 S199 V210	R175-M208 WeakPolarHBondContact CA-O 3.48Å; L176-M208 HydrophobicContact CB-CB 4.41Å; L176-M208 HydrophobicContact CD1-CE 3.5Å; L176-M208 VanDerWaalsContact CD1-CE 3.5Å; L176-M208 PolarHBondContact N-O 3.46Å; L176-M208 PolarHBondContact O-N 3.33Å; L190-M208 HydrophobicContact CD1-CE 4.08Å; L194-M208 HydrophobicContact CD1-CE 4.16Å; V197-M208 HydrophobicContact CG1-CG 3.73Å; V197-M208 HydrophobicContact CG1-SD 3.81Å; V197-M208 HydrophobicContact CG2-SD 4.28Å; S199-M208 WeakPolarHBondContact O-CA 3.31Å; M208-V210 HydrophobicContact CE-CG1 3.65Å; M208-V210 HydrophobicContact CG-CG1 3.66Å; M208-V210 HydrophobicContact SD-CG1 3.77Å
209	V	79.3	Confident	71	Confident	22 Å²	22	70.3 Å²	70.3	13%	0.133	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.7	170.6	-176.8	0	0	0	0	108.9	L174 R175 E198 S199 L237	L174-V209 CarbonylContact O-C 3.55Å; L174-V209 WeakPolarHBondContact O-CA 3.3Å; R175-V209 HydrophobicContact CG-CG2 4.48Å; E198-V209 HydrophobicContact CB-CG1 4.5Å; E198-V209 PolarHBondContact N-O 2.56Å; S199-V209 PolarHBondContact O-N 2.98Å; S199-V209 WeakPolarHBondContact OG-CB 3.24Å; S199-V209 VanDerWaalsContact OG-CG2 3.31Å; S199-V209 WeakPolarHBondContact OG-CG2 3.3Å; V209-L237 HydrophobicContact CG1-CD1 3.99Å; V209-L237 HydrophobicContact CG2-CD1 3.87Å
210	V	77.8	Confident	71.7	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.8	-176.5	-59.8	0	0	0	0	112.7	R173 L174 L176 L194 V197 M208 V212	R173-V210 WeakPolarHBondContact CA-O 3.22Å; L174-V210 HydrophobicContact CB-CG2 3.94Å; L174-V210 PolarHBondContact N-O 2.97Å; L174-V210 PolarHBondContact O-N 2.86Å; L176-V210 HydrophobicContact CD1-CB 4.32Å; L176-V210 HydrophobicContact CD1-CG1 3.82Å; L176-V210 HydrophobicContact CD1-CG2 3.49Å; L176-V210 VanDerWaalsContact CD1-CG2 3.49Å; L176-V210 HydrophobicContact CG-CG2 4.44Å; L194-V210 HydrophobicContact CD1-CG1 3.88Å; L194-V210 HydrophobicContact CD2-CB 3.56Å; L194-V210 HydrophobicContact CD2-CG1 3.74Å; L194-V210 HydrophobicContact CD2-CG2 3.59Å; L194-V210 HydrophobicContact CG-CG1 4.38Å; V197-V210 HydrophobicContact CG2-CG1 4.28Å; M208-V210 HydrophobicContact CE-CG1 3.65Å; M208-V210 HydrophobicContact CG-CG1 3.66Å; M208-V210 HydrophobicContact SD-CG1 3.77Å; V210-V212 HydrophobicContact CG2-CG1 4.27Å; V210-V212 HydrophobicContact CG2-CG2 4.47Å
211	L	74.4	Confident	72.2	Confident	7 Å²	7	66 Å²	66	4%	0.037	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	121.4	169.8	-67.9	172.3	0	0	0	109.8	H171 M172 R173 Q195 V196 E198 D241	H171-L211 HydrophobicContact CB-CB 4.32Å; H171-L211 HydrophobicContact CB-CD2 4.28Å; M172-L211 WeakPolarHBondContact O-CA 3.17Å; R173-L211 HydrophobicContact CB-CD2 4.41Å; R173-L211 HydrophobicContact CG-CD2 3.36Å; R173-L211 HydrophobicContact CG-CG 4.43Å; Q195-L211 PolarHBondContact N-O 3.26Å; V196-L211 HydrophobicContact CB-CB 4.24Å; V196-L211 HydrophobicContact CB-CD1 4.02Å; V196-L211 HydrophobicContact CG1-CD1 4.35Å; V196-L211 PolarHBondContact O-N 3.16Å; E198-L211 HydrophobicContact CG-CD1 4.18Å; E198-L211 HydrophobicContact CG-CG 4.34Å; L211-D241 HydrophobicContact CD2-CB 3.74Å; L211-D241 VanDerWaalsContact CD2-CG 3.49Å; L211-D241 WeakPolarHBondContact CD2-OD2 3.45Å
212	V	72.8	Confident	72.6	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	151.3	-177.9	-79.2	0	0	0	0	112.8	M172 L174 L194 V210 I220	M172-V212 PolarHBondContact N-O 3.41Å; M172-V212 PolarHBondContact O-N 3.35Å; L174-V212 HydrophobicContact CB-CG2 4.42Å; L174-V212 HydrophobicContact CD1-CG2 3.29Å; L174-V212 HydrophobicContact CG-CG2 3.61Å; L194-V212 HydrophobicContact CD2-CG1 3.36Å; V210-V212 HydrophobicContact CG2-CG1 4.27Å; V210-V212 HydrophobicContact CG2-CG2 4.47Å; V212-I220 HydrophobicContact CB-CD1 3.88Å; V212-I220 HydrophobicContact CG1-CD1 3.51Å; V212-I220 HydrophobicContact CG2-CD1 4.13Å
213	D	70.3	Confident	73.1	Confident	57 Å²	57	60.9 Å²	60.9	31%	0.305	31%	0.313	S	S	.	.			trans	-67.2	134.5	171.4	-81.6	-61	0	0	0	110.9	H171 G215 C216	H171-D213 IonicContact CE1-OD1 3.78Å; H171-D213 PolarHBondContact CE1-OD1 3.42Å; H171-D213 IonicContact ND1-OD1 3.92Å; H171-D213 PolarHBondContact ND1-OD1 2.91Å; D213-G215 PolarHBondContact O-N 3.39Å; D213-C216 PolarHBondContact O-N 3.13Å
214	P	68.5	Low	73.5	Confident	60 Å²	60	54 Å²	54	39%	0.39	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.8	178.3	17.9	-29.2	0	0	0	113.7	M172	M172-P214 HydrophobicContact CG-CB 4.15Å; M172-P214 HydrophobicContact SD-CB 3.63Å
215	G	65.4	Low	74.1	Confident	68 Å²	68	53.1 Å²	53.1	70%	0.701	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-29.7	174.5	0	0	0	0	0	113.8	D213	D213-G215 PolarHBondContact O-N 3.39Å
216	C	67.6	Low	74.4	Confident	34 Å²	34	52.6 Å²	52.6	23%	0.23	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-7.7	-177.7	-57.4	0	0	0	0	112.4	D213 R218 E219 I220	D213-C216 PolarHBondContact O-N 3.13Å; C216-R218 VanDerWaalsContact C-N 3.26Å; C216-R218 PolarHBondContact O-N 3.46Å; C216-E219 PolarHBondContact O-N 3.18Å; C216-E219 VanDerWaalsContact O-N 3.16Å; C216-I220 HydrophobicContact CB-CD1 4.12Å; C216-I220 WeakPolarHBondContact O-CD1 3.12Å; C216-I220 VanDerWaalsContact O-CG1 3.28Å; C216-I220 WeakPolarHBondContact O-CG1 3.34Å; C216-I220 PolarHBondContact O-N 3.4Å
217	F	71.7	Confident	74.4	Confident	63 Å²	63	54.5 Å²	54.5	28%	0.276	28%	0.282	S	S	.	.	H	α-helix	trans	-51.4	-43.6	-179.4	178.1	-94.3	0	0	0	112.9	M172 L174 I220 D221 L234 V236	M172-F217 HydrophobicContact CE-CD2 4.13Å; M172-F217 HydrophobicContact CE-CE2 4.44Å; L174-F217 HydrophobicContact CD1-CD2 3.71Å; L174-F217 HydrophobicContact CD1-CE2 4.05Å; L174-F217 HydrophobicContact CD2-CD2 3.96Å; L174-F217 HydrophobicContact CD2-CE2 3.78Å; L174-F217 HydrophobicContact CG-CD2 4.49Å; F217-I220 PolarHBondContact O-N 2.92Å; F217-D221 PolarHBondContact O-N 3.29Å; F217-L234 HydrophobicContact CD2-CD2 4.3Å; F217-L234 HydrophobicContact CE2-CD2 3.48Å; F217-L234 VanDerWaalsContact CE2-CD2 3.48Å; F217-L234 HydrophobicContact CE2-CG 4.41Å; F217-L234 HydrophobicContact CZ-CD2 3.66Å; F217-V236 HydrophobicContact CE2-CG2 3.87Å; F217-V236 HydrophobicContact CZ-CG2 4.24Å
218	R	75.4	Confident	74	Confident	182 Å²	182	51.7 Å²	51.7	69%	0.687	27%	0.269	S	S	*	.	H	α-helix	trans	-68.4	-41.1	-178.2	-173.6	175	176.6	159.1	0.9	112.6	C216 I220 D221 E222	C216-R218 VanDerWaalsContact C-N 3.26Å; C216-R218 PolarHBondContact O-N 3.46Å; R218-I220 VanDerWaalsContact C-N 3.29Å; R218-D221 PolarHBondContact O-N 2.98Å; R218-E222 IonicContact NE-OE1 2.98Å; R218-E222 PolarHBondContact NE-OE1 3.5Å; R218-E222 IonicContact NH2-OE1 2.7Å; R218-E222 WeakPolarHBondContact O-CB 3.2Å; R218-E222 WeakPolarHBondContact O-CG 3.42Å; R218-E222 PolarHBondContact O-N 2.9Å
219	E	78.3	Confident	73.7	Confident	116 Å²	116	60 Å²	60	54%	0.542	31%	0.305	S	S	.	.	H	α-helix	trans	-65.4	-38	176.2	-67.4	-176.9	169.6	0	0	110.7	C216 L223	C216-E219 PolarHBondContact O-N 3.18Å; C216-E219 VanDerWaalsContact O-N 3.16Å; E219-L223 WeakPolarHBondContact O-CB 3.25Å; E219-L223 PolarHBondContact O-N 2.7Å
220	I	75.8	Confident	73.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.9	-47.4	176.9	-67.3	162	0	0	0	111.1	L190 V212 C216 F217 R218 E222 L223 I224	L190-I220 HydrophobicContact CD2-CG1 4.15Å; L190-I220 HydrophobicContact CD2-CG2 4.01Å; V212-I220 HydrophobicContact CB-CD1 3.88Å; V212-I220 HydrophobicContact CG1-CD1 3.51Å; V212-I220 HydrophobicContact CG2-CD1 4.13Å; C216-I220 HydrophobicContact CB-CD1 4.12Å; C216-I220 WeakPolarHBondContact O-CD1 3.12Å; C216-I220 VanDerWaalsContact O-CG1 3.28Å; C216-I220 WeakPolarHBondContact O-CG1 3.34Å; C216-I220 PolarHBondContact O-N 3.4Å; F217-I220 PolarHBondContact O-N 2.92Å; R218-I220 VanDerWaalsContact C-N 3.29Å; I220-E222 PolarHBondContact O-N 2.98Å; I220-L223 PolarHBondContact O-N 2.9Å; I220-I224 HydrophobicContact CG2-CD1 3.58Å; I220-I224 HydrophobicContact CG2-CG1 4.42Å; I220-I224 WeakPolarHBondContact O-CD1 3.33Å; I220-I224 WeakPolarHBondContact O-CG1 3.36Å; I220-I224 PolarHBondContact O-N 2.71Å
221	D	77.3	Confident	72.6	Confident	34 Å²	34	71.2 Å²	71.2	18%	0.182	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-44.8	176.7	-179.8	67.5	0	0	0	111.9	F217 R218 L223 I224 R225 L234	F217-D221 PolarHBondContact O-N 3.29Å; R218-D221 PolarHBondContact O-N 2.98Å; D221-L223 PolarHBondContact O-N 3.18Å; D221-I224 PolarHBondContact O-N 3.46Å; D221-R225 WeakPolarHBondContact O-CB 3.29Å; D221-R225 VanDerWaalsContact O-CG 3.31Å; D221-R225 WeakPolarHBondContact O-CG 3.46Å; D221-R225 PolarHBondContact O-N 2.83Å; D221-R225 IonicContact OD1-CZ 3.53Å; D221-R225 IonicContact OD1-NE 3.93Å; D221-R225 PolarHBondContact OD1-NE 2.83Å; D221-R225 IonicContact OD1-NH2 2.7Å; D221-R225 IonicContact OD2-CZ 2.79Å; D221-R225 VanDerWaalsContact OD2-CZ 3.31Å; D221-R225 IonicContact OD2-NE 3.85Å; D221-R225 PolarHBondContact OD2-NE 3.46Å; D221-R225 IonicContact OD2-NH2 3.5Å; D221-R225 PolarHBondContact OD2-NH2 2.85Å; D221-L234 HydrophobicContact CB-CD2 4.09Å
222	E	80	Confident	72.4	Confident	97 Å²	97	71.8 Å²	71.8	45%	0.453	37%	0.371	S	S	.	.	H	α-helix	trans	-63.6	-40.8	176.6	-75.2	178.6	-166.8	0	0	111.8	R218 I220 R225 C226	R218-E222 IonicContact NE-OE1 2.98Å; R218-E222 PolarHBondContact NE-OE1 3.5Å; R218-E222 IonicContact NH2-OE1 2.7Å; R218-E222 WeakPolarHBondContact O-CB 3.2Å; R218-E222 WeakPolarHBondContact O-CG 3.42Å; R218-E222 PolarHBondContact O-N 2.9Å; I220-E222 PolarHBondContact O-N 2.98Å; E222-R225 PolarHBondContact O-N 2.74Å; E222-C226 WeakPolarHBondContact O-CB 3.34Å; E222-C226 PolarHBondContact O-N 3.48Å; E222-C226 PolarHBondContact O-SG 3Å
223	L	77.1	Confident	72.3	Confident	41 Å²	41	74.5 Å²	74.5	22%	0.215	39%	0.389	C	S	.	.	H	α-helix	trans	-63.7	-44.8	177.3	-163.6	94.3	0	0	0	111.6	L186 K189 L190 E219 I220 D221 C226 E227	L186-L223 HydrophobicContact CD1-CD2 4.14Å; K189-L223 HydrophobicContact CB-CD1 4.47Å; K189-L223 HydrophobicContact CB-CD2 3.79Å; K189-L223 HydrophobicContact CD-CD1 4.24Å; L190-L223 HydrophobicContact CD2-CD2 3.72Å; L190-L223 HydrophobicContact CG-CD2 3.99Å; E219-L223 WeakPolarHBondContact O-CB 3.25Å; E219-L223 PolarHBondContact O-N 2.7Å; I220-L223 PolarHBondContact O-N 2.9Å; D221-L223 PolarHBondContact O-N 3.18Å; L223-C226 PolarHBondContact O-N 3.14Å; L223-E227 WeakPolarHBondContact O-CB 3.31Å; L223-E227 PolarHBondContact O-N 2.94Å
224	I	75.9	Confident	72.7	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-62.7	-48.7	177.9	-65.9	154.9	0	0	0	109.7	L176 L186 I220 D221 C226 E227 T228 L234	L176-I224 HydrophobicContact CD2-CD1 3.15Å; L176-I224 HydrophobicContact CD2-CG1 4.02Å; L186-I224 HydrophobicContact CD1-CG1 4.23Å; L186-I224 HydrophobicContact CD2-CG1 4.13Å; I220-I224 HydrophobicContact CG2-CD1 3.58Å; I220-I224 HydrophobicContact CG2-CG1 4.42Å; I220-I224 WeakPolarHBondContact O-CD1 3.33Å; I220-I224 WeakPolarHBondContact O-CG1 3.36Å; I220-I224 PolarHBondContact O-N 2.71Å; D221-I224 PolarHBondContact O-N 3.46Å; I224-C226 VanDerWaalsContact C-N 3.34Å; I224-C226 PolarHBondContact O-N 3.08Å; I224-E227 PolarHBondContact O-N 3.23Å; I224-T228 HydrophobicContact CG2-CG2 4.41Å; I224-T228 WeakPolarHBondContact O-CB 3.42Å; I224-T228 PolarHBondContact O-N 3.12Å; I224-T228 PolarHBondContact O-OG1 3.15Å; I224-L234 HydrophobicContact CD1-CB 4.44Å; I224-L234 HydrophobicContact CD1-CD1 3.76Å; I224-L234 HydrophobicContact CD1-CG 4.48Å
225	R	77.3	Confident	73.1	Confident	154 Å²	154	74.8 Å²	74.8	58%	0.581	39%	0.385	S	S	*	.	H	α-helix	trans	-60.5	-42.1	179.3	-72.8	176.8	-171	-146.1	2.8	112.6	D221 E222 K229 G230	D221-R225 WeakPolarHBondContact O-CB 3.29Å; D221-R225 VanDerWaalsContact O-CG 3.31Å; D221-R225 WeakPolarHBondContact O-CG 3.46Å; D221-R225 PolarHBondContact O-N 2.83Å; D221-R225 IonicContact OD1-CZ 3.53Å; D221-R225 IonicContact OD1-NE 3.93Å; D221-R225 PolarHBondContact OD1-NE 2.83Å; D221-R225 IonicContact OD1-NH2 2.7Å; D221-R225 IonicContact OD2-CZ 2.79Å; D221-R225 VanDerWaalsContact OD2-CZ 3.31Å; D221-R225 IonicContact OD2-NE 3.85Å; D221-R225 PolarHBondContact OD2-NE 3.46Å; D221-R225 IonicContact OD2-NH2 3.5Å; D221-R225 PolarHBondContact OD2-NH2 2.85Å; E222-R225 PolarHBondContact O-N 2.74Å; R225-K229 WeakPolarHBondContact O-CA 3.38Å; R225-K229 PolarHBondContact O-N 2.84Å; R225-K229 VanDerWaalsContact O-N 3.14Å; R225-G230 PolarHBondContact O-N 3.09Å
226	C	77.4	Confident	73.7	Confident	100 Å²	100	74.8 Å²	74.8	68%	0.676	37%	0.371	S	S	*	.	H	α-helix	trans	-66.8	-46.3	179.2	-72.1	0	0	0	0	112	E222 L223 I224	E222-C226 WeakPolarHBondContact O-CB 3.34Å; E222-C226 PolarHBondContact O-N 3.48Å; E222-C226 PolarHBondContact O-SG 3Å; L223-C226 PolarHBondContact O-N 3.14Å; I224-C226 VanDerWaalsContact C-N 3.34Å; I224-C226 PolarHBondContact O-N 3.08Å
227	E	71.2	Confident	73.9	Confident	43 Å²	43	77.5 Å²	77.5	20%	0.201	38%	0.383	C	S	.	.	H	α-helix	trans	-78	-33.5	-174.6	-145.6	76.8	177.9	0	0	112.1	E182 L186 K189 L223 I224	E182-E227 VanDerWaalsContact OE2-O 3.1Å; L186-E227 HydrophobicContact CD1-CB 3.75Å; L186-E227 HydrophobicContact CD1-CG 4.32Å; K189-E227 IonicContact NZ-OE1 2.88Å; K189-E227 PolarHBondContact NZ-OE1 3.49Å; K189-E227 IonicContact NZ-OE2 3.25Å; K189-E227 PolarHBondContact NZ-OE2 3.16Å; L223-E227 WeakPolarHBondContact O-CB 3.31Å; L223-E227 PolarHBondContact O-N 2.94Å; I224-E227 PolarHBondContact O-N 3.23Å
228	T	68.1	Low	73.6	Confident	1 Å²	1	76.5 Å²	76.5	1%	0.006	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	2.1	-179.3	62.6	0	0	0	0	115	V178 E182 I224 G230 R231 G232	V178-T228 HydrophobicContact CG1-CG2 3.57Å; V178-T228 HydrophobicContact CG2-CG2 4.44Å; E182-T228 VanDerWaalsContact OE2-CA 3.25Å; E182-T228 WeakPolarHBondContact OE2-CA 3.38Å; I224-T228 HydrophobicContact CG2-CG2 4.41Å; I224-T228 WeakPolarHBondContact O-CB 3.42Å; I224-T228 PolarHBondContact O-N 3.12Å; I224-T228 PolarHBondContact O-OG1 3.15Å; T228-G230 PolarHBondContact O-N 2.89Å; T228-G230 VanDerWaalsContact O-N 3.08Å; T228-R231 WeakPolarHBondContact O-CB 3.06Å; T228-R231 PolarHBondContact O-N 3.29Å; T228-G232 PolarHBondContact OG1-N 2.88Å
229	K	66.6	Low	72.9	Confident	178 Å²	178	73.8 Å²	73.8	77%	0.774	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	36.7	-173.1	-61.9	178	179.3	174.5	0	112.5	R225	R225-K229 WeakPolarHBondContact O-CA 3.38Å; R225-K229 PolarHBondContact O-N 2.84Å; R225-K229 VanDerWaalsContact O-N 3.14Å
230	G	66	Low	71.8	Confident	57 Å²	57	72.1 Å²	72.1	59%	0.588	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	14.4	-179.4	0	0	0	0	0	116.3	R225 T228	R225-G230 PolarHBondContact O-N 3.09Å; T228-G230 PolarHBondContact O-N 2.89Å; T228-G230 VanDerWaalsContact O-N 3.08Å
231	R	68.5	Low	70.7	Confident	200 Å²	200	72.5 Å²	72.5	76%	0.755	38%	0.375	S	S	*	.			trans	-92.1	-13.7	174.3	-61.3	-173.3	-166.4	-168.1	2.7	114.3	P179 T228	P179-R231 HydrophobicContact CG-CB 4.12Å; T228-R231 WeakPolarHBondContact O-CB 3.06Å; T228-R231 PolarHBondContact O-N 3.29Å
232	G	68.9	Low	69.3	Low	20 Å²	20	72.8 Å²	72.8	21%	0.206	38%	0.378	C	S	.	.			trans	-79.3	135.8	174.7	0	0	0	0	0	111.4	A177 T228	A177-G232 CarbonylContact O-C 3.57Å; A177-G232 WeakPolarHBondContact O-CA 3.32Å; T228-G232 PolarHBondContact OG1-N 2.88Å
233	S	71.6	Confident	67.4	Low	57 Å²	57	73.6 Å²	73.6	40%	0.399	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	134.7	170	-170.8	0	0	0	0	109.7	A177	A177-S233 PolarHBondContact N-O 2.87Å; A177-S233 PolarHBondContact O-N 2.72Å
234	L	77.2	Confident	65.4	Low	34 Å²	34	80.3 Å²	80.3	18%	0.178	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	110.3	172.6	-177.2	76.1	0	0	0	108	L174 L176 F217 D221 I224	L174-L234 HydrophobicContact CB-CD1 4.18Å; L174-L234 HydrophobicContact CD1-CD1 4.02Å; L176-L234 HydrophobicContact CD2-CD1 3.27Å; L176-L234 HydrophobicContact CG-CD1 3.95Å; F217-L234 HydrophobicContact CD2-CD2 4.3Å; F217-L234 HydrophobicContact CE2-CD2 3.48Å; F217-L234 VanDerWaalsContact CE2-CD2 3.48Å; F217-L234 HydrophobicContact CE2-CG 4.41Å; F217-L234 HydrophobicContact CZ-CD2 3.66Å; D221-L234 HydrophobicContact CB-CD2 4.09Å; I224-L234 HydrophobicContact CD1-CB 4.44Å; I224-L234 HydrophobicContact CD1-CD1 3.76Å; I224-L234 HydrophobicContact CD1-CG 4.48Å
235	E	77.6	Confident	63.3	Low	90 Å²	90	83.2 Å²	83.2	42%	0.421	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.2	176.2	-66.8	-175.9	164.1	0	0	109.7	R175 L237	R175-E235 HydrophobicContact CB-CB 4.23Å; R175-E235 PolarHBondContact N-O 3.37Å; R175-E235 IonicContact NH1-OE2 3.62Å; R175-E235 PolarHBondContact NH1-OE2 2.87Å; R175-E235 PolarHBondContact O-N 2.91Å; E235-L237 PolarHBondContact O-N 2.97Å
236	V	78.5	Confident	61.1	Low	67 Å²	67	81.8 Å²	81.8	41%	0.406	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	105.5	172.2	-176.8	0	0	0	0	107.4	M172 L174 F217 L239	M172-V236 HydrophobicContact CE-CG1 3.73Å; M172-V236 HydrophobicContact CE-CG2 4.28Å; L174-V236 HydrophobicContact CD2-CB 4.17Å; L174-V236 HydrophobicContact CD2-CG1 4.15Å; L174-V236 HydrophobicContact CD2-CG2 3.74Å; F217-V236 HydrophobicContact CE2-CG2 3.87Å; F217-V236 HydrophobicContact CZ-CG2 4.24Å; V236-L239 HydrophobicContact CG1-CD2 4.05Å; V236-L239 HydrophobicContact CG1-CG 4.13Å
237	L	70.7	Confident	58.9	Low	92 Å²	92	86.3 Å²	86.3	48%	0.482	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	-46.8	177.5	-74	175.7	0	0	0	111.2	R173 R175 V209 E235	R173-L237 HydrophobicContact CB-CB 4.29Å; R173-L237 PolarHBondContact O-N 2.83Å; R175-L237 HydrophobicContact CB-CD1 3.63Å; R175-L237 HydrophobicContact CB-CD2 4.24Å; R175-L237 HydrophobicContact CB-CG 3.64Å; R175-L237 HydrophobicContact CG-CD1 4.44Å; V209-L237 HydrophobicContact CG1-CD1 3.99Å; V209-L237 HydrophobicContact CG2-CD1 3.87Å; E235-L237 PolarHBondContact O-N 2.97Å
238	S	66.9	Low	56.9	Low	41 Å²	41	92.1 Å²	92.1	29%	0.287	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	133.3	174.6	-174.2	0	0	0	0	111.5	R173 K240	R173-S238 PolarHBondContact N-O 2.9Å; R173-S238 PolarHBondContact O-N 2.82Å; S238-K240 PolarHBondContact O-N 2.79Å; S238-K240 PolarHBondContact OG-N 3.38Å; S238-K240 VanDerWaalsContact OG-N 3.16Å; S238-K240 PolarHBondContact OG-O 3.06Å
239	L	59.3	Low	55	Low	125 Å²	125	103.6 Å²	103.6	65%	0.654	54%	0.542	S	S	*	.	S	Bend	trans	-72.2	-13.9	172.4	-70.6	160.2	0	0	0	112.2	M172 V236	M172-L239 HydrophobicContact CE-CD2 3.74Å; M172-L239 HydrophobicContact SD-CD2 4.49Å; V236-L239 HydrophobicContact CG1-CD2 4.05Å; V236-L239 HydrophobicContact CG1-CG 4.13Å
240	K	55	Low	54.4	Low	82 Å²	82	99.9 Å²	99.9	36%	0.357	53%	0.53	S	S	.	.			trans	-141.7	116.2	-179.1	-65.2	179.2	-176.2	166	0	109.9	E117 S238 V242	E117-K240 IonicContact OE1-NZ 2.9Å; E117-K240 PolarHBondContact OE1-NZ 3.35Å; S238-K240 PolarHBondContact O-N 2.79Å; S238-K240 PolarHBondContact OG-N 3.38Å; S238-K240 VanDerWaalsContact OG-N 3.16Å; S238-K240 PolarHBondContact OG-O 3.06Å; K240-V242 VanDerWaalsContact C-N 3.29Å; K240-V242 HydrophobicContact CB-CG2 4.27Å; K240-V242 PolarHBondContact O-N 2.73Å; K240-V242 VanDerWaalsContact O-N 3.1Å
241	D	53.2	Low	53.8	Low	8 Å²	8	102.2 Å²	102.2	4%	0.043	53%	0.527	C	S	.	.			trans	-77.4	87.7	161.1	-148	-111.1	0	0	0	108.7	H171 R173 L211	H171-D241 PolarHBondContact O-N 3.37Å; R173-D241 WeakPolarHBondContact CD-OD2 3.47Å; R173-D241 WeakPolarHBondContact CG-OD2 3.43Å; R173-D241 IonicContact CZ-OD2 2.83Å; R173-D241 IonicContact NE-OD2 3.64Å; R173-D241 PolarHBondContact NE-OD2 3.18Å; R173-D241 IonicContact NH1-OD2 2.72Å; R173-D241 PolarHBondContact NH1-OD2 2.93Å; R173-D241 VanDerWaalsContact NH1-OD2 3.15Å; R173-D241 IonicContact NH2-OD1 3.47Å; R173-D241 IonicContact NH2-OD2 2.89Å; R173-D241 PolarHBondContact NH2-OD2 3.47Å; R173-D241 VanDerWaalsContact NH2-OD2 3.12Å; L211-D241 HydrophobicContact CD2-CB 3.74Å; L211-D241 VanDerWaalsContact CD2-CG 3.49Å; L211-D241 WeakPolarHBondContact CD2-OD2 3.45Å
242	V	48.4	Very low	53	Low	40 Å²	40	96.7 Å²	96.7	24%	0.242	52%	0.515	C	S	.	.			trans	-109.4	125.4	163.9	172.7	0	0	0	0	104.9	V120 P127 K240 E244	V120-V242 HydrophobicContact CG1-CG2 4.37Å; P127-V242 HydrophobicContact CG-CG1 4.18Å; K240-V242 VanDerWaalsContact C-N 3.29Å; K240-V242 HydrophobicContact CB-CG2 4.27Å; K240-V242 PolarHBondContact O-N 2.73Å; K240-V242 VanDerWaalsContact O-N 3.1Å; V242-E244 PolarHBondContact O-N 3.04Å
243	E	40.3	Very low	52	Low	114 Å²	114	101.2 Å²	101.2	53%	0.533	53%	0.533	S	S	.	.			trans	-63.1	95.2	160.1	-81.8	-178.6	123.4	0	0	106.3	K125 G245	K125-E243 HydrophobicContact CB-CG 4.44Å; K125-E243 HydrophobicContact CD-CG 4.35Å; E243-G245 PolarHBondContact O-N 3.36Å
244	E	34.5	Very low	50.8	Low	182 Å²	182	104 Å²	104	85%	0.85	54%	0.541	S	S	*	.			trans	-63.1	89.7	163.3	-75.8	-171.2	139	0	0	106.2	V242 D246	V242-E244 PolarHBondContact O-N 3.04Å; E244-D246 PolarHBondContact O-N 2.66Å; E244-D246 VanDerWaalsContact O-N 3.09Å
245	G	32.8	Very low	49.1	Very low	63 Å²	63	108.7 Å²	108.7	65%	0.649	57%	0.565	S	S	*	*			trans	-56.6	115.5	159	0	0	0	0	0	106.7	E243 E247	E243-G245 PolarHBondContact O-N 3.36Å; G245-E247 PolarHBondContact O-N 2.86Å
246	D	31.4	Very low	47	Very low	123 Å²	123	110 Å²	110	66%	0.658	58%	0.576	S	S	*	*			trans	-36.2	98.4	162.8	-92	-65.4	0	0	0	109.8	E244 K248	E244-D246 PolarHBondContact O-N 2.66Å; E244-D246 VanDerWaalsContact O-N 3.09Å; D246-K248 HydrophobicContact CB-CG 4.45Å; D246-K248 PolarHBondContact O-N 3.22Å; D246-K248 WeakPolarHBondContact OD1-CD 3.34Å; D246-K248 WeakPolarHBondContact OD1-CE 3.36Å; D246-K248 WeakPolarHBondContact OD1-CG 3.47Å; D246-K248 IonicContact OD1-NZ 3.33Å; D246-K248 PolarHBondContact OD1-NZ 2.88Å; D246-K248 IonicContact OD2-NZ 3.35Å
247	E	31	Very low	44.6	Very low	195 Å²	195	113.3 Å²	113.3	91%	0.911	59%	0.589	S	S	*	*			trans	-88.8	74	142.4	-84.6	-172.2	110.7	0	0	106.1	G245 L249	G245-E247 PolarHBondContact O-N 2.86Å; E247-L249 PolarHBondContact O-N 3.23Å
248	K	29.1	Very low	42.4	Very low	165 Å²	165	115.1 Å²	115.1	72%	0.717	60%	0.598	S	S	*	*			trans	-63.8	108.1	155.2	-84	169.5	-179.7	149.8	0	107.2	D246	D246-K248 HydrophobicContact CB-CG 4.45Å; D246-K248 PolarHBondContact O-N 3.22Å; D246-K248 WeakPolarHBondContact OD1-CD 3.34Å; D246-K248 WeakPolarHBondContact OD1-CE 3.36Å; D246-K248 WeakPolarHBondContact OD1-CG 3.47Å; D246-K248 IonicContact OD1-NZ 3.33Å; D246-K248 PolarHBondContact OD1-NZ 2.88Å; D246-K248 IonicContact OD2-NZ 3.35Å
249	L	27.4	Very low	40.2	Very low	243 Å²	243	121.8 Å²	121.8	100%	1.272	63%	0.626	S	S	*	*			trans	-64.6	0	150.6	-93.3	140.2	0	0	0	110	E247	E247-L249 PolarHBondContact O-N 3.23Å

Retrieved 249 of 249 residues in 420.5 ms (Link to these results)

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