A0A077Z8D8_TRITR Loading...

U2 small nuclear ribonucleoprotein B

AlphaFold DB , UniProt , Accession A0A077Z8D8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 245 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.5	Very low	38.2	Very low	235 Å²	235	149.5 Å²	149.5	100%	1.158	81%	0.805	S	S	*	*				0	159.7	0	-80.1	-176.1	170.1	0	0	108.7
2	I	43.3	Very low	38.5	Very low	148 Å²	148	143.8 Å²	143.8	76%	0.759	79%	0.793	S	S	*	*			trans	75.7	92.5	-174.9	-48.8	172.4	0	0	0	110.4
3	Y	34	Very low	39.2	Very low	210 Å²	210	141.2 Å²	141.2	82%	0.824	79%	0.791	S	S	*	*				60.6	139.9	75.2	-58.7	-60.4	0	0	0	111.1
4	C	34.8	Very low	39.4	Very low	112 Å²	112	135.4 Å²	135.4	76%	0.757	78%	0.778	S	S	*	*			cis	-163.3	175	-10	-121.6	0	0	0	0	106.7
5	C	37.7	Very low	39.7	Very low	113 Å²	113	135.3 Å²	135.3	76%	0.764	78%	0.775	S	S	*	*			cis	-152.3	-165.5	6.3	-153.3	0	0	0	0	110.7
6	F	33.6	Very low	40.4	Very low	173 Å²	173	132.1 Å²	132.1	76%	0.759	76%	0.763	S	S	*	*			trans	-57.2	144.8	169.5	-87	-127.7	0	0	0	115.7
7	S	38	Very low	40.8	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	75%	0.753	S	S	*	*				-157	102.3	123.1	-86.7	0	0	0	0	111.7	V9	S7-V9 PolarHBondContact O-N 3.36Å
8	T	39.4	Very low	41.2	Very low	110 Å²	110	126.2 Å²	126.2	68%	0.675	74%	0.738	S	S	*	*			trans	-69.9	108.8	173.4	-48.9	0	0	0	0	110	Q10	T8-Q10 HydrophobicContact CG2-CB 4.4Å
9	V	45.4	Very low	41.6	Very low	127 Å²	127	124.9 Å²	124.9	77%	0.77	72%	0.724	S	S	*	*			trans	-96.7	89.7	165.2	179.5	0	0	0	0	108.5	S7 V11	S7-V9 PolarHBondContact O-N 3.36Å; V9-V11 HydrophobicContact CG1-CG2 3.88Å; V9-V11 PolarHBondContact O-N 3.17Å
10	Q	34.3	Very low	41.9	Very low	180 Å²	180	121.9 Å²	121.9	84%	0.841	71%	0.711	S	S	*	*			trans	-84.1	103.1	172.7	-178.3	162	-83.4	0	0	109.6	T8	T8-Q10 HydrophobicContact CG2-CB 4.4Å
11	V	42.7	Very low	42.3	Very low	120 Å²	120	126.1 Å²	126.1	73%	0.727	72%	0.715	S	S	*	*			trans	-130.3	104.9	172	-179.9	0	0	0	0	110.3	V9	V9-V11 HydrophobicContact CG1-CG2 3.88Å; V9-V11 PolarHBondContact O-N 3.17Å
12	A	41.4	Very low	43.1	Very low	81 Å²	81	121.7 Å²	121.7	67%	0.669	69%	0.689	S	S	*	*			trans	40.8	93.2	158	0	0	0	0	0	118.6	G14	A12-G14 VanDerWaalsContact C-N 3.28Å; A12-G14 PolarHBondContact O-N 3.12Å
13	S	47.1	Very low	43.8	Very low	110 Å²	110	118.5 Å²	118.5	77%	0.769	67%	0.672	S	S	*	*			trans	-81.8	10.7	170.4	44.5	0	0	0	0	115.2
14	G	41.8	Very low	44.9	Very low	59 Å²	59	113 Å²	113	61%	0.608	67%	0.67	S	S	*	*	S	Bend	trans	-75.6	-40.2	-170.6	0	0	0	0	0	116.2	A12 S16	A12-G14 VanDerWaalsContact C-N 3.28Å; A12-G14 PolarHBondContact O-N 3.12Å; G14-S16 PolarHBondContact O-N 3.13Å
15	D	45	Very low	46.7	Very low	135 Å²	135	115 Å²	115	72%	0.722	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-21.2	-171.2	-67.1	-45.6	0	0	0	114.1	V17 A18 E19	D15-V17 VanDerWaalsContact C-N 3.3Å; D15-V17 PolarHBondContact O-N 3.33Å; D15-A18 PolarHBondContact O-N 3.36Å; D15-E19 PolarHBondContact O-N 3.46Å
16	S	49.7	Very low	48.9	Very low	84 Å²	84	111.2 Å²	111.2	59%	0.587	65%	0.645	S	S	*	*	H	α-helix	trans	-62.3	-32.6	-171.2	-60.3	0	0	0	0	114	G14 S20	G14-S16 PolarHBondContact O-N 3.13Å; S16-S20 WeakPolarHBondContact O-CB 3.32Å; S16-S20 PolarHBondContact O-N 3.24Å; S16-S20 VanDerWaalsContact O-N 3.11Å
17	V	48.2	Very low	51.7	Low	98 Å²	98	111.4 Å²	111.4	59%	0.594	64%	0.641	S	S	*	*	H	α-helix	trans	-78.2	-35.5	-175.7	-172.3	0	0	0	0	111.7	D15 S20 R21	D15-V17 VanDerWaalsContact C-N 3.3Å; D15-V17 PolarHBondContact O-N 3.33Å; V17-S20 PolarHBondContact O-N 3.43Å; V17-R21 PolarHBondContact O-N 3.37Å; V17-R21 VanDerWaalsContact O-N 3.1Å
18	A	46.9	Very low	54.5	Low	59 Å²	59	109.6 Å²	109.6	49%	0.488	63%	0.626	S	S	.	*	H	α-helix	trans	-70.7	-39.2	177.9	0	0	0	0	0	111.9	D15 K22	D15-A18 PolarHBondContact O-N 3.36Å; A18-K22 PolarHBondContact O-N 3.1Å
19	E	49.4	Very low	57.1	Low	102 Å²	102	104.5 Å²	104.5	48%	0.477	60%	0.595	S	S	.	*	H	α-helix	trans	-67.1	-42.2	173.8	-158.2	65.5	-166.2	0	0	110.5	D15 R21 K22 M23	D15-E19 PolarHBondContact O-N 3.46Å; E19-R21 PolarHBondContact O-N 3.41Å; E19-K22 PolarHBondContact O-N 3.11Å; E19-K22 VanDerWaalsContact O-N 3.13Å; E19-M23 WeakPolarHBondContact O-CG 3.42Å; E19-M23 PolarHBondContact O-N 2.86Å; E19-M23 VanDerWaalsContact O-N 3.17Å
20	S	48.3	Very low	59.6	Low	65 Å²	65	98.9 Å²	98.9	46%	0.455	56%	0.56	S	S	.	*	H	α-helix	trans	-53.4	-49.5	174.4	175.9	0	0	0	0	113.4	S16 V17 K22 M23	S16-S20 WeakPolarHBondContact O-CB 3.32Å; S16-S20 PolarHBondContact O-N 3.24Å; S16-S20 VanDerWaalsContact O-N 3.11Å; V17-S20 PolarHBondContact O-N 3.43Å; S20-K22 VanDerWaalsContact C-N 3.29Å; S20-K22 PolarHBondContact O-N 2.7Å; S20-M23 PolarHBondContact O-N 3.32Å; S20-M23 VanDerWaalsContact O-N 3.12Å
21	R	50.1	Low	62.6	Low	210 Å²	210	90.3 Å²	90.3	79%	0.792	52%	0.52	S	S	*	.	H	α-helix	trans	-64.4	-30	178.4	-82.3	-178.6	156.3	179.6	-6.9	113.7	V17 E19 M23	V17-R21 PolarHBondContact O-N 3.37Å; V17-R21 VanDerWaalsContact O-N 3.1Å; E19-R21 PolarHBondContact O-N 3.41Å; R21-M23 VanDerWaalsContact C-N 3.35Å
22	K	54.4	Low	65.2	Low	142 Å²	142	84.6 Å²	84.6	62%	0.617	49%	0.486	S	S	*	.	H	α-helix	trans	-79.5	-12.3	175.4	-73.2	177.2	179.6	169.8	0	114.1	A18 E19 S20	A18-K22 PolarHBondContact O-N 3.1Å; E19-K22 PolarHBondContact O-N 3.11Å; E19-K22 VanDerWaalsContact O-N 3.13Å; S20-K22 VanDerWaalsContact C-N 3.29Å; S20-K22 PolarHBondContact O-N 2.7Å
23	M	57.4	Low	67.9	Low	82 Å²	82	83 Å²	83	40%	0.404	46%	0.463	S	S	.	.	H	α-helix	trans	-84.1	-18.8	176.4	-70.5	-171.5	-66.2	0	0	113.6	E19 S20 R21 D25 Q105	E19-M23 WeakPolarHBondContact O-CG 3.42Å; E19-M23 PolarHBondContact O-N 2.86Å; E19-M23 VanDerWaalsContact O-N 3.17Å; S20-M23 PolarHBondContact O-N 3.32Å; S20-M23 VanDerWaalsContact O-N 3.12Å; R21-M23 VanDerWaalsContact C-N 3.35Å; M23-D25 PolarHBondContact O-N 3.23Å; M23-Q105 PolarHBondContact SD-NE2 3Å
24	A	57	Low	70.3	Confident	94 Å²	94	77.8 Å²	77.8	78%	0.777	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-22.3	-169.1	0	0	0	0	0	115.2
25	D	73.2	Confident	72.9	Confident	155 Å²	155	76.5 Å²	76.5	83%	0.829	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	27.8	-172.5	-167.3	31.5	0	0	0	113.3	M23 R27	M23-D25 PolarHBondContact O-N 3.23Å; D25-R27 PolarHBondContact O-N 3.48Å
26	I	84.5	Confident	75.4	Confident	33 Å²	33	72.4 Å²	72.4	17%	0.169	38%	0.383	C	S	.	.			trans	-91	100.3	179.6	-46.3	179.3	0	0	0	110.1
27	R	91.9	Very high	77.6	Confident	177 Å²	177	68.5 Å²	68.5	67%	0.668	36%	0.356	S	S	*	.			trans	-53.4	148.6	173.8	72.5	-176.8	-173.1	-176	2.4	112.5	D25 N29	D25-R27 PolarHBondContact O-N 3.48Å; R27-N29 PolarHBondContact O-N 3.43Å
28	P	95.3	Very high	79.8	Confident	78 Å²	78	65 Å²	65	51%	0.506	33%	0.334	S	S	.	.			trans	-52.9	138.4	173.1	-26.8	35.4	0	0	0	112.9	I82 Y106	P28-I82 HydrophobicContact CB-CG2 3.95Å; P28-Y106 HydrophobicContact CB-CE1 4.25Å; P28-Y106 HydrophobicContact CB-CE2 4.21Å; P28-Y106 HydrophobicContact CG-CE2 4.25Å
29	N	95.4	Very high	82.1	Confident	3 Å²	3	66.1 Å²	66.1	2%	0.016	33%	0.329	C	S	.	.			trans	-138.1	147.5	-177.8	-160.8	-55.5	0	0	0	110.5	R27 T31 A85 Y106 A107 D110	R27-N29 PolarHBondContact O-N 3.43Å; N29-T31 PolarHBondContact O-N 3.32Å; N29-T31 PolarHBondContact OD1-N 3.09Å; N29-A85 VanDerWaalsContact O-CB 3.29Å; N29-A85 WeakPolarHBondContact O-CB 3.29Å; N29-Y106 HydrophobicContact CB-CD1 4.35Å; N29-Y106 VanDerWaalsContact N-CD1 3.29Å; N29-A107 PolarHBondContact ND2-O 3.09Å; N29-D110 PolarHBondContact ND2-OD1 3.42Å
30	N	96.8	Very high	84.3	Confident	9 Å²	9	70.6 Å²	70.6	5%	0.048	35%	0.347	C	S	.	.	S	Bend	trans	-56.2	-26.9	168.1	-59.9	82.7	0	0	0	112.5	F79 K80 I82 V114 K118	N30-F79 PolarHBondContact O-N 2.73Å; N30-K80 PolarHBondContact ND2-O 3.24Å; N30-I82 HydrophobicContact CB-CG1 4.41Å; N30-I82 VanDerWaalsContact CG-CG1 3.5Å; N30-I82 WeakPolarHBondContact ND2-CG1 3.39Å; N30-I82 WeakPolarHBondContact OD1-CG1 3.5Å; N30-V114 HydrophobicContact CB-CB 4.45Å; N30-V114 HydrophobicContact CB-CG1 3.92Å; N30-V114 HydrophobicContact CB-CG2 3.63Å; N30-K118 PolarHBondContact OD1-NZ 2.76Å
31	T	97.1	Very high	86.5	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	127.8	-179.5	-49.4	0	0	0	0	110.5	N29 F76 V77 A78 A107 S111	N29-T31 PolarHBondContact O-N 3.32Å; N29-T31 PolarHBondContact OD1-N 3.09Å; T31-F76 HydrophobicContact CG2-CB 4.03Å; T31-F76 HydrophobicContact CG2-CD1 4.23Å; T31-V77 WeakPolarHBondContact CA-O 3.4Å; T31-A78 HydrophobicContact CG2-CB 4.27Å; T31-A107 HydrophobicContact CG2-CB 3.88Å; T31-A107 VanDerWaalsContact O-CB 3.23Å; T31-A107 WeakPolarHBondContact O-CB 3.06Å; T31-A107 PolarHBondContact O-N 3.26Å; T31-S111 WeakPolarHBondContact OG1-CB 3.42Å; T31-S111 PolarHBondContact OG1-OG 2.89Å
32	I	97.8	Very high	88.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	143.2	168.8	58.7	172	0	0	0	110.7	I34 F54 F76 V77 F79 A85 A88 L89 I104 Q105	I32-I34 HydrophobicContact CD1-CD1 4.17Å; I32-I34 HydrophobicContact CD1-CG1 4.27Å; I32-I34 HydrophobicContact CG1-CG1 4.43Å; I32-F54 HydrophobicContact CD1-CD1 3.78Å; I32-F54 HydrophobicContact CD1-CE1 3.29Å; I32-F54 HydrophobicContact CD1-CZ 3.91Å; I32-F76 VanDerWaalsContact O-CA 3.3Å; I32-F76 WeakPolarHBondContact O-CA 3.35Å; I32-V77 HydrophobicContact CD1-CB 4.16Å; I32-V77 HydrophobicContact CG1-CB 3.8Å; I32-V77 WeakPolarHBondContact CG1-O 3.08Å; I32-V77 PolarHBondContact N-O 3.42Å; I32-V77 PolarHBondContact O-N 2.89Å; I32-F79 HydrophobicContact CD1-CE2 4.02Å; I32-F79 HydrophobicContact CG1-CE2 4.3Å; I32-A85 HydrophobicContact CG2-CB 4.02Å; I32-A88 HydrophobicContact CD1-CB 4.41Å; I32-L89 HydrophobicContact CG2-CB 4.45Å; I32-I104 HydrophobicContact CB-CG2 3.88Å; I32-I104 HydrophobicContact CD1-CG2 3.9Å; I32-I104 HydrophobicContact CG1-CG2 4.39Å; I32-I104 HydrophobicContact CG2-CG2 4.21Å; I32-Q105 CarbonylContact C-O 3.59Å; I32-Q105 WeakPolarHBondContact CA-O 3.14Å
33	Y	97.6	Very high	90.6	Very high	47 Å²	47	64.1 Å²	64.1	18%	0.184	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	132	169.1	169.3	-122.6	0	0	0	108.8	N35 Q74 F76 I104 Q105	Y33-N35 HydrophobicContact CE1-CB 4.19Å; Y33-N35 VanDerWaalsContact CE1-ND2 3.34Å; Y33-N35 WeakPolarHBondContact CE1-ND2 3.38Å; Y33-N35 HydrophobicContact CE2-CB 4.41Å; Y33-Q74 HydrophobicContact CE2-CB 4.05Å; Y33-Q74 HydrophobicContact CE2-CG 4.03Å; Y33-Q74 PolarHBondContact OH-OE1 2.85Å; Y33-Q74 VanDerWaalsContact OH-OE1 3.14Å; Y33-F76 HydrophobicContact CD2-CD1 4.09Å; Y33-F76 AromaticContact CD2-CE1 3.55Å; Y33-F76 HydrophobicContact CD2-CE1 3.55Å; Y33-F76 HydrophobicContact CD2-CE2 4.29Å; Y33-F76 AromaticContact CD2-CZ 3.66Å; Y33-F76 HydrophobicContact CD2-CZ 3.66Å; Y33-F76 HydrophobicContact CE2-CZ 4.22Å; Y33-F76 HydrophobicContact CG-CD1 4.5Å; Y33-F76 AromaticContact CG-CE1 3.98Å; Y33-F76 HydrophobicContact CG-CE1 3.98Å; Y33-F76 HydrophobicContact CG-CZ 4.46Å; Y33-I104 WeakPolarHBondContact O-CA 3.46Å; Y33-Q105 HydrophobicContact CD1-CB 4.39Å; Y33-Q105 PolarHBondContact N-O 3.38Å; Y33-Q105 PolarHBondContact O-N 3.37Å
34	I	97.7	Very high	92.4	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.1	-179.9	-48.2	170.7	0	0	0	108.2	I32 L37 L50 F54 Q74 A75 V77 M102 R103 I104	I32-I34 HydrophobicContact CD1-CD1 4.17Å; I32-I34 HydrophobicContact CD1-CG1 4.27Å; I32-I34 HydrophobicContact CG1-CG1 4.43Å; I34-L37 HydrophobicContact CG2-CD1 4.28Å; I34-L37 HydrophobicContact CG2-CD2 3.76Å; I34-L37 HydrophobicContact CG2-CG 4.1Å; I34-L50 HydrophobicContact CD1-CD2 4.06Å; I34-F54 HydrophobicContact CD1-CD2 4.31Å; I34-F54 HydrophobicContact CD1-CE1 4.33Å; I34-F54 HydrophobicContact CD1-CE2 3.42Å; I34-F54 VanDerWaalsContact CD1-CE2 3.42Å; I34-F54 HydrophobicContact CD1-CZ 3.43Å; I34-F54 VanDerWaalsContact CD1-CZ 3.43Å; I34-F54 HydrophobicContact CG1-CZ 4.39Å; I34-Q74 CarbonylContact O-C 3.57Å; I34-Q74 VanDerWaalsContact O-CA 3.25Å; I34-Q74 WeakPolarHBondContact O-CA 3.41Å; I34-A75 PolarHBondContact N-O 3.01Å; I34-A75 PolarHBondContact O-N 3.37Å; I34-V77 HydrophobicContact CD1-CG2 3.72Å; I34-M102 HydrophobicContact CG2-CB 4.13Å; I34-M102 HydrophobicContact CG2-SD 4.3Å; I34-R103 CarbonylContact C-O 3.57Å; I34-R103 WeakPolarHBondContact CA-O 3.45Å; I34-I104 HydrophobicContact CG1-CG1 4.44Å; I34-I104 HydrophobicContact CG1-CG2 4.46Å; I34-I104 HydrophobicContact CG2-CG1 4.44Å
35	N	96.8	Very high	94.3	Very high	32 Å²	32	64.8 Å²	64.8	17%	0.171	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	-176.4	171.4	74.8	42.4	0	0	0	111.9	Y33 L37 G73 Q74 R103	Y33-N35 HydrophobicContact CE1-CB 4.19Å; Y33-N35 VanDerWaalsContact CE1-ND2 3.34Å; Y33-N35 WeakPolarHBondContact CE1-ND2 3.38Å; Y33-N35 HydrophobicContact CE2-CB 4.41Å; N35-L37 PolarHBondContact O-N 3.21Å; N35-G73 WeakPolarHBondContact CA-O 3.37Å; N35-Q74 HydrophobicContact CB-CG 4.03Å; N35-R103 PolarHBondContact N-O 3.11Å; N35-R103 PolarHBondContact O-N 2.99Å; N35-R103 VanDerWaalsContact O-N 3.09Å; N35-R103 WeakPolarHBondContact OD1-CB 3.47Å
36	N	96.9	Very high	95.4	Very high	49 Å²	49	57.6 Å²	57.6	26%	0.262	27%	0.268	S	S	.	.	S	Bend	trans	63.7	17.7	-170	-160.4	36.6	0	0	0	115.1	G73 K100 P101 R103	N36-G73 PolarHBondContact N-O 3.14Å; N36-K100 WeakPolarHBondContact O-CB 3.5Å; N36-K100 WeakPolarHBondContact O-CD 3.39Å; N36-K100 WeakPolarHBondContact O-CE 3.29Å; N36-K100 PolarHBondContact O-NZ 3.46Å; N36-K100 WeakPolarHBondContact OD1-CE 3.34Å; N36-K100 PolarHBondContact OD1-NZ 3.17Å; N36-P101 PolarHBondContact ND2-O 3.14Å; N36-R103 HydrophobicContact CB-CG 4.34Å
37	L	96.9	Very high	96	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.01	28%	0.276	C	S	.	.			trans	-65.9	161.2	177	-57.8	173.5	0	0	0	111.9	I34 N35 E39 L46 L50 G73 A75 F97 K100 M102	I34-L37 HydrophobicContact CG2-CD1 4.28Å; I34-L37 HydrophobicContact CG2-CD2 3.76Å; I34-L37 HydrophobicContact CG2-CG 4.1Å; N35-L37 PolarHBondContact O-N 3.21Å; L37-E39 PolarHBondContact O-N 2.9Å; L37-L46 HydrophobicContact CD1-CD1 4.41Å; L37-L50 HydrophobicContact CD1-CD1 4.44Å; L37-G73 WeakPolarHBondContact CB-O 3.44Å; L37-G73 PolarHBondContact N-O 2.94Å; L37-A75 HydrophobicContact CD1-CB 3.71Å; L37-F97 HydrophobicContact CD2-CD1 3.65Å; L37-F97 HydrophobicContact CD2-CE1 3.87Å; L37-K100 PolarHBondContact O-NZ 3.25Å; L37-K100 VanDerWaalsContact O-NZ 3.12Å; L37-M102 HydrophobicContact CD2-CB 4.3Å
38	N	95.4	Very high	96.3	Very high	25 Å²	25	60.4 Å²	60.4	13%	0.134	28%	0.279	C	S	.	.			trans	-75.9	119.4	176.5	-170.7	-28	0	0	0	110.8	K40 I41 Y98 K100	N38-K40 VanDerWaalsContact C-N 3.32Å; N38-K40 PolarHBondContact O-N 3.39Å; N38-K40 WeakPolarHBondContact OD1-CB 3.38Å; N38-K40 PolarHBondContact OD1-N 2.87Å; N38-I41 HydrophobicContact CB-CG1 3.98Å; N38-Y98 WeakPolarHBondContact CB-O 3.23Å; N38-Y98 PolarHBondContact ND2-O 2.78Å; N38-K100 HydrophobicContact CB-CD 4.18Å
39	E	95	Very high	96.4	Very high	82 Å²	82	57.6 Å²	57.6	38%	0.383	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-26.4	-175.6	-68.4	-171.1	-163.5	0	0	113.6	L37 I41 K67 R72	L37-E39 PolarHBondContact O-N 2.9Å; E39-I41 VanDerWaalsContact C-N 3.34Å; E39-I41 PolarHBondContact O-N 3.27Å; E39-K67 PolarHBondContact O-NZ 3.12Å; E39-R72 HydrophobicContact CG-CB 4.25Å; E39-R72 HydrophobicContact CG-CG 4.36Å; E39-R72 IonicContact OE1-CZ 3.44Å; E39-R72 IonicContact OE1-NE 2.8Å; E39-R72 WeakPolarHBondContact OE2-CD 3.5Å; E39-R72 IonicContact OE2-CZ 3.8Å; E39-R72 IonicContact OE2-NE 2.69Å; E39-R72 PolarHBondContact OE2-NE 3.44Å; E39-R72 IonicContact OE2-NH1 2.78Å; E39-R72 PolarHBondContact OE2-NH1 3.06Å
40	K	95.2	Very high	96.5	Very high	196 Å²	196	57.5 Å²	57.5	85%	0.852	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-27.7	-173.7	-61	-180	179.3	178.1	0	113.2	N38	N38-K40 VanDerWaalsContact C-N 3.32Å; N38-K40 PolarHBondContact O-N 3.39Å; N38-K40 WeakPolarHBondContact OD1-CB 3.38Å; N38-K40 PolarHBondContact OD1-N 2.87Å
41	I	95.1	Very high	96.6	Very high	24 Å²	24	62.6 Å²	62.6	12%	0.123	28%	0.281	C	S	.	.	S	Bend	trans	-64.4	138.9	-177.2	-52.3	-53.7	0	0	0	110.9	N38 E39 E45 L46 K67 Y98	N38-I41 HydrophobicContact CB-CG1 3.98Å; E39-I41 VanDerWaalsContact C-N 3.34Å; E39-I41 PolarHBondContact O-N 3.27Å; I41-E45 HydrophobicContact CG2-CB 4.08Å; I41-E45 HydrophobicContact CG2-CG 3.97Å; I41-L46 HydrophobicContact CG2-CB 4.06Å; I41-K67 WeakPolarHBondContact O-CE 3.28Å; I41-K67 PolarHBondContact O-NZ 3.11Å; I41-Y98 HydrophobicContact CD1-CD1 3.36Å; I41-Y98 HydrophobicContact CD1-CE1 3.62Å; I41-Y98 HydrophobicContact CD1-CG 3.82Å; I41-Y98 HydrophobicContact CG1-CD1 3.83Å; I41-Y98 HydrophobicContact CG1-CD2 4.06Å; I41-Y98 HydrophobicContact CG1-CE1 4.11Å; I41-Y98 HydrophobicContact CG1-CE2 4.35Å; I41-Y98 HydrophobicContact CG1-CG 3.76Å; I41-Y98 HydrophobicContact CG2-CE1 4.35Å; I41-Y98 HydrophobicContact CG2-CE2 4.2Å
42	K	95.3	Very high	96.6	Very high	158 Å²	158	66 Å²	66	69%	0.687	31%	0.309	S	S	*	.			trans	-65.3	152.5	-179.9	-71.1	174	-176.7	170.4	0	111	D44 E45 L46	K42-D44 PolarHBondContact O-N 3.45Å; K42-E45 HydrophobicContact CB-CB 4.2Å; K42-E45 PolarHBondContact O-N 3.27Å; K42-L46 VanDerWaalsContact O-CB 3.27Å; K42-L46 WeakPolarHBondContact O-CB 3.35Å; K42-L46 PolarHBondContact O-N 3.18Å
43	K	94.6	Very high	96.5	Very high	99 Å²	99	67.7 Å²	67.7	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-56.4	-48.5	-175.5	179.5	-174.8	162.2	176.5	0	112.2	L46 K47 C65 K67	K43-L46 PolarHBondContact O-N 3.43Å; K43-K47 PolarHBondContact O-N 2.81Å; K43-C65 WeakPolarHBondContact CE-O 3.41Å; K43-K67 HydrophobicContact CB-CG 4.19Å
44	D	95.4	Very high	96.6	Very high	108 Å²	108	65.4 Å²	65.4	58%	0.578	31%	0.309	S	S	*	.	H	α-helix	trans	-74.3	-35.3	-172.9	-49.9	-68.4	0	0	0	111.9	K42 K47 R48	K42-D44 PolarHBondContact O-N 3.45Å; D44-K47 PolarHBondContact O-N 2.88Å; D44-R48 VanDerWaalsContact O-CG 3.31Å; D44-R48 WeakPolarHBondContact O-CG 3.41Å; D44-R48 PolarHBondContact O-N 2.79Å
45	E	96.6	Very high	96.5	Very high	82 Å²	82	68.9 Å²	68.9	38%	0.383	33%	0.328	S	S	.	.	H	α-helix	trans	-61.3	-49.4	170.5	-171.2	-168.3	162	0	0	111.1	I41 K42 K47 R48 A49 Y98	I41-E45 HydrophobicContact CG2-CB 4.08Å; I41-E45 HydrophobicContact CG2-CG 3.97Å; K42-E45 HydrophobicContact CB-CB 4.2Å; K42-E45 PolarHBondContact O-N 3.27Å; E45-K47 VanDerWaalsContact C-N 3.31Å; E45-K47 PolarHBondContact O-N 2.86Å; E45-R48 PolarHBondContact O-N 2.89Å; E45-R48 VanDerWaalsContact O-N 3.14Å; E45-A49 WeakPolarHBondContact O-CB 3.36Å; E45-A49 PolarHBondContact O-N 2.92Å; E45-Y98 PolarHBondContact OE1-OH 3.28Å; E45-Y98 VanDerWaalsContact OE1-OH 3.08Å
46	L	96.9	Very high	96.6	Very high	5 Å²	5	74.2 Å²	74.2	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-57.3	-42.6	175	-180	62.5	0	0	0	111.8	L37 I41 K42 K43 L50 C65 F97	L37-L46 HydrophobicContact CD1-CD1 4.41Å; I41-L46 HydrophobicContact CG2-CB 4.06Å; K42-L46 VanDerWaalsContact O-CB 3.27Å; K42-L46 WeakPolarHBondContact O-CB 3.35Å; K42-L46 PolarHBondContact O-N 3.18Å; K43-L46 PolarHBondContact O-N 3.43Å; L46-L50 HydrophobicContact CD1-CD1 4.15Å; L46-L50 HydrophobicContact CD1-CG 4.28Å; L46-L50 HydrophobicContact CG-CD1 4.09Å; L46-L50 WeakPolarHBondContact O-CB 3.29Å; L46-L50 VanDerWaalsContact O-CG 3.24Å; L46-L50 WeakPolarHBondContact O-CG 3.11Å; L46-L50 PolarHBondContact O-N 3.25Å; L46-C65 HydrophobicContact CD2-CB 4.39Å; L46-F97 HydrophobicContact CD1-CE1 3.59Å; L46-F97 HydrophobicContact CD1-CZ 4.04Å
47	K	97.1	Very high	96.6	Very high	74 Å²	74	73.9 Å²	73.9	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-41.6	176.3	-175.8	160	177.8	153.1	0	111.9	K43 D44 E45 Y51 D62 I63	K43-K47 PolarHBondContact O-N 2.81Å; D44-K47 PolarHBondContact O-N 2.88Å; E45-K47 VanDerWaalsContact C-N 3.31Å; E45-K47 PolarHBondContact O-N 2.86Å; K47-Y51 WeakPolarHBondContact O-CB 3.36Å; K47-Y51 PolarHBondContact O-N 3.5Å; K47-D62 IonicContact NZ-OD1 2.71Å; K47-D62 PolarHBondContact NZ-OD1 3.45Å; K47-I63 HydrophobicContact CD-CB 4.29Å; K47-I63 WeakPolarHBondContact CE-O 3.24Å; K47-I63 HydrophobicContact CG-CB 4.1Å; K47-I63 HydrophobicContact CG-CG2 4.2Å; K47-I63 PolarHBondContact NZ-O 3.02Å
48	R	97.7	Very high	96.6	Very high	194 Å²	194	74.9 Å²	74.9	73%	0.732	36%	0.359	S	S	*	.	H	α-helix	trans	-65.7	-45.9	177	-71.6	172.7	-173.8	-170.5	1.7	112.2	D44 E45 Y51 A52	D44-R48 VanDerWaalsContact O-CG 3.31Å; D44-R48 WeakPolarHBondContact O-CG 3.41Å; D44-R48 PolarHBondContact O-N 2.79Å; E45-R48 PolarHBondContact O-N 2.89Å; E45-R48 VanDerWaalsContact O-N 3.14Å; R48-Y51 WeakPolarHBondContact O-CB 3.45Å; R48-Y51 PolarHBondContact O-N 2.83Å; R48-A52 PolarHBondContact O-N 2.87Å
49	A	97.3	Very high	96.7	Very high	20 Å²	20	79.2 Å²	79.2	17%	0.165	38%	0.378	C	S	.	.	H	α-helix	trans	-65.8	-41.2	-179.9	0	0	0	0	0	112.1	E45 A52 I53 F97 Y98	E45-A49 WeakPolarHBondContact O-CB 3.36Å; E45-A49 PolarHBondContact O-N 2.92Å; A49-A52 PolarHBondContact O-N 3.31Å; A49-I53 PolarHBondContact O-N 2.89Å; A49-F97 HydrophobicContact CB-CE2 3.86Å; A49-F97 HydrophobicContact CB-CZ 3.77Å; A49-Y98 HydrophobicContact CB-CE2 3.77Å
50	L	97.8	Very high	96.8	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-61.3	-46.2	171	-71.5	170.5	0	0	0	111.1	I34 L37 L46 A52 I53 F54 I63 A75 F97	I34-L50 HydrophobicContact CD1-CD2 4.06Å; L37-L50 HydrophobicContact CD1-CD1 4.44Å; L46-L50 HydrophobicContact CD1-CD1 4.15Å; L46-L50 HydrophobicContact CD1-CG 4.28Å; L46-L50 HydrophobicContact CG-CD1 4.09Å; L46-L50 WeakPolarHBondContact O-CB 3.29Å; L46-L50 VanDerWaalsContact O-CG 3.24Å; L46-L50 WeakPolarHBondContact O-CG 3.11Å; L46-L50 PolarHBondContact O-N 3.25Å; L50-A52 PolarHBondContact O-N 3.41Å; L50-I53 PolarHBondContact O-N 3.01Å; L50-F54 HydrophobicContact CB-CD2 4.45Å; L50-F54 HydrophobicContact CD2-CD2 4.18Å; L50-F54 HydrophobicContact CD2-CE2 3.8Å; L50-F54 WeakPolarHBondContact O-CB 3.39Å; L50-F54 VanDerWaalsContact O-CD2 3.29Å; L50-F54 WeakPolarHBondContact O-CD2 3.37Å; L50-F54 PolarHBondContact O-N 2.88Å; L50-I63 HydrophobicContact CB-CD1 4.17Å; L50-I63 HydrophobicContact CB-CG2 4.36Å; L50-I63 HydrophobicContact CD1-CG2 4.07Å; L50-A75 HydrophobicContact CD1-CB 3.62Å; L50-F97 HydrophobicContact CD2-CE1 4.04Å; L50-F97 HydrophobicContact CD2-CZ 3.91Å; L50-F97 HydrophobicContact CG-CE1 4.38Å; L50-F97 HydrophobicContact CG-CZ 4.03Å
51	Y	98.2	Very high	96.9	Very high	116 Å²	116	69.9 Å²	69.9	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-56.1	-50.2	177.2	-173.2	-86	0	0	0	111.8	K47 R48 I53 F54 N55 I60 I63	K47-Y51 WeakPolarHBondContact O-CB 3.36Å; K47-Y51 PolarHBondContact O-N 3.5Å; R48-Y51 WeakPolarHBondContact O-CB 3.45Å; R48-Y51 PolarHBondContact O-N 2.83Å; Y51-I53 VanDerWaalsContact C-N 3.33Å; Y51-I53 PolarHBondContact O-N 2.92Å; Y51-F54 PolarHBondContact O-N 3.3Å; Y51-N55 HydrophobicContact CD1-CB 4.39Å; Y51-N55 HydrophobicContact CE1-CB 4.13Å; Y51-N55 WeakPolarHBondContact O-CB 3.42Å; Y51-N55 PolarHBondContact O-N 3.37Å; Y51-N55 PolarHBondContact OH-OD1 3.08Å; Y51-I60 HydrophobicContact CD2-CD1 4.04Å; Y51-I60 HydrophobicContact CE2-CB 4.34Å; Y51-I60 HydrophobicContact CE2-CD1 4.34Å; Y51-I63 HydrophobicContact CD2-CD1 4.13Å; Y51-I63 HydrophobicContact CG-CD1 4.45Å
52	A	97.5	Very high	96.9	Very high	72 Å²	72	71.8 Å²	71.8	60%	0.595	35%	0.35	S	S	*	.	H	α-helix	trans	-56.7	-43	-178.3	0	0	0	0	0	113.1	R48 A49 L50	R48-A52 PolarHBondContact O-N 2.87Å; A49-A52 PolarHBondContact O-N 3.31Å; L50-A52 PolarHBondContact O-N 3.41Å
53	I	96.6	Very high	97	Very high	36 Å²	36	64.5 Å²	64.5	19%	0.185	32%	0.318	C	S	.	.	H	α-helix	trans	-76.6	-40.6	-178.3	-66.3	177.6	0	0	0	112	A49 L50 Y51 Q56 L92 F95 F97	A49-I53 PolarHBondContact O-N 2.89Å; L50-I53 PolarHBondContact O-N 3.01Å; Y51-I53 VanDerWaalsContact C-N 3.33Å; Y51-I53 PolarHBondContact O-N 2.92Å; I53-Q56 WeakPolarHBondContact O-CG 3.2Å; I53-Q56 PolarHBondContact O-NE2 3.36Å; I53-L92 HydrophobicContact CG2-CD1 3.59Å; I53-L92 HydrophobicContact CG2-CD2 3.97Å; I53-L92 HydrophobicContact CG2-CG 4.46Å; I53-F95 HydrophobicContact CD1-CE1 4.09Å; I53-F97 HydrophobicContact CD1-CD2 3.48Å; I53-F97 VanDerWaalsContact CD1-CD2 3.48Å; I53-F97 HydrophobicContact CD1-CE2 3.56Å
54	F	97.8	Very high	97.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-83.2	-21.3	-174.4	-78.3	-77.5	0	0	0	113.8	I32 I34 L50 Y51 Q56 F57 I60 V77 F79 A88 L92 M102 I104	I32-F54 HydrophobicContact CD1-CD1 3.78Å; I32-F54 HydrophobicContact CD1-CE1 3.29Å; I32-F54 HydrophobicContact CD1-CZ 3.91Å; I34-F54 HydrophobicContact CD1-CD2 4.31Å; I34-F54 HydrophobicContact CD1-CE1 4.33Å; I34-F54 HydrophobicContact CD1-CE2 3.42Å; I34-F54 VanDerWaalsContact CD1-CE2 3.42Å; I34-F54 HydrophobicContact CD1-CZ 3.43Å; I34-F54 VanDerWaalsContact CD1-CZ 3.43Å; I34-F54 HydrophobicContact CG1-CZ 4.39Å; L50-F54 HydrophobicContact CB-CD2 4.45Å; L50-F54 HydrophobicContact CD2-CD2 4.18Å; L50-F54 HydrophobicContact CD2-CE2 3.8Å; L50-F54 WeakPolarHBondContact O-CB 3.39Å; L50-F54 VanDerWaalsContact O-CD2 3.29Å; L50-F54 WeakPolarHBondContact O-CD2 3.37Å; L50-F54 PolarHBondContact O-N 2.88Å; Y51-F54 PolarHBondContact O-N 3.3Å; F54-Q56 PolarHBondContact O-N 2.91Å; F54-Q56 VanDerWaalsContact O-N 3.16Å; F54-F57 PolarHBondContact O-N 3.22Å; F54-I60 HydrophobicContact CB-CD1 3.78Å; F54-V77 HydrophobicContact CB-CG1 4.22Å; F54-V77 HydrophobicContact CD2-CG2 4.21Å; F54-V77 HydrophobicContact CG-CG1 4.36Å; F54-V77 HydrophobicContact CG-CG2 4.46Å; F54-F79 HydrophobicContact CB-CZ 3.95Å; F54-F79 HydrophobicContact CD1-CE2 4.25Å; F54-F79 AromaticContact CD1-CZ 3.94Å; F54-F79 HydrophobicContact CD1-CZ 3.94Å; F54-F79 HydrophobicContact CG-CZ 4.39Å; F54-F79 WeakPolarHBondContact O-CE1 3.42Å; F54-A88 HydrophobicContact CD1-CB 3.85Å; F54-A88 HydrophobicContact CE1-CB 3.99Å; F54-L92 HydrophobicContact CD1-CD1 3.74Å; F54-L92 HydrophobicContact CE1-CD1 3.35Å; F54-L92 HydrophobicContact CE2-CD1 4.24Å; F54-L92 HydrophobicContact CG-CD1 4.35Å; F54-L92 HydrophobicContact CZ-CD1 3.63Å; F54-M102 HydrophobicContact CE2-SD 4.19Å; F54-M102 HydrophobicContact CZ-SD 3.85Å; F54-I104 HydrophobicContact CE1-CD1 4.1Å; F54-I104 HydrophobicContact CZ-CD1 3.9Å
55	N	97.5	Very high	97	Very high	73 Å²	73	57.7 Å²	57.7	39%	0.39	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-61.4	-25	-176.7	-177.5	87.1	0	0	0	113.8	Y51 F57 I60	Y51-N55 HydrophobicContact CD1-CB 4.39Å; Y51-N55 HydrophobicContact CE1-CB 4.13Å; Y51-N55 WeakPolarHBondContact O-CB 3.42Å; Y51-N55 PolarHBondContact O-N 3.37Å; Y51-N55 PolarHBondContact OH-OD1 3.08Å; N55-F57 PolarHBondContact O-N 3.43Å; N55-I60 HydrophobicContact CB-CD1 4.35Å
56	Q	97.5	Very high	96.8	Very high	144 Å²	144	57.1 Å²	57.1	67%	0.673	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-67.1	-20.3	178.3	72.4	-170.9	-55.6	0	0	114.3	I53 F54	I53-Q56 WeakPolarHBondContact O-CG 3.2Å; I53-Q56 PolarHBondContact O-NE2 3.36Å; F54-Q56 PolarHBondContact O-N 2.91Å; F54-Q56 VanDerWaalsContact O-N 3.16Å
57	F	97.7	Very high	96.5	Very high	42 Å²	42	60.8 Å²	60.8	18%	0.184	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-88.6	-17.6	-176.8	-62.5	-81.3	0	0	0	113.6	F54 N55 F79 A84 N87 A88 L92	F54-F57 PolarHBondContact O-N 3.22Å; N55-F57 PolarHBondContact O-N 3.43Å; F57-F79 HydrophobicContact CB-CE1 4.13Å; F57-F79 HydrophobicContact CB-CZ 4.24Å; F57-A84 WeakPolarHBondContact O-CA 3.29Å; F57-A84 WeakPolarHBondContact O-CB 3.42Å; F57-N87 HydrophobicContact CD1-CB 3.99Å; F57-A88 HydrophobicContact CB-CB 3.98Å; F57-A88 HydrophobicContact CD1-CB 4.16Å; F57-A88 HydrophobicContact CD2-CB 3.78Å; F57-A88 HydrophobicContact CE2-CB 4.38Å; F57-A88 HydrophobicContact CG-CB 3.67Å; F57-L92 HydrophobicContact CD2-CD1 4.36Å; F57-L92 HydrophobicContact CE2-CD1 3.52Å; F57-L92 HydrophobicContact CE2-CG 3.95Å; F57-L92 HydrophobicContact CZ-CD1 4.07Å; F57-L92 HydrophobicContact CZ-CD2 4.48Å; F57-L92 HydrophobicContact CZ-CG 3.96Å
58	G	97	Very high	96.2	Very high	23 Å²	23	60.9 Å²	60.9	24%	0.237	31%	0.311	C	S	.	.	S	Bend	trans	152.7	176.7	-178.4	0	0	0	0	0	113	I60	G58-I60 PolarHBondContact O-N 3.2Å
59	Q	97.4	Very high	95.8	Very high	115 Å²	115	57.5 Å²	57.5	54%	0.537	31%	0.311	S	S	.	.			trans	-65	121.4	-176.5	-173	171.5	29	0	0	111.7	F79 K80	Q59-F79 CarbonylContact O-C 3.55Å; Q59-F79 WeakPolarHBondContact O-CA 3.12Å; Q59-K80 HydrophobicContact CB-CB 4.16Å; Q59-K80 HydrophobicContact CB-CD 4.42Å; Q59-K80 PolarHBondContact O-N 2.89Å
60	I	97.5	Very high	95.4	Very high	21 Å²	21	65.5 Å²	65.5	11%	0.108	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.9	174.6	-59.3	175.6	0	0	0	109.4	Y51 F54 N55 G58 I63 V77 A78 F79	Y51-I60 HydrophobicContact CD2-CD1 4.04Å; Y51-I60 HydrophobicContact CE2-CB 4.34Å; Y51-I60 HydrophobicContact CE2-CD1 4.34Å; F54-I60 HydrophobicContact CB-CD1 3.78Å; N55-I60 HydrophobicContact CB-CD1 4.35Å; G58-I60 PolarHBondContact O-N 3.2Å; I60-I63 HydrophobicContact CD1-CD1 4.31Å; I60-I63 HydrophobicContact CG2-CD1 4.28Å; I60-I63 HydrophobicContact CG2-CG1 3.78Å; I60-V77 HydrophobicContact CD1-CG1 4.23Å; I60-V77 HydrophobicContact CG1-CG1 4.31Å; I60-V77 HydrophobicContact CG2-CG1 4.15Å; I60-A78 CarbonylContact C-O 3.55Å; I60-F79 HydrophobicContact CG1-CD1 4.13Å; I60-F79 HydrophobicContact CG1-CE1 3.84Å; I60-F79 HydrophobicContact CG1-CZ 4.46Å
61	L	96.1	Very high	95.2	Very high	62 Å²	62	67.7 Å²	67.7	33%	0.325	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-44.9	175.4	-59.6	178.7	0	0	0	112.3	A78 K80 A113 V114 M117	L61-A78 HydrophobicContact CB-CB 4.37Å; L61-A78 PolarHBondContact N-O 2.88Å; L61-K80 HydrophobicContact CD2-CB 4.18Å; L61-K80 HydrophobicContact CG-CB 4.37Å; L61-A113 HydrophobicContact CB-CB 3.99Å; L61-V114 HydrophobicContact CD1-CG2 3.98Å; L61-M117 HydrophobicContact CD1-CE 4.28Å; L61-M117 HydrophobicContact CD1-SD 3.9Å; L61-M117 HydrophobicContact CD2-SD 4.46Å
62	D	96.2	Very high	94.9	Very high	64 Å²	64	68 Å²	68	34%	0.342	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	160.5	172.6	-170.2	24.6	0	0	0	111.8	K47 V64 A78 A113	K47-D62 IonicContact NZ-OD1 2.71Å; K47-D62 PolarHBondContact NZ-OD1 3.45Å; D62-V64 WeakPolarHBondContact OD2-CG2 3.19Å; D62-A78 PolarHBondContact O-N 2.76Å; D62-A113 HydrophobicContact CB-CB 4.24Å
63	I	97.3	Very high	94.8	Very high	4 Å²	4	65 Å²	65	2%	0.021	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	113.8	170	-55.4	-178.9	0	0	0	108.9	K47 L50 Y51 I60 F76 V77	K47-I63 HydrophobicContact CD-CB 4.29Å; K47-I63 WeakPolarHBondContact CE-O 3.24Å; K47-I63 HydrophobicContact CG-CB 4.1Å; K47-I63 HydrophobicContact CG-CG2 4.2Å; K47-I63 PolarHBondContact NZ-O 3.02Å; L50-I63 HydrophobicContact CB-CD1 4.17Å; L50-I63 HydrophobicContact CB-CG2 4.36Å; L50-I63 HydrophobicContact CD1-CG2 4.07Å; Y51-I63 HydrophobicContact CD2-CD1 4.13Å; Y51-I63 HydrophobicContact CG-CD1 4.45Å; I60-I63 HydrophobicContact CD1-CD1 4.31Å; I60-I63 HydrophobicContact CG2-CD1 4.28Å; I60-I63 HydrophobicContact CG2-CG1 3.78Å; I63-F76 CarbonylContact C-O 3.59Å; I63-F76 WeakPolarHBondContact CA-O 3.43Å; I63-V77 HydrophobicContact CD1-CG2 4.49Å; I63-V77 HydrophobicContact CG1-CG1 4.31Å; I63-V77 HydrophobicContact CG1-CG2 4.23Å; I63-V77 HydrophobicContact CG2-CG2 4.21Å
64	V	96	Very high	94.8	Very high	58 Å²	58	65.4 Å²	65.4	35%	0.352	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	113.4	179	-176.4	0	0	0	0	109.4	D62 I66 A75 F76	D62-V64 WeakPolarHBondContact OD2-CG2 3.19Å; V64-I66 HydrophobicContact CG1-CD1 4.17Å; V64-I66 HydrophobicContact CG1-CG1 4.18Å; V64-A75 CarbonylContact O-C 3.22Å; V64-A75 VanDerWaalsContact O-CA 3.31Å; V64-A75 WeakPolarHBondContact O-CA 3.25Å; V64-F76 HydrophobicContact CB-CB 4.34Å; V64-F76 PolarHBondContact N-O 2.86Å; V64-F76 PolarHBondContact O-N 2.9Å
65	C	93.8	Very high	94.8	Very high	6 Å²	6	65.4 Å²	65.4	4%	0.041	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.9	171.1	55.3	0	0	0	0	109.9	K43 L46 A75	K43-C65 WeakPolarHBondContact CE-O 3.41Å; L46-C65 HydrophobicContact CD2-CB 4.39Å; C65-A75 HydrophobicContact CB-CB 4.4Å
66	I	93.3	Very high	94.8	Very high	71 Å²	71	64.8 Å²	64.8	36%	0.364	33%	0.325	S	S	.	.			trans	-136.7	129.8	-174	-53.4	178.8	0	0	0	108.7	V64 T68 M71	V64-I66 HydrophobicContact CG1-CD1 4.17Å; V64-I66 HydrophobicContact CG1-CG1 4.18Å; I66-T68 VanDerWaalsContact C-N 3.34Å; I66-T68 HydrophobicContact CG2-CG2 3.83Å; I66-T68 WeakPolarHBondContact CG2-OG1 3.41Å; I66-T68 PolarHBondContact O-N 2.93Å; I66-M71 HydrophobicContact CB-CB 3.8Å; I66-M71 HydrophobicContact CB-CG 4.2Å; I66-M71 HydrophobicContact CG2-CB 4.25Å; I66-M71 HydrophobicContact CG2-CG 4.5Å; I66-M71 CarbonylContact O-C 3.54Å; I66-M71 WeakPolarHBondContact O-CB 3.3Å; I66-M71 VanDerWaalsContact O-O 3.13Å
67	K	90.3	Very high	94.9	Very high	81 Å²	81	57.9 Å²	57.9	35%	0.352	29%	0.293	S	S	.	.			trans	-92.1	18.3	-177	-68.8	-68.1	-168.8	173.6	0	114.2	E39 I41 K43	E39-K67 PolarHBondContact O-NZ 3.12Å; I41-K67 WeakPolarHBondContact O-CE 3.28Å; I41-K67 PolarHBondContact O-NZ 3.11Å; K43-K67 HydrophobicContact CB-CG 4.19Å
68	T	90.9	Very high	94.9	Very high	77 Å²	77	56 Å²	56	47%	0.472	29%	0.285	S	S	.	.	S	Bend	trans	-71.3	155.8	172.6	53.1	0	0	0	0	110.5	I66 K70 M71 R72	I66-T68 VanDerWaalsContact C-N 3.34Å; I66-T68 HydrophobicContact CG2-CG2 3.83Å; I66-T68 WeakPolarHBondContact CG2-OG1 3.41Å; I66-T68 PolarHBondContact O-N 2.93Å; T68-K70 PolarHBondContact O-N 3.31Å; T68-M71 PolarHBondContact O-N 2.69Å; T68-R72 PolarHBondContact O-N 3.03Å
69	V	88.6	Confident	94.9	Very high	122 Å²	122	55 Å²	55	74%	0.739	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-36.3	-175.8	-176.5	0	0	0	0	113.4
70	K	89.2	Confident	94.9	Very high	188 Å²	188	53.7 Å²	53.7	82%	0.817	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-19.9	178.8	-65.3	-170.2	175.8	-172.6	0	115	T68 Q74	T68-K70 PolarHBondContact O-N 3.31Å; K70-Q74 PolarHBondContact O-NE2 3.43Å
71	M	92.3	Very high	94.9	Very high	47 Å²	47	56.3 Å²	56.3	23%	0.232	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-6.9	-172.9	-65.4	-54.6	-49.9	0	0	114.4	I66 T68 Q74 F76	I66-M71 HydrophobicContact CB-CB 3.8Å; I66-M71 HydrophobicContact CB-CG 4.2Å; I66-M71 HydrophobicContact CG2-CB 4.25Å; I66-M71 HydrophobicContact CG2-CG 4.5Å; I66-M71 CarbonylContact O-C 3.54Å; I66-M71 WeakPolarHBondContact O-CB 3.3Å; I66-M71 VanDerWaalsContact O-O 3.13Å; T68-M71 PolarHBondContact O-N 2.69Å; M71-Q74 HydrophobicContact CE-CB 4.27Å; M71-Q74 WeakPolarHBondContact O-CB 3.5Å; M71-Q74 PolarHBondContact O-N 3.14Å; M71-F76 HydrophobicContact CE-CE2 3.86Å
72	R	92.8	Very high	94.9	Very high	121 Å²	121	56.8 Å²	56.8	46%	0.457	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	146.6	173.9	67	-170.4	-174.3	138.8	-6.4	110.6	E39 T68 Q74	E39-R72 HydrophobicContact CG-CB 4.25Å; E39-R72 HydrophobicContact CG-CG 4.36Å; E39-R72 IonicContact OE1-CZ 3.44Å; E39-R72 IonicContact OE1-NE 2.8Å; E39-R72 WeakPolarHBondContact OE2-CD 3.5Å; E39-R72 IonicContact OE2-CZ 3.8Å; E39-R72 IonicContact OE2-NE 2.69Å; E39-R72 PolarHBondContact OE2-NE 3.44Å; E39-R72 IonicContact OE2-NH1 2.78Å; E39-R72 PolarHBondContact OE2-NH1 3.06Å; T68-R72 PolarHBondContact O-N 3.03Å; R72-Q74 PolarHBondContact O-N 3.03Å; R72-Q74 PolarHBondContact O-NE2 2.91Å
73	G	95	Very high	94.9	Very high	10 Å²	10	57.3 Å²	57.3	10%	0.103	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	7.4	-176.2	0	0	0	0	0	114.8	N35 N36 L37	N35-G73 WeakPolarHBondContact CA-O 3.37Å; N36-G73 PolarHBondContact N-O 3.14Å; L37-G73 WeakPolarHBondContact CB-O 3.44Å; L37-G73 PolarHBondContact N-O 2.94Å
74	Q	97.4	Very high	95	Very high	44 Å²	44	57.3 Å²	57.3	21%	0.206	29%	0.293	C	S	.	.			trans	-129.1	153.2	-176.9	-60.3	160.6	62	0	0	112.3	Y33 I34 N35 K70 M71 R72	Y33-Q74 HydrophobicContact CE2-CB 4.05Å; Y33-Q74 HydrophobicContact CE2-CG 4.03Å; Y33-Q74 PolarHBondContact OH-OE1 2.85Å; Y33-Q74 VanDerWaalsContact OH-OE1 3.14Å; I34-Q74 CarbonylContact O-C 3.57Å; I34-Q74 VanDerWaalsContact O-CA 3.25Å; I34-Q74 WeakPolarHBondContact O-CA 3.41Å; N35-Q74 HydrophobicContact CB-CG 4.03Å; K70-Q74 PolarHBondContact O-NE2 3.43Å; M71-Q74 HydrophobicContact CE-CB 4.27Å; M71-Q74 WeakPolarHBondContact O-CB 3.5Å; M71-Q74 PolarHBondContact O-N 3.14Å; R72-Q74 PolarHBondContact O-N 3.03Å; R72-Q74 PolarHBondContact O-NE2 2.91Å
75	A	97.8	Very high	95.1	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	160.8	171.3	0	0	0	0	0	111.4	I34 L37 L50 V64 C65	I34-A75 PolarHBondContact N-O 3.01Å; I34-A75 PolarHBondContact O-N 3.37Å; L37-A75 HydrophobicContact CD1-CB 3.71Å; L50-A75 HydrophobicContact CD1-CB 3.62Å; V64-A75 CarbonylContact O-C 3.22Å; V64-A75 VanDerWaalsContact O-CA 3.31Å; V64-A75 WeakPolarHBondContact O-CA 3.25Å; C65-A75 HydrophobicContact CB-CB 4.4Å
76	F	98	Very high	95.3	Very high	60 Å²	60	55.1 Å²	55.1	26%	0.263	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138	163.9	-62.9	-90.3	0	0	0	109.3	T31 I32 Y33 I63 V64 M71 A107	T31-F76 HydrophobicContact CG2-CB 4.03Å; T31-F76 HydrophobicContact CG2-CD1 4.23Å; I32-F76 VanDerWaalsContact O-CA 3.3Å; I32-F76 WeakPolarHBondContact O-CA 3.35Å; Y33-F76 HydrophobicContact CD2-CD1 4.09Å; Y33-F76 AromaticContact CD2-CE1 3.55Å; Y33-F76 HydrophobicContact CD2-CE1 3.55Å; Y33-F76 HydrophobicContact CD2-CE2 4.29Å; Y33-F76 AromaticContact CD2-CZ 3.66Å; Y33-F76 HydrophobicContact CD2-CZ 3.66Å; Y33-F76 HydrophobicContact CE2-CZ 4.22Å; Y33-F76 HydrophobicContact CG-CD1 4.5Å; Y33-F76 AromaticContact CG-CE1 3.98Å; Y33-F76 HydrophobicContact CG-CE1 3.98Å; Y33-F76 HydrophobicContact CG-CZ 4.46Å; I63-F76 CarbonylContact C-O 3.59Å; I63-F76 WeakPolarHBondContact CA-O 3.43Å; V64-F76 HydrophobicContact CB-CB 4.34Å; V64-F76 PolarHBondContact N-O 2.86Å; V64-F76 PolarHBondContact O-N 2.9Å; M71-F76 HydrophobicContact CE-CE2 3.86Å; F76-A107 HydrophobicContact CD1-CB 4.14Å; F76-A107 HydrophobicContact CE1-CB 4.21Å
77	V	98.1	Very high	95.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	118.8	172.6	178.8	0	0	0	0	107.3	T31 I32 I34 F54 I60 I63 F79	T31-V77 WeakPolarHBondContact CA-O 3.4Å; I32-V77 HydrophobicContact CD1-CB 4.16Å; I32-V77 HydrophobicContact CG1-CB 3.8Å; I32-V77 WeakPolarHBondContact CG1-O 3.08Å; I32-V77 PolarHBondContact N-O 3.42Å; I32-V77 PolarHBondContact O-N 2.89Å; I34-V77 HydrophobicContact CD1-CG2 3.72Å; F54-V77 HydrophobicContact CB-CG1 4.22Å; F54-V77 HydrophobicContact CD2-CG2 4.21Å; F54-V77 HydrophobicContact CG-CG1 4.36Å; F54-V77 HydrophobicContact CG-CG2 4.46Å; I60-V77 HydrophobicContact CD1-CG1 4.23Å; I60-V77 HydrophobicContact CG1-CG1 4.31Å; I60-V77 HydrophobicContact CG2-CG1 4.15Å; I63-V77 HydrophobicContact CD1-CG2 4.49Å; I63-V77 HydrophobicContact CG1-CG1 4.31Å; I63-V77 HydrophobicContact CG1-CG2 4.23Å; I63-V77 HydrophobicContact CG2-CG2 4.21Å; V77-F79 HydrophobicContact CG1-CD2 4.27Å; V77-F79 HydrophobicContact CG1-CE2 3.81Å; V77-F79 HydrophobicContact CG1-CZ 4.12Å
78	A	97.8	Very high	95.8	Very high	3 Å²	3	51.6 Å²	51.6	3%	0.025	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	116.8	179.3	0	0	0	0	0	109.6	T31 I60 L61 D62 S111 V114	T31-A78 HydrophobicContact CG2-CB 4.27Å; I60-A78 CarbonylContact C-O 3.55Å; L61-A78 HydrophobicContact CB-CB 4.37Å; L61-A78 PolarHBondContact N-O 2.88Å; D62-A78 PolarHBondContact O-N 2.76Å; A78-S111 VanDerWaalsContact CB-OG 3.28Å; A78-S111 WeakPolarHBondContact CB-OG 3.4Å; A78-V114 HydrophobicContact CB-CG2 4.23Å
79	F	98.3	Very high	96.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	158.7	171.3	-71.4	-84.9	0	0	0	111.2	N30 I32 F54 F57 Q59 I60 V77 A84 A85 A88	N30-F79 PolarHBondContact O-N 2.73Å; I32-F79 HydrophobicContact CD1-CE2 4.02Å; I32-F79 HydrophobicContact CG1-CE2 4.3Å; F54-F79 HydrophobicContact CB-CZ 3.95Å; F54-F79 HydrophobicContact CD1-CE2 4.25Å; F54-F79 AromaticContact CD1-CZ 3.94Å; F54-F79 HydrophobicContact CD1-CZ 3.94Å; F54-F79 HydrophobicContact CG-CZ 4.39Å; F54-F79 WeakPolarHBondContact O-CE1 3.42Å; F57-F79 HydrophobicContact CB-CE1 4.13Å; F57-F79 HydrophobicContact CB-CZ 4.24Å; Q59-F79 CarbonylContact O-C 3.55Å; Q59-F79 WeakPolarHBondContact O-CA 3.12Å; I60-F79 HydrophobicContact CG1-CD1 4.13Å; I60-F79 HydrophobicContact CG1-CE1 3.84Å; I60-F79 HydrophobicContact CG1-CZ 4.46Å; V77-F79 HydrophobicContact CG1-CD2 4.27Å; V77-F79 HydrophobicContact CG1-CE2 3.81Å; V77-F79 HydrophobicContact CG1-CZ 4.12Å; F79-A84 HydrophobicContact CB-CB 4.15Å; F79-A84 HydrophobicContact CD1-CB 3.75Å; F79-A84 HydrophobicContact CE1-CB 4.34Å; F79-A84 HydrophobicContact CG-CB 4.01Å; F79-A85 HydrophobicContact CB-CB 4.38Å; F79-A85 HydrophobicContact CD2-CB 3.82Å; F79-A85 HydrophobicContact CG-CB 4.41Å; F79-A88 HydrophobicContact CE2-CB 3.91Å; F79-A88 HydrophobicContact CZ-CB 3.88Å
80	K	96.7	Very high	96.5	Very high	88 Å²	88	52 Å²	52	38%	0.383	25%	0.247	S	C	.	.	S	Bend	trans	-63.7	-48.4	166.3	-176.3	172.9	175	-173.8	0	110.7	N30 Q59 L61 M117	N30-K80 PolarHBondContact ND2-O 3.24Å; Q59-K80 HydrophobicContact CB-CB 4.16Å; Q59-K80 HydrophobicContact CB-CD 4.42Å; Q59-K80 PolarHBondContact O-N 2.89Å; L61-K80 HydrophobicContact CD2-CB 4.18Å; L61-K80 HydrophobicContact CG-CB 4.37Å; K80-M117 HydrophobicContact CG-SD 4Å
81	D	96.4	Very high	96.9	Very high	77 Å²	77	47 Å²	47	41%	0.412	24%	0.235	S	C	.	.	S	Bend	trans	-108.1	143.2	-172.3	-53.9	-63.7	0	0	0	112.8	S83 A84 A85	D81-S83 VanDerWaalsContact C-N 3.31Å; D81-S83 PolarHBondContact O-N 3.28Å; D81-A84 HydrophobicContact CB-CB 4.33Å; D81-A84 PolarHBondContact O-N 2.82Å; D81-A85 PolarHBondContact O-N 2.82Å
82	I	96.4	Very high	97.2	Very high	72 Å²	72	45.1 Å²	45.1	37%	0.369	23%	0.226	S	C	.	.	H	α-helix	trans	-69.6	-31.8	178.6	-57.2	175.8	0	0	0	111	P28 N30 A85 T86	P28-I82 HydrophobicContact CB-CG2 3.95Å; N30-I82 HydrophobicContact CB-CG1 4.41Å; N30-I82 VanDerWaalsContact CG-CG1 3.5Å; N30-I82 WeakPolarHBondContact ND2-CG1 3.39Å; N30-I82 WeakPolarHBondContact OD1-CG1 3.5Å; I82-A85 PolarHBondContact O-N 2.89Å; I82-T86 WeakPolarHBondContact O-CB 3.44Å; I82-T86 PolarHBondContact O-N 3.16Å; I82-T86 PolarHBondContact O-OG1 2.85Å
83	S	97.6	Very high	97.4	Very high	75 Å²	75	44.5 Å²	44.5	52%	0.524	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-44.2	174.5	48.8	0	0	0	0	112	D81 T86 N87	D81-S83 VanDerWaalsContact C-N 3.31Å; D81-S83 PolarHBondContact O-N 3.28Å; S83-T86 WeakPolarHBondContact O-CB 3.43Å; S83-T86 PolarHBondContact O-N 2.86Å; S83-N87 WeakPolarHBondContact O-CB 3.39Å; S83-N87 VanDerWaalsContact O-CG 3.24Å; S83-N87 PolarHBondContact O-N 3.09Å
84	A	98.1	Very high	97.4	Very high	4 Å²	4	45.7 Å²	45.7	3%	0.033	24%	0.24	C	C	.	.	H	α-helix	trans	-58.8	-48.4	174.3	0	0	0	0	0	111.6	F57 F79 D81 T86 N87 A88	F57-A84 WeakPolarHBondContact O-CA 3.29Å; F57-A84 WeakPolarHBondContact O-CB 3.42Å; F79-A84 HydrophobicContact CB-CB 4.15Å; F79-A84 HydrophobicContact CD1-CB 3.75Å; F79-A84 HydrophobicContact CE1-CB 4.34Å; F79-A84 HydrophobicContact CG-CB 4.01Å; D81-A84 HydrophobicContact CB-CB 4.33Å; D81-A84 PolarHBondContact O-N 2.82Å; A84-T86 VanDerWaalsContact C-N 3.34Å; A84-T86 PolarHBondContact O-N 3.22Å; A84-N87 PolarHBondContact O-N 3.34Å; A84-A88 VanDerWaalsContact O-CB 3.29Å; A84-A88 WeakPolarHBondContact O-CB 3.48Å; A84-A88 PolarHBondContact O-N 3.18Å
85	A	97.7	Very high	97.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.6	-41.2	175.2	0	0	0	0	0	112.9	N29 I32 F79 D81 I82 L89	N29-A85 VanDerWaalsContact O-CB 3.29Å; N29-A85 WeakPolarHBondContact O-CB 3.29Å; I32-A85 HydrophobicContact CG2-CB 4.02Å; F79-A85 HydrophobicContact CB-CB 4.38Å; F79-A85 HydrophobicContact CD2-CB 3.82Å; F79-A85 HydrophobicContact CG-CB 4.41Å; D81-A85 PolarHBondContact O-N 2.82Å; I82-A85 PolarHBondContact O-N 2.89Å; A85-L89 WeakPolarHBondContact O-CB 3.28Å; A85-L89 PolarHBondContact O-N 3.32Å
86	T	97.7	Very high	97.3	Very high	18 Å²	18	52.3 Å²	52.3	11%	0.11	28%	0.279	C	S	.	.	H	α-helix	trans	-65	-45.4	178.1	-58.4	0	0	0	0	111.7	I82 S83 A84 L89 R90 Y106	I82-T86 WeakPolarHBondContact O-CB 3.44Å; I82-T86 PolarHBondContact O-N 3.16Å; I82-T86 PolarHBondContact O-OG1 2.85Å; S83-T86 WeakPolarHBondContact O-CB 3.43Å; S83-T86 PolarHBondContact O-N 2.86Å; A84-T86 VanDerWaalsContact C-N 3.34Å; A84-T86 PolarHBondContact O-N 3.22Å; T86-L89 PolarHBondContact O-N 2.93Å; T86-R90 VanDerWaalsContact CG2-CZ 3.43Å; T86-R90 WeakPolarHBondContact O-CG 3.34Å; T86-R90 PolarHBondContact O-N 3.44Å; T86-R90 VanDerWaalsContact O-N 3.11Å; T86-Y106 WeakPolarHBondContact CG2-OH 3.16Å; T86-Y106 PolarHBondContact OG1-OH 3.37Å; T86-Y106 VanDerWaalsContact OG1-OH 3.09Å
87	N	98	Very high	97.2	Very high	77 Å²	77	49.9 Å²	49.9	41%	0.412	27%	0.268	S	S	.	.	H	α-helix	trans	-66.9	-46.2	179.3	-68.8	-12.7	0	0	0	110.6	F57 S83 A84 L89 R90 S91	F57-N87 HydrophobicContact CD1-CB 3.99Å; S83-N87 WeakPolarHBondContact O-CB 3.39Å; S83-N87 VanDerWaalsContact O-CG 3.24Å; S83-N87 PolarHBondContact O-N 3.09Å; A84-N87 PolarHBondContact O-N 3.34Å; N87-L89 VanDerWaalsContact C-N 3.32Å; N87-L89 PolarHBondContact O-N 2.8Å; N87-R90 PolarHBondContact O-N 2.89Å; N87-S91 WeakPolarHBondContact O-CB 3.34Å; N87-S91 PolarHBondContact O-N 3.25Å; N87-S91 PolarHBondContact O-OG 3.27Å
88	A	98	Very high	97.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-56.1	-44.4	175	0	0	0	0	0	112.6	I32 F54 F57 F79 A84 L92	I32-A88 HydrophobicContact CD1-CB 4.41Å; F54-A88 HydrophobicContact CD1-CB 3.85Å; F54-A88 HydrophobicContact CE1-CB 3.99Å; F57-A88 HydrophobicContact CB-CB 3.98Å; F57-A88 HydrophobicContact CD1-CB 4.16Å; F57-A88 HydrophobicContact CD2-CB 3.78Å; F57-A88 HydrophobicContact CE2-CB 4.38Å; F57-A88 HydrophobicContact CG-CB 3.67Å; F79-A88 HydrophobicContact CE2-CB 3.91Å; F79-A88 HydrophobicContact CZ-CB 3.88Å; A84-A88 VanDerWaalsContact O-CB 3.29Å; A84-A88 WeakPolarHBondContact O-CB 3.48Å; A84-A88 PolarHBondContact O-N 3.18Å; A88-L92 WeakPolarHBondContact O-CB 3.33Å; A88-L92 PolarHBondContact O-N 2.92Å; A88-L92 VanDerWaalsContact O-N 3.08Å
89	L	97.3	Very high	97	Very high	31 Å²	31	60.7 Å²	60.7	16%	0.162	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-47.1	176.9	-176.1	158.5	0	0	0	111.6	I32 A85 T86 N87 Q93 I104 Y106	I32-L89 HydrophobicContact CG2-CB 4.45Å; A85-L89 WeakPolarHBondContact O-CB 3.28Å; A85-L89 PolarHBondContact O-N 3.32Å; T86-L89 PolarHBondContact O-N 2.93Å; N87-L89 VanDerWaalsContact C-N 3.32Å; N87-L89 PolarHBondContact O-N 2.8Å; L89-Q93 WeakPolarHBondContact O-CB 3.31Å; L89-Q93 PolarHBondContact O-N 3.05Å; L89-I104 HydrophobicContact CB-CG2 4.03Å; L89-I104 HydrophobicContact CD1-CG2 4.3Å; L89-I104 HydrophobicContact CG-CB 4.28Å; L89-I104 HydrophobicContact CG-CG2 3.9Å; L89-Y106 HydrophobicContact CD1-CD1 4.12Å; L89-Y106 HydrophobicContact CD1-CD2 4.13Å; L89-Y106 HydrophobicContact CD1-CE1 4.05Å; L89-Y106 HydrophobicContact CD1-CE2 4.06Å; L89-Y106 HydrophobicContact CD1-CG 4.16Å
90	R	96.7	Very high	96.9	Very high	178 Å²	178	63.7 Å²	63.7	67%	0.672	33%	0.333	S	S	*	.	H	α-helix	trans	-67.1	-44	-179.4	-70.3	173.3	-177.6	156	-1.1	112.6	T86 N87	T86-R90 VanDerWaalsContact CG2-CZ 3.43Å; T86-R90 WeakPolarHBondContact O-CG 3.34Å; T86-R90 PolarHBondContact O-N 3.44Å; T86-R90 VanDerWaalsContact O-N 3.11Å; N87-R90 PolarHBondContact O-N 2.89Å
91	S	97.2	Very high	96.9	Very high	81 Å²	81	62.9 Å²	62.9	57%	0.566	34%	0.337	S	S	*	.	H	α-helix	trans	-78.2	-26.1	-173.7	-63.4	0	0	0	0	114.3	N87	N87-S91 WeakPolarHBondContact O-CB 3.34Å; N87-S91 PolarHBondContact O-N 3.25Å; N87-S91 PolarHBondContact O-OG 3.27Å
92	L	97.5	Very high	96.9	Very high	9 Å²	9	59.2 Å²	59.2	5%	0.047	32%	0.317	C	S	.	.	H	α-helix	trans	-111.8	7	-175.5	-62.2	173.6	0	0	0	114.1	I53 F54 F57 A88 G94 F95 M102 I104	I53-L92 HydrophobicContact CG2-CD1 3.59Å; I53-L92 HydrophobicContact CG2-CD2 3.97Å; I53-L92 HydrophobicContact CG2-CG 4.46Å; F54-L92 HydrophobicContact CD1-CD1 3.74Å; F54-L92 HydrophobicContact CE1-CD1 3.35Å; F54-L92 HydrophobicContact CE2-CD1 4.24Å; F54-L92 HydrophobicContact CG-CD1 4.35Å; F54-L92 HydrophobicContact CZ-CD1 3.63Å; F57-L92 HydrophobicContact CD2-CD1 4.36Å; F57-L92 HydrophobicContact CE2-CD1 3.52Å; F57-L92 HydrophobicContact CE2-CG 3.95Å; F57-L92 HydrophobicContact CZ-CD1 4.07Å; F57-L92 HydrophobicContact CZ-CD2 4.48Å; F57-L92 HydrophobicContact CZ-CG 3.96Å; A88-L92 WeakPolarHBondContact O-CB 3.33Å; A88-L92 PolarHBondContact O-N 2.92Å; A88-L92 VanDerWaalsContact O-N 3.08Å; L92-G94 PolarHBondContact O-N 2.88Å; L92-F95 HydrophobicContact CB-CB 4.22Å; L92-F95 HydrophobicContact CD2-CB 4.12Å; L92-F95 HydrophobicContact CD2-CD1 4.43Å; L92-F95 HydrophobicContact CD2-CD2 3.96Å; L92-F95 HydrophobicContact CD2-CG 3.91Å; L92-F95 VanDerWaalsContact O-CB 3.24Å; L92-F95 WeakPolarHBondContact O-CB 3.41Å; L92-F95 PolarHBondContact O-N 2.9Å; L92-M102 HydrophobicContact CB-SD 4.27Å; L92-M102 WeakPolarHBondContact O-CG 3.14Å; L92-I104 HydrophobicContact CB-CD1 3.52Å
93	Q	96.8	Very high	97	Very high	107 Å²	107	62.9 Å²	62.9	50%	0.5	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	121.5	175.4	-179.4	67.5	-34.3	0	0	110.6	L89 F95	L89-Q93 WeakPolarHBondContact O-CB 3.31Å; L89-Q93 PolarHBondContact O-N 3.05Å; Q93-F95 VanDerWaalsContact C-N 3.26Å; Q93-F95 PolarHBondContact O-N 3.24Å
94	G	96.2	Very high	96.9	Very high	35 Å²	35	59.4 Å²	59.4	36%	0.361	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	0.5	-175.8	0	0	0	0	0	115	L92 P101 M102	L92-G94 PolarHBondContact O-N 2.88Å; G94-P101 VanDerWaalsContact O-CB 3.28Å; G94-P101 WeakPolarHBondContact O-CB 3.24Å; G94-M102 WeakPolarHBondContact CA-O 3.38Å; G94-M102 PolarHBondContact N-O 3.44Å
95	F	96.3	Very high	96.9	Very high	88 Å²	88	60.8 Å²	60.8	39%	0.386	31%	0.308	S	S	.	.			trans	-57.9	127	-176.6	-175.6	-92.9	0	0	0	111.7	I53 L92 Q93 F97 M102	I53-F95 HydrophobicContact CD1-CE1 4.09Å; L92-F95 HydrophobicContact CB-CB 4.22Å; L92-F95 HydrophobicContact CD2-CB 4.12Å; L92-F95 HydrophobicContact CD2-CD1 4.43Å; L92-F95 HydrophobicContact CD2-CD2 3.96Å; L92-F95 HydrophobicContact CD2-CG 3.91Å; L92-F95 VanDerWaalsContact O-CB 3.24Å; L92-F95 WeakPolarHBondContact O-CB 3.41Å; L92-F95 PolarHBondContact O-N 2.9Å; Q93-F95 VanDerWaalsContact C-N 3.26Å; Q93-F95 PolarHBondContact O-N 3.24Å; F95-F97 HydrophobicContact CD1-CB 4.45Å; F95-F97 PolarHBondContact O-N 2.78Å; F95-M102 HydrophobicContact CB-CE 4.45Å; F95-M102 HydrophobicContact CB-CG 4.2Å; F95-M102 HydrophobicContact CD1-CE 4.04Å; F95-M102 PolarHBondContact O-N 3.15Å
96	P	96.6	Very high	96.8	Very high	96 Å²	96	62.5 Å²	62.5	62%	0.623	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.6	118.8	177.4	-23.1	34.5	0	0	0	112.1
97	F	96.8	Very high	96.7	Very high	9 Å²	9	61.8 Å²	61.8	4%	0.039	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	109	-176.3	-179.2	-102.6	0	0	0	110.4	L37 L46 A49 L50 I53 F95 K100 M102	L37-F97 HydrophobicContact CD2-CD1 3.65Å; L37-F97 HydrophobicContact CD2-CE1 3.87Å; L46-F97 HydrophobicContact CD1-CE1 3.59Å; L46-F97 HydrophobicContact CD1-CZ 4.04Å; A49-F97 HydrophobicContact CB-CE2 3.86Å; A49-F97 HydrophobicContact CB-CZ 3.77Å; L50-F97 HydrophobicContact CD2-CE1 4.04Å; L50-F97 HydrophobicContact CD2-CZ 3.91Å; L50-F97 HydrophobicContact CG-CE1 4.38Å; L50-F97 HydrophobicContact CG-CZ 4.03Å; I53-F97 HydrophobicContact CD1-CD2 3.48Å; I53-F97 VanDerWaalsContact CD1-CD2 3.48Å; I53-F97 HydrophobicContact CD1-CE2 3.56Å; F95-F97 HydrophobicContact CD1-CB 4.45Å; F95-F97 PolarHBondContact O-N 2.78Å; F97-K100 PolarHBondContact N-O 2.99Å; F97-K100 PolarHBondContact O-N 3Å; F97-M102 HydrophobicContact CB-CE 3.46Å; F97-M102 VanDerWaalsContact CB-CE 3.46Å; F97-M102 HydrophobicContact CD1-CE 4.22Å; F97-M102 HydrophobicContact CD2-CE 3.95Å; F97-M102 HydrophobicContact CG-CE 3.63Å
98	Y	96.1	Very high	96.5	Very high	71 Å²	71	64.7 Å²	64.7	28%	0.278	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	58.9	-168.7	-64.9	-84.2	0	0	0	112	N38 I41 E45 A49 K100	N38-Y98 WeakPolarHBondContact CB-O 3.23Å; N38-Y98 PolarHBondContact ND2-O 2.78Å; I41-Y98 HydrophobicContact CD1-CD1 3.36Å; I41-Y98 HydrophobicContact CD1-CE1 3.62Å; I41-Y98 HydrophobicContact CD1-CG 3.82Å; I41-Y98 HydrophobicContact CG1-CD1 3.83Å; I41-Y98 HydrophobicContact CG1-CD2 4.06Å; I41-Y98 HydrophobicContact CG1-CE1 4.11Å; I41-Y98 HydrophobicContact CG1-CE2 4.35Å; I41-Y98 HydrophobicContact CG1-CG 3.76Å; I41-Y98 HydrophobicContact CG2-CE1 4.35Å; I41-Y98 HydrophobicContact CG2-CE2 4.2Å; E45-Y98 PolarHBondContact OE1-OH 3.28Å; E45-Y98 VanDerWaalsContact OE1-OH 3.08Å; A49-Y98 HydrophobicContact CB-CE2 3.77Å; Y98-K100 PolarHBondContact O-N 3.36Å
99	D	93.9	Very high	96.1	Very high	158 Å²	158	69.2 Å²	69.2	85%	0.845	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	15.6	175.5	-42	-50.9	0	0	0	115.7
100	K	96.2	Very high	95.7	Very high	64 Å²	64	69.7 Å²	69.7	28%	0.278	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.2	177.1	-61.1	-172.4	72.4	-157.8	0	111.3	N36 L37 N38 F97 Y98 M102	N36-K100 WeakPolarHBondContact O-CB 3.5Å; N36-K100 WeakPolarHBondContact O-CD 3.39Å; N36-K100 WeakPolarHBondContact O-CE 3.29Å; N36-K100 PolarHBondContact O-NZ 3.46Å; N36-K100 WeakPolarHBondContact OD1-CE 3.34Å; N36-K100 PolarHBondContact OD1-NZ 3.17Å; L37-K100 PolarHBondContact O-NZ 3.25Å; L37-K100 VanDerWaalsContact O-NZ 3.12Å; N38-K100 HydrophobicContact CB-CD 4.18Å; F97-K100 PolarHBondContact N-O 2.99Å; F97-K100 PolarHBondContact O-N 3Å; Y98-K100 PolarHBondContact O-N 3.36Å; K100-M102 PolarHBondContact O-N 3.12Å
101	P	96.9	Very high	95.5	Very high	70 Å²	70	62.2 Å²	62.2	46%	0.455	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	115.1	173.2	28.1	-32.8	0	0	0	109.2	N36 G94	N36-P101 PolarHBondContact ND2-O 3.14Å; G94-P101 VanDerWaalsContact O-CB 3.28Å; G94-P101 WeakPolarHBondContact O-CB 3.24Å
102	M	96.9	Very high	95.1	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.315	C	S	.	.			trans	-68.2	146.5	179.4	75	171.4	69.9	0	0	111	I34 L37 F54 L92 G94 F95 F97 K100 I104	I34-M102 HydrophobicContact CG2-CB 4.13Å; I34-M102 HydrophobicContact CG2-SD 4.3Å; L37-M102 HydrophobicContact CD2-CB 4.3Å; F54-M102 HydrophobicContact CE2-SD 4.19Å; F54-M102 HydrophobicContact CZ-SD 3.85Å; L92-M102 HydrophobicContact CB-SD 4.27Å; L92-M102 WeakPolarHBondContact O-CG 3.14Å; G94-M102 WeakPolarHBondContact CA-O 3.38Å; G94-M102 PolarHBondContact N-O 3.44Å; F95-M102 HydrophobicContact CB-CE 4.45Å; F95-M102 HydrophobicContact CB-CG 4.2Å; F95-M102 HydrophobicContact CD1-CE 4.04Å; F95-M102 PolarHBondContact O-N 3.15Å; F97-M102 HydrophobicContact CB-CE 3.46Å; F97-M102 VanDerWaalsContact CB-CE 3.46Å; F97-M102 HydrophobicContact CD1-CE 4.22Å; F97-M102 HydrophobicContact CD2-CE 3.95Å; F97-M102 HydrophobicContact CG-CE 3.63Å; K100-M102 PolarHBondContact O-N 3.12Å; M102-I104 HydrophobicContact CG-CD1 4.28Å; M102-I104 HydrophobicContact CG-CG1 4.16Å; M102-I104 HydrophobicContact SD-CD1 3.77Å; M102-I104 HydrophobicContact SD-CG1 4.06Å
103	R	97.4	Very high	94.8	Very high	149 Å²	149	62.3 Å²	62.3	56%	0.562	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.7	176.1	-70.9	177.3	177.2	177.8	-2.3	108.9	I34 N35 N36	I34-R103 CarbonylContact C-O 3.57Å; I34-R103 WeakPolarHBondContact CA-O 3.45Å; N35-R103 PolarHBondContact N-O 3.11Å; N35-R103 PolarHBondContact O-N 2.99Å; N35-R103 VanDerWaalsContact O-N 3.09Å; N35-R103 WeakPolarHBondContact OD1-CB 3.47Å; N36-R103 HydrophobicContact CB-CG 4.34Å
104	I	97.1	Very high	94.6	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	139.7	-174.4	-47.5	177.7	0	0	0	109.6	I32 Y33 I34 F54 L89 L92 M102	I32-I104 HydrophobicContact CB-CG2 3.88Å; I32-I104 HydrophobicContact CD1-CG2 3.9Å; I32-I104 HydrophobicContact CG1-CG2 4.39Å; I32-I104 HydrophobicContact CG2-CG2 4.21Å; Y33-I104 WeakPolarHBondContact O-CA 3.46Å; I34-I104 HydrophobicContact CG1-CG1 4.44Å; I34-I104 HydrophobicContact CG1-CG2 4.46Å; I34-I104 HydrophobicContact CG2-CG1 4.44Å; F54-I104 HydrophobicContact CE1-CD1 4.1Å; F54-I104 HydrophobicContact CZ-CD1 3.9Å; L89-I104 HydrophobicContact CB-CG2 4.03Å; L89-I104 HydrophobicContact CD1-CG2 4.3Å; L89-I104 HydrophobicContact CG-CB 4.28Å; L89-I104 HydrophobicContact CG-CG2 3.9Å; L92-I104 HydrophobicContact CB-CD1 3.52Å; M102-I104 HydrophobicContact CG-CD1 4.28Å; M102-I104 HydrophobicContact CG-CG1 4.16Å; M102-I104 HydrophobicContact SD-CD1 3.77Å; M102-I104 HydrophobicContact SD-CG1 4.06Å
105	Q	96.5	Very high	94.3	Very high	33 Å²	33	56.2 Å²	56.2	15%	0.154	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	165.8	173.3	-60.9	175.3	19.7	0	0	108.8	M23 I32 Y33	M23-Q105 PolarHBondContact SD-NE2 3Å; I32-Q105 CarbonylContact C-O 3.59Å; I32-Q105 WeakPolarHBondContact CA-O 3.14Å; Y33-Q105 HydrophobicContact CD1-CB 4.39Å; Y33-Q105 PolarHBondContact N-O 3.38Å; Y33-Q105 PolarHBondContact O-N 3.37Å
106	Y	97.5	Very high	94.1	Very high	35 Å²	35	58 Å²	58	14%	0.137	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	149.1	164.1	-65.3	-63.5	0	0	0	110.7	P28 N29 T86 L89	P28-Y106 HydrophobicContact CB-CE1 4.25Å; P28-Y106 HydrophobicContact CB-CE2 4.21Å; P28-Y106 HydrophobicContact CG-CE2 4.25Å; N29-Y106 HydrophobicContact CB-CD1 4.35Å; N29-Y106 VanDerWaalsContact N-CD1 3.29Å; T86-Y106 WeakPolarHBondContact CG2-OH 3.16Å; T86-Y106 PolarHBondContact OG1-OH 3.37Å; T86-Y106 VanDerWaalsContact OG1-OH 3.09Å; L89-Y106 HydrophobicContact CD1-CD1 4.12Å; L89-Y106 HydrophobicContact CD1-CD2 4.13Å; L89-Y106 HydrophobicContact CD1-CE1 4.05Å; L89-Y106 HydrophobicContact CD1-CE2 4.06Å; L89-Y106 HydrophobicContact CD1-CG 4.16Å
107	A	95.6	Very high	93.8	Very high	3 Å²	3	57.7 Å²	57.7	3%	0.025	29%	0.286	C	S	.	.			trans	-72.4	137.4	171.7	0	0	0	0	0	110.7	N29 T31 F76 T109	N29-A107 PolarHBondContact ND2-O 3.09Å; T31-A107 HydrophobicContact CG2-CB 3.88Å; T31-A107 VanDerWaalsContact O-CB 3.23Å; T31-A107 WeakPolarHBondContact O-CB 3.06Å; T31-A107 PolarHBondContact O-N 3.26Å; F76-A107 HydrophobicContact CD1-CB 4.14Å; F76-A107 HydrophobicContact CE1-CB 4.21Å; A107-T109 WeakPolarHBondContact CB-O 3.27Å; A107-T109 PolarHBondContact O-N 3.32Å
108	K	92	Very high	93.5	Very high	138 Å²	138	61.6 Å²	61.6	60%	0.6	30%	0.303	S	S	*	.	S	Bend	trans	-64.5	-22.9	178.1	-61.2	-179.6	-179.1	178.1	0	113.1
109	T	90.7	Very high	93.1	Very high	95 Å²	95	61.6 Å²	61.6	58%	0.583	33%	0.325	S	S	*	.	S	Bend	trans	-137.2	148.3	-179.9	59.2	0	0	0	0	109.8	A107	A107-T109 WeakPolarHBondContact CB-O 3.27Å; A107-T109 PolarHBondContact O-N 3.32Å
110	D	89.2	Confident	92.8	Very high	41 Å²	41	58.4 Å²	58.4	22%	0.219	31%	0.311	C	S	.	.			trans	-60.3	143.1	171.5	-72	29	0	0	0	110.7	N29 V114 K118	N29-D110 PolarHBondContact ND2-OD1 3.42Å; D110-V114 HydrophobicContact CB-CG1 4.28Å; D110-K118 IonicContact OD2-NZ 3.64Å; D110-K118 PolarHBondContact OD2-NZ 3.47Å
111	S	91.5	Very high	92.2	Very high	21 Å²	21	58.9 Å²	58.9	15%	0.147	31%	0.312	C	S	.	.			trans	-76.2	156.8	175.1	55.5	0	0	0	0	111.5	T31 A78 A113 V114 A115	T31-S111 WeakPolarHBondContact OG1-CB 3.42Å; T31-S111 PolarHBondContact OG1-OG 2.89Å; A78-S111 VanDerWaalsContact CB-OG 3.28Å; A78-S111 WeakPolarHBondContact CB-OG 3.4Å; S111-A113 PolarHBondContact O-N 2.94Å; S111-A113 VanDerWaalsContact O-N 3.14Å; S111-V114 PolarHBondContact O-N 2.96Å; S111-V114 VanDerWaalsContact OG-CG2 3.29Å; S111-V114 WeakPolarHBondContact OG-CG2 3.47Å; S111-A115 PolarHBondContact O-N 2.96Å
112	D	89.7	Confident	91.5	Very high	66 Å²	66	61.1 Å²	61.1	35%	0.353	32%	0.324	S	S	.	.	H	α-helix	trans	-56.3	-33	178.7	-67.8	-28	0	0	0	112.4	K116 Y121 R124	D112-K116 WeakPolarHBondContact O-CB 3.45Å; D112-K116 WeakPolarHBondContact O-CG 3.46Å; D112-K116 PolarHBondContact O-N 2.79Å; D112-Y121 HydrophobicContact CB-CD2 4.23Å; D112-Y121 HydrophobicContact CB-CE2 3.79Å; D112-R124 VanDerWaalsContact CG-NH2 3.32Å; D112-R124 IonicContact OD1-CZ 3.7Å; D112-R124 IonicContact OD1-NE 2.7Å; D112-R124 IonicContact OD1-NH2 3.31Å; D112-R124 PolarHBondContact OD1-NH2 2.99Å; D112-R124 IonicContact OD2-NH2 3.55Å; D112-R124 PolarHBondContact OD2-NH2 3.14Å
113	A	91.3	Very high	90.5	Very high	27 Å²	27	66.9 Å²	66.9	22%	0.223	35%	0.351	C	S	.	.	H	α-helix	trans	-67.1	-44.4	175.7	0	0	0	0	0	112.4	L61 D62 S111 K116 M117	L61-A113 HydrophobicContact CB-CB 3.99Å; D62-A113 HydrophobicContact CB-CB 4.24Å; S111-A113 PolarHBondContact O-N 2.94Å; S111-A113 VanDerWaalsContact O-N 3.14Å; A113-K116 PolarHBondContact O-N 3.48Å; A113-M117 PolarHBondContact O-N 2.74Å
114	V	91.5	Very high	89.1	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-68.6	-41.4	177.3	172.5	0	0	0	0	111	N30 L61 A78 D110 S111 K116 M117 K118	N30-V114 HydrophobicContact CB-CB 4.45Å; N30-V114 HydrophobicContact CB-CG1 3.92Å; N30-V114 HydrophobicContact CB-CG2 3.63Å; L61-V114 HydrophobicContact CD1-CG2 3.98Å; A78-V114 HydrophobicContact CB-CG2 4.23Å; D110-V114 HydrophobicContact CB-CG1 4.28Å; S111-V114 PolarHBondContact O-N 2.96Å; S111-V114 VanDerWaalsContact OG-CG2 3.29Å; S111-V114 WeakPolarHBondContact OG-CG2 3.47Å; V114-K116 VanDerWaalsContact C-N 3.33Å; V114-K116 PolarHBondContact O-N 3.18Å; V114-M117 PolarHBondContact O-N 3.44Å; V114-K118 HydrophobicContact CG1-CD 3.92Å; V114-K118 VanDerWaalsContact CG1-CE 3.45Å; V114-K118 HydrophobicContact CG1-CG 4.44Å; V114-K118 WeakPolarHBondContact O-CB 3.48Å; V114-K118 WeakPolarHBondContact O-CG 3.33Å; V114-K118 PolarHBondContact O-N 2.91Å
115	A	91.2	Very high	87.2	Confident	13 Å²	13	71.4 Å²	71.4	11%	0.107	39%	0.388	C	S	.	.	H	α-helix	trans	-63	-38.3	176.1	0	0	0	0	0	111.9	S111 K118 G119 T120 Y121	S111-A115 PolarHBondContact O-N 2.96Å; A115-K118 PolarHBondContact O-N 3.32Å; A115-G119 PolarHBondContact O-N 2.69Å; A115-G119 VanDerWaalsContact O-N 3.12Å; A115-T120 PolarHBondContact O-N 2.96Å; A115-Y121 HydrophobicContact CB-CD2 4.28Å; A115-Y121 PolarHBondContact O-N 3.38Å; A115-Y121 VanDerWaalsContact O-N 3.17Å
116	K	91.1	Very high	85.2	Confident	126 Å²	126	75.4 Å²	75.4	55%	0.548	40%	0.404	S	S	.	.	H	α-helix	trans	-64.5	-44.5	173.7	-76.2	172.7	-176.4	-174	0	111.8	D112 A113 V114 K118 G119 Y121	D112-K116 WeakPolarHBondContact O-CB 3.45Å; D112-K116 WeakPolarHBondContact O-CG 3.46Å; D112-K116 PolarHBondContact O-N 2.79Å; A113-K116 PolarHBondContact O-N 3.48Å; V114-K116 VanDerWaalsContact C-N 3.33Å; V114-K116 PolarHBondContact O-N 3.18Å; K116-K118 VanDerWaalsContact C-N 3.31Å; K116-K118 PolarHBondContact O-N 3.45Å; K116-G119 PolarHBondContact O-N 2.67Å; K116-Y121 HydrophobicContact CD-CD2 4.44Å; K116-Y121 HydrophobicContact CD-CG 4.36Å; K116-Y121 HydrophobicContact CG-CD1 3.98Å; K116-Y121 HydrophobicContact CG-CD2 3.84Å; K116-Y121 HydrophobicContact CG-CG 3.52Å
117	M	90.7	Very high	82.9	Confident	89 Å²	89	79.1 Å²	79.1	44%	0.438	43%	0.433	S	S	.	.	H	α-helix	trans	-62.2	-36.4	176.1	-174.6	-176.5	73.2	0	0	112.6	L61 K80 A113 V114 G119	L61-M117 HydrophobicContact CD1-CE 4.28Å; L61-M117 HydrophobicContact CD1-SD 3.9Å; L61-M117 HydrophobicContact CD2-SD 4.46Å; K80-M117 HydrophobicContact CG-SD 4Å; A113-M117 PolarHBondContact O-N 2.74Å; V114-M117 PolarHBondContact O-N 3.44Å; M117-G119 VanDerWaalsContact C-N 3.32Å
118	K	89.8	Confident	80.5	Confident	92 Å²	92	84.9 Å²	84.9	40%	0.4	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-4.5	177	-69.2	177.1	-176.6	172.6	0	114.1	N30 D110 V114 A115 K116 T120	N30-K118 PolarHBondContact OD1-NZ 2.76Å; D110-K118 IonicContact OD2-NZ 3.64Å; D110-K118 PolarHBondContact OD2-NZ 3.47Å; V114-K118 HydrophobicContact CG1-CD 3.92Å; V114-K118 VanDerWaalsContact CG1-CE 3.45Å; V114-K118 HydrophobicContact CG1-CG 4.44Å; V114-K118 WeakPolarHBondContact O-CB 3.48Å; V114-K118 WeakPolarHBondContact O-CG 3.33Å; V114-K118 PolarHBondContact O-N 2.91Å; A115-K118 PolarHBondContact O-N 3.32Å; K116-K118 VanDerWaalsContact C-N 3.31Å; K116-K118 PolarHBondContact O-N 3.45Å; K118-T120 HydrophobicContact CB-CG2 4.33Å; K118-T120 PolarHBondContact O-N 3.36Å
119	G	88.6	Confident	78.5	Confident	71 Å²	71	86.8 Å²	86.8	73%	0.732	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	7.1	-172.8	0	0	0	0	0	115	A115 K116 M117	A115-G119 PolarHBondContact O-N 2.69Å; A115-G119 VanDerWaalsContact O-N 3.12Å; K116-G119 PolarHBondContact O-N 2.67Å; M117-G119 VanDerWaalsContact C-N 3.32Å
120	T	87.1	Confident	76.4	Confident	91 Å²	91	90.9 Å²	90.9	56%	0.558	48%	0.478	S	S	*	.			trans	-98.1	12.2	-177	57.5	0	0	0	0	113.5	A115 K118 V122	A115-T120 PolarHBondContact O-N 2.96Å; K118-T120 HydrophobicContact CB-CG2 4.33Å; K118-T120 PolarHBondContact O-N 3.36Å; T120-V122 PolarHBondContact O-N 3Å; T120-V122 VanDerWaalsContact O-N 3.14Å
121	Y	85.1	Confident	74.3	Confident	74 Å²	74	95.3 Å²	95.3	29%	0.29	50%	0.502	S	S	.	.			trans	-70.7	106.7	-179.1	-179.3	-104.4	0	0	0	112.3	D112 A115 K116 E123	D112-Y121 HydrophobicContact CB-CD2 4.23Å; D112-Y121 HydrophobicContact CB-CE2 3.79Å; A115-Y121 HydrophobicContact CB-CD2 4.28Å; A115-Y121 PolarHBondContact O-N 3.38Å; A115-Y121 VanDerWaalsContact O-N 3.17Å; K116-Y121 HydrophobicContact CD-CD2 4.44Å; K116-Y121 HydrophobicContact CD-CG 4.36Å; K116-Y121 HydrophobicContact CG-CD1 3.98Å; K116-Y121 HydrophobicContact CG-CD2 3.84Å; K116-Y121 HydrophobicContact CG-CG 3.52Å; Y121-E123 HydrophobicContact CE1-CB 3.94Å
122	V	81.3	Confident	72.6	Confident	117 Å²	117	96.3 Å²	96.3	71%	0.709	51%	0.506	S	S	*	.			trans	-87.4	122.4	164.1	-177.5	0	0	0	0	108.2	T120 R124	T120-V122 PolarHBondContact O-N 3Å; T120-V122 VanDerWaalsContact O-N 3.14Å; V122-R124 PolarHBondContact O-N 2.9Å
123	E	76.8	Confident	70.8	Confident	120 Å²	120	99.1 Å²	99.1	56%	0.561	52%	0.517	S	S	*	.			trans	-66.4	104.6	172.9	-176.7	161.4	-153.5	0	0	109.3	Y121 A125 K126	Y121-E123 HydrophobicContact CE1-CB 3.94Å; E123-A125 PolarHBondContact O-N 3.07Å; E123-A125 VanDerWaalsContact O-N 3.11Å; E123-K126 IonicContact OE1-NZ 3.35Å; E123-K126 PolarHBondContact OE1-NZ 3.43Å
124	R	68.1	Low	69.3	Low	153 Å²	153	102.3 Å²	102.3	58%	0.577	53%	0.529	S	S	*	.			trans	-62.1	115.6	172.3	-68.5	-177.4	-80.5	-168.4	-3.8	108.2	D112 V122 K126	D112-R124 VanDerWaalsContact CG-NH2 3.32Å; D112-R124 IonicContact OD1-CZ 3.7Å; D112-R124 IonicContact OD1-NE 2.7Å; D112-R124 IonicContact OD1-NH2 3.31Å; D112-R124 PolarHBondContact OD1-NH2 2.99Å; D112-R124 IonicContact OD2-NH2 3.55Å; D112-R124 PolarHBondContact OD2-NH2 3.14Å; V122-R124 PolarHBondContact O-N 2.9Å; R124-K126 PolarHBondContact O-N 3.44Å
125	A	55.7	Low	67.9	Low	94 Å²	94	108.5 Å²	108.5	78%	0.777	57%	0.569	S	S	*	*			trans	-48.7	111.5	172.5	0	0	0	0	0	108.7	E123 P127	E123-A125 PolarHBondContact O-N 3.07Å; E123-A125 VanDerWaalsContact O-N 3.11Å; A125-P127 VanDerWaalsContact O-N 3.14Å
126	K	54.1	Low	66.8	Low	117 Å²	117	111.9 Å²	111.9	51%	0.509	61%	0.606	S	S	.	*			trans	-58.9	122	174.6	-68	162.8	-175.2	111	0	105	E123 R124 P128	E123-K126 IonicContact OE1-NZ 3.35Å; E123-K126 PolarHBondContact OE1-NZ 3.43Å; R124-K126 PolarHBondContact O-N 3.44Å; K126-P128 VanDerWaalsContact O-N 3.12Å
127	P	50.4	Low	65.7	Low	114 Å²	114	107.6 Å²	107.6	74%	0.74	59%	0.587	S	S	*	*			trans	-52.3	128.2	175.2	23.9	-33.5	0	0	0	105.9	A125 R129	A125-P127 VanDerWaalsContact O-N 3.14Å; P127-R129 PolarHBondContact O-N 2.88Å
128	P	44.6	Very low	64.8	Low	124 Å²	124	106 Å²	106	81%	0.805	59%	0.585	S	S	*	*			trans	-50.7	107.9	-154	14.4	-30	0	0	0	108.9	K126 R130	K126-P128 VanDerWaalsContact O-N 3.12Å; P128-R130 PolarHBondContact O-N 3.08Å
129	R	50.6	Low	64	Low	178 Å²	178	111.1 Å²	111.1	67%	0.672	61%	0.607	S	S	*	*			trans	-53.4	118	159.4	-67.9	-176.1	179.1	-169.6	0.8	101.9	P127 N131	P127-R129 PolarHBondContact O-N 2.88Å; R129-N131 PolarHBondContact O-N 3.43Å; R129-N131 PolarHBondContact O-OD1 3.24Å
130	R	46.1	Very low	63.4	Low	180 Å²	180	114.9 Å²	114.9	68%	0.679	60%	0.603	S	S	*	*			trans	-53.5	101.7	175	-124.1	-174.7	-171.4	176.7	7.7	104.1	P128 L132 E149	P128-R130 PolarHBondContact O-N 3.08Å; R130-L132 HydrophobicContact CB-CD1 4.23Å; R130-L132 HydrophobicContact CB-CG 4.16Å; R130-L132 PolarHBondContact O-N 3.44Å; R130-E149 IonicContact CZ-OE1 3.96Å; R130-E149 IonicContact NH1-OE1 3.34Å; R130-E149 PolarHBondContact NH1-OE1 3.05Å
131	N	45.9	Very low	62.9	Low	134 Å²	134	115.6 Å²	115.6	72%	0.717	60%	0.601	S	S	*	*			trans	-78.7	70.6	-171.9	-98.3	8.4	0	0	0	105.9	R129 E133	R129-N131 PolarHBondContact O-N 3.43Å; R129-N131 PolarHBondContact O-OD1 3.24Å; N131-E133 PolarHBondContact O-N 2.64Å
132	L	55.1	Low	62.3	Low	43 Å²	43	117.5 Å²	117.5	23%	0.225	61%	0.607	C	S	.	*			trans	-79.8	6.4	169.6	-63.8	170.6	0	0	0	109.6	R130 I134 R145 L146 E149	R130-L132 HydrophobicContact CB-CD1 4.23Å; R130-L132 HydrophobicContact CB-CG 4.16Å; R130-L132 PolarHBondContact O-N 3.44Å; L132-I134 VanDerWaalsContact C-N 3.3Å; L132-I134 PolarHBondContact O-N 3.1Å; L132-R145 VanDerWaalsContact CA-NH2 3.27Å; L132-R145 VanDerWaalsContact CB-NH2 3.34Å; L132-R145 VanDerWaalsContact CD2-NH2 3.28Å; L132-R145 PolarHBondContact O-NH1 3.38Å; L132-R145 PolarHBondContact O-NH2 2.82Å; L132-L146 HydrophobicContact CD1-CD2 3.78Å; L132-E149 WeakPolarHBondContact CD1-OE2 2.84Å
133	E	52.8	Low	62.2	Low	124 Å²	124	119.9 Å²	119.9	58%	0.579	61%	0.608	S	S	*	*			trans	-74.7	86.9	173	-58.7	-165.8	153	0	0	108.4	N131 R142	N131-E133 PolarHBondContact O-N 2.64Å; E133-R142 IonicContact OE1-CZ 3.64Å; E133-R142 IonicContact OE1-NH1 2.65Å; E133-R142 PolarHBondContact OE1-NH1 3.03Å
134	I	59.7	Low	62.4	Low	94 Å²	94	122.6 Å²	122.6	48%	0.482	61%	0.613	S	S	.	*			trans	-70.5	125.7	168.6	-62.2	171.1	0	0	0	106.4	L132 G136 E137 R145	L132-I134 VanDerWaalsContact C-N 3.3Å; L132-I134 PolarHBondContact O-N 3.1Å; I134-G136 PolarHBondContact O-N 3.47Å; I134-E137 HydrophobicContact CB-CB 4.13Å; I134-E137 WeakPolarHBondContact O-CB 3.37Å; I134-E137 PolarHBondContact O-N 2.65Å; I134-R145 VanDerWaalsContact CD1-CZ 3.48Å
135	P	60.7	Low	63	Low	131 Å²	131	118.7 Å²	118.7	85%	0.851	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	123.1	176	-26.3	35.3	0	0	0	110.8
136	G	68.9	Low	64.1	Low	84 Å²	84	117.8 Å²	117.8	87%	0.866	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.4	-9.3	-177.2	0	0	0	0	0	116.4	I134 S138	I134-G136 PolarHBondContact O-N 3.47Å; G136-S138 PolarHBondContact O-N 2.72Å
137	E	67.8	Low	65.3	Low	35 Å²	35	114.6 Å²	114.6	16%	0.164	58%	0.575	C	S	.	*			trans	-66	122.7	-177.4	-171.6	-177.4	-149.4	0	0	112.6	I134 E141 R142 R145	I134-E137 HydrophobicContact CB-CB 4.13Å; I134-E137 WeakPolarHBondContact O-CB 3.37Å; I134-E137 PolarHBondContact O-N 2.65Å; E137-E141 HydrophobicContact CG-CB 3.94Å; E137-E141 HydrophobicContact CG-CG 3.92Å; E137-R142 HydrophobicContact CG-CB 4.1Å; E137-R142 VanDerWaalsContact OE1-CA 3.3Å; E137-R142 WeakPolarHBondContact OE1-CA 3.48Å; E137-R142 PolarHBondContact OE1-N 3.05Å; E137-R145 IonicContact OE1-CZ 2.74Å; E137-R145 IonicContact OE1-NH1 3.8Å; E137-R145 PolarHBondContact OE1-NH1 3.47Å; E137-R145 IonicContact OE2-NH1 3.88Å; E137-R145 PolarHBondContact OE2-NH1 2.83Å
138	S	71.5	Confident	66.7	Low	57 Å²	57	111.6 Å²	111.6	40%	0.399	56%	0.56	S	S	.	*			trans	-69.4	152.2	178.5	73.9	0	0	0	0	112.1	G136 K140 E141 R142	G136-S138 PolarHBondContact O-N 2.72Å; S138-K140 PolarHBondContact O-N 3.44Å; S138-E141 PolarHBondContact O-N 3.37Å; S138-E141 VanDerWaalsContact OG-CB 3.31Å; S138-E141 WeakPolarHBondContact OG-CB 3.31Å; S138-E141 PolarHBondContact OG-N 3.03Å; S138-R142 PolarHBondContact O-N 2.96Å
139	K	73.4	Confident	68.1	Low	199 Å²	199	108.4 Å²	108.4	87%	0.865	54%	0.535	S	S	*	.	H	α-helix	trans	-52.9	-31	175	-75.7	-178.8	179.4	171.7	0	113.3	K143	K139-K143 PolarHBondContact O-N 2.92Å
140	K	76.4	Confident	69.2	Low	149 Å²	149	106.4 Å²	106.4	65%	0.648	53%	0.531	S	S	*	.	H	α-helix	trans	-72.6	-41.7	179.2	-174.3	178	-178.7	179.7	0	111.6	S138 K143 R144	S138-K140 PolarHBondContact O-N 3.44Å; K140-K143 PolarHBondContact O-N 2.97Å; K140-R144 PolarHBondContact O-N 3.28Å
141	E	75.5	Confident	70.3	Confident	107 Å²	107	104.1 Å²	104.1	50%	0.5	53%	0.529	S	S	.	.	H	α-helix	trans	-70.8	-48.1	179.9	-172.5	169.4	-165.3	0	0	111.8	E137 S138 K143 R144 R145	E137-E141 HydrophobicContact CG-CB 3.94Å; E137-E141 HydrophobicContact CG-CG 3.92Å; S138-E141 PolarHBondContact O-N 3.37Å; S138-E141 VanDerWaalsContact OG-CB 3.31Å; S138-E141 WeakPolarHBondContact OG-CB 3.31Å; S138-E141 PolarHBondContact OG-N 3.03Å; E141-K143 PolarHBondContact O-N 3.37Å; E141-K143 VanDerWaalsContact O-N 3.16Å; E141-R144 WeakPolarHBondContact O-CA 3.39Å; E141-R144 WeakPolarHBondContact O-CB 3.28Å; E141-R144 PolarHBondContact O-N 3.37Å; E141-R145 PolarHBondContact O-N 3.32Å
142	R	73.8	Confident	71.7	Confident	114 Å²	114	104.5 Å²	104.5	43%	0.43	53%	0.525	S	S	.	.	H	α-helix	trans	-51.1	-41	170.5	176.3	174.2	159.1	165.9	1.3	112.3	E133 E137 S138 L146	E133-R142 IonicContact OE1-CZ 3.64Å; E133-R142 IonicContact OE1-NH1 2.65Å; E133-R142 PolarHBondContact OE1-NH1 3.03Å; E137-R142 HydrophobicContact CG-CB 4.1Å; E137-R142 VanDerWaalsContact OE1-CA 3.3Å; E137-R142 WeakPolarHBondContact OE1-CA 3.48Å; E137-R142 PolarHBondContact OE1-N 3.05Å; S138-R142 PolarHBondContact O-N 2.96Å; R142-L146 HydrophobicContact CG-CD1 3.82Å; R142-L146 HydrophobicContact CG-CG 4.46Å; R142-L146 VanDerWaalsContact O-CB 3.31Å; R142-L146 WeakPolarHBondContact O-CB 3.35Å; R142-L146 WeakPolarHBondContact O-CD1 3.39Å; R142-L146 VanDerWaalsContact O-CG 3.22Å; R142-L146 WeakPolarHBondContact O-CG 3.45Å; R142-L146 PolarHBondContact O-N 3.01Å
143	K	78.3	Confident	72.2	Confident	166 Å²	166	107.3 Å²	107.3	72%	0.722	54%	0.539	S	S	*	.	H	α-helix	trans	-66.5	-38.3	176.3	-171.5	178.6	179.1	-177.1	0	112.4	K139 K140 E141 A147	K139-K143 PolarHBondContact O-N 2.92Å; K140-K143 PolarHBondContact O-N 2.97Å; E141-K143 PolarHBondContact O-N 3.37Å; E141-K143 VanDerWaalsContact O-N 3.16Å; K143-A147 WeakPolarHBondContact O-CB 3.44Å; K143-A147 PolarHBondContact O-N 3.19Å; K143-A147 VanDerWaalsContact O-N 3.17Å
144	R	82	Confident	72.5	Confident	178 Å²	178	105.3 Å²	105.3	67%	0.672	53%	0.526	S	S	*	.	H	α-helix	trans	-67.4	-47.9	175.5	-73.8	176	166.3	-173.8	-7.3	111.6	K140 E141 A147 A148	K140-R144 PolarHBondContact O-N 3.28Å; E141-R144 WeakPolarHBondContact O-CA 3.39Å; E141-R144 WeakPolarHBondContact O-CB 3.28Å; E141-R144 PolarHBondContact O-N 3.37Å; R144-A147 WeakPolarHBondContact O-CB 3.47Å; R144-A147 PolarHBondContact O-N 3.47Å; R144-A147 VanDerWaalsContact O-N 3.16Å; R144-A148 PolarHBondContact O-N 3.3Å
145	R	80.2	Confident	72.7	Confident	71 Å²	71	108.4 Å²	108.4	27%	0.268	54%	0.539	S	S	.	.	H	α-helix	trans	-61.7	-47	178.8	175.3	160.4	146.6	-112.3	9.2	112.5	L132 I134 E137 E141 A147 A148 E149	L132-R145 VanDerWaalsContact CA-NH2 3.27Å; L132-R145 VanDerWaalsContact CB-NH2 3.34Å; L132-R145 VanDerWaalsContact CD2-NH2 3.28Å; L132-R145 PolarHBondContact O-NH1 3.38Å; L132-R145 PolarHBondContact O-NH2 2.82Å; I134-R145 VanDerWaalsContact CD1-CZ 3.48Å; E137-R145 IonicContact OE1-CZ 2.74Å; E137-R145 IonicContact OE1-NH1 3.8Å; E137-R145 PolarHBondContact OE1-NH1 3.47Å; E137-R145 IonicContact OE2-NH1 3.88Å; E137-R145 PolarHBondContact OE2-NH1 2.83Å; E141-R145 PolarHBondContact O-N 3.32Å; R145-A147 VanDerWaalsContact C-N 3.26Å; R145-A147 PolarHBondContact O-N 3.24Å; R145-A148 PolarHBondContact O-N 3.09Å; R145-E149 WeakPolarHBondContact O-CB 3.21Å; R145-E149 PolarHBondContact O-N 2.83Å
146	L	79	Confident	72.6	Confident	75 Å²	75	110.1 Å²	110.1	39%	0.393	54%	0.538	S	S	.	.	H	α-helix	trans	-62.3	-31.1	174.6	-71.7	169.6	0	0	0	112.9	L132 R142 K150	L132-L146 HydrophobicContact CD1-CD2 3.78Å; R142-L146 HydrophobicContact CG-CD1 3.82Å; R142-L146 HydrophobicContact CG-CG 4.46Å; R142-L146 VanDerWaalsContact O-CB 3.31Å; R142-L146 WeakPolarHBondContact O-CB 3.35Å; R142-L146 WeakPolarHBondContact O-CD1 3.39Å; R142-L146 VanDerWaalsContact O-CG 3.22Å; R142-L146 WeakPolarHBondContact O-CG 3.45Å; R142-L146 PolarHBondContact O-N 3.01Å; L146-K150 WeakPolarHBondContact O-CB 3.38Å; L146-K150 PolarHBondContact O-N 2.74Å
147	A	79.4	Confident	72	Confident	49 Å²	49	109.4 Å²	109.4	41%	0.405	52%	0.516	S	S	.	.	H	α-helix	trans	-71.1	-44.6	173.6	0	0	0	0	0	111.8	K143 R144 R145 K150 M151	K143-A147 WeakPolarHBondContact O-CB 3.44Å; K143-A147 PolarHBondContact O-N 3.19Å; K143-A147 VanDerWaalsContact O-N 3.17Å; R144-A147 WeakPolarHBondContact O-CB 3.47Å; R144-A147 PolarHBondContact O-N 3.47Å; R144-A147 VanDerWaalsContact O-N 3.16Å; R145-A147 VanDerWaalsContact C-N 3.26Å; R145-A147 PolarHBondContact O-N 3.24Å; A147-K150 PolarHBondContact O-N 3.03Å; A147-M151 PolarHBondContact O-N 2.96Å
148	A	79.9	Confident	71.1	Confident	52 Å²	52	110.9 Å²	110.9	43%	0.43	54%	0.542	S	S	.	.	H	α-helix	trans	-65.6	-43.7	178.4	0	0	0	0	0	112.7	R144 R145 K150 M151 K152	R144-A148 PolarHBondContact O-N 3.3Å; R145-A148 PolarHBondContact O-N 3.09Å; A148-K150 VanDerWaalsContact C-N 3.27Å; A148-K150 PolarHBondContact O-N 3.17Å; A148-M151 PolarHBondContact O-N 3.14Å; A148-M151 VanDerWaalsContact O-N 3.14Å; A148-K152 PolarHBondContact O-N 2.98Å
149	E	73.9	Confident	69.8	Low	57 Å²	57	114 Å²	114	27%	0.266	55%	0.55	S	S	.	.	H	α-helix	trans	-61	-38.2	174.8	-170.1	-177.5	151	0	0	111.1	R130 L132 R145 K152 L153	R130-E149 IonicContact CZ-OE1 3.96Å; R130-E149 IonicContact NH1-OE1 3.34Å; R130-E149 PolarHBondContact NH1-OE1 3.05Å; L132-E149 WeakPolarHBondContact CD1-OE2 2.84Å; R145-E149 WeakPolarHBondContact O-CB 3.21Å; R145-E149 PolarHBondContact O-N 2.83Å; E149-K152 PolarHBondContact O-N 2.82Å; E149-L153 WeakPolarHBondContact O-CB 3.48Å; E149-L153 PolarHBondContact O-N 2.94Å
150	K	73.2	Confident	68.5	Low	136 Å²	136	109.3 Å²	109.3	59%	0.591	54%	0.54	S	S	*	.	H	α-helix	trans	-72.9	-24.2	176.4	-164	173.7	-173.5	-179.9	0	113.5	L146 A147 A148 R154	L146-K150 WeakPolarHBondContact O-CB 3.38Å; L146-K150 PolarHBondContact O-N 2.74Å; A147-K150 PolarHBondContact O-N 3.03Å; A148-K150 VanDerWaalsContact C-N 3.27Å; A148-K150 PolarHBondContact O-N 3.17Å; K150-R154 WeakPolarHBondContact O-CD 3.31Å; K150-R154 VanDerWaalsContact O-CG 3.28Å; K150-R154 WeakPolarHBondContact O-CG 3.45Å
151	M	70	Confident	66.9	Low	131 Å²	131	106.6 Å²	106.6	65%	0.645	53%	0.532	S	S	*	.	H	α-helix	trans	-73	-52.3	167.7	-71.5	-174.4	-172.2	0	0	110.9	A147 A148 L153 R154 E155	A147-M151 PolarHBondContact O-N 2.96Å; A148-M151 PolarHBondContact O-N 3.14Å; A148-M151 VanDerWaalsContact O-N 3.14Å; M151-L153 VanDerWaalsContact C-N 3.3Å; M151-L153 PolarHBondContact O-N 3.32Å; M151-R154 WeakPolarHBondContact O-CA 3.22Å; M151-R154 WeakPolarHBondContact O-CB 3.3Å; M151-R154 PolarHBondContact O-N 3.16Å; M151-E155 PolarHBondContact O-N 3Å
152	K	74.4	Confident	65.5	Low	143 Å²	143	105 Å²	105	62%	0.622	53%	0.531	S	S	*	.	H	α-helix	trans	-56.8	-42.1	179.4	-72.6	-168.1	173.2	-167.3	0	112.8	A148 E149 R154 E155 M156	A148-K152 PolarHBondContact O-N 2.98Å; E149-K152 PolarHBondContact O-N 2.82Å; K152-R154 VanDerWaalsContact C-N 3.26Å; K152-R154 PolarHBondContact O-N 2.88Å; K152-E155 PolarHBondContact O-N 3.2Å; K152-M156 WeakPolarHBondContact O-CG 3.39Å; K152-M156 PolarHBondContact O-N 2.87Å
153	L	64.8	Low	64.2	Low	101 Å²	101	101.6 Å²	101.6	53%	0.529	53%	0.525	S	S	.	.	H	α-helix	trans	-64.8	-31.1	176.7	-173.5	63.3	0	0	0	112.3	E149 M151 T157	E149-L153 WeakPolarHBondContact O-CB 3.48Å; E149-L153 PolarHBondContact O-N 2.94Å; M151-L153 VanDerWaalsContact C-N 3.3Å; M151-L153 PolarHBondContact O-N 3.32Å; L153-T157 HydrophobicContact CD1-CG2 3.98Å; L153-T157 HydrophobicContact CG-CG2 4.41Å; L153-T157 WeakPolarHBondContact O-CB 3.37Å; L153-T157 WeakPolarHBondContact O-CG2 3.46Å; L153-T157 PolarHBondContact O-N 3.39Å; L153-T157 VanDerWaalsContact O-N 3.1Å; L153-T157 PolarHBondContact O-OG1 3.31Å
154	R	60	Low	62.8	Low	82 Å²	82	98.9 Å²	98.9	31%	0.309	52%	0.518	S	S	.	.	H	α-helix	trans	-73	-41	176.1	-79.9	173.5	155.2	-170.5	-9.9	112.5	K150 M151 K152 T157 G158 P162	K150-R154 WeakPolarHBondContact O-CD 3.31Å; K150-R154 VanDerWaalsContact O-CG 3.28Å; K150-R154 WeakPolarHBondContact O-CG 3.45Å; M151-R154 WeakPolarHBondContact O-CA 3.22Å; M151-R154 WeakPolarHBondContact O-CB 3.3Å; M151-R154 PolarHBondContact O-N 3.16Å; K152-R154 VanDerWaalsContact C-N 3.26Å; K152-R154 PolarHBondContact O-N 2.88Å; R154-T157 PolarHBondContact O-N 2.99Å; R154-G158 PolarHBondContact O-N 3.3Å; R154-P162 VanDerWaalsContact NH1-CD 3.33Å
155	E	62.9	Low	61.2	Low	159 Å²	159	94.7 Å²	94.7	74%	0.743	51%	0.512	S	S	*	.	H	α-helix	trans	-60.2	-45.3	172.7	-71.5	172.6	133.3	0	0	111.1	M151 K152 T157	M151-E155 PolarHBondContact O-N 3Å; K152-E155 PolarHBondContact O-N 3.2Å; E155-T157 PolarHBondContact O-N 3.17Å
156	M	58.5	Low	59.9	Low	167 Å²	167	98 Å²	98	82%	0.823	54%	0.541	S	S	*	.	H	α-helix	trans	-72.3	-24.3	-179.7	-71.1	-174.7	72.9	0	0	115.1	K152	K152-M156 WeakPolarHBondContact O-CG 3.39Å; K152-M156 PolarHBondContact O-N 2.87Å
157	T	57	Low	59	Low	69 Å²	69	96.7 Å²	96.7	42%	0.423	53%	0.532	S	S	.	.	H	α-helix	trans	-103.3	1.9	-175.7	56.4	0	0	0	0	114.2	L153 R154 E155 Q159	L153-T157 HydrophobicContact CD1-CG2 3.98Å; L153-T157 HydrophobicContact CG-CG2 4.41Å; L153-T157 WeakPolarHBondContact O-CB 3.37Å; L153-T157 WeakPolarHBondContact O-CG2 3.46Å; L153-T157 PolarHBondContact O-N 3.39Å; L153-T157 VanDerWaalsContact O-N 3.1Å; L153-T157 PolarHBondContact O-OG1 3.31Å; R154-T157 PolarHBondContact O-N 2.99Å; E155-T157 PolarHBondContact O-N 3.17Å; T157-Q159 PolarHBondContact O-N 3.45Å
158	G	48.4	Very low	59	Low	67 Å²	67	98.9 Å²	98.9	69%	0.691	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	17	-179.3	0	0	0	0	0	114.3	R154	R154-G158 PolarHBondContact O-N 3.3Å
159	Q	44.5	Very low	59.3	Low	122 Å²	122	99.1 Å²	99.1	57%	0.57	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-69.9	130.1	-175	-79	-173.3	-1	0	0	110.7	T157 N161	T157-Q159 PolarHBondContact O-N 3.45Å; Q159-N161 PolarHBondContact O-N 3.08Å
160	P	45.9	Very low	60.1	Low	101 Å²	101	97.1 Å²	97.1	66%	0.656	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-58.1	140.7	-177.5	21.9	-32.3	0	0	0	111.4
161	N	42.9	Very low	61.1	Low	91 Å²	91	94.5 Å²	94.5	49%	0.487	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-64.2	145.4	-178.8	-111.1	-41.8	0	0	0	109.7	Q159 S163 D164	Q159-N161 PolarHBondContact O-N 3.08Å; N161-S163 PolarHBondContact O-N 3.46Å; N161-D164 PolarHBondContact O-N 3.05Å
162	P	46	Very low	62.3	Low	74 Å²	74	89.9 Å²	89.9	48%	0.481	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	16.3	176.6	35.7	-36.4	0	0	0	112.4	R154	R154-P162 VanDerWaalsContact NH1-CD 3.33Å
163	S	47.9	Very low	63.3	Low	43 Å²	43	83 Å²	83	30%	0.301	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.9	159.2	-42.4	0	0	0	0	111.8	N161 T165 Q167 K239	N161-S163 PolarHBondContact O-N 3.46Å; S163-T165 PolarHBondContact O-N 3.15Å; S163-T165 PolarHBondContact O-OG1 2.78Å; S163-Q167 PolarHBondContact O-NE2 2.95Å; S163-Q167 VanDerWaalsContact O-NE2 3.15Å; S163-K239 PolarHBondContact OG-NZ 3.38Å; S163-K239 VanDerWaalsContact OG-NZ 3.08Å
164	D	48.1	Very low	64.7	Low	108 Å²	108	80.9 Å²	80.9	58%	0.578	45%	0.452	S	S	*	.			trans	-84.4	33.9	172	-56.1	-34.9	0	0	0	111.3	N161 V166	N161-D164 PolarHBondContact O-N 3.05Å; D164-V166 PolarHBondContact O-N 2.93Å
165	T	49.3	Very low	66.3	Low	90 Å²	90	77 Å²	77	55%	0.552	44%	0.437	S	S	*	.	S	Bend	trans	-50.9	127	150.2	41.7	0	0	0	0	107.7	S163 Q167	S163-T165 PolarHBondContact O-N 3.15Å; S163-T165 PolarHBondContact O-OG1 2.78Å; T165-Q167 WeakPolarHBondContact O-CA 3.09Å; T165-Q167 WeakPolarHBondContact O-CG 3.32Å; T165-Q167 PolarHBondContact O-N 3.44Å
166	V	51.5	Low	67.7	Low	142 Å²	142	70.9 Å²	70.9	86%	0.861	41%	0.41	S	S	*	.			trans	-40.5	101.3	175.9	178.6	0	0	0	0	109.4	D164 V168	D164-V166 PolarHBondContact O-N 2.93Å; V166-V168 PolarHBondContact O-N 3.2Å; V166-V168 VanDerWaalsContact O-N 3.09Å
167	Q	61.5	Low	69.3	Low	46 Å²	46	66.8 Å²	66.8	22%	0.215	39%	0.392	C	S	.	.			trans	-81	102.1	-171.1	-61.1	-174.5	4.9	0	0	106.4	S163 T165 P169 T241 F242	S163-Q167 PolarHBondContact O-NE2 2.95Å; S163-Q167 VanDerWaalsContact O-NE2 3.15Å; T165-Q167 WeakPolarHBondContact O-CA 3.09Å; T165-Q167 WeakPolarHBondContact O-CG 3.32Å; T165-Q167 PolarHBondContact O-N 3.44Å; Q167-P169 WeakPolarHBondContact O-CD 3.5Å; Q167-T241 VanDerWaalsContact NE2-CG2 3.33Å; Q167-T241 VanDerWaalsContact OE1-CA 3.26Å; Q167-F242 HydrophobicContact CB-CB 4.3Å; Q167-F242 HydrophobicContact CB-CD2 3.79Å
168	V	79.4	Confident	70.9	Confident	95 Å²	95	63.7 Å²	63.7	58%	0.576	37%	0.373	S	S	*	.			trans	-53	123.9	173	-179.4	0	0	0	0	107.3	V166	V166-V168 PolarHBondContact O-N 3.2Å; V166-V168 VanDerWaalsContact O-N 3.09Å
169	P	85.9	Confident	72.8	Confident	58 Å²	58	61 Å²	61	38%	0.377	34%	0.344	S	S	.	.			trans	-52.3	144.6	177.8	-29	36.9	0	0	0	111.8	Q167 E217 F242 K245	Q167-P169 WeakPolarHBondContact O-CD 3.5Å; P169-E217 HydrophobicContact CB-CB 4.13Å; P169-F242 HydrophobicContact CB-CE2 4.41Å; P169-F242 HydrophobicContact CB-CZ 4.31Å; P169-K245 PolarHBondContact O-NZ 3.22Å
170	N	90.1	Very high	74.8	Confident	14 Å²	14	61.4 Å²	61.4	8%	0.075	35%	0.349	C	S	.	.			trans	-151.1	145.7	-178.6	-166.4	-14.8	0	0	0	107.9	I172 A220 F242 A243	N170-I172 PolarHBondContact O-N 3.08Å; N170-I172 PolarHBondContact OD1-N 3.45Å; N170-A220 VanDerWaalsContact O-CB 3.3Å; N170-A220 WeakPolarHBondContact O-CB 3.35Å; N170-F242 HydrophobicContact CB-CB 4.16Å; N170-F242 HydrophobicContact CB-CD1 4.24Å; N170-F242 WeakPolarHBondContact O-CD1 3.32Å; N170-F242 WeakPolarHBondContact O-CE1 3.05Å; N170-A243 PolarHBondContact ND2-O 3.1Å
171	K	94.3	Very high	76.7	Confident	82 Å²	82	64.5 Å²	64.5	36%	0.357	36%	0.355	S	S	.	.	S	Bend	trans	-68	-17.3	173.7	65.9	170.2	-179.7	156.6	0	112.5	E213 F214	K171-E213 HydrophobicContact CD-CG 4.48Å; K171-E213 WeakPolarHBondContact CE-OE1 3.44Å; K171-E213 IonicContact NZ-OE1 3.22Å; K171-E213 PolarHBondContact NZ-OE1 2.97Å; K171-F214 WeakPolarHBondContact CB-O 3.41Å; K171-F214 PolarHBondContact O-N 2.86Å
172	I	95.2	Very high	78.9	Confident	33 Å²	33	60.5 Å²	60.5	17%	0.169	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	126	176.2	-52	173.7	0	0	0	109.9	N170 F211 I212 E213 A243	N170-I172 PolarHBondContact O-N 3.08Å; N170-I172 PolarHBondContact OD1-N 3.45Å; I172-F211 HydrophobicContact CG2-CB 4.06Å; I172-F211 HydrophobicContact CG2-CD1 3.96Å; I172-F211 HydrophobicContact CG2-CG 4.48Å; I172-I212 CarbonylContact C-O 3.58Å; I172-I212 WeakPolarHBondContact CA-O 3.35Å; I172-E213 HydrophobicContact CG1-CB 4.32Å; I172-E213 HydrophobicContact CG1-CG 4.09Å; I172-A243 HydrophobicContact CB-CB 3.85Å; I172-A243 HydrophobicContact CG2-CB 3.76Å; I172-A243 VanDerWaalsContact O-CB 3.32Å; I172-A243 WeakPolarHBondContact O-CB 3.49Å; I172-A243 PolarHBondContact O-N 3.33Å
173	L	95.1	Very high	81	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	139.3	168.2	-60.7	-179.6	0	0	0	110.4	F191 F211 I212 F214 A220 A223 K224 I240 T241 F242	L173-F191 HydrophobicContact CD1-CE1 4.1Å; L173-F211 CarbonylContact O-C 3.54Å; L173-F211 VanDerWaalsContact O-CA 3.29Å; L173-F211 WeakPolarHBondContact O-CA 3.41Å; L173-I212 HydrophobicContact CB-CB 4.41Å; L173-I212 PolarHBondContact N-O 3.03Å; L173-I212 PolarHBondContact O-N 3.27Å; L173-F214 HydrophobicContact CD1-CD2 4.22Å; L173-F214 HydrophobicContact CD1-CE2 3.83Å; L173-F214 HydrophobicContact CG-CD2 4.45Å; L173-F214 HydrophobicContact CG-CE2 4.5Å; L173-A220 WeakPolarHBondContact CD1-O 3.29Å; L173-A220 HydrophobicContact CD2-CB 4Å; L173-A220 HydrophobicContact CG-CB 4.09Å; L173-A223 HydrophobicContact CD1-CB 4.17Å; L173-K224 HydrophobicContact CD1-CB 4.14Å; L173-K224 HydrophobicContact CD2-CB 3.87Å; L173-K224 HydrophobicContact CD2-CD 4.25Å; L173-I240 HydrophobicContact CB-CG2 4.03Å; L173-I240 HydrophobicContact CD1-CG2 3.98Å; L173-I240 HydrophobicContact CD2-CG2 4.2Å; L173-I240 HydrophobicContact CG-CG2 4.3Å; L173-T241 WeakPolarHBondContact CA-O 3.48Å; L173-F242 HydrophobicContact CD2-CD1 3.68Å; L173-F242 HydrophobicContact CD2-CE1 3.87Å
174	F	94.6	Very high	83	Confident	55 Å²	55	63.5 Å²	63.5	24%	0.241	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	112.6	170.2	177.1	-123.7	0	0	0	108.8	T176 I209 F211 T241 A243	F174-T176 HydrophobicContact CD1-CG2 3.84Å; F174-T176 HydrophobicContact CE1-CG2 3.24Å; F174-T176 HydrophobicContact CE2-CG2 4.18Å; F174-T176 HydrophobicContact CZ-CG2 3.44Å; F174-T176 VanDerWaalsContact CZ-CG2 3.44Å; F174-I209 HydrophobicContact CE2-CB 3.92Å; F174-I209 HydrophobicContact CE2-CD1 4.33Å; F174-I209 HydrophobicContact CE2-CG2 4.1Å; F174-I209 HydrophobicContact CZ-CB 4.36Å; F174-I209 HydrophobicContact CZ-CG2 4.02Å; F174-F211 HydrophobicContact CB-CD1 4.18Å; F174-F211 HydrophobicContact CB-CE1 4Å; F174-F211 AromaticContact CD2-CD1 3.89Å; F174-F211 HydrophobicContact CD2-CD1 3.89Å; F174-F211 AromaticContact CD2-CE1 3.37Å; F174-F211 HydrophobicContact CD2-CE1 3.37Å; F174-F211 HydrophobicContact CD2-CE2 4.12Å; F174-F211 HydrophobicContact CD2-CG 4.47Å; F174-F211 AromaticContact CD2-CZ 3.5Å; F174-F211 HydrophobicContact CD2-CZ 3.5Å; F174-F211 VanDerWaalsContact CD2-CZ 3.5Å; F174-F211 HydrophobicContact CE2-CE1 4.12Å; F174-F211 HydrophobicContact CE2-CE2 4.22Å; F174-F211 AromaticContact CE2-CZ 3.76Å; F174-F211 HydrophobicContact CE2-CZ 3.76Å; F174-F211 HydrophobicContact CG-CD1 4.48Å; F174-F211 AromaticContact CG-CE1 3.97Å; F174-F211 HydrophobicContact CG-CE1 3.97Å; F174-F211 HydrophobicContact CG-CZ 4.43Å; F174-T241 PolarHBondContact N-O 3.15Å; F174-T241 PolarHBondContact O-N 2.98Å; F174-T241 PolarHBondContact O-OG1 3.22Å; F174-A243 HydrophobicContact CB-CB 4.31Å
175	C	93.3	Very high	85	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	141.8	174.8	-69	0	0	0	0	110.5	I209 A210 I212 I238	C175-I209 WeakPolarHBondContact O-CA 3.38Å; C175-A210 HydrophobicContact CB-CB 4.47Å; C175-A210 PolarHBondContact N-O 3.32Å; C175-A210 PolarHBondContact O-N 3.45Å; C175-A210 VanDerWaalsContact O-N 3.11Å; C175-I212 HydrophobicContact CB-CD1 4.07Å; C175-I212 WeakPolarHBondContact SG-CD1 3.39Å; C175-I238 HydrophobicContact CB-CG2 3.9Å
176	T	92.4	Very high	87	Confident	31 Å²	31	67.4 Å²	67.4	19%	0.19	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	161.8	-179.8	54.8	0	0	0	0	109.9	F174 L178 D208 I209 K239	F174-T176 HydrophobicContact CD1-CG2 3.84Å; F174-T176 HydrophobicContact CE1-CG2 3.24Å; F174-T176 HydrophobicContact CE2-CG2 4.18Å; F174-T176 HydrophobicContact CZ-CG2 3.44Å; F174-T176 VanDerWaalsContact CZ-CG2 3.44Å; T176-L178 VanDerWaalsContact C-N 3.33Å; T176-D208 CarbonylContact C-O 3.55Å; T176-D208 WeakPolarHBondContact CA-O 3.42Å; T176-I209 HydrophobicContact CG2-CG2 4.05Å; T176-K239 PolarHBondContact N-O 3.08Å; T176-K239 PolarHBondContact O-N 3.03Å; T176-K239 PolarHBondContact OG1-O 3.28Å
177	N	91.2	Very high	88.9	Confident	81 Å²	81	60.8 Å²	60.8	43%	0.433	30%	0.303	S	S	.	.			trans	64.4	38	-177.3	-161.8	62	0	0	0	112.5	D208 A237	N177-D208 PolarHBondContact N-O 2.9Å; N177-D208 VanDerWaalsContact N-O 3.11Å; N177-A237 PolarHBondContact ND2-O 3.22Å
178	L	91.1	Very high	90.4	Very high	5 Å²	5	61.2 Å²	61.2	3%	0.026	31%	0.307	C	S	.	.			trans	-76.7	140	167.1	-60	176.4	0	0	0	109.2	T176 T182 L187 D208 A210 I238	T176-L178 VanDerWaalsContact C-N 3.33Å; L178-T182 HydrophobicContact CB-CG2 4.44Å; L178-T182 HydrophobicContact CD1-CG2 4.3Å; L178-T182 HydrophobicContact CD2-CG2 4.39Å; L178-L187 HydrophobicContact CD1-CD1 4.14Å; L178-L187 HydrophobicContact CD1-CD2 4.46Å; L178-L187 HydrophobicContact CD2-CD2 4.07Å; L178-D208 PolarHBondContact N-O 3.16Å; L178-D208 VanDerWaalsContact N-O 3.12Å; L178-D208 WeakPolarHBondContact O-CA 3.31Å; L178-A210 HydrophobicContact CD1-CB 3.62Å; L178-I238 HydrophobicContact CD2-CD1 3.82Å; L178-I238 HydrophobicContact CD2-CG1 3.86Å; L178-I238 HydrophobicContact CD2-CG2 4.08Å
179	P	89	Confident	91	Very high	11 Å²	11	63.2 Å²	63.2	7%	0.071	31%	0.314	C	S	.	.			trans	-66.7	149.1	168.8	25.2	-30.6	0	0	0	110.7	E181 T182 V232 T233 H236	P179-E181 PolarHBondContact O-N 3.25Å; P179-E181 VanDerWaalsContact O-N 3.08Å; P179-T182 WeakPolarHBondContact CD-OG1 3.32Å; P179-T182 VanDerWaalsContact CG-OG1 3.32Å; P179-T182 WeakPolarHBondContact CG-OG1 3.2Å; P179-T182 WeakPolarHBondContact O-CB 3.2Å; P179-T182 PolarHBondContact O-N 3.03Å; P179-T182 PolarHBondContact O-OG1 3.36Å; P179-V232 HydrophobicContact CG-CB 4.35Å; P179-V232 HydrophobicContact CG-CG1 3.83Å; P179-T233 HydrophobicContact CB-CG2 4.48Å; P179-T233 HydrophobicContact CG-CG2 4.06Å; P179-H236 HydrophobicContact CB-CB 4.4Å; P179-H236 HydrophobicContact CG-CB 4.31Å
180	D	86.1	Confident	91.3	Very high	129 Å²	129	61.6 Å²	61.6	69%	0.69	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.4	-177.1	-66	-42.2	0	0	0	113.7	T182 H207	D180-T182 PolarHBondContact O-N 3.3Å; D180-H207 HydrophobicContact CB-CB 4.48Å
181	E	86.7	Confident	91.5	Very high	167 Å²	167	60.9 Å²	60.9	78%	0.78	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-4.6	174.1	-63.2	171.1	-165.6	0	0	113.8	P179 T183	P179-E181 PolarHBondContact O-N 3.25Å; P179-E181 VanDerWaalsContact O-N 3.08Å; E181-T183 PolarHBondContact O-N 3.03Å
182	T	88.4	Confident	91.4	Very high	6 Å²	6	62.4 Å²	62.4	4%	0.037	31%	0.31	C	S	.	.			trans	-67.8	106.4	-176.8	-55.9	0	0	0	0	111.1	L178 P179 D180 L187	L178-T182 HydrophobicContact CB-CG2 4.44Å; L178-T182 HydrophobicContact CD1-CG2 4.3Å; L178-T182 HydrophobicContact CD2-CG2 4.39Å; P179-T182 WeakPolarHBondContact CD-OG1 3.32Å; P179-T182 VanDerWaalsContact CG-OG1 3.32Å; P179-T182 WeakPolarHBondContact CG-OG1 3.2Å; P179-T182 WeakPolarHBondContact O-CB 3.2Å; P179-T182 PolarHBondContact O-N 3.03Å; P179-T182 PolarHBondContact O-OG1 3.36Å; D180-T182 PolarHBondContact O-N 3.3Å; T182-L187 HydrophobicContact CG2-CD1 4.04Å; T182-L187 HydrophobicContact CG2-CD2 3.89Å; T182-L187 HydrophobicContact CG2-CG 3.72Å
183	T	89.8	Confident	91.4	Very high	83 Å²	83	67.7 Å²	67.7	51%	0.509	33%	0.328	S	S	.	.			trans	-85.1	154.7	171.2	58.8	0	0	0	0	111.6	E181 R185 M186 L187	E181-T183 PolarHBondContact O-N 3.03Å; T183-R185 PolarHBondContact O-N 3Å; T183-M186 WeakPolarHBondContact O-CB 3.38Å; T183-M186 PolarHBondContact O-N 2.94Å; T183-L187 PolarHBondContact O-N 3.19Å
184	E	90.6	Very high	91.3	Very high	97 Å²	97	68.9 Å²	68.9	45%	0.453	33%	0.333	S	S	.	.	H	α-helix	trans	-52.8	-40.8	173.5	-169.4	-167.7	149.7	0	0	111.4	M186 L187 L188 V200 L202	E184-M186 VanDerWaalsContact C-N 3.27Å; E184-M186 PolarHBondContact O-N 3.26Å; E184-L187 PolarHBondContact O-N 3.02Å; E184-L187 VanDerWaalsContact O-N 3.12Å; E184-L188 HydrophobicContact CG-CD1 4.04Å; E184-L188 HydrophobicContact CG-CG 4.42Å; E184-L188 WeakPolarHBondContact O-CB 3.44Å; E184-L188 WeakPolarHBondContact O-CG 3.25Å; E184-L188 PolarHBondContact O-N 3.23Å; E184-V200 HydrophobicContact CG-CB 4.02Å; E184-V200 HydrophobicContact CG-CG1 3.93Å; E184-L202 HydrophobicContact CB-CD1 3.96Å; E184-L202 HydrophobicContact CB-CG 4.5Å
185	R	90.5	Very high	91.3	Very high	195 Å²	195	70.4 Å²	70.4	74%	0.736	35%	0.349	S	S	*	.	H	α-helix	trans	-59.6	-33	177.2	-166.9	170.7	-175.9	152.2	1	113.3	T183 L189	T183-R185 PolarHBondContact O-N 3Å; R185-L189 WeakPolarHBondContact O-CG 3.48Å; R185-L189 PolarHBondContact O-N 3.32Å; R185-L189 VanDerWaalsContact O-N 3.15Å
186	M	90.3	Very high	91.3	Very high	86 Å²	86	71.4 Å²	71.4	42%	0.424	36%	0.359	S	S	.	.	H	α-helix	trans	-71.1	-41.2	176	-164.1	178.9	-162.5	0	0	111.5	T183 E184 L190 V232	T183-M186 WeakPolarHBondContact O-CB 3.38Å; T183-M186 PolarHBondContact O-N 2.94Å; E184-M186 VanDerWaalsContact C-N 3.27Å; E184-M186 PolarHBondContact O-N 3.26Å; M186-L190 PolarHBondContact O-N 2.89Å; M186-V232 HydrophobicContact CE-CG1 3.54Å; M186-V232 HydrophobicContact SD-CG1 3.68Å
187	L	92.4	Very high	91.4	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-68.8	-40	175.1	-64.2	176.4	0	0	0	111.7	L178 T182 T183 E184 L189 L190 F191 V200 L202 A210	L178-L187 HydrophobicContact CD1-CD1 4.14Å; L178-L187 HydrophobicContact CD1-CD2 4.46Å; L178-L187 HydrophobicContact CD2-CD2 4.07Å; T182-L187 HydrophobicContact CG2-CD1 4.04Å; T182-L187 HydrophobicContact CG2-CD2 3.89Å; T182-L187 HydrophobicContact CG2-CG 3.72Å; T183-L187 PolarHBondContact O-N 3.19Å; E184-L187 PolarHBondContact O-N 3.02Å; E184-L187 VanDerWaalsContact O-N 3.12Å; L187-L189 PolarHBondContact O-N 2.94Å; L187-L190 PolarHBondContact O-N 2.95Å; L187-L190 VanDerWaalsContact O-N 3.08Å; L187-F191 HydrophobicContact CB-CD2 4.45Å; L187-F191 HydrophobicContact CD2-CE2 4.22Å; L187-F191 WeakPolarHBondContact O-CD2 3.35Å; L187-F191 PolarHBondContact O-N 2.93Å; L187-V200 HydrophobicContact CB-CG1 4Å; L187-V200 HydrophobicContact CB-CG2 3.83Å; L187-V200 HydrophobicContact CD1-CG1 3.69Å; L187-L202 HydrophobicContact CD1-CD2 3.72Å; L187-A210 HydrophobicContact CD1-CB 3.59Å
188	L	92.9	Very high	91.6	Very high	56 Å²	56	72.8 Å²	72.8	29%	0.293	36%	0.358	S	S	.	.	H	α-helix	trans	-54.5	-51.5	173.2	-77.5	164.2	0	0	0	110.8	E184 L190 F191 N192 F197 V200	E184-L188 HydrophobicContact CG-CD1 4.04Å; E184-L188 HydrophobicContact CG-CG 4.42Å; E184-L188 WeakPolarHBondContact O-CB 3.44Å; E184-L188 WeakPolarHBondContact O-CG 3.25Å; E184-L188 PolarHBondContact O-N 3.23Å; L188-L190 PolarHBondContact O-N 3.27Å; L188-F191 PolarHBondContact O-N 3.04Å; L188-N192 WeakPolarHBondContact O-CB 3.44Å; L188-N192 PolarHBondContact O-N 2.78Å; L188-F197 HydrophobicContact CD2-CE1 3.67Å; L188-F197 HydrophobicContact CD2-CZ 3.51Å; L188-V200 HydrophobicContact CD2-CG2 4.36Å; L188-V200 HydrophobicContact CG-CG2 4.31Å
189	L	91.4	Very high	91.7	Very high	136 Å²	136	76.4 Å²	76.4	71%	0.712	38%	0.375	S	S	*	.	H	α-helix	trans	-59.5	-33	176.7	-70.7	169.7	0	0	0	113.3	R185 L187	R185-L189 WeakPolarHBondContact O-CG 3.48Å; R185-L189 PolarHBondContact O-N 3.32Å; R185-L189 VanDerWaalsContact O-N 3.15Å; L187-L189 PolarHBondContact O-N 2.94Å
190	L	91.7	Very high	92	Very high	24 Å²	24	76.4 Å²	76.4	13%	0.126	38%	0.375	C	S	.	.	H	α-helix	trans	-79.6	-35.9	-177.2	-169.3	65.6	0	0	0	113.7	M186 L187 L188 R193 L227 F230 I238	M186-L190 PolarHBondContact O-N 2.89Å; L187-L190 PolarHBondContact O-N 2.95Å; L187-L190 VanDerWaalsContact O-N 3.08Å; L188-L190 PolarHBondContact O-N 3.27Å; L190-R193 WeakPolarHBondContact O-CD 3.18Å; L190-R193 WeakPolarHBondContact O-CG 3.3Å; L190-R193 PolarHBondContact O-NE 2.89Å; L190-L227 HydrophobicContact CD1-CD2 3.57Å; L190-L227 HydrophobicContact CD2-CD1 4.29Å; L190-L227 HydrophobicContact CD2-CD2 3.94Å; L190-L227 HydrophobicContact CG-CD1 3.96Å; L190-L227 HydrophobicContact CG-CD2 3.66Å; L190-L227 HydrophobicContact CG-CG 4.5Å; L190-F230 HydrophobicContact CD1-CD1 3.89Å; L190-F230 HydrophobicContact CD1-CE1 3.53Å; L190-F230 HydrophobicContact CD1-CE2 4.42Å; L190-F230 HydrophobicContact CD1-CG 4.48Å; L190-F230 HydrophobicContact CD1-CZ 3.82Å; L190-F230 HydrophobicContact CD2-CD1 3.97Å; L190-F230 HydrophobicContact CD2-CE1 4.22Å; L190-I238 HydrophobicContact CD2-CD1 3.61Å
191	F	94.2	Very high	92.3	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-99.2	-27.4	-175.4	-75.1	-82.8	0	0	0	113.9	L173 L187 L188 R193 F194 F197 I212 F214 A223 L227 I240	L173-F191 HydrophobicContact CD1-CE1 4.1Å; L187-F191 HydrophobicContact CB-CD2 4.45Å; L187-F191 HydrophobicContact CD2-CE2 4.22Å; L187-F191 WeakPolarHBondContact O-CD2 3.35Å; L187-F191 PolarHBondContact O-N 2.93Å; L188-F191 PolarHBondContact O-N 3.04Å; F191-R193 PolarHBondContact O-N 2.94Å; F191-F194 PolarHBondContact O-N 3.24Å; F191-F197 HydrophobicContact CB-CD2 3.68Å; F191-F197 HydrophobicContact CB-CE2 3.85Å; F191-I212 HydrophobicContact CB-CG2 4.24Å; F191-I212 HydrophobicContact CD1-CG1 4.35Å; F191-I212 HydrophobicContact CD1-CG2 3.98Å; F191-I212 HydrophobicContact CD2-CD1 4.4Å; F191-I212 HydrophobicContact CD2-CG1 3.81Å; F191-I212 HydrophobicContact CE1-CG1 4.3Å; F191-I212 HydrophobicContact CE1-CG2 4.47Å; F191-I212 HydrophobicContact CE2-CD1 3.87Å; F191-I212 HydrophobicContact CE2-CG1 3.78Å; F191-I212 HydrophobicContact CG-CG1 4.11Å; F191-I212 HydrophobicContact CG-CG2 4.01Å; F191-I212 HydrophobicContact CZ-CD1 4Å; F191-I212 HydrophobicContact CZ-CG1 4.02Å; F191-F214 HydrophobicContact CB-CZ 4.5Å; F191-F214 AromaticContact CD1-CE2 3.98Å; F191-F214 HydrophobicContact CD1-CE2 3.98Å; F191-F214 AromaticContact CD1-CZ 3.94Å; F191-F214 HydrophobicContact CD1-CZ 3.94Å; F191-A223 HydrophobicContact CD1-CB 4.4Å; F191-L227 HydrophobicContact CD1-CD1 3.62Å; F191-L227 HydrophobicContact CD2-CD1 4.41Å; F191-L227 HydrophobicContact CE1-CD1 3.35Å; F191-L227 HydrophobicContact CE2-CD1 4.16Å; F191-L227 HydrophobicContact CG-CD1 4.17Å; F191-L227 HydrophobicContact CZ-CD1 3.64Å; F191-I240 HydrophobicContact CE1-CD1 4.27Å; F191-I240 HydrophobicContact CZ-CD1 3.94Å
192	N	93.5	Very high	92.6	Very high	114 Å²	114	69.9 Å²	69.9	61%	0.61	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-9.8	178	-171.9	59.5	0	0	0	114	L188 F194 F197	L188-N192 WeakPolarHBondContact O-CB 3.44Å; L188-N192 PolarHBondContact O-N 2.78Å; N192-F194 VanDerWaalsContact C-N 3.27Å; N192-F197 HydrophobicContact CB-CD1 4.28Å
193	R	93.3	Very high	92.6	Very high	143 Å²	143	71.6 Å²	71.6	54%	0.54	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.8	171.6	73	-168	-178.6	136	11.4	114.1	L190 F191	L190-R193 WeakPolarHBondContact O-CD 3.18Å; L190-R193 WeakPolarHBondContact O-CG 3.3Å; L190-R193 PolarHBondContact O-NE 2.89Å; F191-R193 PolarHBondContact O-N 2.94Å
194	F	94.9	Very high	92.3	Very high	26 Å²	26	72.7 Å²	72.7	11%	0.114	36%	0.357	C	S	.	.	S	Bend	trans	-102	141.9	175.7	-64.4	-80.8	0	0	0	110.2	F191 N192 F214 T222 A223 A226 L227	F191-F194 PolarHBondContact O-N 3.24Å; N192-F194 VanDerWaalsContact C-N 3.27Å; F194-F214 HydrophobicContact CB-CE1 3.77Å; F194-F214 HydrophobicContact CB-CZ 4.12Å; F194-T222 HydrophobicContact CD1-CG2 4.47Å; F194-A223 HydrophobicContact CB-CB 4.13Å; F194-A223 HydrophobicContact CD1-CB 4.06Å; F194-A223 HydrophobicContact CD2-CB 3.83Å; F194-A223 HydrophobicContact CE1-CB 4.48Å; F194-A223 HydrophobicContact CE2-CB 4.27Å; F194-A223 HydrophobicContact CG-CB 3.72Å; F194-A226 HydrophobicContact CE1-CB 3.55Å; F194-A226 HydrophobicContact CZ-CB 3.53Å; F194-L227 HydrophobicContact CD2-CD1 4.38Å; F194-L227 HydrophobicContact CE2-CD1 3.6Å; F194-L227 HydrophobicContact CE2-CG 3.85Å; F194-L227 HydrophobicContact CZ-CD1 4.34Å; F194-L227 HydrophobicContact CZ-CG 4.12Å
195	P	93.3	Very high	92	Very high	87 Å²	87	75.6 Å²	75.6	57%	0.565	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	156.4	175.8	28.4	-35.7	0	0	0	111	F197 F214 D219	P195-F197 PolarHBondContact O-N 3.37Å; P195-F197 VanDerWaalsContact O-N 3.12Å; P195-F214 WeakPolarHBondContact O-CD1 3.32Å; P195-F214 WeakPolarHBondContact O-CE1 3.42Å; P195-D219 WeakPolarHBondContact O-CB 3.37Å
196	G	93.2	Very high	91.8	Very high	21 Å²	21	73.6 Å²	73.6	22%	0.216	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	7.2	176.8	0	0	0	0	0	115.5	K198 F214 E215	G196-K198 PolarHBondContact O-N 3.1Å; G196-F214 CarbonylContact O-C 3.35Å; G196-F214 WeakPolarHBondContact O-CA 3.37Å; G196-E215 WeakPolarHBondContact O-CB 3.5Å; G196-E215 PolarHBondContact O-N 3.45Å
197	F	95.6	Very high	91.6	Very high	36 Å²	36	74.5 Å²	74.5	16%	0.158	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	132.1	173.6	171.1	-94.9	0	0	0	111	L188 F191 N192 P195 V200 I212 F214	L188-F197 HydrophobicContact CD2-CE1 3.67Å; L188-F197 HydrophobicContact CD2-CZ 3.51Å; F191-F197 HydrophobicContact CB-CD2 3.68Å; F191-F197 HydrophobicContact CB-CE2 3.85Å; N192-F197 HydrophobicContact CB-CD1 4.28Å; P195-F197 PolarHBondContact O-N 3.37Å; P195-F197 VanDerWaalsContact O-N 3.12Å; F197-V200 HydrophobicContact CE2-CG2 3.91Å; F197-V200 HydrophobicContact CZ-CG2 3.93Å; F197-I212 HydrophobicContact CD2-CG2 3.94Å; F197-I212 HydrophobicContact CE2-CG2 3.78Å; F197-F214 HydrophobicContact CB-CD1 4.4Å; F197-F214 HydrophobicContact CB-CE1 3.95Å; F197-F214 HydrophobicContact CB-CZ 4.48Å; F197-F214 HydrophobicContact CD2-CZ 4.38Å
198	K	94.3	Very high	91.4	Very high	105 Å²	105	77.7 Å²	77.7	46%	0.457	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-63.5	178.7	-70.6	-172.3	166.5	174.4	0	113	G196 E213 E215	G196-K198 PolarHBondContact O-N 3.1Å; K198-E213 WeakPolarHBondContact CA-O 3.38Å; K198-E213 HydrophobicContact CB-CB 4.45Å; K198-E213 HydrophobicContact CB-CG 4.44Å; K198-E213 WeakPolarHBondContact CB-O 3.38Å; K198-E213 PolarHBondContact N-O 3.42Å; K198-E215 HydrophobicContact CD-CB 4.49Å; K198-E215 IonicContact NZ-OE1 2.65Å
199	E	93.9	Very high	91.4	Very high	81 Å²	81	75.8 Å²	75.8	38%	0.379	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	157.1	-175.3	59.7	172.7	-139.1	0	0	113.6	R201 I212 E213	E199-R201 WeakPolarHBondContact OE1-CD 3.42Å; E199-R201 VanDerWaalsContact OE1-CG 3.32Å; E199-R201 WeakPolarHBondContact OE1-CG 3.43Å; E199-R201 IonicContact OE1-CZ 3.85Å; E199-R201 IonicContact OE1-NE 3.03Å; E199-R201 PolarHBondContact OE1-NE 3.27Å; E199-R201 IonicContact OE1-NH1 2.82Å; E199-R201 PolarHBondContact OE1-NH1 2.87Å; E199-R201 IonicContact OE1-NH2 2.83Å; E199-I212 WeakPolarHBondContact O-CA 3.49Å; E199-E213 HydrophobicContact CG-CB 3.98Å; E199-E213 PolarHBondContact N-O 2.99Å; E199-E213 PolarHBondContact O-N 3.18Å
200	V	95	Very high	91.6	Very high	10 Å²	10	69.3 Å²	69.3	6%	0.061	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	127.5	166.9	172.2	0	0	0	0	107.9	E184 L187 L188 F197 L202 I212	E184-V200 HydrophobicContact CG-CB 4.02Å; E184-V200 HydrophobicContact CG-CG1 3.93Å; L187-V200 HydrophobicContact CB-CG1 4Å; L187-V200 HydrophobicContact CB-CG2 3.83Å; L187-V200 HydrophobicContact CD1-CG1 3.69Å; L188-V200 HydrophobicContact CD2-CG2 4.36Å; L188-V200 HydrophobicContact CG-CG2 4.31Å; F197-V200 HydrophobicContact CE2-CG2 3.91Å; F197-V200 HydrophobicContact CZ-CG2 3.93Å; V200-L202 HydrophobicContact CG1-CD2 4.42Å; V200-L202 HydrophobicContact CG1-CG 4.41Å; V200-I212 HydrophobicContact CG2-CG1 4.2Å
201	R	92.7	Very high	91.8	Very high	97 Å²	97	71.4 Å²	71.4	37%	0.366	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	106.3	170.8	-69.8	-177.8	-71.1	-125.3	-4.4	109.4	E199 F211 E213	E199-R201 WeakPolarHBondContact OE1-CD 3.42Å; E199-R201 VanDerWaalsContact OE1-CG 3.32Å; E199-R201 WeakPolarHBondContact OE1-CG 3.43Å; E199-R201 IonicContact OE1-CZ 3.85Å; E199-R201 IonicContact OE1-NE 3.03Å; E199-R201 PolarHBondContact OE1-NE 3.27Å; E199-R201 IonicContact OE1-NH1 2.82Å; E199-R201 PolarHBondContact OE1-NH1 2.87Å; E199-R201 IonicContact OE1-NH2 2.83Å; R201-F211 HydrophobicContact CB-CB 4.31Å; R201-F211 PolarHBondContact N-O 3.26Å; R201-F211 PolarHBondContact O-N 3.32Å; R201-E213 IonicContact CZ-OE2 3.03Å; R201-E213 IonicContact NH1-OE2 2.61Å; R201-E213 PolarHBondContact NH1-OE2 3.38Å; R201-E213 VanDerWaalsContact NH1-OE2 3.12Å; R201-E213 IonicContact NH2-OE2 3.93Å; R201-E213 PolarHBondContact NH2-OE2 2.85Å
202	L	91.6	Very high	91.8	Very high	63 Å²	63	71.4 Å²	71.4	33%	0.33	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	148.8	168	-66	179.9	0	0	0	110.3	E184 L187 V200 A210	E184-L202 HydrophobicContact CB-CD1 3.96Å; E184-L202 HydrophobicContact CB-CG 4.5Å; L187-L202 HydrophobicContact CD1-CD2 3.72Å; V200-L202 HydrophobicContact CG1-CD2 4.42Å; V200-L202 HydrophobicContact CG1-CG 4.41Å; L202-A210 HydrophobicContact CD2-CB 3.83Å
203	V	89.2	Confident	91.9	Very high	41 Å²	41	67.1 Å²	67.1	25%	0.248	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	123.1	178.6	-178.6	0	0	0	0	109.5	N205 R206 I209 F211	V203-N205 PolarHBondContact O-N 2.83Å; V203-R206 HydrophobicContact CB-CB 4.3Å; V203-R206 HydrophobicContact CG1-CB 4.24Å; V203-R206 CarbonylContact O-C 3.52Å; V203-R206 PolarHBondContact O-N 2.59Å; V203-R206 VanDerWaalsContact O-N 3.1Å; V203-R206 VanDerWaalsContact O-O 3.13Å; V203-I209 HydrophobicContact CB-CD1 4Å; V203-I209 HydrophobicContact CB-CG1 3.93Å; V203-I209 HydrophobicContact CG1-CD1 4.24Å; V203-I209 HydrophobicContact CG2-CD1 3.79Å; V203-I209 HydrophobicContact CG2-CG1 3.81Å; V203-F211 HydrophobicContact CG2-CD2 3.99Å; V203-F211 HydrophobicContact CG2-CE2 3.79Å
204	P	84.6	Confident	92.1	Very high	107 Å²	107	60.3 Å²	60.3	70%	0.695	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	138.8	176.1	25.3	-33.6	0	0	0	110.4	R206	P204-R206 PolarHBondContact O-N 3.4Å
205	N	83.7	Confident	92.1	Very high	157 Å²	157	64.8 Å²	64.8	84%	0.84	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	10.7	-174.3	-47.4	-39.6	0	0	0	115.8	V203	V203-N205 PolarHBondContact O-N 2.83Å
206	R	86	Confident	92.2	Very high	154 Å²	154	63.3 Å²	63.3	58%	0.581	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	93.3	172.3	-69.3	-165.3	-173.9	177.9	4.5	112	V203 P204 D208 I209	V203-R206 HydrophobicContact CB-CB 4.3Å; V203-R206 HydrophobicContact CG1-CB 4.24Å; V203-R206 CarbonylContact O-C 3.52Å; V203-R206 PolarHBondContact O-N 2.59Å; V203-R206 VanDerWaalsContact O-N 3.1Å; V203-R206 VanDerWaalsContact O-O 3.13Å; P204-R206 PolarHBondContact O-N 3.4Å; R206-D208 VanDerWaalsContact C-N 3.29Å; R206-D208 PolarHBondContact O-N 3.06Å; R206-I209 HydrophobicContact CB-CD1 3.89Å; R206-I209 HydrophobicContact CB-CG1 3.82Å; R206-I209 HydrophobicContact CG-CD1 4.47Å
207	H	86.1	Confident	92.2	Very high	104 Å²	104	66.2 Å²	66.2	48%	0.481	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-13.6	-179.2	-58.2	-81.5	0	0	0	113.2	D180 I209	D180-H207 HydrophobicContact CB-CB 4.48Å; H207-I209 VanDerWaalsContact C-N 3.27Å; H207-I209 PolarHBondContact O-N 3.48Å
208	D	89.1	Confident	92.1	Very high	70 Å²	70	72.4 Å²	72.4	37%	0.374	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-8.1	-179.8	71.4	-51.2	0	0	0	114.5	T176 N177 L178 R206	T176-D208 CarbonylContact C-O 3.55Å; T176-D208 WeakPolarHBondContact CA-O 3.42Å; N177-D208 PolarHBondContact N-O 2.9Å; N177-D208 VanDerWaalsContact N-O 3.11Å; L178-D208 PolarHBondContact N-O 3.16Å; L178-D208 VanDerWaalsContact N-O 3.12Å; L178-D208 WeakPolarHBondContact O-CA 3.31Å; R206-D208 VanDerWaalsContact C-N 3.29Å; R206-D208 PolarHBondContact O-N 3.06Å
209	I	93	Very high	92.2	Very high	15 Å²	15	68.4 Å²	68.4	8%	0.077	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	146.5	-174.4	64.7	179.5	0	0	0	113.5	F174 C175 T176 V203 R206 H207	F174-I209 HydrophobicContact CE2-CB 3.92Å; F174-I209 HydrophobicContact CE2-CD1 4.33Å; F174-I209 HydrophobicContact CE2-CG2 4.1Å; F174-I209 HydrophobicContact CZ-CB 4.36Å; F174-I209 HydrophobicContact CZ-CG2 4.02Å; C175-I209 WeakPolarHBondContact O-CA 3.38Å; T176-I209 HydrophobicContact CG2-CG2 4.05Å; V203-I209 HydrophobicContact CB-CD1 4Å; V203-I209 HydrophobicContact CB-CG1 3.93Å; V203-I209 HydrophobicContact CG1-CD1 4.24Å; V203-I209 HydrophobicContact CG2-CD1 3.79Å; V203-I209 HydrophobicContact CG2-CG1 3.81Å; R206-I209 HydrophobicContact CB-CD1 3.89Å; R206-I209 HydrophobicContact CB-CG1 3.82Å; R206-I209 HydrophobicContact CG-CD1 4.47Å; H207-I209 VanDerWaalsContact C-N 3.27Å; H207-I209 PolarHBondContact O-N 3.48Å
210	A	94.5	Very high	92.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	152.2	174.1	0	0	0	0	0	111.4	C175 L178 L187 L202 I212	C175-A210 HydrophobicContact CB-CB 4.47Å; C175-A210 PolarHBondContact N-O 3.32Å; C175-A210 PolarHBondContact O-N 3.45Å; C175-A210 VanDerWaalsContact O-N 3.11Å; L178-A210 HydrophobicContact CD1-CB 3.62Å; L187-A210 HydrophobicContact CD1-CB 3.59Å; L202-A210 HydrophobicContact CD2-CB 3.83Å; A210-I212 HydrophobicContact CB-CD1 4.11Å
211	F	95.3	Very high	92.2	Very high	69 Å²	69	68.5 Å²	68.5	30%	0.303	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.9	167.6	-65.9	-85.8	0	0	0	109.6	I172 L173 F174 R201 V203 A243	I172-F211 HydrophobicContact CG2-CB 4.06Å; I172-F211 HydrophobicContact CG2-CD1 3.96Å; I172-F211 HydrophobicContact CG2-CG 4.48Å; L173-F211 CarbonylContact O-C 3.54Å; L173-F211 VanDerWaalsContact O-CA 3.29Å; L173-F211 WeakPolarHBondContact O-CA 3.41Å; F174-F211 HydrophobicContact CB-CD1 4.18Å; F174-F211 HydrophobicContact CB-CE1 4Å; F174-F211 AromaticContact CD2-CD1 3.89Å; F174-F211 HydrophobicContact CD2-CD1 3.89Å; F174-F211 AromaticContact CD2-CE1 3.37Å; F174-F211 HydrophobicContact CD2-CE1 3.37Å; F174-F211 HydrophobicContact CD2-CE2 4.12Å; F174-F211 HydrophobicContact CD2-CG 4.47Å; F174-F211 AromaticContact CD2-CZ 3.5Å; F174-F211 HydrophobicContact CD2-CZ 3.5Å; F174-F211 VanDerWaalsContact CD2-CZ 3.5Å; F174-F211 HydrophobicContact CE2-CE1 4.12Å; F174-F211 HydrophobicContact CE2-CE2 4.22Å; F174-F211 AromaticContact CE2-CZ 3.76Å; F174-F211 HydrophobicContact CE2-CZ 3.76Å; F174-F211 HydrophobicContact CG-CD1 4.48Å; F174-F211 AromaticContact CG-CE1 3.97Å; F174-F211 HydrophobicContact CG-CE1 3.97Å; F174-F211 HydrophobicContact CG-CZ 4.43Å; R201-F211 HydrophobicContact CB-CB 4.31Å; R201-F211 PolarHBondContact N-O 3.26Å; R201-F211 PolarHBondContact O-N 3.32Å; V203-F211 HydrophobicContact CG2-CD2 3.99Å; V203-F211 HydrophobicContact CG2-CE2 3.79Å; F211-A243 HydrophobicContact CD1-CB 4.24Å; F211-A243 HydrophobicContact CE1-CB 4.25Å
212	I	95.7	Very high	92.3	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.3	176.4	-62.4	78	0	0	0	107.7	I172 L173 C175 F191 F197 E199 V200 A210 F214	I172-I212 CarbonylContact C-O 3.58Å; I172-I212 WeakPolarHBondContact CA-O 3.35Å; L173-I212 HydrophobicContact CB-CB 4.41Å; L173-I212 PolarHBondContact N-O 3.03Å; L173-I212 PolarHBondContact O-N 3.27Å; C175-I212 HydrophobicContact CB-CD1 4.07Å; C175-I212 WeakPolarHBondContact SG-CD1 3.39Å; F191-I212 HydrophobicContact CB-CG2 4.24Å; F191-I212 HydrophobicContact CD1-CG1 4.35Å; F191-I212 HydrophobicContact CD1-CG2 3.98Å; F191-I212 HydrophobicContact CD2-CD1 4.4Å; F191-I212 HydrophobicContact CD2-CG1 3.81Å; F191-I212 HydrophobicContact CE1-CG1 4.3Å; F191-I212 HydrophobicContact CE1-CG2 4.47Å; F191-I212 HydrophobicContact CE2-CD1 3.87Å; F191-I212 HydrophobicContact CE2-CG1 3.78Å; F191-I212 HydrophobicContact CG-CG1 4.11Å; F191-I212 HydrophobicContact CG-CG2 4.01Å; F191-I212 HydrophobicContact CZ-CD1 4Å; F191-I212 HydrophobicContact CZ-CG1 4.02Å; F197-I212 HydrophobicContact CD2-CG2 3.94Å; F197-I212 HydrophobicContact CE2-CG2 3.78Å; E199-I212 WeakPolarHBondContact O-CA 3.49Å; V200-I212 HydrophobicContact CG2-CG1 4.2Å; A210-I212 HydrophobicContact CB-CD1 4.11Å; I212-F214 HydrophobicContact CG2-CD2 4.01Å; I212-F214 HydrophobicContact CG2-CE2 3.53Å; I212-F214 HydrophobicContact CG2-CZ 4.31Å
213	E	95.8	Very high	92.5	Very high	24 Å²	24	63.4 Å²	63.4	11%	0.112	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.7	176.1	-172.4	159.9	164.1	0	0	111	K171 I172 K198 E199 R201	K171-E213 HydrophobicContact CD-CG 4.48Å; K171-E213 WeakPolarHBondContact CE-OE1 3.44Å; K171-E213 IonicContact NZ-OE1 3.22Å; K171-E213 PolarHBondContact NZ-OE1 2.97Å; I172-E213 HydrophobicContact CG1-CB 4.32Å; I172-E213 HydrophobicContact CG1-CG 4.09Å; K198-E213 WeakPolarHBondContact CA-O 3.38Å; K198-E213 HydrophobicContact CB-CB 4.45Å; K198-E213 HydrophobicContact CB-CG 4.44Å; K198-E213 WeakPolarHBondContact CB-O 3.38Å; K198-E213 PolarHBondContact N-O 3.42Å; E199-E213 HydrophobicContact CG-CB 3.98Å; E199-E213 PolarHBondContact N-O 2.99Å; E199-E213 PolarHBondContact O-N 3.18Å; R201-E213 IonicContact CZ-OE2 3.03Å; R201-E213 IonicContact NH1-OE2 2.61Å; R201-E213 PolarHBondContact NH1-OE2 3.38Å; R201-E213 VanDerWaalsContact NH1-OE2 3.12Å; R201-E213 IonicContact NH2-OE2 3.93Å; R201-E213 PolarHBondContact NH2-OE2 2.85Å
214	F	96.8	Very high	92.7	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	168.3	170.2	-78.5	-91.9	0	0	0	110.8	K171 L173 F191 F194 P195 G196 F197 I212 D219 A220 A223	K171-F214 WeakPolarHBondContact CB-O 3.41Å; K171-F214 PolarHBondContact O-N 2.86Å; L173-F214 HydrophobicContact CD1-CD2 4.22Å; L173-F214 HydrophobicContact CD1-CE2 3.83Å; L173-F214 HydrophobicContact CG-CD2 4.45Å; L173-F214 HydrophobicContact CG-CE2 4.5Å; F191-F214 HydrophobicContact CB-CZ 4.5Å; F191-F214 AromaticContact CD1-CE2 3.98Å; F191-F214 HydrophobicContact CD1-CE2 3.98Å; F191-F214 AromaticContact CD1-CZ 3.94Å; F191-F214 HydrophobicContact CD1-CZ 3.94Å; F194-F214 HydrophobicContact CB-CE1 3.77Å; F194-F214 HydrophobicContact CB-CZ 4.12Å; P195-F214 WeakPolarHBondContact O-CD1 3.32Å; P195-F214 WeakPolarHBondContact O-CE1 3.42Å; G196-F214 CarbonylContact O-C 3.35Å; G196-F214 WeakPolarHBondContact O-CA 3.37Å; F197-F214 HydrophobicContact CB-CD1 4.4Å; F197-F214 HydrophobicContact CB-CE1 3.95Å; F197-F214 HydrophobicContact CB-CZ 4.48Å; F197-F214 HydrophobicContact CD2-CZ 4.38Å; I212-F214 HydrophobicContact CG2-CD2 4.01Å; I212-F214 HydrophobicContact CG2-CE2 3.53Å; I212-F214 HydrophobicContact CG2-CZ 4.31Å; F214-D219 HydrophobicContact CB-CB 4.24Å; F214-D219 HydrophobicContact CD1-CB 3.68Å; F214-D219 HydrophobicContact CE1-CB 4.46Å; F214-D219 HydrophobicContact CG-CB 4.25Å; F214-A220 HydrophobicContact CB-CB 4.04Å; F214-A220 HydrophobicContact CD2-CB 4.04Å; F214-A220 HydrophobicContact CG-CB 4.19Å; F214-A223 HydrophobicContact CE1-CB 4.04Å; F214-A223 HydrophobicContact CE2-CB 3.75Å; F214-A223 HydrophobicContact CZ-CB 3.37Å
215	E	95.3	Very high	93	Very high	119 Å²	119	63.6 Å²	63.6	56%	0.556	30%	0.298	S	S	*	.	S	Bend	trans	-70.9	-47.8	175.8	-176.2	147.4	-130.8	0	0	112	G196 K198	G196-E215 WeakPolarHBondContact O-CB 3.5Å; G196-E215 PolarHBondContact O-N 3.45Å; K198-E215 HydrophobicContact CD-CB 4.49Å; K198-E215 IonicContact NZ-OE1 2.65Å
216	T	94.5	Very high	93.5	Very high	57 Å²	57	58.9 Å²	58.9	35%	0.35	28%	0.28	S	S	.	.	S	Bend	trans	-119.8	158.3	179.6	80.1	0	0	0	0	112.6	Y218 D219 A220	T216-Y218 PolarHBondContact O-N 3.02Å; T216-Y218 PolarHBondContact OG1-N 3.11Å; T216-D219 WeakPolarHBondContact CB-OD2 3.48Å; T216-D219 WeakPolarHBondContact CG2-OD2 3.4Å; T216-D219 PolarHBondContact N-OD2 3.12Å; T216-D219 PolarHBondContact O-N 3.11Å; T216-D219 PolarHBondContact OG1-N 2.84Å; T216-D219 PolarHBondContact OG1-OD2 2.8Å; T216-A220 PolarHBondContact O-N 2.88Å
217	E	93.6	Very high	93.8	Very high	82 Å²	82	51.6 Å²	51.6	38%	0.383	25%	0.253	S	S	.	.	H	α-helix	trans	-65.3	-22	171.5	-53.3	-169.7	157.2	0	0	111.8	P169 K221 K245	P169-E217 HydrophobicContact CB-CB 4.13Å; E217-K221 WeakPolarHBondContact O-CB 3.42Å; E217-K221 PolarHBondContact O-N 2.71Å; E217-K221 VanDerWaalsContact O-N 3.1Å; E217-K245 IonicContact OE1-NZ 2.83Å; E217-K245 PolarHBondContact OE1-NZ 3.43Å
218	Y	94.2	Very high	94	Very high	165 Å²	165	49.9 Å²	49.9	65%	0.647	25%	0.245	S	C	*	.	H	α-helix	trans	-73.5	-47.7	177.1	179.6	-92.9	0	0	0	111.5	T216 A220 K221 T222	T216-Y218 PolarHBondContact O-N 3.02Å; T216-Y218 PolarHBondContact OG1-N 3.11Å; Y218-A220 VanDerWaalsContact C-N 3.34Å; Y218-A220 PolarHBondContact O-N 3.05Å; Y218-K221 WeakPolarHBondContact O-CA 3.22Å; Y218-K221 VanDerWaalsContact O-CB 3.32Å; Y218-K221 WeakPolarHBondContact O-CB 3.5Å; Y218-K221 PolarHBondContact O-N 3.02Å; Y218-K221 VanDerWaalsContact O-N 3.08Å; Y218-T222 PolarHBondContact O-N 2.88Å; Y218-T222 PolarHBondContact O-OG1 2.84Å
219	D	95.7	Very high	93.9	Very high	22 Å²	22	51.7 Å²	51.7	12%	0.118	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-44	177.5	-55.5	-49.9	0	0	0	111.2	P195 F214 T216 K221 T222 A223	P195-D219 WeakPolarHBondContact O-CB 3.37Å; F214-D219 HydrophobicContact CB-CB 4.24Å; F214-D219 HydrophobicContact CD1-CB 3.68Å; F214-D219 HydrophobicContact CE1-CB 4.46Å; F214-D219 HydrophobicContact CG-CB 4.25Å; T216-D219 WeakPolarHBondContact CB-OD2 3.48Å; T216-D219 WeakPolarHBondContact CG2-OD2 3.4Å; T216-D219 PolarHBondContact N-OD2 3.12Å; T216-D219 PolarHBondContact O-N 3.11Å; T216-D219 PolarHBondContact OG1-N 2.84Å; T216-D219 PolarHBondContact OG1-OD2 2.8Å; D219-K221 VanDerWaalsContact C-N 3.29Å; D219-K221 PolarHBondContact O-N 3.37Å; D219-T222 PolarHBondContact O-N 3.39Å; D219-A223 WeakPolarHBondContact O-CB 3.49Å; D219-A223 PolarHBondContact O-N 3.08Å
220	A	95.2	Very high	93.7	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-56.5	-42.5	172.4	0	0	0	0	0	111.8	N170 L173 F214 T216 Y218 K224 F242	N170-A220 VanDerWaalsContact O-CB 3.3Å; N170-A220 WeakPolarHBondContact O-CB 3.35Å; L173-A220 WeakPolarHBondContact CD1-O 3.29Å; L173-A220 HydrophobicContact CD2-CB 4Å; L173-A220 HydrophobicContact CG-CB 4.09Å; F214-A220 HydrophobicContact CB-CB 4.04Å; F214-A220 HydrophobicContact CD2-CB 4.04Å; F214-A220 HydrophobicContact CG-CB 4.19Å; T216-A220 PolarHBondContact O-N 2.88Å; Y218-A220 VanDerWaalsContact C-N 3.34Å; Y218-A220 PolarHBondContact O-N 3.05Å; A220-K224 VanDerWaalsContact O-CB 3.25Å; A220-K224 WeakPolarHBondContact O-CB 3.17Å; A220-K224 PolarHBondContact O-N 2.65Å; A220-F242 HydrophobicContact CB-CE1 4.09Å
221	K	93.6	Very high	93.4	Very high	92 Å²	92	61.6 Å²	61.6	40%	0.4	30%	0.298	S	S	.	.	H	α-helix	trans	-61.9	-48.9	176.1	-172.8	-172.7	166	-169.9	0	111.4	E217 Y218 D219 K224 E225 F242	E217-K221 WeakPolarHBondContact O-CB 3.42Å; E217-K221 PolarHBondContact O-N 2.71Å; E217-K221 VanDerWaalsContact O-N 3.1Å; Y218-K221 WeakPolarHBondContact O-CA 3.22Å; Y218-K221 VanDerWaalsContact O-CB 3.32Å; Y218-K221 WeakPolarHBondContact O-CB 3.5Å; Y218-K221 PolarHBondContact O-N 3.02Å; Y218-K221 VanDerWaalsContact O-N 3.08Å; D219-K221 VanDerWaalsContact C-N 3.29Å; D219-K221 PolarHBondContact O-N 3.37Å; K221-K224 PolarHBondContact O-N 3.12Å; K221-E225 WeakPolarHBondContact CE-OE1 3.49Å; K221-E225 IonicContact NZ-OE1 3.12Å; K221-E225 WeakPolarHBondContact O-CG 3.32Å; K221-E225 PolarHBondContact O-N 3.25Å; K221-F242 HydrophobicContact CB-CE1 4.45Å; K221-F242 HydrophobicContact CB-CZ 3.83Å; K221-F242 HydrophobicContact CG-CZ 4.13Å
222	T	94.8	Very high	92.8	Very high	53 Å²	53	59.5 Å²	59.5	33%	0.325	29%	0.29	S	S	.	.	H	α-helix	trans	-60.9	-45.8	179.8	-58.2	0	0	0	0	111.6	F194 Y218 D219 E225 A226	F194-T222 HydrophobicContact CD1-CG2 4.47Å; Y218-T222 PolarHBondContact O-N 2.88Å; Y218-T222 PolarHBondContact O-OG1 2.84Å; D219-T222 PolarHBondContact O-N 3.39Å; T222-E225 PolarHBondContact O-N 3.08Å; T222-A226 WeakPolarHBondContact O-CB 3.33Å; T222-A226 PolarHBondContact O-N 3.22Å
223	A	95	Very high	92.1	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-43.2	175.8	0	0	0	0	0	112.1	L173 F191 F194 F214 D219 A226 L227	L173-A223 HydrophobicContact CD1-CB 4.17Å; F191-A223 HydrophobicContact CD1-CB 4.4Å; F194-A223 HydrophobicContact CB-CB 4.13Å; F194-A223 HydrophobicContact CD1-CB 4.06Å; F194-A223 HydrophobicContact CD2-CB 3.83Å; F194-A223 HydrophobicContact CE1-CB 4.48Å; F194-A223 HydrophobicContact CE2-CB 4.27Å; F194-A223 HydrophobicContact CG-CB 3.72Å; F214-A223 HydrophobicContact CE1-CB 4.04Å; F214-A223 HydrophobicContact CE2-CB 3.75Å; F214-A223 HydrophobicContact CZ-CB 3.37Å; D219-A223 WeakPolarHBondContact O-CB 3.49Å; D219-A223 PolarHBondContact O-N 3.08Å; A223-A226 PolarHBondContact O-N 3.12Å; A223-L227 VanDerWaalsContact O-CB 3.32Å; A223-L227 WeakPolarHBondContact O-CB 2.97Å; A223-L227 PolarHBondContact O-N 3.34Å
224	K	94.2	Very high	91.4	Very high	35 Å²	35	64.5 Å²	64.5	15%	0.152	33%	0.331	C	S	.	.	H	α-helix	trans	-59.6	-47.1	175.2	169.4	173.2	171.7	-78.7	0	112.2	L173 A220 K221 Q228 I240 F242	L173-K224 HydrophobicContact CD1-CB 4.14Å; L173-K224 HydrophobicContact CD2-CB 3.87Å; L173-K224 HydrophobicContact CD2-CD 4.25Å; A220-K224 VanDerWaalsContact O-CB 3.25Å; A220-K224 WeakPolarHBondContact O-CB 3.17Å; A220-K224 PolarHBondContact O-N 2.65Å; K221-K224 PolarHBondContact O-N 3.12Å; K224-Q228 WeakPolarHBondContact O-CB 3.45Å; K224-Q228 PolarHBondContact O-N 3.38Å; K224-I240 HydrophobicContact CB-CG2 3.96Å; K224-I240 HydrophobicContact CD-CG2 4.4Å; K224-I240 HydrophobicContact CG-CB 4.26Å; K224-I240 HydrophobicContact CG-CG2 3.91Å; K224-F242 HydrophobicContact CD-CD2 4.28Å; K224-F242 HydrophobicContact CD-CE2 4.14Å; K224-F242 HydrophobicContact CD-CZ 4.28Å
225	E	91.8	Very high	90.8	Very high	118 Å²	118	71.4 Å²	71.4	55%	0.551	37%	0.368	S	S	*	.	H	α-helix	trans	-67.5	-37.4	-178	-73.5	173.4	177.8	0	0	111.8	K221 T222	K221-E225 WeakPolarHBondContact CE-OE1 3.49Å; K221-E225 IonicContact NZ-OE1 3.12Å; K221-E225 WeakPolarHBondContact O-CG 3.32Å; K221-E225 PolarHBondContact O-N 3.25Å; T222-E225 PolarHBondContact O-N 3.08Å
226	A	92.8	Very high	90.2	Very high	58 Å²	58	69 Å²	69	48%	0.479	36%	0.356	S	S	.	.	H	α-helix	trans	-80.3	-16.8	179.2	0	0	0	0	0	115.3	F194 T222 A223	F194-A226 HydrophobicContact CE1-CB 3.55Å; F194-A226 HydrophobicContact CZ-CB 3.53Å; T222-A226 WeakPolarHBondContact O-CB 3.33Å; T222-A226 PolarHBondContact O-N 3.22Å; A223-A226 PolarHBondContact O-N 3.12Å
227	L	92.7	Very high	89.9	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-113.9	1.2	179.5	-75.3	172.7	0	0	0	114.4	L190 F191 F194 A223 N229 F230 I240	L190-L227 HydrophobicContact CD1-CD2 3.57Å; L190-L227 HydrophobicContact CD2-CD1 4.29Å; L190-L227 HydrophobicContact CD2-CD2 3.94Å; L190-L227 HydrophobicContact CG-CD1 3.96Å; L190-L227 HydrophobicContact CG-CD2 3.66Å; L190-L227 HydrophobicContact CG-CG 4.5Å; F191-L227 HydrophobicContact CD1-CD1 3.62Å; F191-L227 HydrophobicContact CD2-CD1 4.41Å; F191-L227 HydrophobicContact CE1-CD1 3.35Å; F191-L227 HydrophobicContact CE2-CD1 4.16Å; F191-L227 HydrophobicContact CG-CD1 4.17Å; F191-L227 HydrophobicContact CZ-CD1 3.64Å; F194-L227 HydrophobicContact CD2-CD1 4.38Å; F194-L227 HydrophobicContact CE2-CD1 3.6Å; F194-L227 HydrophobicContact CE2-CG 3.85Å; F194-L227 HydrophobicContact CZ-CD1 4.34Å; F194-L227 HydrophobicContact CZ-CG 4.12Å; A223-L227 VanDerWaalsContact O-CB 3.32Å; A223-L227 WeakPolarHBondContact O-CB 2.97Å; A223-L227 PolarHBondContact O-N 3.34Å; L227-N229 PolarHBondContact O-N 3.46Å; L227-F230 HydrophobicContact CB-CB 4.47Å; L227-F230 HydrophobicContact CD2-CB 3.91Å; L227-F230 HydrophobicContact CD2-CD1 4.28Å; L227-F230 HydrophobicContact CD2-CD2 4.06Å; L227-F230 HydrophobicContact CD2-CG 3.81Å; L227-F230 WeakPolarHBondContact O-CB 3.2Å; L227-F230 PolarHBondContact O-N 2.82Å; L227-I240 HydrophobicContact CB-CD1 3.37Å; L227-I240 HydrophobicContact CD1-CD1 4.47Å
228	Q	89.9	Confident	89.8	Confident	68 Å²	68	63.6 Å²	63.6	32%	0.318	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	126	179.8	-173.8	69.3	-35.7	0	0	111	K224 F230 I240	K224-Q228 WeakPolarHBondContact O-CB 3.45Å; K224-Q228 PolarHBondContact O-N 3.38Å; Q228-F230 PolarHBondContact O-N 2.88Å; Q228-I240 PolarHBondContact NE2-O 3.49Å; Q228-I240 PolarHBondContact OE1-O 2.89Å
229	N	87.7	Confident	89.7	Confident	108 Å²	108	58.8 Å²	58.8	58%	0.578	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	19.7	-173.3	-47.1	-50.2	0	0	0	114.6	L227 K231 A237 I238	L227-N229 PolarHBondContact O-N 3.46Å; N229-K231 PolarHBondContact O-N 2.91Å; N229-A237 HydrophobicContact CB-CB 4.44Å; N229-I238 WeakPolarHBondContact CA-O 3.32Å; N229-I238 PolarHBondContact N-O 3.42Å
230	F	89.7	Confident	89.6	Confident	84 Å²	84	57.8 Å²	57.8	37%	0.368	31%	0.309	S	S	.	.			trans	-61.1	126.2	173.8	-178.2	-93.8	0	0	0	110.5	L190 L227 Q228 V232 A237 I238	L190-F230 HydrophobicContact CD1-CD1 3.89Å; L190-F230 HydrophobicContact CD1-CE1 3.53Å; L190-F230 HydrophobicContact CD1-CE2 4.42Å; L190-F230 HydrophobicContact CD1-CG 4.48Å; L190-F230 HydrophobicContact CD1-CZ 3.82Å; L190-F230 HydrophobicContact CD2-CD1 3.97Å; L190-F230 HydrophobicContact CD2-CE1 4.22Å; L227-F230 HydrophobicContact CB-CB 4.47Å; L227-F230 HydrophobicContact CD2-CB 3.91Å; L227-F230 HydrophobicContact CD2-CD1 4.28Å; L227-F230 HydrophobicContact CD2-CD2 4.06Å; L227-F230 HydrophobicContact CD2-CG 3.81Å; L227-F230 WeakPolarHBondContact O-CB 3.2Å; L227-F230 PolarHBondContact O-N 2.82Å; Q228-F230 PolarHBondContact O-N 2.88Å; F230-V232 HydrophobicContact CD1-CG2 4.29Å; F230-V232 PolarHBondContact O-N 2.92Å; F230-A237 CarbonylContact O-C 3.55Å; F230-A237 WeakPolarHBondContact O-CA 3.36Å; F230-I238 PolarHBondContact O-N 2.87Å
231	K	86.6	Confident	89.4	Confident	139 Å²	139	58.8 Å²	58.8	60%	0.604	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	108.7	-179.5	-69.3	-169.6	176.2	-164	0	110.9	N229 H236 A237	N229-K231 PolarHBondContact O-N 2.91Å; K231-H236 WeakPolarHBondContact CA-O 3.34Å; K231-A237 HydrophobicContact CG-CB 4.24Å
232	V	82.8	Confident	89.4	Confident	24 Å²	24	55.3 Å²	55.3	15%	0.145	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	-40.6	174.4	174.5	0	0	0	0	110.5	P179 M186 F230 H236 I238	P179-V232 HydrophobicContact CG-CB 4.35Å; P179-V232 HydrophobicContact CG-CG1 3.83Å; M186-V232 HydrophobicContact CE-CG1 3.54Å; M186-V232 HydrophobicContact SD-CG1 3.68Å; F230-V232 HydrophobicContact CD1-CG2 4.29Å; F230-V232 PolarHBondContact O-N 2.92Å; V232-H236 PolarHBondContact N-O 2.78Å; V232-I238 HydrophobicContact CG2-CD1 3.43Å; V232-I238 VanDerWaalsContact CG2-CD1 3.43Å; V232-I238 HydrophobicContact CG2-CG1 3.38Å
233	T	81.6	Confident	89.2	Confident	49 Å²	49	53.3 Å²	53.3	30%	0.301	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	167.1	168.6	58.1	0	0	0	0	108.6	P179 N235 H236	P179-T233 HydrophobicContact CB-CG2 4.48Å; P179-T233 HydrophobicContact CG-CG2 4.06Å; T233-N235 PolarHBondContact O-N 3.12Å; T233-H236 PolarHBondContact O-N 2.65Å; T233-H236 WeakPolarHBondContact OG1-CB 3.36Å; T233-H236 PolarHBondContact OG1-N 2.61Å; T233-H236 PolarHBondContact OG1-ND1 2.71Å; T233-H236 VanDerWaalsContact OG1-ND1 3.08Å
234	A	81.9	Confident	88.7	Confident	80 Å²	80	62.7 Å²	62.7	66%	0.661	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-33.6	-178.3	0	0	0	0	0	113.7
235	N	83.7	Confident	87.6	Confident	146 Å²	146	70.5 Å²	70.5	78%	0.781	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-16.3	-174.1	-60.6	-16.5	0	0	0	114.2	T233	T233-N235 PolarHBondContact O-N 3.12Å
236	H	82.5	Confident	87.4	Confident	67 Å²	67	68.1 Å²	68.1	31%	0.31	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	108.6	-176.1	-61.4	88.3	0	0	0	112.2	P179 K231 V232 T233	P179-H236 HydrophobicContact CB-CB 4.4Å; P179-H236 HydrophobicContact CG-CB 4.31Å; K231-H236 WeakPolarHBondContact CA-O 3.34Å; V232-H236 PolarHBondContact N-O 2.78Å; T233-H236 PolarHBondContact O-N 2.65Å; T233-H236 WeakPolarHBondContact OG1-CB 3.36Å; T233-H236 PolarHBondContact OG1-N 2.61Å; T233-H236 PolarHBondContact OG1-ND1 2.71Å; T233-H236 VanDerWaalsContact OG1-ND1 3.08Å
237	A	88.2	Confident	87.1	Confident	27 Å²	27	68.6 Å²	68.6	22%	0.223	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	126	168.2	0	0	0	0	0	110	N177 N229 F230 K231 K239	N177-A237 PolarHBondContact ND2-O 3.22Å; N229-A237 HydrophobicContact CB-CB 4.44Å; F230-A237 CarbonylContact O-C 3.55Å; F230-A237 WeakPolarHBondContact O-CA 3.36Å; K231-A237 HydrophobicContact CG-CB 4.24Å; A237-K239 PolarHBondContact O-N 3.28Å
238	I	91.3	Very high	86.8	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.366	C	S	.	.			trans	-64.9	133.5	175.6	-48.9	-174.9	0	0	0	109	C175 L178 L190 N229 F230 V232 I240	C175-I238 HydrophobicContact CB-CG2 3.9Å; L178-I238 HydrophobicContact CD2-CD1 3.82Å; L178-I238 HydrophobicContact CD2-CG1 3.86Å; L178-I238 HydrophobicContact CD2-CG2 4.08Å; L190-I238 HydrophobicContact CD2-CD1 3.61Å; N229-I238 WeakPolarHBondContact CA-O 3.32Å; N229-I238 PolarHBondContact N-O 3.42Å; F230-I238 PolarHBondContact O-N 2.87Å; V232-I238 HydrophobicContact CG2-CD1 3.43Å; V232-I238 VanDerWaalsContact CG2-CD1 3.43Å; V232-I238 HydrophobicContact CG2-CG1 3.38Å; I238-I240 HydrophobicContact CB-CG1 4.45Å; I238-I240 HydrophobicContact CG2-CD1 4.29Å; I238-I240 HydrophobicContact CG2-CG1 3.66Å
239	K	92	Very high	86.7	Confident	64 Å²	64	72.6 Å²	72.6	28%	0.278	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.2	165.8	-179.5	176.4	178.7	-180	0	109.9	S163 T176 A237	S163-K239 PolarHBondContact OG-NZ 3.38Å; S163-K239 VanDerWaalsContact OG-NZ 3.08Å; T176-K239 PolarHBondContact N-O 3.08Å; T176-K239 PolarHBondContact O-N 3.03Å; T176-K239 PolarHBondContact OG1-O 3.28Å; A237-K239 PolarHBondContact O-N 3.28Å
240	I	93.2	Very high	86.6	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	135	-175.5	-49.6	-175	0	0	0	109.9	L173 F191 K224 L227 Q228 I238	L173-I240 HydrophobicContact CB-CG2 4.03Å; L173-I240 HydrophobicContact CD1-CG2 3.98Å; L173-I240 HydrophobicContact CD2-CG2 4.2Å; L173-I240 HydrophobicContact CG-CG2 4.3Å; F191-I240 HydrophobicContact CE1-CD1 4.27Å; F191-I240 HydrophobicContact CZ-CD1 3.94Å; K224-I240 HydrophobicContact CB-CG2 3.96Å; K224-I240 HydrophobicContact CD-CG2 4.4Å; K224-I240 HydrophobicContact CG-CB 4.26Å; K224-I240 HydrophobicContact CG-CG2 3.91Å; L227-I240 HydrophobicContact CB-CD1 3.37Å; L227-I240 HydrophobicContact CD1-CD1 4.47Å; Q228-I240 PolarHBondContact NE2-O 3.49Å; Q228-I240 PolarHBondContact OE1-O 2.89Å; I238-I240 HydrophobicContact CB-CG1 4.45Å; I238-I240 HydrophobicContact CG2-CD1 4.29Å; I238-I240 HydrophobicContact CG2-CG1 3.66Å
241	T	92.5	Very high	86.4	Confident	21 Å²	21	69.5 Å²	69.5	13%	0.129	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	158.8	175.1	59.1	0	0	0	0	109.8	Q167 L173 F174	Q167-T241 VanDerWaalsContact NE2-CG2 3.33Å; Q167-T241 VanDerWaalsContact OE1-CA 3.26Å; L173-T241 WeakPolarHBondContact CA-O 3.48Å; F174-T241 PolarHBondContact N-O 3.15Å; F174-T241 PolarHBondContact O-N 2.98Å; F174-T241 PolarHBondContact O-OG1 3.22Å
242	F	93.7	Very high	86.4	Confident	20 Å²	20	64.6 Å²	64.6	9%	0.088	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	136.6	165.9	-69.3	-65.3	0	0	0	109.6	Q167 P169 N170 L173 A220 K221 K224	Q167-F242 HydrophobicContact CB-CB 4.3Å; Q167-F242 HydrophobicContact CB-CD2 3.79Å; P169-F242 HydrophobicContact CB-CE2 4.41Å; P169-F242 HydrophobicContact CB-CZ 4.31Å; N170-F242 HydrophobicContact CB-CB 4.16Å; N170-F242 HydrophobicContact CB-CD1 4.24Å; N170-F242 WeakPolarHBondContact O-CD1 3.32Å; N170-F242 WeakPolarHBondContact O-CE1 3.05Å; L173-F242 HydrophobicContact CD2-CD1 3.68Å; L173-F242 HydrophobicContact CD2-CE1 3.87Å; A220-F242 HydrophobicContact CB-CE1 4.09Å; K221-F242 HydrophobicContact CB-CE1 4.45Å; K221-F242 HydrophobicContact CB-CZ 3.83Å; K221-F242 HydrophobicContact CG-CZ 4.13Å; K224-F242 HydrophobicContact CD-CD2 4.28Å; K224-F242 HydrophobicContact CD-CE2 4.14Å; K224-F242 HydrophobicContact CD-CZ 4.28Å
243	A	90.5	Very high	86.6	Confident	10 Å²	10	67.7 Å²	67.7	8%	0.083	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-62.4	142.9	172.6	0	0	0	0	0	109.8	N170 I172 F174 F211	N170-A243 PolarHBondContact ND2-O 3.1Å; I172-A243 HydrophobicContact CB-CB 3.85Å; I172-A243 HydrophobicContact CG2-CB 3.76Å; I172-A243 VanDerWaalsContact O-CB 3.32Å; I172-A243 WeakPolarHBondContact O-CB 3.49Å; I172-A243 PolarHBondContact O-N 3.33Å; F174-A243 HydrophobicContact CB-CB 4.31Å; F211-A243 HydrophobicContact CD1-CB 4.24Å; F211-A243 HydrophobicContact CE1-CB 4.25Å
244	K	84.6	Confident	87.1	Confident	197 Å²	197	69.3 Å²	69.3	86%	0.857	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-68.6	137.8	175.7	-63.5	178.7	-178.3	176.8	0	109.3
245	K	70.9	Confident	87.5	Confident	199 Å²	199	68.3 Å²	68.3	87%	0.865	33%	0.328	S	S	*	.			trans	-72.2	0	163.5	-64.8	-177.2	179.6	177.2	0	109.1	P169 E217	P169-K245 PolarHBondContact O-NZ 3.22Å; E217-K245 IonicContact OE1-NZ 2.83Å; E217-K245 PolarHBondContact OE1-NZ 3.43Å

Retrieved 245 of 245 residues in 66.4 ms (Link to these results)

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