A0A5K4F8M8_SCHMA Loading...

Apple domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F8M8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 255 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	34.6	Very low	27.3	Very low	240 Å²	240	161.9 Å²	161.9	100%	1.182	77%	0.768	S	S	*	*				0	94	0	-97.8	174.2	75.3	0	0	108.5
2	T	30.4	Very low	27.2	Very low	138 Å²	138	159 Å²	159	85%	0.847	76%	0.758	S	S	*	*			trans	-170.5	83.9	176	13.7	0	0	0	0	104
3	K	27.1	Very low	27	Very low	174 Å²	174	152.2 Å²	152.2	76%	0.757	74%	0.738	S	S	*	*				55.8	99.4	83	-88.9	-170.3	171.7	-176.8	0	114.2
4	Y	25.6	Very low	27	Very low	182 Å²	182	150.5 Å²	150.5	71%	0.714	73%	0.732	S	S	*	*			trans	69.8	116.2	152.8	-54.3	-77.8	0	0	0	118.8
5	L	26.7	Very low	26.7	Very low	161 Å²	161	151.7 Å²	151.7	84%	0.843	73%	0.727	S	S	*	*				-153	105.6	108	-124.9	104.3	0	0	0	108.8	I7	L5-I7 PolarHBondContact O-N 3.02Å
6	F	25.4	Very low	26.5	Very low	178 Å²	178	151.7 Å²	151.7	78%	0.781	73%	0.731	S	S	*	*			trans	-69.4	106.2	167.6	-109.9	-99.1	0	0	0	107.2	I8	F6-I8 VanDerWaalsContact C-N 3.28Å; F6-I8 HydrophobicContact CB-CG1 4.45Å; F6-I8 HydrophobicContact CD1-CG1 4.26Å; F6-I8 PolarHBondContact O-N 3.25Å
7	I	28.9	Very low	26.3	Very low	124 Å²	124	151.6 Å²	151.6	64%	0.636	73%	0.727	S	S	*	*			trans	-77.4	89.1	167.4	-60.3	175	0	0	0	106.4	L5 H9	L5-I7 PolarHBondContact O-N 3.02Å; I7-H9 VanDerWaalsContact C-N 3.33Å; I7-H9 PolarHBondContact O-N 3.13Å
8	I	27.5	Very low	26	Very low	119 Å²	119	146.9 Å²	146.9	61%	0.61	72%	0.718	S	S	*	*			trans	-80.2	90.1	164.1	-66.2	173.2	0	0	0	105.8	F6 I10	F6-I8 VanDerWaalsContact C-N 3.28Å; F6-I8 HydrophobicContact CB-CG1 4.45Å; F6-I8 HydrophobicContact CD1-CG1 4.26Å; F6-I8 PolarHBondContact O-N 3.25Å; I8-I10 VanDerWaalsContact C-N 3.28Å; I8-I10 HydrophobicContact CG2-CD1 3.63Å; I8-I10 HydrophobicContact CG2-CG1 3.58Å; I8-I10 PolarHBondContact O-N 2.73Å
9	H	24.9	Very low	25.8	Very low	150 Å²	150	144.5 Å²	144.5	69%	0.694	72%	0.715	S	S	*	*			trans	-75.9	86.9	164.7	-84.1	-27.4	0	0	0	108.7	I7 Y11	I7-H9 VanDerWaalsContact C-N 3.33Å; I7-H9 PolarHBondContact O-N 3.13Å; H9-Y11 HydrophobicContact CB-CD2 4.25Å; H9-Y11 PolarHBondContact O-N 3.14Å
10	I	25.4	Very low	25.6	Very low	123 Å²	123	147.3 Å²	147.3	63%	0.631	72%	0.719	S	S	*	*			trans	-70	87.7	160.6	-72.8	153.5	0	0	0	106.7	I8 I12	I8-I10 VanDerWaalsContact C-N 3.28Å; I8-I10 HydrophobicContact CG2-CD1 3.63Å; I8-I10 HydrophobicContact CG2-CG1 3.58Å; I8-I10 PolarHBondContact O-N 2.73Å; I10-I12 HydrophobicContact CG2-CB 4.25Å; I10-I12 HydrophobicContact CG2-CD1 3.35Å; I10-I12 HydrophobicContact CG2-CG1 3.44Å; I10-I12 VanDerWaalsContact CG2-CG1 3.44Å; I10-I12 PolarHBondContact O-N 3.29Å; I10-I12 VanDerWaalsContact O-N 3.1Å
11	Y	24	Very low	25.5	Very low	192 Å²	192	148.4 Å²	148.4	75%	0.753	72%	0.717	S	S	*	*			trans	-76.7	81.1	158.8	-97.3	-94	0	0	0	107.4	H9 S13	H9-Y11 HydrophobicContact CB-CD2 4.25Å; H9-Y11 PolarHBondContact O-N 3.14Å; Y11-S13 PolarHBondContact O-N 2.71Å
12	I	26.4	Very low	24.8	Very low	127 Å²	127	142.9 Å²	142.9	65%	0.651	70%	0.697	S	S	*	*			trans	-72.8	77.3	154.7	-72.9	159.8	0	0	0	105.3	I10 I14	I10-I12 HydrophobicContact CG2-CB 4.25Å; I10-I12 HydrophobicContact CG2-CD1 3.35Å; I10-I12 HydrophobicContact CG2-CG1 3.44Å; I10-I12 VanDerWaalsContact CG2-CG1 3.44Å; I10-I12 PolarHBondContact O-N 3.29Å; I10-I12 VanDerWaalsContact O-N 3.1Å; I12-I14 HydrophobicContact CG2-CD1 3.84Å; I12-I14 HydrophobicContact CG2-CG1 3.59Å; I12-I14 PolarHBondContact O-N 3.08Å
13	S	24.5	Very low	24.6	Very low	70 Å²	70	142.5 Å²	142.5	49%	0.49	69%	0.685	S	S	.	*			trans	-71.4	90.6	157.2	-74.3	0	0	0	0	105.9	Y11 Y15	Y11-S13 PolarHBondContact O-N 2.71Å; S13-Y15 PolarHBondContact O-N 3.19Å
14	I	26	Very low	24.5	Very low	129 Å²	129	136.8 Å²	136.8	66%	0.662	67%	0.667	S	S	*	*			trans	-63.2	77.9	151.7	-64.2	156.6	0	0	0	104.6	I12 L16	I12-I14 HydrophobicContact CG2-CD1 3.84Å; I12-I14 HydrophobicContact CG2-CG1 3.59Å; I12-I14 PolarHBondContact O-N 3.08Å; I14-L16 HydrophobicContact CG2-CB 4.46Å; I14-L16 HydrophobicContact CG2-CD1 3.93Å; I14-L16 HydrophobicContact CG2-CG 3.8Å; I14-L16 PolarHBondContact O-N 2.93Å
15	Y	22.6	Very low	24.5	Very low	169 Å²	169	133.6 Å²	133.6	66%	0.663	66%	0.662	S	S	*	*			trans	-65.7	86.2	149.4	-87.6	-85.6	0	0	0	104.5	S13 F17	S13-Y15 PolarHBondContact O-N 3.19Å; Y15-F17 AromaticContact CD1-CD2 3.95Å; Y15-F17 HydrophobicContact CD1-CD2 3.95Å; Y15-F17 AromaticContact CD1-CE2 3.57Å; Y15-F17 HydrophobicContact CD1-CE2 3.57Å; Y15-F17 AromaticContact CD1-CZ 3.99Å; Y15-F17 HydrophobicContact CD1-CZ 3.99Å; Y15-F17 HydrophobicContact CE1-CE2 4.31Å; Y15-F17 HydrophobicContact CE1-CZ 4.37Å; Y15-F17 HydrophobicContact CG-CD2 4.03Å; Y15-F17 AromaticContact CG-CE2 3.76Å; Y15-F17 HydrophobicContact CG-CE2 3.76Å; Y15-F17 PolarHBondContact O-N 3.49Å
16	L	23.6	Very low	24.8	Very low	151 Å²	151	128.9 Å²	128.9	79%	0.791	64%	0.64	S	S	*	*			trans	-56.3	76.3	137.1	-82.1	152.8	0	0	0	105.3	I14 A18	I14-L16 HydrophobicContact CG2-CB 4.46Å; I14-L16 HydrophobicContact CG2-CD1 3.93Å; I14-L16 HydrophobicContact CG2-CG 3.8Å; I14-L16 PolarHBondContact O-N 2.93Å; L16-A18 PolarHBondContact O-N 3.18Å
17	F	22.8	Very low	25.7	Very low	151 Å²	151	123.4 Å²	123.4	66%	0.662	62%	0.615	S	S	*	*			trans	-57.8	92.6	145.8	-86.1	-80.8	0	0	0	102.9	Y15 C19	Y15-F17 AromaticContact CD1-CD2 3.95Å; Y15-F17 HydrophobicContact CD1-CD2 3.95Å; Y15-F17 AromaticContact CD1-CE2 3.57Å; Y15-F17 HydrophobicContact CD1-CE2 3.57Å; Y15-F17 AromaticContact CD1-CZ 3.99Å; Y15-F17 HydrophobicContact CD1-CZ 3.99Å; Y15-F17 HydrophobicContact CE1-CE2 4.31Å; Y15-F17 HydrophobicContact CE1-CZ 4.37Å; Y15-F17 HydrophobicContact CG-CD2 4.03Å; Y15-F17 AromaticContact CG-CE2 3.76Å; Y15-F17 HydrophobicContact CG-CE2 3.76Å; Y15-F17 PolarHBondContact O-N 3.49Å; F17-C19 PolarHBondContact O-N 3.26Å
18	A	21.5	Very low	26.5	Very low	67 Å²	67	123 Å²	123	55%	0.554	61%	0.614	S	S	*	*				-45.8	91.2	129	0	0	0	0	0	104.2	L16 Y20	L16-A18 PolarHBondContact O-N 3.18Å; A18-Y20 HydrophobicContact CB-CD2 4.04Å; A18-Y20 HydrophobicContact CB-CE2 4.28Å; A18-Y20 PolarHBondContact O-N 3.4Å
19	C	22.8	Very low	27.9	Very low	100 Å²	100	119.4 Å²	119.4	68%	0.676	60%	0.596	S	S	*	*			trans	-57.7	80.4	150.4	-77.9	0	0	0	0	103.3	F17 Y21	F17-C19 PolarHBondContact O-N 3.26Å; C19-Y21 PolarHBondContact O-N 3.21Å
20	Y	20.7	Very low	30	Very low	200 Å²	200	112.8 Å²	112.8	78%	0.784	57%	0.566	S	S	*	*			trans	-47	93.2	135.4	-84.9	-87.7	0	0	0	102.9	A18 T22	A18-Y20 HydrophobicContact CB-CD2 4.04Å; A18-Y20 HydrophobicContact CB-CE2 4.28Å; A18-Y20 PolarHBondContact O-N 3.4Å; Y20-T22 PolarHBondContact O-N 2.99Å
21	Y	23.3	Very low	32.1	Very low	171 Å²	171	110.2 Å²	110.2	67%	0.671	56%	0.556	S	S	*	*			trans	-50.7	86.6	154.9	-119.1	-97.6	0	0	0	103	C19 Q23	C19-Y21 PolarHBondContact O-N 3.21Å; Y21-Q23 PolarHBondContact O-N 2.85Å
22	T	21.2	Very low	34.3	Very low	125 Å²	125	103 Å²	103	77%	0.767	53%	0.53	S	S	*	.			trans	-66.2	83.7	157.4	37.5	0	0	0	0	102.2	Y20 S24	Y20-T22 PolarHBondContact O-N 2.99Å; T22-S24 VanDerWaalsContact C-N 3.3Å; T22-S24 PolarHBondContact O-N 3.47Å
23	Q	25.4	Very low	36.5	Very low	129 Å²	129	100.2 Å²	100.2	60%	0.603	52%	0.516	S	S	*	.			trans	-44.8	106	170.1	-163.1	177.9	37.4	0	0	103.9	Y21 N25	Y21-Q23 PolarHBondContact O-N 2.85Å; Q23-N25 PolarHBondContact O-N 3.26Å
24	S	24.8	Very low	38.8	Very low	54 Å²	54	98.3 Å²	98.3	38%	0.378	50%	0.503	S	S	.	.			trans	-51.2	116.7	170	176.1	0	0	0	0	103.7	T22 T26	T22-S24 VanDerWaalsContact C-N 3.3Å; T22-S24 PolarHBondContact O-N 3.47Å; S24-T26 PolarHBondContact O-N 3.2Å; S24-T26 PolarHBondContact O-OG1 2.85Å
25	N	25.9	Very low	40.8	Very low	115 Å²	115	92.7 Å²	92.7	62%	0.615	48%	0.475	S	S	*	.			trans	-76.3	50.7	-169.4	-146.8	-5.4	0	0	0	108.5	Q23 R27	Q23-N25 PolarHBondContact O-N 3.26Å; N25-R27 PolarHBondContact O-N 2.85Å; N25-R27 VanDerWaalsContact O-N 3.11Å; N25-R27 VanDerWaalsContact OD1-CD 3.24Å; N25-R27 WeakPolarHBondContact OD1-CD 3.4Å; N25-R27 WeakPolarHBondContact OD1-CG 3.38Å
26	T	32.9	Very low	43.3	Very low	62 Å²	62	85.8 Å²	85.8	38%	0.38	45%	0.451	S	S	.	.			trans	-81.8	61.1	164.6	49.6	0	0	0	0	107.3	S24 N28 D29	S24-T26 PolarHBondContact O-N 3.2Å; S24-T26 PolarHBondContact O-OG1 2.85Å; T26-N28 PolarHBondContact O-N 3.19Å; T26-D29 PolarHBondContact O-N 3.09Å; T26-D29 VanDerWaalsContact O-N 3.07Å; T26-D29 PolarHBondContact OG1-OD2 2.93Å
27	R	44.9	Very low	46	Very low	63 Å²	63	84.9 Å²	84.9	24%	0.238	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	31.6	170.8	-83.3	177.7	161	169.6	-14.1	113.1	N25 W57 R118 T119	N25-R27 PolarHBondContact O-N 2.85Å; N25-R27 VanDerWaalsContact O-N 3.11Å; N25-R27 VanDerWaalsContact OD1-CD 3.24Å; N25-R27 WeakPolarHBondContact OD1-CD 3.4Å; N25-R27 WeakPolarHBondContact OD1-CG 3.38Å; R27-W57 HydrophobicContact CB-CB 4.4Å; R27-W57 HydrophobicContact CB-CG 4.42Å; R27-W57 HydrophobicContact CG-CG 4.28Å; R27-R118 WeakPolarHBondContact CD-O 3.49Å; R27-T119 VanDerWaalsContact CZ-CA 3.48Å; R27-T119 PolarHBondContact NH1-O 2.79Å; R27-T119 PolarHBondContact NH2-O 3.5Å
28	N	45.6	Very low	48.9	Very low	116 Å²	116	84.1 Å²	84.1	62%	0.62	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	0	164.9	-67.6	-2.4	0	0	0	111.4	T26 L30 R118	T26-N28 PolarHBondContact O-N 3.19Å; N28-L30 PolarHBondContact O-N 2.82Å; N28-R118 PolarHBondContact OD1-NH1 2.95Å
29	D	56.5	Low	51.9	Low	44 Å²	44	81.5 Å²	81.5	24%	0.235	41%	0.41	C	S	.	.			trans	-74.3	114.7	-174	-66	-23.8	0	0	0	110.6	T26 A138	T26-D29 PolarHBondContact O-N 3.09Å; T26-D29 VanDerWaalsContact O-N 3.07Å; T26-D29 PolarHBondContact OG1-OD2 2.93Å; D29-A138 WeakPolarHBondContact OD1-CB 3.08Å
30	L	68.5	Low	54.7	Low	11 Å²	11	82.1 Å²	82.1	6%	0.058	41%	0.411	C	S	.	.			trans	-71.4	134.6	169.8	-79.2	169.8	0	0	0	109	N28 I54 G55 A56 P111 L112 I135 I137	N28-L30 PolarHBondContact O-N 2.82Å; L30-I54 HydrophobicContact CD2-CD1 3.82Å; L30-I54 HydrophobicContact CD2-CG1 4.46Å; L30-G55 CarbonylContact C-O 3.41Å; L30-G55 VanDerWaalsContact CA-O 3.27Å; L30-G55 WeakPolarHBondContact CA-O 3.41Å; L30-G55 WeakPolarHBondContact CD2-O 3.39Å; L30-A56 HydrophobicContact CD2-CB 3.81Å; L30-P111 HydrophobicContact CD1-CG 4.45Å; L30-P111 HydrophobicContact CD2-CB 3.66Å; L30-P111 HydrophobicContact CD2-CG 3.91Å; L30-L112 HydrophobicContact CD1-CD2 3.96Å; L30-I135 HydrophobicContact CB-CG2 4.48Å; L30-I135 HydrophobicContact CD1-CD1 4.05Å; L30-I135 HydrophobicContact CD1-CG2 3.37Å; L30-I137 HydrophobicContact CB-CG1 4.12Å; L30-I137 VanDerWaalsContact O-CD1 3.27Å; L30-I137 WeakPolarHBondContact O-CD1 3.17Å; L30-I137 WeakPolarHBondContact O-CG1 3.14Å; L30-I137 WeakPolarHBondContact O-CG2 3.29Å
31	T	69.7	Low	57.7	Low	68 Å²	68	76 Å²	76	42%	0.417	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	146.5	173.7	43.5	0	0	0	0	110.3	I54 G55	T31-I54 CarbonylContact O-C 3.46Å; T31-I54 WeakPolarHBondContact O-CA 3.5Å; T31-I54 WeakPolarHBondContact O-CB 3.06Å; T31-G55 PolarHBondContact N-O 3.08Å; T31-G55 PolarHBondContact O-N 3.17Å; T31-G55 WeakPolarHBondContact OG1-CA 3.35Å
32	L	71	Confident	60.6	Low	42 Å²	42	67.8 Å²	67.8	22%	0.22	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	122.1	172.3	-62.8	-179.2	0	0	0	109.2	I54 I132 I137 M228	L32-I54 HydrophobicContact CD2-CG2 3.75Å; L32-I132 HydrophobicContact CD2-CD1 3.81Å; L32-I137 HydrophobicContact CD1-CD1 4.38Å; L32-I137 HydrophobicContact CD2-CD1 3.84Å; L32-I137 HydrophobicContact CG-CD1 3.62Å; L32-M228 HydrophobicContact CD1-CE 3.29Å; L32-M228 HydrophobicContact CD1-CG 4.33Å; L32-M228 HydrophobicContact CD1-SD 3.44Å; L32-M228 WeakPolarHBondContact CD1-SD 3.33Å
33	L	73	Confident	63.4	Low	67 Å²	67	67 Å²	67	35%	0.351	35%	0.35	S	S	.	.			trans	-101.1	-19.8	179.7	-60.1	178.8	0	0	0	112.9	W53 L80 F92	L33-W53 HydrophobicContact CB-CB 3.9Å; L33-W53 PolarHBondContact N-O 3.05Å; L33-L80 HydrophobicContact CB-CD2 4.18Å; L33-F92 HydrophobicContact CD1-CZ 4.14Å
34	S	73	Confident	66	Low	30 Å²	30	66.1 Å²	66.1	21%	0.21	35%	0.353	C	S	.	.	S	Bend	trans	-153.5	170	177.9	62.1	0	0	0	0	112.1	R52 W53	S34-R52 VanDerWaalsContact O-CZ 3.28Å; S34-R52 PolarHBondContact O-NE 2.81Å; S34-R52 PolarHBondContact O-NH2 3.06Å; S34-W53 PolarHBondContact N-O 3.21Å; S34-W53 WeakPolarHBondContact OG-CA 3.3Å; S34-W53 VanDerWaalsContact OG-CB 3.24Å; S34-W53 WeakPolarHBondContact OG-CB 3.34Å; S34-W53 PolarHBondContact OG-N 2.82Å
35	T	67	Low	68.9	Low	12 Å²	12	66 Å²	66	7%	0.074	35%	0.348	C	S	.	.			trans	-81.8	167.4	175.3	70.1	0	0	0	0	112	K37 R52 V202 E226	T35-K37 PolarHBondContact O-N 3.35Å; T35-K37 WeakPolarHBondContact OG1-CE 3.17Å; T35-R52 VanDerWaalsContact O-CB 3.28Å; T35-R52 WeakPolarHBondContact O-CB 3.27Å; T35-V202 HydrophobicContact CG2-CB 4.08Å; T35-V202 HydrophobicContact CG2-CG1 3.57Å; T35-E226 WeakPolarHBondContact CB-OE1 3.44Å; T35-E226 HydrophobicContact CG2-CG 4.22Å; T35-E226 VanDerWaalsContact CG2-OE1 3.22Å; T35-E226 WeakPolarHBondContact CG2-OE1 3.17Å; T35-E226 WeakPolarHBondContact CG2-OE2 3.13Å; T35-E226 PolarHBondContact OG1-OE1 3.03Å
36	C	75.3	Confident	72	Confident	24 Å²	24	61.7 Å²	61.7	16%	0.162	33%	0.325	C	S	.	.			trans	-71.6	121	177	-171.2	0	0	0	0	109.7	C129	C36-C129 VanDerWaalsContact CA-SG 3.52Å; C36-C129 HydrophobicContact CB-CB 4.01Å; C36-C129 WeakPolarHBondContact CB-SG 3.42Å; C36-C129 WeakPolarHBondContact SG-CB 3.48Å; C36-C129 CovalentContact SG-SG 2.02Å; C36-C129 PolarHBondContact SG-SG 3.47Å
37	K	79.8	Confident	74.5	Confident	132 Å²	132	64.2 Å²	64.2	57%	0.574	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135	152	-178.2	-65.8	-171.1	-179.4	-175.6	0	111.3	T35 C39 Y50 S51	T35-K37 PolarHBondContact O-N 3.35Å; T35-K37 WeakPolarHBondContact OG1-CE 3.17Å; K37-C39 PolarHBondContact O-N 3.23Å; K37-Y50 WeakPolarHBondContact O-CA 3.02Å; K37-S51 PolarHBondContact N-O 3.33Å; K37-S51 PolarHBondContact O-N 2.67Å; K37-S51 VanDerWaalsContact O-O 3.08Å
38	W	84.4	Confident	76.4	Confident	134 Å²	134	62 Å²	62	51%	0.508	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	137.2	168.2	-175.4	-94.6	0	0	0	109.8	N49 Y50	W38-N49 CarbonylContact C-O 3.5Å; W38-N49 WeakPolarHBondContact CA-O 3.17Å; W38-N49 HydrophobicContact CD2-CB 4.27Å; W38-N49 HydrophobicContact CE3-CB 3.71Å; W38-N49 HydrophobicContact CH2-CB 3.49Å; W38-N49 VanDerWaalsContact CH2-CB 3.49Å; W38-N49 WeakPolarHBondContact CH2-ND2 3.26Å; W38-N49 HydrophobicContact CZ2-CB 4.01Å; W38-N49 HydrophobicContact CZ3-CB 3.3Å; W38-Y50 HydrophobicContact CB-CE1 4.24Å; W38-Y50 AromaticContact CE3-CD2 3.83Å; W38-Y50 HydrophobicContact CE3-CD2 3.83Å; W38-Y50 HydrophobicContact CE3-CE1 4.26Å; W38-Y50 AromaticContact CE3-CE2 3.36Å; W38-Y50 HydrophobicContact CE3-CE2 3.36Å; W38-Y50 HydrophobicContact CE3-CG 4.46Å; W38-Y50 AromaticContact CE3-CZ 3.6Å; W38-Y50 HydrophobicContact CZ3-CD2 4.13Å; W38-Y50 AromaticContact CZ3-CE2 3.61Å; W38-Y50 HydrophobicContact CZ3-CE2 3.61Å
39	C	84.5	Confident	78.4	Confident	12 Å²	12	59.2 Å²	59.2	8%	0.081	32%	0.324	C	S	.	.			trans	-130.9	98.8	-178.6	173.2	0	0	0	0	108.8	K37 N41 C42 N49 S51	K37-C39 PolarHBondContact O-N 3.23Å; C39-N41 PolarHBondContact O-N 2.93Å; C39-N41 VanDerWaalsContact O-N 3.16Å; C39-C42 HydrophobicContact CB-CB 3.61Å; C39-C42 WeakPolarHBondContact CB-SG 3.3Å; C39-C42 WeakPolarHBondContact O-CB 3.37Å; C39-C42 PolarHBondContact O-N 2.89Å; C39-C42 WeakPolarHBondContact SG-CB 3.38Å; C39-C42 PolarHBondContact SG-N 2.86Å; C39-C42 VanDerWaalsContact SG-N 3.37Å; C39-C42 CovalentContact SG-SG 2.02Å; C39-C42 PolarHBondContact SG-SG 2.88Å; C39-N49 PolarHBondContact N-O 3.33Å; C39-S51 VanDerWaalsContact CB-OG 3.31Å; C39-S51 WeakPolarHBondContact CB-OG 3.3Å
40	T	81.5	Confident	79.7	Confident	113 Å²	113	63.3 Å²	63.3	69%	0.693	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-34.7	-174	-41.6	0	0	0	0	112.8
41	N	82.7	Confident	80.6	Confident	71 Å²	71	62.8 Å²	62.8	38%	0.38	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	1.3	-177.8	-62.1	-11.8	0	0	0	113.4	C39 I43 T44 P87 F90	C39-N41 PolarHBondContact O-N 2.93Å; C39-N41 VanDerWaalsContact O-N 3.16Å; N41-I43 VanDerWaalsContact C-N 3.34Å; N41-I43 PolarHBondContact O-N 2.02Å; N41-T44 PolarHBondContact O-OG1 3.02Å; N41-P87 PolarHBondContact ND2-O 3.01Å; N41-P87 VanDerWaalsContact ND2-O 3.11Å; N41-F90 HydrophobicContact CB-CZ 4.42Å; N41-F90 WeakPolarHBondContact O-CZ 3.48Å
42	C	84.9	Confident	81.4	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-69.9	-30.5	-172.5	-82.3	0	0	0	0	113.3	C39 T44 N45 M46 C48 S51	C39-C42 HydrophobicContact CB-CB 3.61Å; C39-C42 WeakPolarHBondContact CB-SG 3.3Å; C39-C42 WeakPolarHBondContact O-CB 3.37Å; C39-C42 PolarHBondContact O-N 2.89Å; C39-C42 WeakPolarHBondContact SG-CB 3.38Å; C39-C42 PolarHBondContact SG-N 2.86Å; C39-C42 VanDerWaalsContact SG-N 3.37Å; C39-C42 CovalentContact SG-SG 2.02Å; C39-C42 PolarHBondContact SG-SG 2.88Å; C42-T44 PolarHBondContact O-N 2.95Å; C42-N45 PolarHBondContact O-N 3.04Å; C42-M46 HydrophobicContact CB-CB 4.28Å; C42-M46 HydrophobicContact CB-SD 4.16Å; C42-M46 WeakPolarHBondContact O-CA 3.45Å; C42-M46 VanDerWaalsContact O-CB 3.28Å; C42-M46 WeakPolarHBondContact O-CB 3.43Å; C42-M46 PolarHBondContact O-N 2.86Å; C42-C48 VanDerWaalsContact CB-O 3.27Å; C42-C48 WeakPolarHBondContact CB-O 3.31Å; C42-S51 PolarHBondContact SG-OG 3.2Å
43	I	80.1	Confident	82.2	Confident	107 Å²	107	58.1 Å²	58.1	55%	0.549	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-58.8	-26.4	-177.7	-62.6	171.2	0	0	0	112.8	N41 M46 N49	N41-I43 VanDerWaalsContact C-N 3.34Å; N41-I43 PolarHBondContact O-N 2.02Å; I43-M46 WeakPolarHBondContact CA-O 3.5Å; I43-N49 WeakPolarHBondContact CD1-OD1 3.48Å; I43-N49 WeakPolarHBondContact CG1-OD1 3.48Å
44	T	80.9	Confident	82.7	Confident	111 Å²	111	55 Å²	55	68%	0.681	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-74.2	-26.9	-179.5	59	0	0	0	0	113	N41 C42	N41-T44 PolarHBondContact O-OG1 3.02Å; C42-T44 PolarHBondContact O-N 2.95Å
45	N	85.7	Confident	83.1	Confident	51 Å²	51	53.8 Å²	53.8	27%	0.273	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-7.4	-173.7	-80	-40.1	0	0	0	114.1	C42 F90 S106 K107	C42-N45 PolarHBondContact O-N 3.04Å; N45-F90 HydrophobicContact CB-CD1 4.34Å; N45-F90 HydrophobicContact CB-CE1 4.05Å; N45-F90 HydrophobicContact CB-CE2 4.3Å; N45-F90 HydrophobicContact CB-CZ 4.03Å; N45-F90 VanDerWaalsContact ND2-CE2 3.28Å; N45-F90 WeakPolarHBondContact ND2-CE2 3.45Å; N45-S106 PolarHBondContact ND2-O 3.47Å; N45-S106 VanDerWaalsContact ND2-O 3.09Å; N45-K107 VanDerWaalsContact OD1-CE 3.24Å; N45-K107 WeakPolarHBondContact OD1-CE 3.37Å
46	M	89.8	Confident	83.8	Confident	25 Å²	25	53.7 Å²	53.7	12%	0.123	28%	0.282	C	S	.	.	S	Bend	trans	-140.8	155.8	-175.3	-56.2	179.1	69.1	0	0	110	C42 I43 C48 F90 P108 R126 I127	C42-M46 HydrophobicContact CB-CB 4.28Å; C42-M46 HydrophobicContact CB-SD 4.16Å; C42-M46 WeakPolarHBondContact O-CA 3.45Å; C42-M46 VanDerWaalsContact O-CB 3.28Å; C42-M46 WeakPolarHBondContact O-CB 3.43Å; C42-M46 PolarHBondContact O-N 2.86Å; I43-M46 WeakPolarHBondContact CA-O 3.5Å; M46-C48 PolarHBondContact O-N 3.4Å; M46-F90 HydrophobicContact CG-CD1 4.42Å; M46-F90 HydrophobicContact CG-CE1 4.46Å; M46-F90 HydrophobicContact SD-CD1 4.01Å; M46-F90 HydrophobicContact SD-CE1 4.22Å; M46-P108 HydrophobicContact CG-CG 4.03Å; M46-R126 HydrophobicContact CE-CB 4.08Å; M46-R126 HydrophobicContact SD-CB 3.81Å; M46-I127 VanDerWaalsContact CE-C 3.41Å
47	S	86.7	Confident	84.1	Confident	115 Å²	115	55 Å²	55	80%	0.804	28%	0.284	S	S	*	.	S	Bend	trans	-84.8	18.1	-179.7	50	0	0	0	0	114.1
48	C	83.9	Confident	84.4	Confident	16 Å²	16	48.7 Å²	48.7	11%	0.108	26%	0.257	C	S	.	.			trans	-149.3	157.8	-171.6	63	0	0	0	0	113	C42 M46 Y50 C128	C42-C48 VanDerWaalsContact CB-O 3.27Å; C42-C48 WeakPolarHBondContact CB-O 3.31Å; M46-C48 PolarHBondContact O-N 3.4Å; C48-Y50 PolarHBondContact SG-O 2.73Å; C48-C128 HydrophobicContact CB-CB 3.69Å; C48-C128 WeakPolarHBondContact CB-SG 3.24Å; C48-C128 WeakPolarHBondContact SG-CA 3.41Å; C48-C128 WeakPolarHBondContact SG-CB 3.36Å; C48-C128 CovalentContact SG-SG 2.03Å; C48-C128 PolarHBondContact SG-SG 3.34Å
49	N	87.9	Confident	84.5	Confident	58 Å²	58	43.3 Å²	43.3	31%	0.31	24%	0.238	S	C	.	.	S	Bend	trans	-100.5	-21.1	178.3	-53.1	-5.2	0	0	0	112.1	W38 C39 I43	W38-N49 CarbonylContact C-O 3.5Å; W38-N49 WeakPolarHBondContact CA-O 3.17Å; W38-N49 HydrophobicContact CD2-CB 4.27Å; W38-N49 HydrophobicContact CE3-CB 3.71Å; W38-N49 HydrophobicContact CH2-CB 3.49Å; W38-N49 VanDerWaalsContact CH2-CB 3.49Å; W38-N49 WeakPolarHBondContact CH2-ND2 3.26Å; W38-N49 HydrophobicContact CZ2-CB 4.01Å; W38-N49 HydrophobicContact CZ3-CB 3.3Å; C39-N49 PolarHBondContact N-O 3.33Å; I43-N49 WeakPolarHBondContact CD1-OD1 3.48Å; I43-N49 WeakPolarHBondContact CG1-OD1 3.48Å
50	Y	84.3	Confident	84.7	Confident	131 Å²	131	43 Å²	43	51%	0.514	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	116.9	175.7	-76.9	-89.2	0	0	0	109.2	K37 W38 C48 C129	K37-Y50 WeakPolarHBondContact O-CA 3.02Å; W38-Y50 HydrophobicContact CB-CE1 4.24Å; W38-Y50 AromaticContact CE3-CD2 3.83Å; W38-Y50 HydrophobicContact CE3-CD2 3.83Å; W38-Y50 HydrophobicContact CE3-CE1 4.26Å; W38-Y50 AromaticContact CE3-CE2 3.36Å; W38-Y50 HydrophobicContact CE3-CE2 3.36Å; W38-Y50 HydrophobicContact CE3-CG 4.46Å; W38-Y50 AromaticContact CE3-CZ 3.6Å; W38-Y50 HydrophobicContact CZ3-CD2 4.13Å; W38-Y50 AromaticContact CZ3-CE2 3.61Å; W38-Y50 HydrophobicContact CZ3-CE2 3.61Å; C48-Y50 PolarHBondContact SG-O 2.73Å; Y50-C129 PolarHBondContact O-N 3.36Å
51	S	86.8	Confident	85.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	164.9	179.9	66.2	0	0	0	0	110.7	K37 C39 C42 R126 I127	K37-S51 PolarHBondContact N-O 3.33Å; K37-S51 PolarHBondContact O-N 2.67Å; K37-S51 VanDerWaalsContact O-O 3.08Å; C39-S51 VanDerWaalsContact CB-OG 3.31Å; C39-S51 WeakPolarHBondContact CB-OG 3.3Å; C42-S51 PolarHBondContact SG-OG 3.2Å; S51-R126 PolarHBondContact OG-NH1 3.43Å; S51-I127 VanDerWaalsContact CA-O 3.24Å; S51-I127 WeakPolarHBondContact CA-O 3.36Å; S51-I127 WeakPolarHBondContact CB-O 3.11Å
52	R	86.1	Confident	85.3	Confident	8 Å²	8	43.4 Å²	43.4	3%	0.03	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	163.2	168.4	67.1	-164.3	-55.1	-170.3	9.2	110.6	S34 T35 R126 I127 I132	S34-R52 VanDerWaalsContact O-CZ 3.28Å; S34-R52 PolarHBondContact O-NE 2.81Å; S34-R52 PolarHBondContact O-NH2 3.06Å; T35-R52 VanDerWaalsContact O-CB 3.28Å; T35-R52 WeakPolarHBondContact O-CB 3.27Å; R52-R126 WeakPolarHBondContact O-CA 3.28Å; R52-I127 HydrophobicContact CG-CG2 4.13Å; R52-I127 PolarHBondContact N-O 2.73Å; R52-I127 PolarHBondContact O-N 3.19Å; R52-I132 VanDerWaalsContact CD-CD1 3.48Å; R52-I132 HydrophobicContact CG-CD1 3.65Å
53	W	87.2	Confident	85.7	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.015	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	134.5	173.1	-66.8	88.2	0	0	0	111.6	L33 S34 L80 C83 L84 F90 F92 R126	L33-W53 HydrophobicContact CB-CB 3.9Å; L33-W53 PolarHBondContact N-O 3.05Å; S34-W53 PolarHBondContact N-O 3.21Å; S34-W53 WeakPolarHBondContact OG-CA 3.3Å; S34-W53 VanDerWaalsContact OG-CB 3.24Å; S34-W53 WeakPolarHBondContact OG-CB 3.34Å; S34-W53 PolarHBondContact OG-N 2.82Å; W53-L80 HydrophobicContact CB-CD1 4.11Å; W53-L80 HydrophobicContact CD2-CD1 3.71Å; W53-L80 HydrophobicContact CE3-CD1 4.03Å; W53-L80 HydrophobicContact CG-CD1 3.73Å; W53-C83 HydrophobicContact CH2-CB 4.22Å; W53-C83 WeakPolarHBondContact CH2-SG 3.35Å; W53-L84 HydrophobicContact CZ2-CD2 4.5Å; W53-F90 VanDerWaalsContact CH2-C 3.42Å; W53-F90 WeakPolarHBondContact CH2-O 2.98Å; W53-F90 WeakPolarHBondContact CZ3-O 3.37Å; W53-F92 HydrophobicContact CE3-CD1 4.39Å; W53-F92 HydrophobicContact CE3-CE1 4.06Å; W53-F92 AromaticContact CZ3-CD1 3.9Å; W53-F92 HydrophobicContact CZ3-CD1 3.9Å; W53-F92 HydrophobicContact CZ3-CE1 4.05Å; W53-R126 HydrophobicContact CD2-CG 3.82Å; W53-R126 VanDerWaalsContact CE2-CG 3.47Å; W53-R126 HydrophobicContact CE3-CG 4.16Å; W53-R126 HydrophobicContact CG-CG 4.46Å; W53-R126 HydrophobicContact CH2-CG 3.75Å; W53-R126 HydrophobicContact CZ2-CG 3.46Å; W53-R126 VanDerWaalsContact CZ2-CG 3.46Å; W53-R126 VanDerWaalsContact CZ2-NE 3.28Å; W53-R126 HydrophobicContact CZ3-CG 4.14Å; W53-R126 VanDerWaalsContact NE1-CZ 3.3Å
54	I	83.6	Confident	86.3	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150	169.2	52.3	176	0	0	0	110.8	L30 T31 L32 P111 G124 T125 I127 I132	L30-I54 HydrophobicContact CD2-CD1 3.82Å; L30-I54 HydrophobicContact CD2-CG1 4.46Å; T31-I54 CarbonylContact O-C 3.46Å; T31-I54 WeakPolarHBondContact O-CA 3.5Å; T31-I54 WeakPolarHBondContact O-CB 3.06Å; L32-I54 HydrophobicContact CD2-CG2 3.75Å; I54-P111 HydrophobicContact CD1-CB 4.5Å; I54-P111 HydrophobicContact CD1-CG 3.7Å; I54-G124 CarbonylContact O-C 3.54Å; I54-G124 VanDerWaalsContact O-CA 3.28Å; I54-G124 WeakPolarHBondContact O-CA 3.08Å; I54-T125 HydrophobicContact CD1-CG2 4.14Å; I54-T125 HydrophobicContact CG1-CG2 3.77Å; I54-T125 WeakPolarHBondContact CG1-O 3.45Å; I54-T125 PolarHBondContact N-O 3Å; I54-T125 PolarHBondContact O-N 3.21Å; I54-I127 HydrophobicContact CD1-CB 4Å; I54-I127 HydrophobicContact CD1-CD1 3.97Å; I54-I127 HydrophobicContact CD1-CG2 3.74Å; I54-I127 HydrophobicContact CG1-CB 4.41Å; I54-I127 HydrophobicContact CG1-CG2 3.95Å; I54-I127 HydrophobicContact CG2-CG2 4.03Å; I54-I132 HydrophobicContact CG2-CD1 3.55Å
55	G	82.4	Confident	86.8	Confident	4 Å²	4	39.5 Å²	39.5	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	150.3	172.7	0	0	0	0	0	110.1	L30 T31 L123	L30-G55 CarbonylContact C-O 3.41Å; L30-G55 VanDerWaalsContact CA-O 3.27Å; L30-G55 WeakPolarHBondContact CA-O 3.41Å; L30-G55 WeakPolarHBondContact CD2-O 3.39Å; T31-G55 PolarHBondContact N-O 3.08Å; T31-G55 PolarHBondContact O-N 3.17Å; T31-G55 WeakPolarHBondContact OG1-CA 3.35Å; G55-L123 CarbonylContact C-O 3.47Å; G55-L123 WeakPolarHBondContact CA-O 3.27Å
56	A	81	Confident	87	Confident	9 Å²	9	42.3 Å²	42.3	7%	0.074	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	-178.1	173.9	0	0	0	0	0	108.6	L30 P111 L123	L30-A56 HydrophobicContact CD2-CB 3.81Å; A56-P111 HydrophobicContact CB-CB 4.13Å; A56-L123 HydrophobicContact CB-CB 4.32Å; A56-L123 HydrophobicContact CB-CD2 4.17Å; A56-L123 HydrophobicContact CB-CG 4.47Å; A56-L123 PolarHBondContact N-O 2.89Å; A56-L123 PolarHBondContact O-N 3.35Å
57	W	81.9	Confident	87.3	Confident	51 Å²	51	46.3 Å²	46.3	19%	0.193	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	137.7	175.5	-65.8	90.3	0	0	0	111.6	R27 T96 L115 R118 E122	R27-W57 HydrophobicContact CB-CB 4.4Å; R27-W57 HydrophobicContact CB-CG 4.42Å; R27-W57 HydrophobicContact CG-CG 4.28Å; W57-T96 HydrophobicContact CE3-CG2 4.43Å; W57-T96 HydrophobicContact CH2-CG2 4.43Å; W57-T96 HydrophobicContact CZ3-CG2 3.57Å; W57-L115 WeakPolarHBondContact O-CD1 3.34Å; W57-R118 HydrophobicContact CB-CB 4.41Å; W57-R118 VanDerWaalsContact CB-O 3.27Å; W57-R118 WeakPolarHBondContact CB-O 3.45Å; W57-E122 HydrophobicContact CE3-CG 4.02Å; W57-E122 HydrophobicContact CH2-CG 3.73Å; W57-E122 WeakPolarHBondContact CH2-OE1 3.41Å; W57-E122 HydrophobicContact CZ2-CG 4.43Å; W57-E122 HydrophobicContact CZ3-CG 3.5Å
58	G	86.2	Confident	87.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	114.3	177	174.6	0	0	0	0	0	115	Y116 F121 L123	G58-Y116 CarbonylContact C-O 3.07Å; G58-Y116 WeakPolarHBondContact CA-O 3.48Å; G58-F121 PolarHBondContact N-O 2.97Å; G58-L123 WeakPolarHBondContact O-CB 3.24Å
59	L	87.5	Confident	88.3	Confident	22 Å²	22	46.4 Å²	46.4	12%	0.115	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-104.8	143.1	176.3	-86.2	156.1	0	0	0	110.1	I65 T93 L115 Y116 N117 F121	L59-I65 HydrophobicContact CD2-CD1 4.15Å; L59-T93 HydrophobicContact CD2-CG2 4.19Å; L59-L115 CarbonylContact O-C 3.58Å; L59-L115 VanDerWaalsContact O-CA 3.32Å; L59-L115 WeakPolarHBondContact O-CA 3.35Å; L59-Y116 PolarHBondContact N-O 2.81Å; L59-Y116 PolarHBondContact O-N 2.89Å; L59-N117 HydrophobicContact CD1-CB 4.21Å; L59-F121 HydrophobicContact CD1-CB 4.43Å; L59-F121 HydrophobicContact CD1-CD1 3.83Å; L59-F121 HydrophobicContact CD1-CD2 3.23Å; L59-F121 HydrophobicContact CD1-CE1 3.82Å; L59-F121 HydrophobicContact CD1-CE2 3.26Å; L59-F121 HydrophobicContact CD1-CG 3.55Å; L59-F121 HydrophobicContact CD1-CZ 3.57Å; L59-F121 HydrophobicContact CD2-CD1 3.91Å; L59-F121 HydrophobicContact CD2-CE1 4.14Å; L59-F121 HydrophobicContact CD2-CG 4.2Å; L59-F121 HydrophobicContact CG-CB 3.95Å; L59-F121 HydrophobicContact CG-CD1 3.74Å; L59-F121 HydrophobicContact CG-CD2 3.73Å; L59-F121 HydrophobicContact CG-CE1 4.16Å; L59-F121 HydrophobicContact CG-CE2 4.19Å; L59-F121 HydrophobicContact CG-CG 3.5Å; L59-F121 HydrophobicContact CG-CZ 4.39Å
60	P	88.6	Confident	88.5	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.039	24%	0.236	C	C	.	.			trans	-63.4	165.4	166.1	29.5	-32.6	0	0	0	110.8	F64 I65 V109	P60-F64 HydrophobicContact CB-CB 3.96Å; P60-F64 HydrophobicContact CB-CD1 3.57Å; P60-F64 HydrophobicContact CB-CE1 4.28Å; P60-F64 HydrophobicContact CB-CG 3.82Å; P60-F64 HydrophobicContact CG-CD1 3.6Å; P60-F64 HydrophobicContact CG-CE1 4.15Å; P60-F64 HydrophobicContact CG-CG 4.35Å; P60-I65 HydrophobicContact CG-CG1 3.92Å; P60-V109 HydrophobicContact CB-CG1 4.13Å; P60-V109 HydrophobicContact CB-CG2 3.91Å; P60-V109 HydrophobicContact CG-CG2 4.03Å
61	N	88.7	Confident	89	Confident	73 Å²	73	41.9 Å²	41.9	39%	0.39	23%	0.225	S	C	.	.			trans	-64.1	160.5	178.4	71.2	23.2	0	0	0	111.9	S63 F64 I65 Y116	N61-S63 VanDerWaalsContact C-N 3.29Å; N61-S63 PolarHBondContact O-N 3.13Å; N61-S63 PolarHBondContact OD1-N 3.4Å; N61-F64 WeakPolarHBondContact O-CB 3.37Å; N61-F64 PolarHBondContact O-N 2.99Å; N61-F64 VanDerWaalsContact OD1-CB 3.24Å; N61-F64 WeakPolarHBondContact OD1-CB 3.37Å; N61-F64 PolarHBondContact OD1-N 3.06Å; N61-I65 PolarHBondContact O-N 3.41Å; N61-I65 VanDerWaalsContact O-N 3.11Å; N61-Y116 HydrophobicContact CB-CD2 4.24Å; N61-Y116 HydrophobicContact CB-CE2 3.62Å
62	Q	88.2	Confident	89.4	Confident	118 Å²	118	46 Å²	46	55%	0.551	25%	0.249	S	C	*	.	H	α-helix	trans	-58.7	-40.8	-175.9	-169	60.8	41.6	0	0	112.5	F64 I65 D66	Q62-F64 VanDerWaalsContact C-N 3.25Å; Q62-F64 PolarHBondContact O-N 2.76Å; Q62-I65 WeakPolarHBondContact O-CB 3.36Å; Q62-I65 PolarHBondContact O-N 2.69Å; Q62-D66 PolarHBondContact NE2-OD1 3.36Å; Q62-D66 VanDerWaalsContact O-CG 3.24Å; Q62-D66 PolarHBondContact O-N 2.66Å
63	S	91.9	Very high	89.8	Confident	72 Å²	72	47.9 Å²	47.9	50%	0.503	26%	0.262	S	S	.	.	H	α-helix	trans	-58.4	-37	177.3	-179.3	0	0	0	0	112.9	N61 N67	N61-S63 VanDerWaalsContact C-N 3.29Å; N61-S63 PolarHBondContact O-N 3.13Å; N61-S63 PolarHBondContact OD1-N 3.4Å; S63-N67 WeakPolarHBondContact O-CB 3.45Å; S63-N67 PolarHBondContact O-N 3.42Å; S63-N67 PolarHBondContact O-ND2 3.19Å
64	F	92.4	Very high	90	Very high	29 Å²	29	57.9 Å²	57.9	13%	0.127	30%	0.299	C	S	.	.	H	α-helix	trans	-69.3	-44.4	174.8	-175.5	-77.7	0	0	0	111.1	P60 N61 Q62 D66 N67 Y68 Y105 K107 V109	P60-F64 HydrophobicContact CB-CB 3.96Å; P60-F64 HydrophobicContact CB-CD1 3.57Å; P60-F64 HydrophobicContact CB-CE1 4.28Å; P60-F64 HydrophobicContact CB-CG 3.82Å; P60-F64 HydrophobicContact CG-CD1 3.6Å; P60-F64 HydrophobicContact CG-CE1 4.15Å; P60-F64 HydrophobicContact CG-CG 4.35Å; N61-F64 WeakPolarHBondContact O-CB 3.37Å; N61-F64 PolarHBondContact O-N 2.99Å; N61-F64 VanDerWaalsContact OD1-CB 3.24Å; N61-F64 WeakPolarHBondContact OD1-CB 3.37Å; N61-F64 PolarHBondContact OD1-N 3.06Å; Q62-F64 VanDerWaalsContact C-N 3.25Å; Q62-F64 PolarHBondContact O-N 2.76Å; F64-D66 VanDerWaalsContact C-N 3.33Å; F64-D66 PolarHBondContact O-N 3.45Å; F64-N67 PolarHBondContact O-N 2.68Å; F64-Y68 HydrophobicContact CB-CD2 4.36Å; F64-Y68 HydrophobicContact CD1-CD2 4.18Å; F64-Y68 AromaticContact CD2-CD2 3.53Å; F64-Y68 HydrophobicContact CD2-CD2 3.53Å; F64-Y68 AromaticContact CD2-CE2 3.91Å; F64-Y68 HydrophobicContact CD2-CE2 3.91Å; F64-Y68 HydrophobicContact CE1-CD2 4.31Å; F64-Y68 AromaticContact CE2-CD2 3.71Å; F64-Y68 HydrophobicContact CE2-CD2 3.71Å; F64-Y68 HydrophobicContact CE2-CE2 4.21Å; F64-Y68 HydrophobicContact CE2-CG 4.44Å; F64-Y68 AromaticContact CG-CD2 3.78Å; F64-Y68 HydrophobicContact CG-CD2 3.78Å; F64-Y68 HydrophobicContact CG-CE2 4.44Å; F64-Y68 HydrophobicContact CZ-CD2 4.09Å; F64-Y68 HydrophobicContact CZ-CG 4.46Å; F64-Y68 WeakPolarHBondContact O-CB 3.47Å; F64-Y68 WeakPolarHBondContact O-CD2 3.38Å; F64-Y68 PolarHBondContact O-N 2.76Å; F64-Y105 HydrophobicContact CD1-CD1 4.31Å; F64-Y105 AromaticContact CE1-CD1 3.94Å; F64-Y105 HydrophobicContact CE1-CD1 3.94Å; F64-Y105 HydrophobicContact CE1-CD2 4.49Å; F64-Y105 AromaticContact CE1-CG 3.9Å; F64-Y105 HydrophobicContact CE1-CG 3.9Å; F64-K107 HydrophobicContact CE2-CB 4.26Å; F64-K107 HydrophobicContact CZ-CB 4.14Å; F64-V109 HydrophobicContact CD1-CG2 4.07Å; F64-V109 HydrophobicContact CE1-CG2 3.37Å; F64-V109 HydrophobicContact CE2-CG2 4.04Å; F64-V109 HydrophobicContact CZ-CB 4.32Å; F64-V109 HydrophobicContact CZ-CG2 3.36Å
65	I	91.4	Very high	90.2	Very high	35 Å²	35	58.3 Å²	58.3	18%	0.179	30%	0.302	C	S	.	.	H	α-helix	trans	-57.7	-48.9	178.3	-64.6	172	0	0	0	109.8	L59 P60 N61 Q62 N67 T69 Y105	L59-I65 HydrophobicContact CD2-CD1 4.15Å; P60-I65 HydrophobicContact CG-CG1 3.92Å; N61-I65 PolarHBondContact O-N 3.41Å; N61-I65 VanDerWaalsContact O-N 3.11Å; Q62-I65 WeakPolarHBondContact O-CB 3.36Å; Q62-I65 PolarHBondContact O-N 2.69Å; I65-N67 VanDerWaalsContact C-N 3.34Å; I65-N67 PolarHBondContact O-N 2.76Å; I65-T69 VanDerWaalsContact O-CB 3.3Å; I65-T69 WeakPolarHBondContact O-CB 3.05Å; I65-T69 PolarHBondContact O-N 2.76Å; I65-T69 PolarHBondContact O-OG1 2.89Å; I65-Y105 HydrophobicContact CG1-CE1 4.28Å
66	D	91.8	Very high	90.2	Very high	111 Å²	111	64.3 Å²	64.3	59%	0.594	34%	0.344	S	S	*	.	H	α-helix	trans	-65.2	-37.5	-175.8	-62.4	-21.8	0	0	0	112.5	Q62 F64	Q62-D66 PolarHBondContact NE2-OD1 3.36Å; Q62-D66 VanDerWaalsContact O-CG 3.24Å; Q62-D66 PolarHBondContact O-N 2.66Å; F64-D66 VanDerWaalsContact C-N 3.33Å; F64-D66 PolarHBondContact O-N 3.45Å
67	N	94.5	Very high	90.3	Very high	109 Å²	109	66.7 Å²	66.7	58%	0.583	36%	0.36	S	S	*	.	H	α-helix	trans	-89.1	-24.6	-172.7	-71.2	-44.4	0	0	0	114.4	S63 F64 I65	S63-N67 WeakPolarHBondContact O-CB 3.45Å; S63-N67 PolarHBondContact O-N 3.42Å; S63-N67 PolarHBondContact O-ND2 3.19Å; F64-N67 PolarHBondContact O-N 2.68Å; I65-N67 VanDerWaalsContact C-N 3.34Å; I65-N67 PolarHBondContact O-N 2.76Å
68	Y	95.3	Very high	90.6	Very high	77 Å²	77	66.3 Å²	66.3	30%	0.302	36%	0.364	S	S	.	.	H	α-helix	trans	-123.3	1	-168.7	-55.9	-62.6	0	0	0	114.4	F64 L70 Y105 S106 K107	F64-Y68 HydrophobicContact CB-CD2 4.36Å; F64-Y68 HydrophobicContact CD1-CD2 4.18Å; F64-Y68 AromaticContact CD2-CD2 3.53Å; F64-Y68 HydrophobicContact CD2-CD2 3.53Å; F64-Y68 AromaticContact CD2-CE2 3.91Å; F64-Y68 HydrophobicContact CD2-CE2 3.91Å; F64-Y68 HydrophobicContact CE1-CD2 4.31Å; F64-Y68 AromaticContact CE2-CD2 3.71Å; F64-Y68 HydrophobicContact CE2-CD2 3.71Å; F64-Y68 HydrophobicContact CE2-CE2 4.21Å; F64-Y68 HydrophobicContact CE2-CG 4.44Å; F64-Y68 AromaticContact CG-CD2 3.78Å; F64-Y68 HydrophobicContact CG-CD2 3.78Å; F64-Y68 HydrophobicContact CG-CE2 4.44Å; F64-Y68 HydrophobicContact CZ-CD2 4.09Å; F64-Y68 HydrophobicContact CZ-CG 4.46Å; F64-Y68 WeakPolarHBondContact O-CB 3.47Å; F64-Y68 WeakPolarHBondContact O-CD2 3.38Å; F64-Y68 PolarHBondContact O-N 2.76Å; Y68-L70 PolarHBondContact O-N 2.84Å; Y68-Y105 CarbonylContact O-C 3.52Å; Y68-Y105 WeakPolarHBondContact O-CA 3.38Å; Y68-Y105 WeakPolarHBondContact O-CB 3.11Å; Y68-S106 PolarHBondContact O-N 2.93Å; Y68-S106 PolarHBondContact O-OG 3.25Å; Y68-K107 HydrophobicContact CD1-CB 3.99Å; Y68-K107 HydrophobicContact CD1-CD 4.07Å; Y68-K107 HydrophobicContact CD1-CG 3.6Å; Y68-K107 HydrophobicContact CD2-CB 4.49Å; Y68-K107 HydrophobicContact CE1-CB 4.4Å; Y68-K107 HydrophobicContact CE1-CD 3.66Å; Y68-K107 HydrophobicContact CE1-CG 3.75Å; Y68-K107 HydrophobicContact CG-CB 4.03Å; Y68-K107 HydrophobicContact CG-CG 4.18Å
69	T	95.9	Very high	90.8	Very high	56 Å²	56	66.6 Å²	66.6	34%	0.344	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	123.9	175.9	-63.9	0	0	0	0	110.9	I65 T103 Y105	I65-T69 VanDerWaalsContact O-CB 3.3Å; I65-T69 WeakPolarHBondContact O-CB 3.05Å; I65-T69 PolarHBondContact O-N 2.76Å; I65-T69 PolarHBondContact O-OG1 2.89Å; T69-T103 HydrophobicContact CG2-CG2 3.94Å; T69-Y105 WeakPolarHBondContact OG1-CE1 3.03Å
70	L	93.4	Very high	90.9	Very high	68 Å²	68	67 Å²	67	36%	0.356	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-37	170.6	-70.7	170.5	0	0	0	111.4	Y68 L88 C89 L104	Y68-L70 PolarHBondContact O-N 2.84Å; L70-L88 HydrophobicContact CD1-CB 4.17Å; L70-L88 HydrophobicContact CD2-CB 4.29Å; L70-C89 HydrophobicContact CD1-CB 4Å; L70-L104 HydrophobicContact CB-CB 4.3Å; L70-L104 PolarHBondContact N-O 3.06Å
71	G	94.7	Very high	90.9	Very high	26 Å²	26	70.7 Å²	70.7	27%	0.268	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	164.8	171.7	179.3	0	0	0	0	0	112.7	L104	G71-L104 PolarHBondContact O-N 2.75Å
72	V	94.4	Very high	91.1	Very high	85 Å²	85	69.7 Å²	69.7	52%	0.515	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.7	172.6	-178.2	0	0	0	0	108	Q101 C102 T103	V72-Q101 HydrophobicContact CG1-CG 3.81Å; V72-C102 CarbonylContact C-O 3.54Å; V72-C102 VanDerWaalsContact CA-O 3.29Å; V72-C102 WeakPolarHBondContact CA-O 3.26Å; V72-T103 HydrophobicContact CG2-CG2 4.27Å
73	V	94.1	Very high	91.3	Very high	48 Å²	48	64.1 Å²	64.1	29%	0.291	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	149.6	-179.8	-58.5	0	0	0	0	110.5	E82 C102 L104	V73-E82 HydrophobicContact CG2-CB 4.2Å; V73-E82 HydrophobicContact CG2-CG 4.1Å; V73-C102 HydrophobicContact CG2-CB 3.75Å; V73-C102 PolarHBondContact N-O 2.99Å; V73-C102 PolarHBondContact O-N 2.82Å; V73-L104 HydrophobicContact CG1-CD1 4.45Å; V73-L104 HydrophobicContact CG2-CD1 4.11Å; V73-L104 HydrophobicContact CG2-CG 4.24Å
74	R	93	Very high	91.2	Very high	215 Å²	215	65 Å²	65	81%	0.811	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	129	165.5	-74.8	-175.3	176.6	174	-0.2	108.4	T100	R74-T100 CarbonylContact C-O 3.54Å; R74-T100 WeakPolarHBondContact CA-O 3.08Å
75	T	87.1	Confident	91.1	Very high	10 Å²	10	67.7 Å²	67.7	6%	0.061	38%	0.376	C	S	.	.			trans	-121.8	145.6	-179.4	-173.1	0	0	0	0	111.6	S77 E82 T100 C102	T75-S77 VanDerWaalsContact C-N 3.27Å; T75-S77 PolarHBondContact OG1-N 3.04Å; T75-S77 PolarHBondContact OG1-OG 2.03Å; T75-E82 VanDerWaalsContact CB-CG 3.45Å; T75-E82 WeakPolarHBondContact CB-OE1 3.17Å; T75-E82 HydrophobicContact CG2-CG 3.93Å; T75-E82 WeakPolarHBondContact OG1-CG 3.13Å; T75-E82 PolarHBondContact OG1-OE1 3.3Å; T75-T100 PolarHBondContact N-O 2.81Å; T75-T100 WeakPolarHBondContact O-CB 3.44Å; T75-T100 WeakPolarHBondContact O-CG2 3.33Å; T75-C102 VanDerWaalsContact CG2-SG 3.52Å
76	S	81.7	Confident	91.1	Very high	131 Å²	131	68.3 Å²	68.3	92%	0.916	38%	0.38	S	S	*	.	S	Bend	trans	-84.8	-4.3	165	55.9	0	0	0	0	112.6
77	S	83.7	Confident	91	Very high	59 Å²	59	67.1 Å²	67.1	41%	0.413	38%	0.378	S	S	.	.	S	Bend	trans	-107.2	-120.7	-178.1	74.9	0	0	0	0	111.8	T75	T75-S77 VanDerWaalsContact C-N 3.27Å; T75-S77 PolarHBondContact OG1-N 3.04Å; T75-S77 PolarHBondContact OG1-OG 2.03Å
78	S	88	Confident	90.8	Very high	42 Å²	42	67 Å²	67	29%	0.294	38%	0.377	S	S	.	.			trans	-130.9	152.6	175.3	73.5	0	0	0	0	110.5	L80 N81 E82	S78-L80 PolarHBondContact O-N 3.23Å; S78-N81 WeakPolarHBondContact O-CB 3.31Å; S78-N81 PolarHBondContact O-N 3.35Å; S78-N81 VanDerWaalsContact OG-CG 3.29Å; S78-N81 PolarHBondContact OG-N 3.33Å; S78-N81 PolarHBondContact OG-ND2 3.41Å; S78-E82 PolarHBondContact O-N 2.86Å; S78-E82 VanDerWaalsContact O-N 3.1Å
79	C	90.4	Very high	90.8	Very high	6 Å²	6	63.5 Å²	63.5	4%	0.041	36%	0.364	C	S	.	.	H	α-helix	trans	-62.4	-28.2	176.6	-59.2	0	0	0	0	113.4	C83 F92 P99 C102	C79-C83 VanDerWaalsContact O-CB 3.29Å; C79-C83 WeakPolarHBondContact O-CB 3.17Å; C79-C83 PolarHBondContact O-N 2.02Å; C79-F92 HydrophobicContact CB-CB 4.37Å; C79-F92 HydrophobicContact CB-CD2 3.38Å; C79-F92 HydrophobicContact CB-CE2 3.74Å; C79-F92 HydrophobicContact CB-CG 3.92Å; C79-P99 PolarHBondContact SG-O 2.85Å; C79-C102 WeakPolarHBondContact CA-SG 3.34Å; C79-C102 HydrophobicContact CB-CB 3.61Å; C79-C102 WeakPolarHBondContact CB-SG 3.35Å; C79-C102 WeakPolarHBondContact SG-CA 2.87Å; C79-C102 WeakPolarHBondContact SG-CB 3.4Å; C79-C102 CovalentContact SG-SG 2.02Å; C79-C102 PolarHBondContact SG-SG 2.96Å
80	L	90.8	Very high	90.8	Very high	30 Å²	30	61 Å²	61	16%	0.157	35%	0.348	C	S	.	.	H	α-helix	trans	-61.6	-45.5	170.1	177.6	62.3	0	0	0	111.1	L33 W53 S78 C83 L84 F92	L33-L80 HydrophobicContact CB-CD2 4.18Å; W53-L80 HydrophobicContact CB-CD1 4.11Å; W53-L80 HydrophobicContact CD2-CD1 3.71Å; W53-L80 HydrophobicContact CE3-CD1 4.03Å; W53-L80 HydrophobicContact CG-CD1 3.73Å; S78-L80 PolarHBondContact O-N 3.23Å; L80-C83 PolarHBondContact O-N 3.25Å; L80-L84 HydrophobicContact CD1-CD1 4.14Å; L80-L84 HydrophobicContact CD1-CG 4.11Å; L80-L84 HydrophobicContact CG-CD1 3.95Å; L80-L84 HydrophobicContact CG-CG 4.34Å; L80-L84 WeakPolarHBondContact O-CB 3.18Å; L80-L84 VanDerWaalsContact O-CG 3.23Å; L80-L84 WeakPolarHBondContact O-CG 3.5Å; L80-L84 PolarHBondContact O-N 3.21Å; L80-F92 HydrophobicContact CB-CE1 3.82Å; L80-F92 HydrophobicContact CB-CZ 3.84Å; L80-F92 HydrophobicContact CD1-CE1 3.84Å; L80-F92 HydrophobicContact CD1-CZ 4.49Å; L80-F92 HydrophobicContact CG-CE1 4.45Å
81	N	88.4	Confident	90.9	Very high	84 Å²	84	57.8 Å²	57.8	45%	0.449	33%	0.331	S	S	.	.	H	α-helix	trans	-66.1	-40.9	-179.7	-71.5	-14.9	0	0	0	112	S78 C83 L84 S85	S78-N81 WeakPolarHBondContact O-CB 3.31Å; S78-N81 PolarHBondContact O-N 3.35Å; S78-N81 VanDerWaalsContact OG-CG 3.29Å; S78-N81 PolarHBondContact OG-N 3.33Å; S78-N81 PolarHBondContact OG-ND2 3.41Å; N81-C83 VanDerWaalsContact C-N 3.3Å; N81-C83 PolarHBondContact O-N 2.67Å; N81-L84 PolarHBondContact O-N 2.99Å; N81-S85 PolarHBondContact O-N 3.29Å; N81-S85 PolarHBondContact O-OG 3.31Å
82	E	91.6	Very high	90.9	Very high	53 Å²	53	57.2 Å²	57.2	25%	0.248	32%	0.321	C	S	.	.	H	α-helix	trans	-62.3	-38.1	173.2	-65.7	-56.2	150.7	0	0	112.5	V73 T75 S78 S85 N86 L104	V73-E82 HydrophobicContact CG2-CB 4.2Å; V73-E82 HydrophobicContact CG2-CG 4.1Å; T75-E82 VanDerWaalsContact CB-CG 3.45Å; T75-E82 WeakPolarHBondContact CB-OE1 3.17Å; T75-E82 HydrophobicContact CG2-CG 3.93Å; T75-E82 WeakPolarHBondContact OG1-CG 3.13Å; T75-E82 PolarHBondContact OG1-OE1 3.3Å; S78-E82 PolarHBondContact O-N 2.86Å; S78-E82 VanDerWaalsContact O-N 3.1Å; E82-S85 PolarHBondContact O-OG 3.41Å; E82-N86 PolarHBondContact O-N 3.31Å; E82-L104 HydrophobicContact CB-CD1 4.39Å; E82-L104 HydrophobicContact CB-CD2 4.44Å
83	C	93.1	Very high	90.9	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.007	30%	0.297	C	S	.	.	H	α-helix	trans	-73.8	-31.9	177.1	-163.8	0	0	0	0	111.8	W53 C79 L80 N81 N86 C89 F92 L104	W53-C83 HydrophobicContact CH2-CB 4.22Å; W53-C83 WeakPolarHBondContact CH2-SG 3.35Å; C79-C83 VanDerWaalsContact O-CB 3.29Å; C79-C83 WeakPolarHBondContact O-CB 3.17Å; C79-C83 PolarHBondContact O-N 2.02Å; L80-C83 PolarHBondContact O-N 3.25Å; N81-C83 VanDerWaalsContact C-N 3.3Å; N81-C83 PolarHBondContact O-N 2.67Å; C83-N86 PolarHBondContact O-N 3.41Å; C83-C89 WeakPolarHBondContact CA-SG 3.46Å; C83-C89 HydrophobicContact CB-CB 4.03Å; C83-C89 WeakPolarHBondContact CB-SG 3.28Å; C83-C89 WeakPolarHBondContact O-CB 3.48Å; C83-C89 WeakPolarHBondContact SG-CB 2.99Å; C83-C89 CovalentContact SG-SG 2.02Å; C83-C89 PolarHBondContact SG-SG 3.37Å; C83-F92 HydrophobicContact CB-CB 4.4Å; C83-F92 HydrophobicContact CB-CD1 3.86Å; C83-L104 HydrophobicContact CB-CD2 4.06Å
84	L	89.7	Confident	90.8	Very high	90 Å²	90	51 Å²	51	47%	0.471	28%	0.284	S	S	.	.	H	α-helix	trans	-70.8	-30.2	174.3	-72.9	173.8	0	0	0	113.1	W53 L80 N81 N86	W53-L84 HydrophobicContact CZ2-CD2 4.5Å; L80-L84 HydrophobicContact CD1-CD1 4.14Å; L80-L84 HydrophobicContact CD1-CG 4.11Å; L80-L84 HydrophobicContact CG-CD1 3.95Å; L80-L84 HydrophobicContact CG-CG 4.34Å; L80-L84 WeakPolarHBondContact O-CB 3.18Å; L80-L84 VanDerWaalsContact O-CG 3.23Å; L80-L84 WeakPolarHBondContact O-CG 3.5Å; L80-L84 PolarHBondContact O-N 3.21Å; N81-L84 PolarHBondContact O-N 2.99Å; L84-N86 VanDerWaalsContact C-N 3.31Å
85	S	90.2	Very high	90.7	Very high	85 Å²	85	41.7 Å²	41.7	59%	0.594	25%	0.251	S	S	*	.	H	α-helix	trans	-77	-17.7	176.3	68.3	0	0	0	0	112.9	N81 E82	N81-S85 PolarHBondContact O-N 3.29Å; N81-S85 PolarHBondContact O-OG 3.31Å; E82-S85 PolarHBondContact O-OG 3.41Å
86	N	91.3	Very high	90.6	Very high	48 Å²	48	44.1 Å²	44.1	26%	0.257	27%	0.266	S	S	.	.			trans	-101.6	109.3	176.7	-173.1	-23.6	0	0	0	111.6	E82 C83 L84 L88 C89	E82-N86 PolarHBondContact O-N 3.31Å; C83-N86 PolarHBondContact O-N 3.41Å; L84-N86 VanDerWaalsContact C-N 3.31Å; N86-L88 PolarHBondContact O-N 3.1Å; N86-L88 WeakPolarHBondContact OD1-CB 3.39Å; N86-L88 PolarHBondContact OD1-N 3.31Å; N86-C89 HydrophobicContact CB-CB 3.91Å; N86-C89 WeakPolarHBondContact O-CB 3.03Å; N86-C89 PolarHBondContact O-N 3.11Å
87	P	89.1	Confident	90.9	Very high	87 Å²	87	44.6 Å²	44.6	57%	0.565	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.4	-176.6	26.9	-34.9	0	0	0	114.8	N41	N41-P87 PolarHBondContact ND2-O 3.01Å; N41-P87 VanDerWaalsContact ND2-O 3.11Å
88	L	91.8	Very high	91	Very high	107 Å²	107	43.6 Å²	43.6	56%	0.56	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-7	174.7	-59.4	177.9	0	0	0	112.8	L70 N86 F90 S106	L70-L88 HydrophobicContact CD1-CB 4.17Å; L70-L88 HydrophobicContact CD2-CB 4.29Å; N86-L88 PolarHBondContact O-N 3.1Å; N86-L88 WeakPolarHBondContact OD1-CB 3.39Å; N86-L88 PolarHBondContact OD1-N 3.31Å; L88-F90 WeakPolarHBondContact O-CD2 3.46Å; L88-S106 WeakPolarHBondContact O-CA 3.49Å
89	C	94.5	Very high	90.9	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.02	26%	0.26	C	S	.	.			trans	-88.2	127.7	-174.6	-169.2	0	0	0	0	112.2	L70 C83 N86 S91 Y105	L70-C89 HydrophobicContact CD1-CB 4Å; C83-C89 WeakPolarHBondContact CA-SG 3.46Å; C83-C89 HydrophobicContact CB-CB 4.03Å; C83-C89 WeakPolarHBondContact CB-SG 3.28Å; C83-C89 WeakPolarHBondContact O-CB 3.48Å; C83-C89 WeakPolarHBondContact SG-CB 2.99Å; C83-C89 CovalentContact SG-SG 2.02Å; C83-C89 PolarHBondContact SG-SG 3.37Å; N86-C89 HydrophobicContact CB-CB 3.91Å; N86-C89 WeakPolarHBondContact O-CB 3.03Å; N86-C89 PolarHBondContact O-N 3.11Å; C89-S91 PolarHBondContact SG-O 3.35Å; C89-S91 VanDerWaalsContact SG-O 3.32Å; C89-Y105 WeakPolarHBondContact CA-O 3.33Å
90	F	95.3	Very high	90.8	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.018	28%	0.279	C	S	.	.			trans	-123.9	-15.4	-177.6	-73.7	-95.3	0	0	0	113.4	N41 N45 M46 W53 L88 Y105 S106 K107 R126	N41-F90 HydrophobicContact CB-CZ 4.42Å; N41-F90 WeakPolarHBondContact O-CZ 3.48Å; N45-F90 HydrophobicContact CB-CD1 4.34Å; N45-F90 HydrophobicContact CB-CE1 4.05Å; N45-F90 HydrophobicContact CB-CE2 4.3Å; N45-F90 HydrophobicContact CB-CZ 4.03Å; N45-F90 VanDerWaalsContact ND2-CE2 3.28Å; N45-F90 WeakPolarHBondContact ND2-CE2 3.45Å; M46-F90 HydrophobicContact CG-CD1 4.42Å; M46-F90 HydrophobicContact CG-CE1 4.46Å; M46-F90 HydrophobicContact SD-CD1 4.01Å; M46-F90 HydrophobicContact SD-CE1 4.22Å; W53-F90 VanDerWaalsContact CH2-C 3.42Å; W53-F90 WeakPolarHBondContact CH2-O 2.98Å; W53-F90 WeakPolarHBondContact CZ3-O 3.37Å; L88-F90 WeakPolarHBondContact O-CD2 3.46Å; F90-Y105 PolarHBondContact N-O 3.41Å; F90-S106 WeakPolarHBondContact CD2-O 3.05Å; F90-K107 VanDerWaalsContact CB-C 3.4Å; F90-R126 PolarHBondContact O-N 3.18Å
91	S	95.7	Very high	91	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163	169	59.7	0	0	0	0	111	C89 Y105 K107 G124	C89-S91 PolarHBondContact SG-O 3.35Å; C89-S91 VanDerWaalsContact SG-O 3.32Å; S91-Y105 PolarHBondContact N-O 3.12Å; S91-Y105 PolarHBondContact O-N 2.79Å; S91-Y105 WeakPolarHBondContact OG-CB 3.39Å; S91-Y105 WeakPolarHBondContact OG-CD2 3.01Å; S91-K107 PolarHBondContact OG-O 3.23Å; S91-G124 CarbonylContact C-O 2.91Å; S91-G124 WeakPolarHBondContact CA-O 2.9Å; S91-G124 WeakPolarHBondContact CB-O 2.96Å
92	F	95.3	Very high	91.3	Very high	13 Å²	13	46 Å²	46	6%	0.057	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	154.2	174.8	64.2	-95.5	0	0	0	110.7	L33 W53 C79 L80 C83 T103 L104 L123 G124	L33-F92 HydrophobicContact CD1-CZ 4.14Å; W53-F92 HydrophobicContact CE3-CD1 4.39Å; W53-F92 HydrophobicContact CE3-CE1 4.06Å; W53-F92 AromaticContact CZ3-CD1 3.9Å; W53-F92 HydrophobicContact CZ3-CD1 3.9Å; W53-F92 HydrophobicContact CZ3-CE1 4.05Å; C79-F92 HydrophobicContact CB-CB 4.37Å; C79-F92 HydrophobicContact CB-CD2 3.38Å; C79-F92 HydrophobicContact CB-CE2 3.74Å; C79-F92 HydrophobicContact CB-CG 3.92Å; L80-F92 HydrophobicContact CB-CE1 3.82Å; L80-F92 HydrophobicContact CB-CZ 3.84Å; L80-F92 HydrophobicContact CD1-CE1 3.84Å; L80-F92 HydrophobicContact CD1-CZ 4.49Å; L80-F92 HydrophobicContact CG-CE1 4.45Å; C83-F92 HydrophobicContact CB-CB 4.4Å; C83-F92 HydrophobicContact CB-CD1 3.86Å; F92-T103 CarbonylContact C-O 3.56Å; F92-T103 WeakPolarHBondContact CA-O 3.43Å; F92-L104 HydrophobicContact CB-CD2 3.77Å; F92-L123 CarbonylContact O-C 3.52Å; F92-L123 WeakPolarHBondContact O-CA 3.2Å; F92-L123 WeakPolarHBondContact O-CD1 3.45Å; F92-G124 PolarHBondContact N-O 3.02Å; F92-G124 PolarHBondContact O-N 2.77Å
93	T	94.6	Very high	91.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.5	165.1	56.9	0	0	0	0	110.7	L59 C102 T103 Y105 E122 L123	L59-T93 HydrophobicContact CD2-CG2 4.19Å; T93-C102 WeakPolarHBondContact O-CA 3.44Å; T93-T103 PolarHBondContact N-O 2.99Å; T93-T103 PolarHBondContact O-N 3.1Å; T93-Y105 HydrophobicContact CG2-CE2 3.78Å; T93-Y105 PolarHBondContact OG1-OH 2.83Å; T93-E122 CarbonylContact C-O 3.52Å; T93-E122 WeakPolarHBondContact CA-O 3.41Å; T93-L123 HydrophobicContact CG2-CB 4.23Å; T93-L123 HydrophobicContact CG2-CD1 3.72Å
94	S	92.4	Very high	91.7	Very high	4 Å²	4	44.9 Å²	44.9	3%	0.028	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	132.6	172.4	49.8	0	0	0	0	110.7	F121 E122	S94-F121 WeakPolarHBondContact O-CA 3.25Å; S94-E122 PolarHBondContact N-O 2.78Å; S94-E122 PolarHBondContact O-N 2.75Å
95	P	89.9	Confident	92	Very high	19 Å²	19	40.6 Å²	40.6	12%	0.123	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	137.3	169.1	-15.9	28.3	0	0	0	110.2	D97 S98 P99 Q101 A120 F121	P95-D97 WeakPolarHBondContact CB-OD1 3.45Å; P95-D97 PolarHBondContact O-N 3.46Å; P95-S98 CarbonylContact O-C 3.55Å; P95-S98 PolarHBondContact O-N 3.06Å; P95-S98 VanDerWaalsContact O-N 3.09Å; P95-P99 WeakPolarHBondContact O-CA 3.19Å; P95-Q101 WeakPolarHBondContact CD-O 3.22Å; P95-A120 WeakPolarHBondContact CA-O 3.42Å; P95-F121 HydrophobicContact CB-CD1 4.46Å; P95-F121 HydrophobicContact CB-CE1 4.06Å; P95-F121 HydrophobicContact CB-CZ 4.46Å; P95-F121 HydrophobicContact CG-CD1 4.37Å; P95-F121 HydrophobicContact CG-CE1 3.78Å; P95-F121 HydrophobicContact CG-CZ 4.45Å
96	T	85.5	Confident	92.2	Very high	60 Å²	60	38 Å²	38	37%	0.368	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-29	179.2	48.6	0	0	0	0	113.1	W57 S98 A120 E122	W57-T96 HydrophobicContact CE3-CG2 4.43Å; W57-T96 HydrophobicContact CH2-CG2 4.43Å; W57-T96 HydrophobicContact CZ3-CG2 3.57Å; T96-S98 VanDerWaalsContact C-N 3.34Å; T96-A120 PolarHBondContact N-O 3.24Å; T96-A120 PolarHBondContact OG1-O 3.26Å; T96-E122 HydrophobicContact CG2-CG 4.26Å
97	D	86.8	Confident	92.4	Very high	142 Å²	142	39.2 Å²	39.2	76%	0.759	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-12.6	175.8	59.4	-22.9	0	0	0	112.8	P95	P95-D97 WeakPolarHBondContact CB-OD1 3.45Å; P95-D97 PolarHBondContact O-N 3.46Å
98	S	87.7	Confident	92.6	Very high	38 Å²	38	36.5 Å²	36.5	27%	0.266	21%	0.207	S	C	.	.			trans	-144.8	68.3	177	-157.3	0	0	0	0	111.6	P95 T96 T100 Q101	P95-S98 CarbonylContact O-C 3.55Å; P95-S98 PolarHBondContact O-N 3.06Å; P95-S98 VanDerWaalsContact O-N 3.09Å; T96-S98 VanDerWaalsContact C-N 3.34Å; S98-T100 PolarHBondContact O-N 3.14Å; S98-Q101 PolarHBondContact O-N 2.87Å
99	P	84.8	Confident	92.5	Very high	74 Å²	74	31.9 Å²	31.9	48%	0.481	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.4	-173	26.8	-35.7	0	0	0	113.9	C79 P95	C79-P99 PolarHBondContact SG-O 2.85Å; P95-P99 WeakPolarHBondContact O-CA 3.19Å
100	T	88.9	Confident	92	Very high	69 Å²	69	36.7 Å²	36.7	42%	0.423	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-9.3	175	53.3	0	0	0	0	113.2	R74 T75 S98	R74-T100 CarbonylContact C-O 3.54Å; R74-T100 WeakPolarHBondContact CA-O 3.08Å; T75-T100 PolarHBondContact N-O 2.81Å; T75-T100 WeakPolarHBondContact O-CB 3.44Å; T75-T100 WeakPolarHBondContact O-CG2 3.33Å; S98-T100 PolarHBondContact O-N 3.14Å
101	Q	93.5	Very high	90.9	Very high	68 Å²	68	37.2 Å²	37.2	32%	0.318	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	111	173.4	-176	171.9	-14.9	0	0	109.6	V72 P95 S98	V72-Q101 HydrophobicContact CG1-CG 3.81Å; P95-Q101 WeakPolarHBondContact CD-O 3.22Å; S98-Q101 PolarHBondContact O-N 2.87Å
102	C	95.1	Very high	89.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.7	-174.7	-48.6	0	0	0	0	110.3	V72 V73 T75 C79 T93 L104	V72-C102 CarbonylContact C-O 3.54Å; V72-C102 VanDerWaalsContact CA-O 3.29Å; V72-C102 WeakPolarHBondContact CA-O 3.26Å; V73-C102 HydrophobicContact CG2-CB 3.75Å; V73-C102 PolarHBondContact N-O 2.99Å; V73-C102 PolarHBondContact O-N 2.82Å; T75-C102 VanDerWaalsContact CG2-SG 3.52Å; C79-C102 WeakPolarHBondContact CA-SG 3.34Å; C79-C102 HydrophobicContact CB-CB 3.61Å; C79-C102 WeakPolarHBondContact CB-SG 3.35Å; C79-C102 WeakPolarHBondContact SG-CA 2.87Å; C79-C102 WeakPolarHBondContact SG-CB 3.4Å; C79-C102 CovalentContact SG-SG 2.02Å; C79-C102 PolarHBondContact SG-SG 2.96Å; T93-C102 WeakPolarHBondContact O-CA 3.44Å; C102-L104 HydrophobicContact CB-CD2 4.07Å
103	T	96.6	Very high	88.4	Confident	24 Å²	24	43.4 Å²	43.4	15%	0.147	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	121.5	162.9	-53	0	0	0	0	107.8	T69 V72 F92 T93 Y105	T69-T103 HydrophobicContact CG2-CG2 3.94Å; V72-T103 HydrophobicContact CG2-CG2 4.27Å; F92-T103 CarbonylContact C-O 3.56Å; F92-T103 WeakPolarHBondContact CA-O 3.43Å; T93-T103 PolarHBondContact N-O 2.99Å; T93-T103 PolarHBondContact O-N 3.1Å; T103-Y105 HydrophobicContact CG2-CD1 4.46Å; T103-Y105 HydrophobicContact CG2-CE1 3.68Å; T103-Y105 HydrophobicContact CG2-CE2 4.22Å
104	L	97	Very high	87.1	Confident	7 Å²	7	46.3 Å²	46.3	4%	0.037	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	141.5	-178.6	-56.1	-173.2	0	0	0	110	L70 G71 V73 E82 C83 F92 C102	L70-L104 HydrophobicContact CB-CB 4.3Å; L70-L104 PolarHBondContact N-O 3.06Å; G71-L104 PolarHBondContact O-N 2.75Å; V73-L104 HydrophobicContact CG1-CD1 4.45Å; V73-L104 HydrophobicContact CG2-CD1 4.11Å; V73-L104 HydrophobicContact CG2-CG 4.24Å; E82-L104 HydrophobicContact CB-CD1 4.39Å; E82-L104 HydrophobicContact CB-CD2 4.44Å; C83-L104 HydrophobicContact CB-CD2 4.06Å; F92-L104 HydrophobicContact CB-CD2 3.77Å; C102-L104 HydrophobicContact CB-CD2 4.07Å
105	Y	96.7	Very high	86.4	Confident	1 Å²	1	47 Å²	47	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	147.8	-179.2	-46.8	-86.4	0	0	0	113.1	F64 I65 Y68 T69 C89 F90 S91 T93 T103 K107	F64-Y105 HydrophobicContact CD1-CD1 4.31Å; F64-Y105 AromaticContact CE1-CD1 3.94Å; F64-Y105 HydrophobicContact CE1-CD1 3.94Å; F64-Y105 HydrophobicContact CE1-CD2 4.49Å; F64-Y105 AromaticContact CE1-CG 3.9Å; F64-Y105 HydrophobicContact CE1-CG 3.9Å; I65-Y105 HydrophobicContact CG1-CE1 4.28Å; Y68-Y105 CarbonylContact O-C 3.52Å; Y68-Y105 WeakPolarHBondContact O-CA 3.38Å; Y68-Y105 WeakPolarHBondContact O-CB 3.11Å; T69-Y105 WeakPolarHBondContact OG1-CE1 3.03Å; C89-Y105 WeakPolarHBondContact CA-O 3.33Å; F90-Y105 PolarHBondContact N-O 3.41Å; S91-Y105 PolarHBondContact N-O 3.12Å; S91-Y105 PolarHBondContact O-N 2.79Å; S91-Y105 WeakPolarHBondContact OG-CB 3.39Å; S91-Y105 WeakPolarHBondContact OG-CD2 3.01Å; T93-Y105 HydrophobicContact CG2-CE2 3.78Å; T93-Y105 PolarHBondContact OG1-OH 2.83Å; T103-Y105 HydrophobicContact CG2-CD1 4.46Å; T103-Y105 HydrophobicContact CG2-CE1 3.68Å; T103-Y105 HydrophobicContact CG2-CE2 4.22Å; Y105-K107 VanDerWaalsContact C-N 3.34Å
106	S	94.8	Very high	85.9	Confident	31 Å²	31	53 Å²	53	22%	0.217	31%	0.305	C	S	.	.	S	Bend	trans	-83.1	-6.2	-176.6	63.3	0	0	0	0	114.6	N45 Y68 L88 F90	N45-S106 PolarHBondContact ND2-O 3.47Å; N45-S106 VanDerWaalsContact ND2-O 3.09Å; Y68-S106 PolarHBondContact O-N 2.93Å; Y68-S106 PolarHBondContact O-OG 3.25Å; L88-S106 WeakPolarHBondContact O-CA 3.49Å; F90-S106 WeakPolarHBondContact CD2-O 3.05Å
107	K	94.5	Very high	85.3	Confident	72 Å²	72	54.8 Å²	54.8	31%	0.313	31%	0.313	S	S	.	.	S	Bend	trans	-130.1	154.3	175.9	-78.2	-140.1	179.4	-159.9	0	112.2	N45 F64 Y68 F90 S91 Y105	N45-K107 VanDerWaalsContact OD1-CE 3.24Å; N45-K107 WeakPolarHBondContact OD1-CE 3.37Å; F64-K107 HydrophobicContact CE2-CB 4.26Å; F64-K107 HydrophobicContact CZ-CB 4.14Å; Y68-K107 HydrophobicContact CD1-CB 3.99Å; Y68-K107 HydrophobicContact CD1-CD 4.07Å; Y68-K107 HydrophobicContact CD1-CG 3.6Å; Y68-K107 HydrophobicContact CD2-CB 4.49Å; Y68-K107 HydrophobicContact CE1-CB 4.4Å; Y68-K107 HydrophobicContact CE1-CD 3.66Å; Y68-K107 HydrophobicContact CE1-CG 3.75Å; Y68-K107 HydrophobicContact CG-CB 4.03Å; Y68-K107 HydrophobicContact CG-CG 4.18Å; F90-K107 VanDerWaalsContact CB-C 3.4Å; S91-K107 PolarHBondContact OG-O 3.23Å; Y105-K107 VanDerWaalsContact C-N 3.34Å
108	P	93.3	Very high	84.3	Confident	31 Å²	31	51.4 Å²	51.4	20%	0.201	29%	0.289	C	S	.	.			trans	-68.5	137.1	170.4	28.9	-33.6	0	0	0	109.9	M46 T125 R126	M46-P108 HydrophobicContact CG-CG 4.03Å; P108-T125 WeakPolarHBondContact CA-OG1 2.95Å; P108-R126 WeakPolarHBondContact CB-O 3.39Å
109	V	90.8	Very high	83.5	Confident	9 Å²	9	53.4 Å²	53.4	6%	0.055	30%	0.3	C	S	.	.			trans	-80.7	139.1	167.7	175.2	0	0	0	0	108.4	P60 F64 P111 L115 L123 T125	P60-V109 HydrophobicContact CB-CG1 4.13Å; P60-V109 HydrophobicContact CB-CG2 3.91Å; P60-V109 HydrophobicContact CG-CG2 4.03Å; F64-V109 HydrophobicContact CD1-CG2 4.07Å; F64-V109 HydrophobicContact CE1-CG2 3.37Å; F64-V109 HydrophobicContact CE2-CG2 4.04Å; F64-V109 HydrophobicContact CZ-CB 4.32Å; F64-V109 HydrophobicContact CZ-CG2 3.36Å; V109-P111 WeakPolarHBondContact O-CD 3.19Å; V109-L115 HydrophobicContact CG1-CD2 3.77Å; V109-L123 HydrophobicContact CB-CD1 4.11Å; V109-L123 HydrophobicContact CB-CD2 4.11Å; V109-L123 HydrophobicContact CG1-CD1 4.42Å; V109-L123 HydrophobicContact CG1-CD2 3.71Å; V109-L123 HydrophobicContact CG2-CD1 3.97Å; V109-T125 PolarHBondContact N-OG1 2.78Å; V109-T125 WeakPolarHBondContact O-CG2 3.24Å; V109-T125 PolarHBondContact O-OG1 3.49Å
110	N	83.5	Confident	83.3	Confident	105 Å²	105	51.5 Å²	51.5	56%	0.561	29%	0.29	S	S	*	.			trans	-75.2	106.4	166.5	177.9	0.3	0	0	0	109	L112 G113	N110-L112 PolarHBondContact O-N 2.82Å; N110-L112 PolarHBondContact OD1-N 3.48Å; N110-G113 PolarHBondContact O-N 2.79Å; N110-G113 VanDerWaalsContact O-N 3.09Å; N110-G113 PolarHBondContact OD1-N 2.88Å
111	P	71.3	Confident	83.3	Confident	15 Å²	15	50.3 Å²	50.3	10%	0.097	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-12.3	-173.9	35.6	-37.8	0	0	0	113.1	L30 I54 A56 V109 G113 T125	L30-P111 HydrophobicContact CD1-CG 4.45Å; L30-P111 HydrophobicContact CD2-CB 3.66Å; L30-P111 HydrophobicContact CD2-CG 3.91Å; I54-P111 HydrophobicContact CD1-CB 4.5Å; I54-P111 HydrophobicContact CD1-CG 3.7Å; A56-P111 HydrophobicContact CB-CB 4.13Å; V109-P111 WeakPolarHBondContact O-CD 3.19Å; P111-G113 VanDerWaalsContact C-N 3.33Å; P111-T125 HydrophobicContact CB-CG2 4.22Å; P111-T125 HydrophobicContact CG-CG2 4.2Å
112	L	68.8	Low	83	Confident	119 Å²	119	51 Å²	51	62%	0.623	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.1	172.2	-58.6	178.1	0	0	0	112.1	L30 N110 I135	L30-L112 HydrophobicContact CD1-CD2 3.96Å; N110-L112 PolarHBondContact O-N 2.82Å; N110-L112 PolarHBondContact OD1-N 3.48Å; L112-I135 HydrophobicContact CD1-CD1 4.3Å
113	G	69.3	Low	82.8	Confident	23 Å²	23	51.1 Å²	51.1	24%	0.237	28%	0.283	C	S	.	.	S	Bend	trans	-74.7	179.4	177.2	0	0	0	0	0	113.6	N110 P111 L115 R118	N110-G113 PolarHBondContact O-N 2.79Å; N110-G113 VanDerWaalsContact O-N 3.09Å; N110-G113 PolarHBondContact OD1-N 2.88Å; P111-G113 VanDerWaalsContact C-N 3.33Å; G113-L115 PolarHBondContact O-N 2.93Å; G113-L115 VanDerWaalsContact O-N 3.09Å; G113-R118 PolarHBondContact O-NH2 3.47Å
114	G	68.7	Low	82.5	Confident	62 Å²	62	50 Å²	50	64%	0.639	28%	0.276	S	S	*	.			trans	-64.9	107.8	169.7	0	0	0	0	0	110.2
115	L	77.3	Confident	82.3	Confident	17 Å²	17	49.7 Å²	49.7	9%	0.089	27%	0.274	C	S	.	.			trans	-109.4	133.7	173.5	-61.8	176	0	0	0	108.2	W57 L59 V109 G113 R118 L123	W57-L115 WeakPolarHBondContact O-CD1 3.34Å; L59-L115 CarbonylContact O-C 3.58Å; L59-L115 VanDerWaalsContact O-CA 3.32Å; L59-L115 WeakPolarHBondContact O-CA 3.35Å; V109-L115 HydrophobicContact CG1-CD2 3.77Å; G113-L115 PolarHBondContact O-N 2.93Å; G113-L115 VanDerWaalsContact O-N 3.09Å; L115-R118 HydrophobicContact CB-CG 4.25Å; L115-R118 PolarHBondContact O-NE 2.84Å; L115-L123 HydrophobicContact CD1-CD2 3.81Å; L115-L123 HydrophobicContact CD2-CD2 4.09Å
116	Y	78.4	Confident	82	Confident	146 Å²	146	51.7 Å²	51.7	57%	0.573	28%	0.282	S	S	*	.	B	Isolated β-bridge	trans	-90	162.9	177.9	-62.1	-86.5	0	0	0	110.3	G58 L59 N61 R118	G58-Y116 CarbonylContact C-O 3.07Å; G58-Y116 WeakPolarHBondContact CA-O 3.48Å; L59-Y116 PolarHBondContact N-O 2.81Å; L59-Y116 PolarHBondContact O-N 2.89Å; N61-Y116 HydrophobicContact CB-CD2 4.24Å; N61-Y116 HydrophobicContact CB-CE2 3.62Å; Y116-R118 PolarHBondContact O-N 2.82Å
117	N	73.5	Confident	81.6	Confident	98 Å²	98	51.1 Å²	51.1	52%	0.524	28%	0.276	S	S	.	.			trans	47.7	43.1	172.6	-63	-12.9	0	0	0	114.2	L59 T119 A120 F121	L59-N117 HydrophobicContact CD1-CB 4.21Å; N117-T119 PolarHBondContact O-N 2.04Å; N117-A120 PolarHBondContact O-N 2.91Å; N117-A120 VanDerWaalsContact O-N 3.09Å; N117-F121 HydrophobicContact CB-CD2 4.03Å; N117-F121 HydrophobicContact CB-CE2 4.43Å
118	R	67.1	Low	81.2	Confident	71 Å²	71	47.8 Å²	47.8	27%	0.268	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-5.4	-179.9	-62.1	-168.6	177.4	-166.8	-11	114.1	R27 N28 W57 G113 L115 Y116	R27-R118 WeakPolarHBondContact CD-O 3.49Å; N28-R118 PolarHBondContact OD1-NH1 2.95Å; W57-R118 HydrophobicContact CB-CB 4.41Å; W57-R118 VanDerWaalsContact CB-O 3.27Å; W57-R118 WeakPolarHBondContact CB-O 3.45Å; G113-R118 PolarHBondContact O-NH2 3.47Å; L115-R118 HydrophobicContact CB-CG 4.25Å; L115-R118 PolarHBondContact O-NE 2.84Å; Y116-R118 PolarHBondContact O-N 2.82Å
119	T	69.7	Low	80.5	Confident	80 Å²	80	46.7 Å²	46.7	49%	0.491	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-19.7	-178	55.8	0	0	0	0	114.7	R27 N117	R27-T119 VanDerWaalsContact CZ-CA 3.48Å; R27-T119 PolarHBondContact NH1-O 2.79Å; R27-T119 PolarHBondContact NH2-O 3.5Å; N117-T119 PolarHBondContact O-N 2.04Å
120	A	81.6	Confident	79.7	Confident	33 Å²	33	49.8 Å²	49.8	27%	0.273	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-6.5	-168.4	0	0	0	0	0	113.4	P95 T96 N117	P95-A120 WeakPolarHBondContact CA-O 3.42Å; T96-A120 PolarHBondContact N-O 3.24Å; T96-A120 PolarHBondContact OG1-O 3.26Å; N117-A120 PolarHBondContact O-N 2.91Å; N117-A120 VanDerWaalsContact O-N 3.09Å
121	F	87.5	Confident	79.3	Confident	44 Å²	44	48.4 Å²	48.4	19%	0.193	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	134.2	-176.7	-70.5	-95.8	0	0	0	111.1	G58 L59 S94 P95 N117	G58-F121 PolarHBondContact N-O 2.97Å; L59-F121 HydrophobicContact CD1-CB 4.43Å; L59-F121 HydrophobicContact CD1-CD1 3.83Å; L59-F121 HydrophobicContact CD1-CD2 3.23Å; L59-F121 HydrophobicContact CD1-CE1 3.82Å; L59-F121 HydrophobicContact CD1-CE2 3.26Å; L59-F121 HydrophobicContact CD1-CG 3.55Å; L59-F121 HydrophobicContact CD1-CZ 3.57Å; L59-F121 HydrophobicContact CD2-CD1 3.91Å; L59-F121 HydrophobicContact CD2-CE1 4.14Å; L59-F121 HydrophobicContact CD2-CG 4.2Å; L59-F121 HydrophobicContact CG-CB 3.95Å; L59-F121 HydrophobicContact CG-CD1 3.74Å; L59-F121 HydrophobicContact CG-CD2 3.73Å; L59-F121 HydrophobicContact CG-CE1 4.16Å; L59-F121 HydrophobicContact CG-CE2 4.19Å; L59-F121 HydrophobicContact CG-CG 3.5Å; L59-F121 HydrophobicContact CG-CZ 4.39Å; S94-F121 WeakPolarHBondContact O-CA 3.25Å; P95-F121 HydrophobicContact CB-CD1 4.46Å; P95-F121 HydrophobicContact CB-CE1 4.06Å; P95-F121 HydrophobicContact CB-CZ 4.46Å; P95-F121 HydrophobicContact CG-CD1 4.37Å; P95-F121 HydrophobicContact CG-CE1 3.78Å; P95-F121 HydrophobicContact CG-CZ 4.45Å; N117-F121 HydrophobicContact CB-CD2 4.03Å; N117-F121 HydrophobicContact CB-CE2 4.43Å
122	E	88.3	Confident	79	Confident	83 Å²	83	47.9 Å²	47.9	39%	0.388	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	138.3	163.2	-66.4	-179.3	171.8	0	0	108.5	W57 T93 S94 T96	W57-E122 HydrophobicContact CE3-CG 4.02Å; W57-E122 HydrophobicContact CH2-CG 3.73Å; W57-E122 WeakPolarHBondContact CH2-OE1 3.41Å; W57-E122 HydrophobicContact CZ2-CG 4.43Å; W57-E122 HydrophobicContact CZ3-CG 3.5Å; T93-E122 CarbonylContact C-O 3.52Å; T93-E122 WeakPolarHBondContact CA-O 3.41Å; S94-E122 PolarHBondContact N-O 2.78Å; S94-E122 PolarHBondContact O-N 2.75Å; T96-E122 HydrophobicContact CG2-CG 4.26Å
123	L	89.9	Confident	78.4	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.016	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.9	177.5	168.3	67.3	0	0	0	108.2	G55 A56 G58 F92 T93 V109 L115	G55-L123 CarbonylContact C-O 3.47Å; G55-L123 WeakPolarHBondContact CA-O 3.27Å; A56-L123 HydrophobicContact CB-CB 4.32Å; A56-L123 HydrophobicContact CB-CD2 4.17Å; A56-L123 HydrophobicContact CB-CG 4.47Å; A56-L123 PolarHBondContact N-O 2.89Å; A56-L123 PolarHBondContact O-N 3.35Å; G58-L123 WeakPolarHBondContact O-CB 3.24Å; F92-L123 CarbonylContact O-C 3.52Å; F92-L123 WeakPolarHBondContact O-CA 3.2Å; F92-L123 WeakPolarHBondContact O-CD1 3.45Å; T93-L123 HydrophobicContact CG2-CB 4.23Å; T93-L123 HydrophobicContact CG2-CD1 3.72Å; V109-L123 HydrophobicContact CB-CD1 4.11Å; V109-L123 HydrophobicContact CB-CD2 4.11Å; V109-L123 HydrophobicContact CG1-CD1 4.42Å; V109-L123 HydrophobicContact CG1-CD2 3.71Å; V109-L123 HydrophobicContact CG2-CD1 3.97Å; L115-L123 HydrophobicContact CD1-CD2 3.81Å; L115-L123 HydrophobicContact CD2-CD2 4.09Å
124	G	90.8	Very high	77.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	136.3	162.1	0	0	0	0	0	110.4	I54 S91 F92	I54-G124 CarbonylContact O-C 3.54Å; I54-G124 VanDerWaalsContact O-CA 3.28Å; I54-G124 WeakPolarHBondContact O-CA 3.08Å; S91-G124 CarbonylContact C-O 2.91Å; S91-G124 WeakPolarHBondContact CA-O 2.9Å; S91-G124 WeakPolarHBondContact CB-O 2.96Å; F92-G124 PolarHBondContact N-O 3.02Å; F92-G124 PolarHBondContact O-N 2.77Å
125	T	92.4	Very high	77.1	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	148.5	179.7	-171.4	0	0	0	0	111.6	I54 P108 V109 P111	I54-T125 HydrophobicContact CD1-CG2 4.14Å; I54-T125 HydrophobicContact CG1-CG2 3.77Å; I54-T125 WeakPolarHBondContact CG1-O 3.45Å; I54-T125 PolarHBondContact N-O 3Å; I54-T125 PolarHBondContact O-N 3.21Å; P108-T125 WeakPolarHBondContact CA-OG1 2.95Å; V109-T125 PolarHBondContact N-OG1 2.78Å; V109-T125 WeakPolarHBondContact O-CG2 3.24Å; V109-T125 PolarHBondContact O-OG1 3.49Å; P111-T125 HydrophobicContact CB-CG2 4.22Å; P111-T125 HydrophobicContact CG-CG2 4.2Å
126	R	91	Very high	76.2	Confident	43 Å²	43	47.2 Å²	47.2	16%	0.162	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	143.4	168.8	-74.8	-171.9	177.7	-91.8	-0.8	110.8	M46 S51 R52 W53 F90 P108	M46-R126 HydrophobicContact CE-CB 4.08Å; M46-R126 HydrophobicContact SD-CB 3.81Å; S51-R126 PolarHBondContact OG-NH1 3.43Å; R52-R126 WeakPolarHBondContact O-CA 3.28Å; W53-R126 HydrophobicContact CD2-CG 3.82Å; W53-R126 VanDerWaalsContact CE2-CG 3.47Å; W53-R126 HydrophobicContact CE3-CG 4.16Å; W53-R126 HydrophobicContact CG-CG 4.46Å; W53-R126 HydrophobicContact CH2-CG 3.75Å; W53-R126 HydrophobicContact CZ2-CG 3.46Å; W53-R126 VanDerWaalsContact CZ2-CG 3.46Å; W53-R126 VanDerWaalsContact CZ2-NE 3.28Å; W53-R126 HydrophobicContact CZ3-CG 4.14Å; W53-R126 VanDerWaalsContact NE1-CZ 3.3Å; F90-R126 PolarHBondContact O-N 3.18Å; P108-R126 WeakPolarHBondContact CB-O 3.39Å
127	I	86.6	Confident	75.4	Confident	19 Å²	19	41.1 Å²	41.1	10%	0.097	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.2	171.9	-169.4	164.7	0	0	0	110.2	M46 S51 R52 I54 D131 I132 I135	M46-I127 VanDerWaalsContact CE-C 3.41Å; S51-I127 VanDerWaalsContact CA-O 3.24Å; S51-I127 WeakPolarHBondContact CA-O 3.36Å; S51-I127 WeakPolarHBondContact CB-O 3.11Å; R52-I127 HydrophobicContact CG-CG2 4.13Å; R52-I127 PolarHBondContact N-O 2.73Å; R52-I127 PolarHBondContact O-N 3.19Å; I54-I127 HydrophobicContact CD1-CB 4Å; I54-I127 HydrophobicContact CD1-CD1 3.97Å; I54-I127 HydrophobicContact CD1-CG2 3.74Å; I54-I127 HydrophobicContact CG1-CB 4.41Å; I54-I127 HydrophobicContact CG1-CG2 3.95Å; I54-I127 HydrophobicContact CG2-CG2 4.03Å; I127-D131 HydrophobicContact CD1-CB 4.24Å; I127-D131 HydrophobicContact CG1-CB 4.11Å; I127-I132 HydrophobicContact CD1-CG1 4.4Å; I127-I132 HydrophobicContact CG2-CD1 3.45Å; I127-I132 VanDerWaalsContact CG2-CD1 3.45Å; I127-I132 HydrophobicContact CG2-CG1 3.96Å; I127-I135 HydrophobicContact CD1-CD1 3.72Å
128	C	85.7	Confident	74.9	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.02	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	135.1	172.4	-64.9	0	0	0	0	110.1	C48 T130 D131 I132	C48-C128 HydrophobicContact CB-CB 3.69Å; C48-C128 WeakPolarHBondContact CB-SG 3.24Å; C48-C128 WeakPolarHBondContact SG-CA 3.41Å; C48-C128 WeakPolarHBondContact SG-CB 3.36Å; C48-C128 CovalentContact SG-SG 2.03Å; C48-C128 PolarHBondContact SG-SG 3.34Å; C128-T130 PolarHBondContact O-N 3.35Å; C128-D131 HydrophobicContact CB-CB 4.38Å; C128-D131 WeakPolarHBondContact CB-OD2 3.49Å; C128-D131 PolarHBondContact O-N 2.65Å; C128-I132 PolarHBondContact O-N 3.46Å
129	C	78.6	Confident	74.8	Confident	7 Å²	7	37.6 Å²	37.6	5%	0.047	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-28.9	-178.6	-59.2	0	0	0	0	112.4	C36 Y50 D131	C36-C129 VanDerWaalsContact CA-SG 3.52Å; C36-C129 HydrophobicContact CB-CB 4.01Å; C36-C129 WeakPolarHBondContact CB-SG 3.42Å; C36-C129 WeakPolarHBondContact SG-CB 3.48Å; C36-C129 CovalentContact SG-SG 2.02Å; C36-C129 PolarHBondContact SG-SG 3.47Å; Y50-C129 PolarHBondContact O-N 3.36Å; C129-D131 VanDerWaalsContact C-N 3.35Å
130	T	73.7	Confident	74.4	Confident	74 Å²	74	34.4 Å²	34.4	45%	0.454	18%	0.184	S	C	.	.	H	α-helix	trans	-63.4	-38.1	174.5	49	0	0	0	0	112.8	C128 I132 K133	C128-T130 PolarHBondContact O-N 3.35Å; T130-I132 VanDerWaalsContact C-N 3.3Å; T130-I132 PolarHBondContact O-N 3.01Å; T130-K133 PolarHBondContact O-N 3.49Å
131	D	74.9	Confident	73.6	Confident	76 Å²	76	34.8 Å²	34.8	41%	0.406	18%	0.184	S	C	.	.	H	α-helix	trans	-75.3	-28.2	-174.9	-58.1	-8.9	0	0	0	110.9	I127 C128 C129 K133 N134	I127-D131 HydrophobicContact CD1-CB 4.24Å; I127-D131 HydrophobicContact CG1-CB 4.11Å; C128-D131 HydrophobicContact CB-CB 4.38Å; C128-D131 WeakPolarHBondContact CB-OD2 3.49Å; C128-D131 PolarHBondContact O-N 2.65Å; C129-D131 VanDerWaalsContact C-N 3.35Å; D131-K133 VanDerWaalsContact C-N 3.27Å; D131-K133 PolarHBondContact O-N 2.98Å; D131-N134 PolarHBondContact O-N 2.02Å
132	I	66.1	Low	73	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.026	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-24.2	179.4	-116.4	171.8	0	0	0	113.3	L32 R52 I54 I127 C128 T130 N134 I135 P163	L32-I132 HydrophobicContact CD2-CD1 3.81Å; R52-I132 VanDerWaalsContact CD-CD1 3.48Å; R52-I132 HydrophobicContact CG-CD1 3.65Å; I54-I132 HydrophobicContact CG2-CD1 3.55Å; I127-I132 HydrophobicContact CD1-CG1 4.4Å; I127-I132 HydrophobicContact CG2-CD1 3.45Å; I127-I132 VanDerWaalsContact CG2-CD1 3.45Å; I127-I132 HydrophobicContact CG2-CG1 3.96Å; C128-I132 PolarHBondContact O-N 3.46Å; T130-I132 VanDerWaalsContact C-N 3.3Å; T130-I132 PolarHBondContact O-N 3.01Å; I132-N134 PolarHBondContact O-N 2.97Å; I132-I135 HydrophobicContact CG1-CD1 4.41Å; I132-I135 PolarHBondContact O-N 3.26Å; I132-P163 HydrophobicContact CG2-CB 4.5Å; I132-P163 HydrophobicContact CG2-CG 3.41Å; I132-P163 VanDerWaalsContact CG2-CG 3.41Å
133	K	55.8	Low	72.5	Confident	71 Å²	71	34.6 Å²	34.6	31%	0.309	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-25.4	178	-60	-174.7	-165.1	-161.7	0	111.8	T130 D131 Y221 D223	T130-K133 PolarHBondContact O-N 3.49Å; D131-K133 VanDerWaalsContact C-N 3.27Å; D131-K133 PolarHBondContact O-N 2.98Å; K133-Y221 HydrophobicContact CD-CD1 3.81Å; K133-Y221 HydrophobicContact CD-CE1 4.13Å; K133-Y221 HydrophobicContact CD-CG 4.01Å; K133-Y221 HydrophobicContact CG-CD1 4.25Å; K133-Y221 HydrophobicContact CG-CD2 4.42Å; K133-Y221 HydrophobicContact CG-CE1 4.26Å; K133-Y221 HydrophobicContact CG-CG 4.22Å; K133-D223 IonicContact NZ-OD1 2.75Å; K133-D223 PolarHBondContact NZ-OD1 2.91Å
134	N	54	Low	72.1	Confident	106 Å²	106	39.1 Å²	39.1	57%	0.567	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-13.9	-179.3	-63.5	-35	0	0	0	113.8	D131 I132	D131-N134 PolarHBondContact O-N 2.02Å; I132-N134 PolarHBondContact O-N 2.97Å
135	I	56.5	Low	71.5	Confident	19 Å²	19	39.3 Å²	39.3	10%	0.097	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-95.9	117.5	-174.2	-58.9	-179.4	0	0	0	109.2	L30 L112 I127 I132	L30-I135 HydrophobicContact CB-CG2 4.48Å; L30-I135 HydrophobicContact CD1-CD1 4.05Å; L30-I135 HydrophobicContact CD1-CG2 3.37Å; L112-I135 HydrophobicContact CD1-CD1 4.3Å; I127-I135 HydrophobicContact CD1-CD1 3.72Å; I132-I135 HydrophobicContact CG1-CD1 4.41Å; I132-I135 PolarHBondContact O-N 3.26Å
136	G	58.5	Low	70.8	Confident	10 Å²	10	44.2 Å²	44.2	10%	0.103	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-92.7	131.2	169.8	0	0	0	0	0	110.5	I160	G136-I160 VanDerWaalsContact CA-CG2 3.45Å
137	I	61.5	Low	70.1	Confident	19 Å²	19	45.5 Å²	45.5	10%	0.097	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.1	177.2	-65.1	172.8	0	0	0	108.8	L30 L32 M139 I160 V161	L30-I137 HydrophobicContact CB-CG1 4.12Å; L30-I137 VanDerWaalsContact O-CD1 3.27Å; L30-I137 WeakPolarHBondContact O-CD1 3.17Å; L30-I137 WeakPolarHBondContact O-CG1 3.14Å; L30-I137 WeakPolarHBondContact O-CG2 3.29Å; L32-I137 HydrophobicContact CD1-CD1 4.38Å; L32-I137 HydrophobicContact CD2-CD1 3.84Å; L32-I137 HydrophobicContact CG-CD1 3.62Å; I137-M139 HydrophobicContact CG2-CG 4.21Å; I137-I160 CarbonylContact O-C 3.59Å; I137-I160 VanDerWaalsContact O-CA 3.29Å; I137-I160 WeakPolarHBondContact O-CA 3.27Å; I137-V161 PolarHBondContact N-O 2.88Å; I137-V161 PolarHBondContact O-N 3.04Å
138	A	62.5	Low	69.5	Low	17 Å²	17	44.6 Å²	44.6	14%	0.14	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	132.1	170.3	0	0	0	0	0	109.5	D29 Y158 Y159	D29-A138 WeakPolarHBondContact OD1-CB 3.08Å; A138-Y158 HydrophobicContact CB-CD2 3.84Å; A138-Y158 HydrophobicContact CB-CE2 3.97Å; A138-Y159 CarbonylContact C-O 3.45Å; A138-Y159 VanDerWaalsContact CA-O 3.3Å; A138-Y159 WeakPolarHBondContact CA-O 2.99Å
139	M	65.5	Low	68.5	Low	77 Å²	77	47.8 Å²	47.8	38%	0.379	28%	0.278	S	S	.	.			trans	-116.9	-4.7	-178.6	-79.1	-159.9	68.9	0	0	113.8	I137 Y159 V161 A186 F198	I137-M139 HydrophobicContact CG2-CG 4.21Å; M139-Y159 PolarHBondContact N-O 3.37Å; M139-V161 HydrophobicContact CB-CG2 4.21Å; M139-V161 HydrophobicContact CG-CB 4.37Å; M139-V161 HydrophobicContact CG-CG2 3.61Å; M139-V161 HydrophobicContact SD-CB 4.03Å; M139-V161 HydrophobicContact SD-CG2 3.19Å; M139-V161 WeakPolarHBondContact SD-CG2 3.34Å; M139-A186 HydrophobicContact CB-CB 4.41Å; M139-A186 HydrophobicContact CE-CB 4.5Å; M139-F198 HydrophobicContact SD-CZ 4.37Å
140	S	61.3	Low	68.2	Low	14 Å²	14	56 Å²	56	10%	0.098	31%	0.313	C	S	.	.	S	Bend	trans	-142.2	154.9	-179.3	76.4	0	0	0	0	110.3	Y158 Y159 E190	S140-Y158 WeakPolarHBondContact OG-CA 3.27Å; S140-Y159 PolarHBondContact OG-N 3.28Å; S140-E190 WeakPolarHBondContact CB-OE1 3.5Å
141	P	65.4	Low	68.1	Low	41 Å²	41	56.2 Å²	56.2	27%	0.266	31%	0.311	S	S	.	.			trans	-63.6	167.4	164.2	29.7	-34.2	0	0	0	110.6	L143	P141-L143 HydrophobicContact CG-CD1 4.35Å; P141-L143 HydrophobicContact CG-CD2 4.19Å; P141-L143 HydrophobicContact CG-CG 4.11Å; P141-L143 PolarHBondContact O-N 2.93Å
142	C	75.3	Confident	67.9	Low	60 Å²	60	52.7 Å²	52.7	41%	0.405	29%	0.292	S	S	.	.			trans	-65.5	116.3	167.3	-88	0	0	0	0	110.6	C235	C142-C235 WeakPolarHBondContact CA-SG 3.41Å; C142-C235 HydrophobicContact CB-CB 4.03Å; C142-C235 WeakPolarHBondContact CB-SG 3.3Å; C142-C235 WeakPolarHBondContact SG-CB 3.24Å; C142-C235 CovalentContact SG-SG 2.02Å; C142-C235 PolarHBondContact SG-SG 2.76Å
143	L	76.2	Confident	68.4	Low	63 Å²	63	59.2 Å²	59.2	33%	0.33	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.6	-177.2	-67.6	173.6	0	0	0	111.3	P141 C145 Q156 T157 E190	P141-L143 HydrophobicContact CG-CD1 4.35Å; P141-L143 HydrophobicContact CG-CD2 4.19Å; P141-L143 HydrophobicContact CG-CG 4.11Å; P141-L143 PolarHBondContact O-N 2.93Å; L143-C145 PolarHBondContact O-N 3.36Å; L143-Q156 CarbonylContact O-C 3.59Å; L143-Q156 WeakPolarHBondContact O-CA 3.3Å; L143-T157 PolarHBondContact N-O 2.02Å; L143-T157 PolarHBondContact O-N 2.93Å; L143-E190 WeakPolarHBondContact CD1-OE1 3.28Å
144	P	81.7	Confident	69.3	Low	97 Å²	97	56.7 Å²	56.7	63%	0.63	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	136.5	173.1	-22.8	33.3	0	0	0	112.2	N155	P144-N155 CarbonylContact C-O 3.49Å; P144-N155 VanDerWaalsContact CA-O 3.25Å; P144-N155 WeakPolarHBondContact CA-O 3.16Å
145	C	79.3	Confident	70.5	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.027	32%	0.315	C	S	.	.			trans	-134	88.9	172.8	-176.1	0	0	0	0	110.4	L143 I147 C148 N155 T157 K232	L143-C145 PolarHBondContact O-N 3.36Å; C145-I147 VanDerWaalsContact C-N 3.29Å; C145-I147 PolarHBondContact O-N 3.16Å; C145-C148 HydrophobicContact CB-CB 3.57Å; C145-C148 WeakPolarHBondContact CB-SG 3.3Å; C145-C148 WeakPolarHBondContact O-CB 2.99Å; C145-C148 PolarHBondContact O-N 2.81Å; C145-C148 VanDerWaalsContact O-N 3.1Å; C145-C148 WeakPolarHBondContact SG-CB 2.89Å; C145-C148 PolarHBondContact SG-N 2.71Å; C145-C148 CovalentContact SG-SG 2.03Å; C145-C148 PolarHBondContact SG-SG 2.97Å; C145-N155 PolarHBondContact N-O 3.16Å; C145-T157 HydrophobicContact CB-CG2 4.02Å; C145-T157 WeakPolarHBondContact CB-OG1 3Å; C145-K232 PolarHBondContact SG-NZ 3.41Å; C145-K232 VanDerWaalsContact SG-NZ 3.41Å
146	P	76.1	Confident	71.6	Confident	103 Å²	103	60.4 Å²	60.4	67%	0.669	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-39.9	-178.3	-24.3	33.7	0	0	0	112.9	C148 T149	P146-C148 VanDerWaalsContact C-N 3.28Å; P146-C148 PolarHBondContact O-N 2.91Å; P146-T149 PolarHBondContact O-N 2.94Å; P146-T149 PolarHBondContact O-OG1 3.48Å
147	I	76.2	Confident	72.6	Confident	70 Å²	70	60.1 Å²	60.1	36%	0.359	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-26.9	-179.9	-65.9	161.5	0	0	0	111.6	C145 T149 K150 P193	C145-I147 VanDerWaalsContact C-N 3.29Å; C145-I147 PolarHBondContact O-N 3.16Å; I147-T149 PolarHBondContact O-N 2.9Å; I147-K150 PolarHBondContact O-N 2.02Å; I147-P193 HydrophobicContact CD1-CB 4.21Å; I147-P193 WeakPolarHBondContact CD1-O 3.36Å
148	C	75	Confident	73.2	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-68.1	-18.7	178.4	-62	0	0	0	0	112.9	C145 P146 K150 L151 M152 Q153 C154 T157	C145-C148 HydrophobicContact CB-CB 3.57Å; C145-C148 WeakPolarHBondContact CB-SG 3.3Å; C145-C148 WeakPolarHBondContact O-CB 2.99Å; C145-C148 PolarHBondContact O-N 2.81Å; C145-C148 VanDerWaalsContact O-N 3.1Å; C145-C148 WeakPolarHBondContact SG-CB 2.89Å; C145-C148 PolarHBondContact SG-N 2.71Å; C145-C148 CovalentContact SG-SG 2.03Å; C145-C148 PolarHBondContact SG-SG 2.97Å; P146-C148 VanDerWaalsContact C-N 3.28Å; P146-C148 PolarHBondContact O-N 2.91Å; C148-K150 PolarHBondContact O-N 2.84Å; C148-L151 PolarHBondContact O-N 3.26Å; C148-M152 HydrophobicContact CB-CB 4.38Å; C148-M152 HydrophobicContact CB-CG 4.48Å; C148-M152 HydrophobicContact CB-SD 4.17Å; C148-M152 WeakPolarHBondContact O-CA 3.34Å; C148-M152 PolarHBondContact O-N 2.76Å; C148-Q153 PolarHBondContact O-N 2.03Å; C148-C154 CarbonylContact C-O 3.41Å; C148-T157 HydrophobicContact CB-CG2 4.03Å
149	T	65.5	Low	73.9	Confident	71 Å²	71	59.8 Å²	59.8	44%	0.436	32%	0.321	S	S	.	.	H	α-helix	trans	-59.6	-33.2	177.9	56.1	0	0	0	0	112.7	P146 I147 Q153 C154 N155	P146-T149 PolarHBondContact O-N 2.94Å; P146-T149 PolarHBondContact O-OG1 3.48Å; I147-T149 PolarHBondContact O-N 2.9Å; T149-Q153 WeakPolarHBondContact O-CA 2.9Å; T149-Q153 PolarHBondContact O-N 3.28Å; T149-C154 PolarHBondContact N-O 2.88Å; T149-N155 HydrophobicContact CG2-CB 4.12Å
150	K	71.1	Confident	74.3	Confident	179 Å²	179	56.4 Å²	56.4	78%	0.778	30%	0.304	S	S	*	.	H	α-helix	trans	-80	-30.4	177.7	-69.1	-174.8	178.4	-177.4	0	113.8	I147 C148	I147-K150 PolarHBondContact O-N 2.02Å; C148-K150 PolarHBondContact O-N 2.84Å
151	L	71.3	Confident	75	Confident	79 Å²	79	55.8 Å²	55.8	41%	0.414	30%	0.3	S	S	.	.	H	α-helix	trans	-101.4	-38	-170.9	-65.4	169.8	0	0	0	113	C148 L196 V214	C148-L151 PolarHBondContact O-N 3.26Å; L151-L196 HydrophobicContact CD1-CD1 3.32Å; L151-V214 HydrophobicContact CB-CG2 4.16Å; L151-V214 HydrophobicContact CD1-CG2 4.38Å
152	M	70.3	Confident	75.3	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-4.6	-173.2	-58.2	177.1	69.4	0	0	113	C148 C154 T157 V214 K232 C234 L250	C148-M152 HydrophobicContact CB-CB 4.38Å; C148-M152 HydrophobicContact CB-CG 4.48Å; C148-M152 HydrophobicContact CB-SD 4.17Å; C148-M152 WeakPolarHBondContact O-CA 3.34Å; C148-M152 PolarHBondContact O-N 2.76Å; M152-C154 PolarHBondContact O-N 2.69Å; M152-T157 HydrophobicContact CE-CG2 4.41Å; M152-T157 HydrophobicContact SD-CG2 4.27Å; M152-V214 HydrophobicContact CE-CG1 4.37Å; M152-V214 HydrophobicContact CG-CG1 4.12Å; M152-V214 HydrophobicContact CG-CG2 3.86Å; M152-V214 HydrophobicContact SD-CG1 4.1Å; M152-V214 HydrophobicContact SD-CG2 4.02Å; M152-K232 HydrophobicContact CE-CB 4.2Å; M152-K232 WeakPolarHBondContact CE-O 3.12Å; M152-K232 HydrophobicContact SD-CB 3.96Å; M152-C234 PolarHBondContact O-SG 2.8Å; M152-L250 WeakPolarHBondContact O-CD1 3.47Å
153	Q	77.3	Confident	75	Confident	142 Å²	142	53 Å²	53	66%	0.664	28%	0.278	S	S	*	.	S	Bend	trans	54.2	34.5	-176.9	-59.3	175.1	-5.4	0	0	113.5	C148 T149 L250	C148-Q153 PolarHBondContact O-N 2.03Å; T149-Q153 WeakPolarHBondContact O-CA 2.9Å; T149-Q153 PolarHBondContact O-N 3.28Å; Q153-L250 HydrophobicContact CB-CD1 3.7Å; Q153-L250 VanDerWaalsContact CD-CD1 3.45Å; Q153-L250 HydrophobicContact CG-CD1 3.7Å
154	C	75.4	Confident	74.9	Confident	18 Å²	18	50.1 Å²	50.1	12%	0.122	26%	0.263	C	S	.	.			trans	-140.5	150.2	173.4	59.7	0	0	0	0	110.6	C148 T149 M152 C234	C148-C154 CarbonylContact C-O 3.41Å; T149-C154 PolarHBondContact N-O 2.88Å; M152-C154 PolarHBondContact O-N 2.69Å; C154-C234 HydrophobicContact CB-CB 3.57Å; C154-C234 WeakPolarHBondContact CB-SG 3.45Å; C154-C234 WeakPolarHBondContact SG-CA 3.44Å; C154-C234 WeakPolarHBondContact SG-CB 2.98Å; C154-C234 CovalentContact SG-SG 2.04Å; C154-C234 PolarHBondContact SG-SG 3.05Å
155	N	78.2	Confident	74.5	Confident	109 Å²	109	47.3 Å²	47.3	58%	0.583	24%	0.243	S	C	*	.	S	Bend	trans	-100.6	-12.8	-178.4	66.6	-11.2	0	0	0	113.1	P144 C145 T149	P144-N155 CarbonylContact C-O 3.49Å; P144-N155 VanDerWaalsContact CA-O 3.25Å; P144-N155 WeakPolarHBondContact CA-O 3.16Å; C145-N155 PolarHBondContact N-O 3.16Å; T149-N155 HydrophobicContact CG2-CB 4.12Å
156	Q	80.6	Confident	74.4	Confident	94 Å²	94	47.2 Å²	47.2	44%	0.439	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.4	176.1	-70.4	-172.3	-14.6	0	0	109.7	L143 C235	L143-Q156 CarbonylContact O-C 3.59Å; L143-Q156 WeakPolarHBondContact O-CA 3.3Å; Q156-C235 VanDerWaalsContact C-SG 3.53Å; Q156-C235 HydrophobicContact CB-CB 3.75Å; Q156-C235 PolarHBondContact O-N 2.6Å
157	T	78.9	Confident	74.5	Confident	4 Å²	4	44.8 Å²	44.8	3%	0.025	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	157.5	-176.6	57.5	0	0	0	0	111.7	L143 C145 C148 M152 K232 V233 C235	L143-T157 PolarHBondContact N-O 2.02Å; L143-T157 PolarHBondContact O-N 2.93Å; C145-T157 HydrophobicContact CB-CG2 4.02Å; C145-T157 WeakPolarHBondContact CB-OG1 3Å; C148-T157 HydrophobicContact CB-CG2 4.03Å; M152-T157 HydrophobicContact CE-CG2 4.41Å; M152-T157 HydrophobicContact SD-CG2 4.27Å; T157-K232 HydrophobicContact CG2-CB 4.43Å; T157-V233 CarbonylContact C-O 3.43Å; T157-V233 WeakPolarHBondContact CA-O 3.43Å; T157-V233 VanDerWaalsContact CB-O 3.3Å; T157-V233 WeakPolarHBondContact CB-O 3.36Å; T157-C235 VanDerWaalsContact C-SG 3.53Å; T157-C235 PolarHBondContact N-SG 3.05Å
158	Y	74.4	Confident	74.7	Confident	26 Å²	26	47.8 Å²	47.8	10%	0.102	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	159.5	167.5	64	-74.7	0	0	0	109.5	A138 S140 I160 K232 V233 S238	A138-Y158 HydrophobicContact CB-CD2 3.84Å; A138-Y158 HydrophobicContact CB-CE2 3.97Å; S140-Y158 WeakPolarHBondContact OG-CA 3.27Å; Y158-I160 HydrophobicContact CD2-CG1 4Å; Y158-I160 HydrophobicContact CE2-CD1 3.66Å; Y158-I160 HydrophobicContact CE2-CG1 3.44Å; Y158-I160 VanDerWaalsContact CE2-CG1 3.44Å; Y158-K232 CarbonylContact O-C 3.46Å; Y158-K232 WeakPolarHBondContact O-CA 3.32Å; Y158-V233 HydrophobicContact CD1-CG2 3.78Å; Y158-V233 HydrophobicContact CD2-CG2 3.78Å; Y158-V233 HydrophobicContact CE1-CB 4.2Å; Y158-V233 HydrophobicContact CE1-CG2 3.5Å; Y158-V233 HydrophobicContact CE2-CG2 3.54Å; Y158-V233 HydrophobicContact CG-CG2 3.91Å; Y158-V233 PolarHBondContact N-O 2.81Å; Y158-V233 WeakPolarHBondContact O-CG2 3.17Å; Y158-V233 PolarHBondContact O-N 3.46Å; Y158-S238 WeakPolarHBondContact OH-CB 3.44Å; Y158-S238 PolarHBondContact OH-OG 2.83Å
159	Y	77.9	Confident	75.1	Confident	3 Å²	3	55.5 Å²	55.5	1%	0.012	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	130	174.6	-78.4	-76.3	0	0	0	111	A138 M139 S140 C189 E190 C195 L196 F198 K232	A138-Y159 CarbonylContact C-O 3.45Å; A138-Y159 VanDerWaalsContact CA-O 3.3Å; A138-Y159 WeakPolarHBondContact CA-O 2.99Å; M139-Y159 PolarHBondContact N-O 3.37Å; S140-Y159 PolarHBondContact OG-N 3.28Å; Y159-C189 PolarHBondContact OH-SG 2.9Å; Y159-E190 HydrophobicContact CD2-CG 4.27Å; Y159-E190 HydrophobicContact CE2-CG 3.65Å; Y159-C195 PolarHBondContact OH-O 3.37Å; Y159-L196 WeakPolarHBondContact CE1-O 3.44Å; Y159-F198 AromaticContact CD1-CD1 3.89Å; Y159-F198 HydrophobicContact CD1-CD1 3.89Å; Y159-F198 AromaticContact CD1-CE1 3.47Å; Y159-F198 HydrophobicContact CD1-CE1 3.47Å; Y159-F198 VanDerWaalsContact CD1-CE1 3.47Å; Y159-F198 HydrophobicContact CD2-CE1 4.47Å; Y159-F198 AromaticContact CE1-CD1 3.83Å; Y159-F198 HydrophobicContact CE1-CD1 3.83Å; Y159-F198 AromaticContact CE1-CE1 3.9Å; Y159-F198 HydrophobicContact CE1-CE1 3.9Å; Y159-F198 AromaticContact CG-CE1 3.79Å; Y159-F198 HydrophobicContact CG-CE1 3.79Å; Y159-K232 HydrophobicContact CD1-CG 3.94Å; Y159-K232 HydrophobicContact CE1-CB 4.49Å; Y159-K232 HydrophobicContact CE1-CD 4.45Å; Y159-K232 HydrophobicContact CE1-CG 3.45Å; Y159-K232 VanDerWaalsContact CE1-CG 3.45Å; Y159-K232 HydrophobicContact CE2-CG 4.15Å; Y159-K232 HydrophobicContact CG-CG 4.48Å; Y159-K232 VanDerWaalsContact CZ-CE 3.41Å; Y159-K232 WeakPolarHBondContact OH-CE 3.06Å
160	I	73.8	Confident	76	Confident	5 Å²	5	53.1 Å²	53.1	3%	0.026	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.6	162.5	-76	179	0	0	0	108.7	G136 I137 Y158 K162 G230 G231 V233 H245 L247	G136-I160 VanDerWaalsContact CA-CG2 3.45Å; I137-I160 CarbonylContact O-C 3.59Å; I137-I160 VanDerWaalsContact O-CA 3.29Å; I137-I160 WeakPolarHBondContact O-CA 3.27Å; Y158-I160 HydrophobicContact CD2-CG1 4Å; Y158-I160 HydrophobicContact CE2-CD1 3.66Å; Y158-I160 HydrophobicContact CE2-CG1 3.44Å; Y158-I160 VanDerWaalsContact CE2-CG1 3.44Å; I160-K162 HydrophobicContact CG2-CG 4.24Å; I160-G230 CarbonylContact O-C 3.49Å; I160-G230 VanDerWaalsContact O-CA 3.26Å; I160-G230 WeakPolarHBondContact O-CA 3.49Å; I160-G231 PolarHBondContact N-O 3.03Å; I160-G231 PolarHBondContact O-N 3.29Å; I160-V233 HydrophobicContact CB-CG2 4.04Å; I160-V233 HydrophobicContact CD1-CB 4.36Å; I160-V233 HydrophobicContact CD1-CG1 4.15Å; I160-V233 HydrophobicContact CD1-CG2 3.51Å; I160-V233 HydrophobicContact CG1-CG2 3.49Å; I160-V233 VanDerWaalsContact CG1-CG2 3.49Å; I160-H245 WeakPolarHBondContact CD1-ND1 3.32Å; I160-L247 HydrophobicContact CG2-CD1 4.48Å
161	V	75.5	Confident	76.8	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.6	173.4	-171.3	0	0	0	0	110.5	I137 M139 F198 Y200 M228 T229	I137-V161 PolarHBondContact N-O 2.88Å; I137-V161 PolarHBondContact O-N 3.04Å; M139-V161 HydrophobicContact CB-CG2 4.21Å; M139-V161 HydrophobicContact CG-CB 4.37Å; M139-V161 HydrophobicContact CG-CG2 3.61Å; M139-V161 HydrophobicContact SD-CB 4.03Å; M139-V161 HydrophobicContact SD-CG2 3.19Å; M139-V161 WeakPolarHBondContact SD-CG2 3.34Å; V161-F198 HydrophobicContact CG2-CE2 4.11Å; V161-F198 HydrophobicContact CG2-CZ 3.59Å; V161-Y200 HydrophobicContact CG1-CE1 4.02Å; V161-M228 HydrophobicContact CG1-CB 3.76Å; V161-M228 HydrophobicContact CG1-CE 3.6Å; V161-T229 WeakPolarHBondContact CA-O 3.29Å
162	K	71.1	Confident	77.4	Confident	33 Å²	33	47.1 Å²	47.1	14%	0.143	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	149.4	172.9	-73.4	-172.2	168.8	-168.8	0	110.3	I160 T229 H245	I160-K162 HydrophobicContact CG2-CG 4.24Å; K162-T229 PolarHBondContact N-O 2.87Å; K162-T229 PolarHBondContact O-N 3.41Å; K162-H245 PolarHBondContact NZ-O 2.89Å
163	P	69.2	Low	78.3	Confident	10 Å²	10	50.7 Å²	50.7	7%	0.065	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	145.5	171.1	-15.3	27.3	0	0	0	112.5	I132 Y221 M228	I132-P163 HydrophobicContact CG2-CB 4.5Å; I132-P163 HydrophobicContact CG2-CG 3.41Å; I132-P163 VanDerWaalsContact CG2-CG 3.41Å; P163-Y221 HydrophobicContact CB-CD2 3.58Å; P163-Y221 HydrophobicContact CB-CE2 3.18Å; P163-Y221 HydrophobicContact CG-CE2 4.26Å; P163-M228 HydrophobicContact CB-CE 4.33Å; P163-M228 HydrophobicContact CB-SD 3.93Å; P163-M228 HydrophobicContact CG-CE 4Å; P163-M228 HydrophobicContact CG-SD 4.09Å
164	G	73.3	Confident	78.8	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.01	25%	0.254	C	S	.	.	S	Bend	trans	118.9	172.1	-179.7	0	0	0	0	0	113	V219 I220 Q227 M228 T229	G164-V219 VanDerWaalsContact C-CG1 3.42Å; G164-I220 WeakPolarHBondContact CA-O 3.17Å; G164-Q227 PolarHBondContact N-O 2.91Å; G164-Q227 CarbonylContact O-C 3.48Å; G164-M228 CarbonylContact O-C 3.58Å; G164-T229 PolarHBondContact O-N 2.94Å; G164-T229 PolarHBondContact O-OG1 3.45Å
165	L	75.2	Confident	79.5	Confident	38 Å²	38	51.4 Å²	51.4	20%	0.199	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	154.7	168.5	-84	-175.8	0	0	0	112.7	S199 V219 I220 Q227 T229	L165-S199 WeakPolarHBondContact CD2-OG 2.96Å; L165-V219 VanDerWaalsContact C-CG1 3.47Å; L165-V219 CarbonylContact O-C 3.49Å; L165-V219 WeakPolarHBondContact O-CA 3.39Å; L165-V219 WeakPolarHBondContact O-CG1 3.21Å; L165-I220 PolarHBondContact N-O 2.82Å; L165-I220 PolarHBondContact O-N 2.8Å; L165-Q227 HydrophobicContact CD1-CB 4.41Å; L165-Q227 HydrophobicContact CD1-CG 4.11Å; L165-Q227 HydrophobicContact CD2-CB 3.93Å; L165-Q227 HydrophobicContact CD2-CG 4.18Å; L165-Q227 HydrophobicContact CG-CB 3.64Å; L165-Q227 VanDerWaalsContact CG-CD 3.44Å; L165-Q227 HydrophobicContact CG-CG 3.88Å; L165-T229 WeakPolarHBondContact CA-OG1 3.5Å
166	P	76.2	Confident	80	Confident	3 Å²	3	49 Å²	49	2%	0.019	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	149	166.5	-9.3	23.7	0	0	0	110.2	F170 I171 Y211 M215 T229	P166-F170 HydrophobicContact CB-CB 3.94Å; P166-F170 HydrophobicContact CB-CD1 3.32Å; P166-F170 HydrophobicContact CB-CE1 4.04Å; P166-F170 HydrophobicContact CB-CG 3.84Å; P166-F170 HydrophobicContact CG-CD1 3.93Å; P166-F170 HydrophobicContact CG-CE1 4.22Å; P166-I171 HydrophobicContact CB-CG1 4.07Å; P166-I171 HydrophobicContact CG-CG1 4.4Å; P166-I171 VanDerWaalsContact O-CD1 3.3Å; P166-I171 WeakPolarHBondContact O-CD1 3.13Å; P166-Y211 HydrophobicContact CG-CE1 4.43Å; P166-Y211 HydrophobicContact CG-CE2 3.98Å; P166-M215 HydrophobicContact CB-SD 3.98Å; P166-M215 HydrophobicContact CG-SD 3.94Å; P166-T229 WeakPolarHBondContact CD-OG1 3.41Å; P166-T229 HydrophobicContact CG-CG2 4.03Å
167	D	78.8	Confident	80.6	Confident	52 Å²	52	49.5 Å²	49.5	28%	0.278	26%	0.258	S	S	.	.			trans	-64.2	163.6	175	70.2	32	0	0	0	112.3	K169 F170 I171 I220	D167-K169 PolarHBondContact O-N 3.48Å; D167-K169 WeakPolarHBondContact OD1-CA 3.31Å; D167-K169 WeakPolarHBondContact OD1-CB 3.33Å; D167-K169 PolarHBondContact OD1-N 2.97Å; D167-K169 VanDerWaalsContact OD1-N 3.08Å; D167-F170 PolarHBondContact O-N 2.75Å; D167-F170 VanDerWaalsContact O-N 3.14Å; D167-F170 WeakPolarHBondContact OD1-CB 3.06Å; D167-F170 PolarHBondContact OD1-N 2.85Å; D167-I171 WeakPolarHBondContact O-CG1 2.91Å; D167-I171 PolarHBondContact O-N 3.26Å; D167-I220 HydrophobicContact CB-CD1 3.59Å; D167-I220 HydrophobicContact CB-CG1 3.93Å
168	N	80.8	Confident	81.2	Confident	133 Å²	133	56.5 Å²	56.5	71%	0.711	29%	0.288	S	S	*	.	H	α-helix	trans	-59.6	-31.4	-177.7	-73.9	-19.1	0	0	0	112.8	I171 S172	N168-I171 PolarHBondContact O-N 2.94Å; N168-S172 WeakPolarHBondContact O-CB 3.48Å; N168-S172 PolarHBondContact O-N 3.43Å; N168-S172 PolarHBondContact O-OG 3.44Å; N168-S172 VanDerWaalsContact O-OG 3.13Å
169	K	83.1	Confident	82	Confident	161 Å²	161	57.3 Å²	57.3	70%	0.7	29%	0.294	S	S	*	.	H	α-helix	trans	-68.8	-40.9	179	-177.8	-177.1	178.1	-177.1	0	111	D167 S172 S173	D167-K169 PolarHBondContact O-N 3.48Å; D167-K169 WeakPolarHBondContact OD1-CA 3.31Å; D167-K169 WeakPolarHBondContact OD1-CB 3.33Å; D167-K169 PolarHBondContact OD1-N 2.97Å; D167-K169 VanDerWaalsContact OD1-N 3.08Å; K169-S172 PolarHBondContact O-OG 3.1Å; K169-S173 WeakPolarHBondContact O-CB 3.45Å; K169-S173 PolarHBondContact O-N 3.25Å; K169-S173 PolarHBondContact O-OG 2.83Å
170	F	84.5	Confident	82.6	Confident	22 Å²	22	63.1 Å²	63.1	10%	0.096	33%	0.325	C	S	.	.	H	α-helix	trans	-66.4	-48	174.8	-174.1	-84.3	0	0	0	110.4	P166 D167 S172 S173 Y174 T197 Y211 M215	P166-F170 HydrophobicContact CB-CB 3.94Å; P166-F170 HydrophobicContact CB-CD1 3.32Å; P166-F170 HydrophobicContact CB-CE1 4.04Å; P166-F170 HydrophobicContact CB-CG 3.84Å; P166-F170 HydrophobicContact CG-CD1 3.93Å; P166-F170 HydrophobicContact CG-CE1 4.22Å; D167-F170 PolarHBondContact O-N 2.75Å; D167-F170 VanDerWaalsContact O-N 3.14Å; D167-F170 WeakPolarHBondContact OD1-CB 3.06Å; D167-F170 PolarHBondContact OD1-N 2.85Å; F170-S172 VanDerWaalsContact C-N 3.34Å; F170-S172 PolarHBondContact O-N 2.75Å; F170-S173 PolarHBondContact O-N 3.45Å; F170-Y174 HydrophobicContact CD1-CD2 4.27Å; F170-Y174 AromaticContact CD2-CD2 3.52Å; F170-Y174 HydrophobicContact CD2-CD2 3.52Å; F170-Y174 AromaticContact CD2-CE2 3.88Å; F170-Y174 HydrophobicContact CD2-CE2 3.88Å; F170-Y174 HydrophobicContact CE1-CD2 4.38Å; F170-Y174 AromaticContact CE2-CD2 3.62Å; F170-Y174 HydrophobicContact CE2-CD2 3.62Å; F170-Y174 HydrophobicContact CE2-CE2 4.05Å; F170-Y174 HydrophobicContact CE2-CG 4.3Å; F170-Y174 AromaticContact CG-CD2 3.88Å; F170-Y174 HydrophobicContact CG-CD2 3.88Å; F170-Y174 HydrophobicContact CZ-CD2 4.08Å; F170-Y174 HydrophobicContact CZ-CG 4.37Å; F170-Y174 WeakPolarHBondContact O-CD2 3.4Å; F170-Y174 PolarHBondContact O-N 2.82Å; F170-T197 HydrophobicContact CE1-CG2 4.29Å; F170-T197 HydrophobicContact CZ-CG2 4.36Å; F170-Y211 HydrophobicContact CD1-CD1 4.34Å; F170-Y211 HydrophobicContact CE1-CD1 4.06Å; F170-Y211 HydrophobicContact CE1-CD2 4.39Å; F170-Y211 AromaticContact CE1-CG 3.85Å; F170-Y211 HydrophobicContact CE1-CG 3.85Å; F170-M215 HydrophobicContact CD2-CG 4.4Å; F170-M215 HydrophobicContact CE1-CG 4.49Å; F170-M215 HydrophobicContact CE2-CB 4.25Å; F170-M215 HydrophobicContact CE2-CG 4.11Å; F170-M215 HydrophobicContact CZ-CB 4.15Å; F170-M215 HydrophobicContact CZ-CG 4.13Å
171	I	86.1	Confident	83	Confident	41 Å²	41	63.1 Å²	63.1	21%	0.21	33%	0.325	C	S	.	.	H	α-helix	trans	-57.2	-48.5	179.1	-66	171.9	0	0	0	110.4	P166 D167 N168 S173 I175 Y211	P166-I171 HydrophobicContact CB-CG1 4.07Å; P166-I171 HydrophobicContact CG-CG1 4.4Å; P166-I171 VanDerWaalsContact O-CD1 3.3Å; P166-I171 WeakPolarHBondContact O-CD1 3.13Å; D167-I171 WeakPolarHBondContact O-CG1 2.91Å; D167-I171 PolarHBondContact O-N 3.26Å; N168-I171 PolarHBondContact O-N 2.94Å; I171-S173 PolarHBondContact O-N 3.47Å; I171-I175 HydrophobicContact CG2-CD1 4.39Å; I171-I175 VanDerWaalsContact O-CB 3.27Å; I171-I175 WeakPolarHBondContact O-CB 3.39Å; I171-I175 WeakPolarHBondContact O-CG2 3.35Å; I171-I175 PolarHBondContact O-N 3.22Å; I171-Y211 HydrophobicContact CB-CE1 4.5Å; I171-Y211 HydrophobicContact CG1-CE1 4.06Å; I171-Y211 HydrophobicContact CG2-CE1 4.47Å
172	S	85.9	Confident	83	Confident	91 Å²	91	67.9 Å²	67.9	64%	0.636	36%	0.355	S	S	*	.	H	α-helix	trans	-65.4	-26	-177.8	63.2	0	0	0	0	113.7	N168 K169 F170	N168-S172 WeakPolarHBondContact O-CB 3.48Å; N168-S172 PolarHBondContact O-N 3.43Å; N168-S172 PolarHBondContact O-OG 3.44Å; N168-S172 VanDerWaalsContact O-OG 3.13Å; K169-S172 PolarHBondContact O-OG 3.1Å; F170-S172 VanDerWaalsContact C-N 3.34Å; F170-S172 PolarHBondContact O-N 2.75Å
173	S	87.8	Confident	83.2	Confident	76 Å²	76	71.6 Å²	71.6	53%	0.531	38%	0.375	S	S	.	.	H	α-helix	trans	-94.7	-30	-173.7	-52.8	0	0	0	0	113.3	K169 F170 I171	K169-S173 WeakPolarHBondContact O-CB 3.45Å; K169-S173 PolarHBondContact O-N 3.25Å; K169-S173 PolarHBondContact O-OG 2.83Å; F170-S173 PolarHBondContact O-N 3.45Å; I171-S173 PolarHBondContact O-N 3.47Å
174	Y	88.8	Confident	83.8	Confident	105 Å²	105	73.6 Å²	73.6	41%	0.412	39%	0.385	S	S	.	.	H	α-helix	trans	-123.5	-1.5	-166.5	-63.5	-68.6	0	0	0	114.6	F170 L176 Y211 S212 G213	F170-Y174 HydrophobicContact CD1-CD2 4.27Å; F170-Y174 AromaticContact CD2-CD2 3.52Å; F170-Y174 HydrophobicContact CD2-CD2 3.52Å; F170-Y174 AromaticContact CD2-CE2 3.88Å; F170-Y174 HydrophobicContact CD2-CE2 3.88Å; F170-Y174 HydrophobicContact CE1-CD2 4.38Å; F170-Y174 AromaticContact CE2-CD2 3.62Å; F170-Y174 HydrophobicContact CE2-CD2 3.62Å; F170-Y174 HydrophobicContact CE2-CE2 4.05Å; F170-Y174 HydrophobicContact CE2-CG 4.3Å; F170-Y174 AromaticContact CG-CD2 3.88Å; F170-Y174 HydrophobicContact CG-CD2 3.88Å; F170-Y174 HydrophobicContact CZ-CD2 4.08Å; F170-Y174 HydrophobicContact CZ-CG 4.37Å; F170-Y174 WeakPolarHBondContact O-CD2 3.4Å; F170-Y174 PolarHBondContact O-N 2.82Å; Y174-L176 PolarHBondContact O-N 3.19Å; Y174-Y211 CarbonylContact O-C 3.5Å; Y174-Y211 WeakPolarHBondContact O-CA 3.35Å; Y174-S212 PolarHBondContact O-N 2.98Å; Y174-S212 PolarHBondContact O-OG 3.05Å; Y174-G213 VanDerWaalsContact CD1-CA 3.44Å
175	I	89.8	Confident	84.3	Confident	71 Å²	71	73.8 Å²	73.8	36%	0.364	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	125.2	179.8	-166.9	162.4	0	0	0	110.8	I171 K178 Y211	I171-I175 HydrophobicContact CG2-CD1 4.39Å; I171-I175 VanDerWaalsContact O-CB 3.27Å; I171-I175 WeakPolarHBondContact O-CB 3.39Å; I171-I175 WeakPolarHBondContact O-CG2 3.35Å; I171-I175 PolarHBondContact O-N 3.22Å; I175-K178 HydrophobicContact CD1-CG 4.32Å; I175-Y211 HydrophobicContact CB-CD1 4.21Å; I175-Y211 HydrophobicContact CB-CE1 4.38Å; I175-Y211 HydrophobicContact CG1-CD1 4.45Å; I175-Y211 HydrophobicContact CG1-CE1 4.38Å
176	L	89.3	Confident	84.6	Confident	58 Å²	58	72 Å²	72	30%	0.304	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-56.9	174	-73.4	171.7	0	0	0	109.8	Y174 C195 L210	Y174-L176 PolarHBondContact O-N 3.19Å; L176-C195 HydrophobicContact CD1-CB 4Å; L176-L210 HydrophobicContact CB-CB 4.36Å; L176-L210 WeakPolarHBondContact CB-O 3.46Å; L176-L210 PolarHBondContact N-O 2.02Å
177	N	91.3	Very high	84.8	Confident	104 Å²	104	72.7 Å²	72.7	56%	0.556	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-164.2	160.5	-177.5	-116.6	-16.6	0	0	0	112	I179 L210	N177-I179 HydrophobicContact CB-CG2 4.19Å; N177-L210 PolarHBondContact N-O 3.43Å; N177-L210 PolarHBondContact O-N 3.25Å
178	K	92.7	Very high	85.1	Confident	151 Å²	151	71.8 Å²	71.8	66%	0.657	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.6	164.4	-66.1	-175.8	179.4	176.8	0	108.7	I175 C208	I175-K178 HydrophobicContact CD1-CG 4.32Å; K178-C208 CarbonylContact C-O 3.48Å; K178-C208 VanDerWaalsContact CA-O 3.3Å; K178-C208 WeakPolarHBondContact CA-O 3.39Å
179	I	91	Very high	85.5	Confident	44 Å²	44	65.5 Å²	65.5	23%	0.226	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	162.2	-173.3	64.5	169	0	0	0	111.1	N177 E188 C208 L210	N177-I179 HydrophobicContact CB-CG2 4.19Å; I179-E188 HydrophobicContact CD1-CB 3.49Å; I179-E188 VanDerWaalsContact CD1-CB 3.49Å; I179-E188 HydrophobicContact CD1-CG 3.73Å; I179-C208 HydrophobicContact CD1-CB 4.42Å; I179-C208 HydrophobicContact CG1-CB 3.81Å; I179-C208 PolarHBondContact N-O 2.56Å; I179-C208 PolarHBondContact O-N 3.11Å; I179-L210 HydrophobicContact CD1-CD1 3.68Å; I179-L210 HydrophobicContact CD1-CD2 4.43Å; I179-L210 HydrophobicContact CD1-CG 4.09Å; I179-L210 HydrophobicContact CG1-CD1 4.36Å; I179-L210 HydrophobicContact CG1-CG 4.31Å
180	N	90.3	Very high	85.5	Confident	125 Å²	125	61 Å²	61	67%	0.668	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	105.9	167.1	-151.7	1.9	0	0	0	107.8	R206	N180-R206 CarbonylContact C-O 3.54Å; N180-R206 WeakPolarHBondContact CA-O 3.48Å; N180-R206 PolarHBondContact OD1-O 2.64Å
181	A	82.5	Confident	85.5	Confident	4 Å²	4	66.3 Å²	66.3	3%	0.033	35%	0.353	C	S	.	.			trans	-64.2	141	-175.4	0	0	0	0	0	112	E188 R206 C208	A181-E188 WeakPolarHBondContact CA-OE1 3.47Å; A181-E188 HydrophobicContact CB-CG 3.45Å; A181-E188 VanDerWaalsContact CB-CG 3.45Å; A181-R206 HydrophobicContact CB-CB 4.32Å; A181-R206 PolarHBondContact N-O 2.88Å; A181-R206 WeakPolarHBondContact O-CD 3.23Å; A181-C208 VanDerWaalsContact CB-SG 3.56Å
182	T	76.3	Confident	85.5	Confident	102 Å²	102	66.7 Å²	66.7	63%	0.626	36%	0.355	S	S	*	.	S	Bend	trans	-75.4	-37.6	171.1	55.4	0	0	0	0	111.4	E188	T182-E188 PolarHBondContact N-OE1 3.45Å; T182-E188 PolarHBondContact OG1-OE1 3Å
183	I	74	Confident	85.4	Confident	112 Å²	112	66.2 Å²	66.2	57%	0.574	35%	0.35	S	S	*	.	S	Bend	trans	-113.4	-78.8	-178.7	-55.6	173.9	0	0	0	110.4
184	N	81.5	Confident	85.4	Confident	52 Å²	52	70 Å²	70	28%	0.278	35%	0.354	S	S	.	.			trans	-155.5	164.3	177.6	69.3	58.9	0	0	0	109.7	A186 S187 E188	N184-A186 VanDerWaalsContact C-N 3.33Å; N184-A186 PolarHBondContact O-N 3.25Å; N184-A186 WeakPolarHBondContact OD1-CA 3.27Å; N184-A186 WeakPolarHBondContact OD1-CB 3.43Å; N184-A186 PolarHBondContact OD1-N 2.68Å; N184-S187 PolarHBondContact ND2-OG 2.91Å; N184-S187 PolarHBondContact O-N 3.39Å; N184-S187 PolarHBondContact OD1-N 3.06Å; N184-S187 PolarHBondContact OD1-OG 2.94Å; N184-E188 WeakPolarHBondContact O-CG 3.48Å; N184-E188 PolarHBondContact O-N 2.73Å; N184-E188 VanDerWaalsContact O-N 3.11Å
185	C	83.8	Confident	85.4	Confident	4 Å²	4	65 Å²	65	3%	0.027	33%	0.334	C	S	.	.	H	α-helix	trans	-66.2	-29.6	-175	-57.6	0	0	0	0	115.1	C189 F198 Y200 P205 C208	C185-C189 VanDerWaalsContact O-CB 3.28Å; C185-C189 WeakPolarHBondContact O-CB 3.28Å; C185-C189 PolarHBondContact O-N 3.03Å; C185-F198 HydrophobicContact CB-CB 4.38Å; C185-F198 HydrophobicContact CB-CD2 3.37Å; C185-F198 HydrophobicContact CB-CE2 3.8Å; C185-F198 HydrophobicContact CB-CG 4.03Å; C185-Y200 HydrophobicContact CB-CD1 4.37Å; C185-Y200 VanDerWaalsContact SG-CB 3.56Å; C185-P205 PolarHBondContact SG-O 2.78Å; C185-C208 WeakPolarHBondContact CA-SG 3.29Å; C185-C208 HydrophobicContact CB-CB 3.69Å; C185-C208 WeakPolarHBondContact CB-SG 3.28Å; C185-C208 VanDerWaalsContact SG-CA 3.58Å; C185-C208 WeakPolarHBondContact SG-CB 3.41Å; C185-C208 CovalentContact SG-SG 2.02Å; C185-C208 PolarHBondContact SG-SG 2.79Å
186	A	82.7	Confident	85.2	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-66.3	-49	176.8	0	0	0	0	0	110.4	M139 N184 E188 C189 E190 F198	M139-A186 HydrophobicContact CB-CB 4.41Å; M139-A186 HydrophobicContact CE-CB 4.5Å; N184-A186 VanDerWaalsContact C-N 3.33Å; N184-A186 PolarHBondContact O-N 3.25Å; N184-A186 WeakPolarHBondContact OD1-CA 3.27Å; N184-A186 WeakPolarHBondContact OD1-CB 3.43Å; N184-A186 PolarHBondContact OD1-N 2.68Å; A186-E188 PolarHBondContact O-N 2.72Å; A186-C189 CarbonylContact O-C 3.48Å; A186-C189 WeakPolarHBondContact O-CB 3.34Å; A186-C189 PolarHBondContact O-N 2.89Å; A186-C189 VanDerWaalsContact O-N 3.12Å; A186-E190 WeakPolarHBondContact O-CG 3.35Å; A186-E190 PolarHBondContact O-N 2.89Å; A186-F198 HydrophobicContact CB-CE1 3.66Å; A186-F198 HydrophobicContact CB-CE2 4.48Å; A186-F198 HydrophobicContact CB-CZ 3.61Å
187	S	79.9	Confident	85.2	Confident	18 Å²	18	59 Å²	59	13%	0.126	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-42.4	178	-59	0	0	0	0	112	N184 C189 E190 L191	N184-S187 PolarHBondContact ND2-OG 2.91Å; N184-S187 PolarHBondContact O-N 3.39Å; N184-S187 PolarHBondContact OD1-N 3.06Å; N184-S187 PolarHBondContact OD1-OG 2.94Å; S187-C189 VanDerWaalsContact C-N 3.3Å; S187-C189 PolarHBondContact O-N 2.95Å; S187-E190 WeakPolarHBondContact O-CB 3.19Å; S187-E190 PolarHBondContact O-N 3.07Å; S187-E190 VanDerWaalsContact O-N 3.14Å; S187-L191 WeakPolarHBondContact O-CG 3.4Å; S187-L191 PolarHBondContact O-N 3.4Å
188	E	85.7	Confident	85.1	Confident	33 Å²	33	54.1 Å²	54.1	15%	0.154	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-36.7	174.8	-63.6	-66.1	168.6	0	0	112.4	I179 A181 T182 N184 A186 E190 L191 N192	I179-E188 HydrophobicContact CD1-CB 3.49Å; I179-E188 VanDerWaalsContact CD1-CB 3.49Å; I179-E188 HydrophobicContact CD1-CG 3.73Å; A181-E188 WeakPolarHBondContact CA-OE1 3.47Å; A181-E188 HydrophobicContact CB-CG 3.45Å; A181-E188 VanDerWaalsContact CB-CG 3.45Å; T182-E188 PolarHBondContact N-OE1 3.45Å; T182-E188 PolarHBondContact OG1-OE1 3Å; N184-E188 WeakPolarHBondContact O-CG 3.48Å; N184-E188 PolarHBondContact O-N 2.73Å; N184-E188 VanDerWaalsContact O-N 3.11Å; A186-E188 PolarHBondContact O-N 2.72Å; E188-E190 VanDerWaalsContact C-N 3.33Å; E188-L191 PolarHBondContact O-N 2.63Å; E188-N192 PolarHBondContact O-N 3.11Å
189	C	87.8	Confident	84.9	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-70.3	-28.8	174.8	-165.1	0	0	0	0	111.9	Y159 C185 A186 S187 C195 F198 L210	Y159-C189 PolarHBondContact OH-SG 2.9Å; C185-C189 VanDerWaalsContact O-CB 3.28Å; C185-C189 WeakPolarHBondContact O-CB 3.28Å; C185-C189 PolarHBondContact O-N 3.03Å; A186-C189 CarbonylContact O-C 3.48Å; A186-C189 WeakPolarHBondContact O-CB 3.34Å; A186-C189 PolarHBondContact O-N 2.89Å; A186-C189 VanDerWaalsContact O-N 3.12Å; S187-C189 VanDerWaalsContact C-N 3.3Å; S187-C189 PolarHBondContact O-N 2.95Å; C189-C195 VanDerWaalsContact CA-SG 3.52Å; C189-C195 HydrophobicContact CB-CB 4.01Å; C189-C195 WeakPolarHBondContact CB-SG 3.4Å; C189-C195 WeakPolarHBondContact O-CB 3.21Å; C189-C195 VanDerWaalsContact SG-C 3.58Å; C189-C195 WeakPolarHBondContact SG-CB 3.48Å; C189-C195 CovalentContact SG-SG 2.02Å; C189-C195 PolarHBondContact SG-SG 3.42Å; C189-F198 HydrophobicContact CB-CB 4.17Å; C189-F198 HydrophobicContact CB-CD1 3.99Å; C189-F198 HydrophobicContact CB-CG 4.43Å; C189-L210 HydrophobicContact CB-CD2 3.94Å
190	E	84	Confident	84.6	Confident	67 Å²	67	46.6 Å²	46.6	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-69.6	-35	171.8	-72.3	177.3	172.5	0	0	112.8	S140 L143 Y159 A186 S187 E188 N192	S140-E190 WeakPolarHBondContact CB-OE1 3.5Å; L143-E190 WeakPolarHBondContact CD1-OE1 3.28Å; Y159-E190 HydrophobicContact CD2-CG 4.27Å; Y159-E190 HydrophobicContact CE2-CG 3.65Å; A186-E190 WeakPolarHBondContact O-CG 3.35Å; A186-E190 PolarHBondContact O-N 2.89Å; S187-E190 WeakPolarHBondContact O-CB 3.19Å; S187-E190 PolarHBondContact O-N 3.07Å; S187-E190 VanDerWaalsContact O-N 3.14Å; E188-E190 VanDerWaalsContact C-N 3.33Å; E190-N192 VanDerWaalsContact C-N 3.26Å; E190-N192 PolarHBondContact O-N 3.38Å
191	L	84.6	Confident	84	Confident	134 Å²	134	43.3 Å²	43.3	70%	0.702	22%	0.224	S	C	*	.	H	α-helix	trans	-70.5	-22.5	177.7	-67.6	172.9	0	0	0	112.8	S187 E188	S187-L191 WeakPolarHBondContact O-CG 3.4Å; S187-L191 PolarHBondContact O-N 3.4Å; E188-L191 PolarHBondContact O-N 2.63Å
192	N	86.7	Confident	83.5	Confident	49 Å²	49	44.7 Å²	44.7	26%	0.262	23%	0.232	S	C	.	.	S	Bend	trans	-95.3	111.7	174.8	-172.8	-32.6	0	0	0	110.4	E188 E190 Y194 C195	E188-N192 PolarHBondContact O-N 3.11Å; E190-N192 VanDerWaalsContact C-N 3.26Å; E190-N192 PolarHBondContact O-N 3.38Å; N192-Y194 PolarHBondContact O-N 3.01Å; N192-Y194 PolarHBondContact OD1-N 2.9Å; N192-C195 HydrophobicContact CB-CB 3.82Å; N192-C195 WeakPolarHBondContact O-CB 3.1Å; N192-C195 PolarHBondContact O-N 3.31Å
193	P	83.6	Confident	83.2	Confident	81 Å²	81	45.3 Å²	45.3	53%	0.526	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-23.1	-175.3	24.3	-33.7	0	0	0	113.6	I147	I147-P193 HydrophobicContact CD1-CB 4.21Å; I147-P193 WeakPolarHBondContact CD1-O 3.36Å
194	Y	86.9	Confident	83.3	Confident	156 Å²	156	47.8 Å²	47.8	61%	0.612	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-9.7	178.8	-56.6	-71.2	0	0	0	113.4	N192 S212	N192-Y194 PolarHBondContact O-N 3.01Å; N192-Y194 PolarHBondContact OD1-N 2.9Å; Y194-S212 VanDerWaalsContact O-CA 3.26Å; Y194-S212 WeakPolarHBondContact O-CA 3.24Å
195	C	88.3	Confident	82.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.			trans	-82.9	127.7	-176.2	-169.9	0	0	0	0	111.3	Y159 L176 C189 N192 T197 Y211	Y159-C195 PolarHBondContact OH-O 3.37Å; L176-C195 HydrophobicContact CD1-CB 4Å; C189-C195 VanDerWaalsContact CA-SG 3.52Å; C189-C195 HydrophobicContact CB-CB 4.01Å; C189-C195 WeakPolarHBondContact CB-SG 3.4Å; C189-C195 WeakPolarHBondContact O-CB 3.21Å; C189-C195 VanDerWaalsContact SG-C 3.58Å; C189-C195 WeakPolarHBondContact SG-CB 3.48Å; C189-C195 CovalentContact SG-SG 2.02Å; C189-C195 PolarHBondContact SG-SG 3.42Å; N192-C195 HydrophobicContact CB-CB 3.82Å; N192-C195 WeakPolarHBondContact O-CB 3.1Å; N192-C195 PolarHBondContact O-N 3.31Å; C195-T197 PolarHBondContact SG-O 3.32Å; C195-T197 VanDerWaalsContact SG-O 3.35Å; C195-Y211 WeakPolarHBondContact CA-O 2.99Å
196	L	86.8	Confident	82.6	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	27%	0.266	C	S	.	.			trans	-125.4	-20.9	-177.9	-59.3	-179.9	0	0	0	112.6	L151 Y159 Y211 S212 V214 K232	L151-L196 HydrophobicContact CD1-CD1 3.32Å; Y159-L196 WeakPolarHBondContact CE1-O 3.44Å; L196-Y211 PolarHBondContact N-O 3.09Å; L196-S212 WeakPolarHBondContact CD1-O 3.45Å; L196-V214 HydrophobicContact CB-CG2 4.19Å; L196-V214 HydrophobicContact CD1-CG2 3.49Å; L196-V214 VanDerWaalsContact CD1-CG2 3.49Å; L196-V214 HydrophobicContact CG-CG2 4.41Å; L196-K232 HydrophobicContact CD2-CD 3.9Å; L196-K232 PolarHBondContact O-N 2.02Å
197	T	88.5	Confident	82.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	147.2	177.5	-58.3	0	0	0	0	108	F170 C195 Y211 G213 M215 T229 G230	F170-T197 HydrophobicContact CE1-CG2 4.29Å; F170-T197 HydrophobicContact CZ-CG2 4.36Å; C195-T197 PolarHBondContact SG-O 3.32Å; C195-T197 VanDerWaalsContact SG-O 3.35Å; T197-Y211 HydrophobicContact CG2-CD2 3.94Å; T197-Y211 PolarHBondContact N-O 3.47Å; T197-Y211 WeakPolarHBondContact O-CD2 3.22Å; T197-Y211 PolarHBondContact O-N 3.07Å; T197-G213 WeakPolarHBondContact CB-O 3.22Å; T197-G213 PolarHBondContact OG1-O 2.79Å; T197-M215 HydrophobicContact CG2-CB 3.97Å; T197-M215 HydrophobicContact CG2-CG 4.43Å; T197-M215 HydrophobicContact CG2-SD 4.18Å; T197-M215 PolarHBondContact OG1-N 2.7Å; T197-T229 HydrophobicContact CG2-CG2 3.59Å; T197-G230 CarbonylContact C-O 3.6Å; T197-G230 WeakPolarHBondContact CA-O 3.17Å; T197-G230 WeakPolarHBondContact CG2-O 3.37Å
198	F	89.7	Confident	83.3	Confident	1 Å²	1	58 Å²	58	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	157.4	171.6	64.9	-92.4	0	0	0	110.1	M139 Y159 V161 C185 A186 C189 Y200 S209 L210 T229 G230	M139-F198 HydrophobicContact SD-CZ 4.37Å; Y159-F198 AromaticContact CD1-CD1 3.89Å; Y159-F198 HydrophobicContact CD1-CD1 3.89Å; Y159-F198 AromaticContact CD1-CE1 3.47Å; Y159-F198 HydrophobicContact CD1-CE1 3.47Å; Y159-F198 VanDerWaalsContact CD1-CE1 3.47Å; Y159-F198 HydrophobicContact CD2-CE1 4.47Å; Y159-F198 AromaticContact CE1-CD1 3.83Å; Y159-F198 HydrophobicContact CE1-CD1 3.83Å; Y159-F198 AromaticContact CE1-CE1 3.9Å; Y159-F198 HydrophobicContact CE1-CE1 3.9Å; Y159-F198 AromaticContact CG-CE1 3.79Å; Y159-F198 HydrophobicContact CG-CE1 3.79Å; V161-F198 HydrophobicContact CG2-CE2 4.11Å; V161-F198 HydrophobicContact CG2-CZ 3.59Å; C185-F198 HydrophobicContact CB-CB 4.38Å; C185-F198 HydrophobicContact CB-CD2 3.37Å; C185-F198 HydrophobicContact CB-CE2 3.8Å; C185-F198 HydrophobicContact CB-CG 4.03Å; A186-F198 HydrophobicContact CB-CE1 3.66Å; A186-F198 HydrophobicContact CB-CE2 4.48Å; A186-F198 HydrophobicContact CB-CZ 3.61Å; C189-F198 HydrophobicContact CB-CB 4.17Å; C189-F198 HydrophobicContact CB-CD1 3.99Å; C189-F198 HydrophobicContact CB-CG 4.43Å; F198-Y200 HydrophobicContact CD2-CD1 4.02Å; F198-Y200 HydrophobicContact CD2-CE1 4.45Å; F198-Y200 AromaticContact CE2-CD1 3.81Å; F198-Y200 HydrophobicContact CE2-CD1 3.81Å; F198-Y200 AromaticContact CE2-CE1 3.79Å; F198-Y200 HydrophobicContact CE2-CE1 3.79Å; F198-S209 CarbonylContact C-O 3.43Å; F198-S209 WeakPolarHBondContact CA-O 3.16Å; F198-L210 HydrophobicContact CB-CD2 3.78Å; F198-T229 CarbonylContact O-C 3.52Å; F198-T229 VanDerWaalsContact O-CA 3.31Å; F198-T229 WeakPolarHBondContact O-CA 3.19Å; F198-T229 WeakPolarHBondContact O-CG2 2.98Å; F198-G230 PolarHBondContact N-O 3.22Å; F198-G230 PolarHBondContact O-N 3.17Å
199	S	88.2	Confident	83.6	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	154	170	71.5	0	0	0	0	111.5	L165 C208 S209 Y211 M228	L165-S199 WeakPolarHBondContact CD2-OG 2.96Å; S199-C208 CarbonylContact O-C 3.56Å; S199-C208 WeakPolarHBondContact O-CA 3.05Å; S199-S209 PolarHBondContact N-O 2.79Å; S199-S209 PolarHBondContact O-N 2.86Å; S199-S209 WeakPolarHBondContact OG-CB 3.43Å; S199-Y211 WeakPolarHBondContact OG-CE2 3.44Å; S199-Y211 PolarHBondContact OG-OH 3.09Å; S199-M228 CarbonylContact C-O 3.48Å; S199-M228 WeakPolarHBondContact CA-O 3.49Å; S199-M228 WeakPolarHBondContact CB-O 3.45Å
200	Y	85.1	Confident	83.8	Confident	35 Å²	35	57.7 Å²	57.7	14%	0.137	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	158.9	177.2	64.1	-84.9	0	0	0	110.9	V161 C185 F198 P205 Q227 M228	V161-Y200 HydrophobicContact CG1-CE1 4.02Å; C185-Y200 HydrophobicContact CB-CD1 4.37Å; C185-Y200 VanDerWaalsContact SG-CB 3.56Å; F198-Y200 HydrophobicContact CD2-CD1 4.02Å; F198-Y200 HydrophobicContact CD2-CE1 4.45Å; F198-Y200 AromaticContact CE2-CD1 3.81Å; F198-Y200 HydrophobicContact CE2-CD1 3.81Å; F198-Y200 AromaticContact CE2-CE1 3.79Å; F198-Y200 HydrophobicContact CE2-CE1 3.79Å; Y200-P205 HydrophobicContact CD2-CB 4.1Å; Y200-P205 HydrophobicContact CE2-CB 4.36Å; Y200-Q227 CarbonylContact O-C 3.56Å; Y200-Q227 WeakPolarHBondContact O-CA 3.4Å; Y200-M228 HydrophobicContact CD1-CB 3.93Å; Y200-M228 HydrophobicContact CD2-CB 4.19Å; Y200-M228 HydrophobicContact CD2-CG 4.42Å; Y200-M228 HydrophobicContact CE1-CB 3.44Å; Y200-M228 VanDerWaalsContact CE1-CB 3.44Å; Y200-M228 HydrophobicContact CE1-CG 4.26Å; Y200-M228 HydrophobicContact CE2-CB 3.75Å; Y200-M228 HydrophobicContact CE2-CG 3.74Å; Y200-M228 HydrophobicContact CG-CB 4.29Å; Y200-M228 PolarHBondContact N-O 3.17Å; Y200-M228 PolarHBondContact O-N 3.34Å
201	I	78.3	Confident	84.2	Confident	56 Å²	56	54.7 Å²	54.7	29%	0.287	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	133	169.9	-58	171.2	0	0	0	106.8	D203 R204 P205 E226 Q227	I201-D203 VanDerWaalsContact C-N 3.27Å; I201-D203 HydrophobicContact CG2-CB 4.33Å; I201-D203 PolarHBondContact O-N 2.85Å; I201-R204 HydrophobicContact CB-CB 4.33Å; I201-R204 CarbonylContact O-C 3.41Å; I201-R204 WeakPolarHBondContact O-CA 3.1Å; I201-R204 PolarHBondContact O-N 2.76Å; I201-R204 VanDerWaalsContact O-O 3.13Å; I201-P205 WeakPolarHBondContact O-CA 3.18Å; I201-P205 VanDerWaalsContact O-N 3.16Å; I201-E226 CarbonylContact C-O 3.46Å; I201-E226 WeakPolarHBondContact CA-O 3.36Å; I201-Q227 HydrophobicContact CG1-CG 3.91Å
202	V	72.2	Confident	84.4	Confident	32 Å²	32	50.2 Å²	50.2	19%	0.194	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-42.1	-177.2	179.4	0	0	0	0	111.2	T35 R204 P205 E226 M228	T35-V202 HydrophobicContact CG2-CB 4.08Å; T35-V202 HydrophobicContact CG2-CG1 3.57Å; V202-R204 PolarHBondContact O-N 2.87Å; V202-P205 WeakPolarHBondContact O-CD 3.4Å; V202-E226 HydrophobicContact CB-CB 4.04Å; V202-E226 HydrophobicContact CG2-CB 4.13Å; V202-E226 WeakPolarHBondContact CG2-O 3.49Å; V202-E226 PolarHBondContact N-O 2.96Å; V202-M228 HydrophobicContact CG2-CG 3.51Å; V202-M228 HydrophobicContact CG2-SD 4.1Å
203	D	68.8	Low	84.3	Confident	116 Å²	116	48.1 Å²	48.1	62%	0.62	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-13.6	175	-78.6	-13.2	0	0	0	114.4	I201	I201-D203 VanDerWaalsContact C-N 3.27Å; I201-D203 HydrophobicContact CG2-CB 4.33Å; I201-D203 PolarHBondContact O-N 2.85Å
204	R	77.2	Confident	84	Confident	163 Å²	163	45.3 Å²	45.3	62%	0.615	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	63.7	177.4	-57.8	-177.3	-172.8	-179.9	1.8	109.4	I201 V202 R206 L207	I201-R204 HydrophobicContact CB-CB 4.33Å; I201-R204 CarbonylContact O-C 3.41Å; I201-R204 WeakPolarHBondContact O-CA 3.1Å; I201-R204 PolarHBondContact O-N 2.76Å; I201-R204 VanDerWaalsContact O-O 3.13Å; V202-R204 PolarHBondContact O-N 2.87Å; R204-R206 PolarHBondContact O-N 3.07Å; R204-L207 HydrophobicContact CB-CB 4.03Å; R204-L207 PolarHBondContact O-N 2.74Å
205	P	71.8	Confident	83.1	Confident	69 Å²	69	38.3 Å²	38.3	45%	0.448	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	-9.3	-167.5	30.1	-34.9	0	0	0	113.4	C185 Y200 I201 V202	C185-P205 PolarHBondContact SG-O 2.78Å; Y200-P205 HydrophobicContact CD2-CB 4.1Å; Y200-P205 HydrophobicContact CE2-CB 4.36Å; I201-P205 WeakPolarHBondContact O-CA 3.18Å; I201-P205 VanDerWaalsContact O-N 3.16Å; V202-P205 WeakPolarHBondContact O-CD 3.4Å
206	R	78.9	Confident	81.6	Confident	142 Å²	142	39.3 Å²	39.3	54%	0.536	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-14.1	172.5	-65.3	-173.2	177.5	-174.9	1.4	113.4	N180 A181 R204 C208	N180-R206 CarbonylContact C-O 3.54Å; N180-R206 WeakPolarHBondContact CA-O 3.48Å; N180-R206 PolarHBondContact OD1-O 2.64Å; A181-R206 HydrophobicContact CB-CB 4.32Å; A181-R206 PolarHBondContact N-O 2.88Å; A181-R206 WeakPolarHBondContact O-CD 3.23Å; R204-R206 PolarHBondContact O-N 3.07Å; R206-C208 PolarHBondContact O-N 2.9Å; R206-C208 PolarHBondContact O-SG 2.96Å; R206-C208 VanDerWaalsContact O-SG 3.33Å
207	L	86.4	Confident	79.8	Confident	79 Å²	79	43 Å²	43	41%	0.414	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	96.9	175.5	-163.6	83.4	0	0	0	109	R204	R204-L207 HydrophobicContact CB-CB 4.03Å; R204-L207 PolarHBondContact O-N 2.74Å
208	C	89.4	Confident	77.9	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.007	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	139.2	-171.9	-47.1	0	0	0	0	111.2	K178 I179 A181 C185 S199 R206 L210	K178-C208 CarbonylContact C-O 3.48Å; K178-C208 VanDerWaalsContact CA-O 3.3Å; K178-C208 WeakPolarHBondContact CA-O 3.39Å; I179-C208 HydrophobicContact CD1-CB 4.42Å; I179-C208 HydrophobicContact CG1-CB 3.81Å; I179-C208 PolarHBondContact N-O 2.56Å; I179-C208 PolarHBondContact O-N 3.11Å; A181-C208 VanDerWaalsContact CB-SG 3.56Å; C185-C208 WeakPolarHBondContact CA-SG 3.29Å; C185-C208 HydrophobicContact CB-CB 3.69Å; C185-C208 WeakPolarHBondContact CB-SG 3.28Å; C185-C208 VanDerWaalsContact SG-CA 3.58Å; C185-C208 WeakPolarHBondContact SG-CB 3.41Å; C185-C208 CovalentContact SG-SG 2.02Å; C185-C208 PolarHBondContact SG-SG 2.79Å; S199-C208 CarbonylContact O-C 3.56Å; S199-C208 WeakPolarHBondContact O-CA 3.05Å; R206-C208 PolarHBondContact O-N 2.9Å; R206-C208 PolarHBondContact O-SG 2.96Å; R206-C208 VanDerWaalsContact O-SG 3.33Å; C208-L210 HydrophobicContact CB-CD2 4.18Å
209	S	92.5	Very high	76.3	Confident	20 Å²	20	48.6 Å²	48.6	14%	0.14	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.9	158.8	-55.1	0	0	0	0	108.3	F198 S199 Y211	F198-S209 CarbonylContact C-O 3.43Å; F198-S209 WeakPolarHBondContact CA-O 3.16Å; S199-S209 PolarHBondContact N-O 2.79Å; S199-S209 PolarHBondContact O-N 2.86Å; S199-S209 WeakPolarHBondContact OG-CB 3.43Å; S209-Y211 VanDerWaalsContact CB-OH 3.3Å; S209-Y211 WeakPolarHBondContact CB-OH 3.33Å; S209-Y211 VanDerWaalsContact O-CE2 3.31Å; S209-Y211 WeakPolarHBondContact O-CE2 3.27Å
210	L	92.6	Very high	74.7	Confident	5 Å²	5	52.9 Å²	52.9	3%	0.026	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	142.1	179.9	-59.4	-168.3	0	0	0	109.9	L176 N177 I179 C189 F198 C208	L176-L210 HydrophobicContact CB-CB 4.36Å; L176-L210 WeakPolarHBondContact CB-O 3.46Å; L176-L210 PolarHBondContact N-O 2.02Å; N177-L210 PolarHBondContact N-O 3.43Å; N177-L210 PolarHBondContact O-N 3.25Å; I179-L210 HydrophobicContact CD1-CD1 3.68Å; I179-L210 HydrophobicContact CD1-CD2 4.43Å; I179-L210 HydrophobicContact CD1-CG 4.09Å; I179-L210 HydrophobicContact CG1-CD1 4.36Å; I179-L210 HydrophobicContact CG1-CG 4.31Å; C189-L210 HydrophobicContact CB-CD2 3.94Å; F198-L210 HydrophobicContact CB-CD2 3.78Å; C208-L210 HydrophobicContact CB-CD2 4.18Å
211	Y	91.8	Very high	73.2	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.5	-177	-44.8	-90.5	0	0	0	112	P166 F170 I171 Y174 I175 C195 L196 T197 S199 S209	P166-Y211 HydrophobicContact CG-CE1 4.43Å; P166-Y211 HydrophobicContact CG-CE2 3.98Å; F170-Y211 HydrophobicContact CD1-CD1 4.34Å; F170-Y211 HydrophobicContact CE1-CD1 4.06Å; F170-Y211 HydrophobicContact CE1-CD2 4.39Å; F170-Y211 AromaticContact CE1-CG 3.85Å; F170-Y211 HydrophobicContact CE1-CG 3.85Å; I171-Y211 HydrophobicContact CB-CE1 4.5Å; I171-Y211 HydrophobicContact CG1-CE1 4.06Å; I171-Y211 HydrophobicContact CG2-CE1 4.47Å; Y174-Y211 CarbonylContact O-C 3.5Å; Y174-Y211 WeakPolarHBondContact O-CA 3.35Å; I175-Y211 HydrophobicContact CB-CD1 4.21Å; I175-Y211 HydrophobicContact CB-CE1 4.38Å; I175-Y211 HydrophobicContact CG1-CD1 4.45Å; I175-Y211 HydrophobicContact CG1-CE1 4.38Å; C195-Y211 WeakPolarHBondContact CA-O 2.99Å; L196-Y211 PolarHBondContact N-O 3.09Å; T197-Y211 HydrophobicContact CG2-CD2 3.94Å; T197-Y211 PolarHBondContact N-O 3.47Å; T197-Y211 WeakPolarHBondContact O-CD2 3.22Å; T197-Y211 PolarHBondContact O-N 3.07Å; S199-Y211 WeakPolarHBondContact OG-CE2 3.44Å; S199-Y211 PolarHBondContact OG-OH 3.09Å; S209-Y211 VanDerWaalsContact CB-OH 3.3Å; S209-Y211 WeakPolarHBondContact CB-OH 3.33Å; S209-Y211 VanDerWaalsContact O-CE2 3.31Å; S209-Y211 WeakPolarHBondContact O-CE2 3.27Å
212	S	89.5	Confident	72	Confident	41 Å²	41	54.3 Å²	54.3	29%	0.287	29%	0.294	S	S	.	.	S	Bend	trans	-85.2	-12.9	177.6	57.9	0	0	0	0	114.3	Y174 Y194 L196	Y174-S212 PolarHBondContact O-N 2.98Å; Y174-S212 PolarHBondContact O-OG 3.05Å; Y194-S212 VanDerWaalsContact O-CA 3.26Å; Y194-S212 WeakPolarHBondContact O-CA 3.24Å; L196-S212 WeakPolarHBondContact CD1-O 3.45Å
213	G	83.7	Confident	70.9	Confident	4 Å²	4	57.4 Å²	57.4	4%	0.041	31%	0.31	C	S	.	.	S	Bend	trans	-83.8	149.5	-180	0	0	0	0	0	112.2	Y174 T197	Y174-G213 VanDerWaalsContact CD1-CA 3.44Å; T197-G213 WeakPolarHBondContact CB-O 3.22Å; T197-G213 PolarHBondContact OG1-O 2.79Å
214	V	76.7	Confident	69.7	Low	23 Å²	23	57.4 Å²	57.4	14%	0.139	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-84.5	128	163.8	-175	0	0	0	0	107.8	L151 M152 L196 I249	L151-V214 HydrophobicContact CB-CG2 4.16Å; L151-V214 HydrophobicContact CD1-CG2 4.38Å; M152-V214 HydrophobicContact CE-CG1 4.37Å; M152-V214 HydrophobicContact CG-CG1 4.12Å; M152-V214 HydrophobicContact CG-CG2 3.86Å; M152-V214 HydrophobicContact SD-CG1 4.1Å; M152-V214 HydrophobicContact SD-CG2 4.02Å; L196-V214 HydrophobicContact CB-CG2 4.19Å; L196-V214 HydrophobicContact CD1-CG2 3.49Å; L196-V214 VanDerWaalsContact CD1-CG2 3.49Å; L196-V214 HydrophobicContact CG-CG2 4.41Å; V214-I249 HydrophobicContact CG1-CG1 4.32Å; V214-I249 WeakPolarHBondContact O-CD1 3.4Å
215	M	68.1	Low	68.5	Low	8 Å²	8	51.1 Å²	51.1	4%	0.039	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-84.4	133.4	-173	-151.3	-175.4	53.8	0	0	112.7	P166 F170 T197 V219 T229 L247	P166-M215 HydrophobicContact CB-SD 3.98Å; P166-M215 HydrophobicContact CG-SD 3.94Å; F170-M215 HydrophobicContact CD2-CG 4.4Å; F170-M215 HydrophobicContact CE1-CG 4.49Å; F170-M215 HydrophobicContact CE2-CB 4.25Å; F170-M215 HydrophobicContact CE2-CG 4.11Å; F170-M215 HydrophobicContact CZ-CB 4.15Å; F170-M215 HydrophobicContact CZ-CG 4.13Å; T197-M215 HydrophobicContact CG2-CB 3.97Å; T197-M215 HydrophobicContact CG2-CG 4.43Å; T197-M215 HydrophobicContact CG2-SD 4.18Å; T197-M215 PolarHBondContact OG1-N 2.7Å; M215-V219 HydrophobicContact CE-CB 4.31Å; M215-V219 HydrophobicContact CE-CG1 3.71Å; M215-V219 HydrophobicContact CE-CG2 3.79Å; M215-V219 HydrophobicContact SD-CG1 3.96Å; M215-T229 HydrophobicContact CE-CG2 3.54Å; M215-T229 HydrophobicContact SD-CG2 3.38Å; M215-T229 WeakPolarHBondContact SD-CG2 3.41Å; M215-L247 HydrophobicContact CB-CD2 4.36Å; M215-L247 WeakPolarHBondContact O-CD2 3.48Å
216	G	57.1	Low	68.4	Low	21 Å²	21	50.3 Å²	50.3	22%	0.216	29%	0.285	C	S	.	.			trans	-111.1	86.5	-169.5	0	0	0	0	0	113.4	T218 I249	G216-T218 PolarHBondContact O-N 2.97Å; G216-T218 PolarHBondContact O-OG1 3.09Å; G216-I249 VanDerWaalsContact N-CD1 3.31Å
217	A	50.1	Low	68.2	Low	79 Å²	79	45.4 Å²	45.4	65%	0.653	27%	0.268	S	S	*	.	S	Bend	trans	55.7	-21.4	172.4	0	0	0	0	0	118.3	V219	A217-V219 PolarHBondContact O-N 2.83Å
218	T	48.6	Very low	67.8	Low	92 Å²	92	41.7 Å²	41.7	56%	0.564	25%	0.249	S	C	*	.			trans	-105.2	82.8	-173.1	-22.2	0	0	0	0	110.2	G216	G216-T218 PolarHBondContact O-N 2.97Å; G216-T218 PolarHBondContact O-OG1 3.09Å
219	V	54.6	Low	67.5	Low	28 Å²	28	41.7 Å²	41.7	17%	0.17	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	122.9	160.2	-125.4	0	0	0	0	106	G164 L165 M215 A217 Y221 T229	G164-V219 VanDerWaalsContact C-CG1 3.42Å; L165-V219 VanDerWaalsContact C-CG1 3.47Å; L165-V219 CarbonylContact O-C 3.49Å; L165-V219 WeakPolarHBondContact O-CA 3.39Å; L165-V219 WeakPolarHBondContact O-CG1 3.21Å; M215-V219 HydrophobicContact CE-CB 4.31Å; M215-V219 HydrophobicContact CE-CG1 3.71Å; M215-V219 HydrophobicContact CE-CG2 3.79Å; M215-V219 HydrophobicContact SD-CG1 3.96Å; A217-V219 PolarHBondContact O-N 2.83Å; V219-Y221 PolarHBondContact O-N 3.25Å; V219-T229 HydrophobicContact CG1-CG2 4.36Å
220	I	55	Low	67.1	Low	93 Å²	93	40.8 Å²	40.8	48%	0.477	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	104.1	170.1	-57.7	-178.1	0	0	0	106	G164 L165 D167 N222	G164-I220 WeakPolarHBondContact CA-O 3.17Å; L165-I220 PolarHBondContact N-O 2.82Å; L165-I220 PolarHBondContact O-N 2.8Å; D167-I220 HydrophobicContact CB-CD1 3.59Å; D167-I220 HydrophobicContact CB-CG1 3.93Å; I220-N222 PolarHBondContact O-N 2.9Å
221	Y	53	Low	66.6	Low	46 Å²	46	40.6 Å²	40.6	18%	0.18	24%	0.242	C	C	.	.			trans	-84.5	106.5	171.2	-168.8	-94.1	0	0	0	108.4	K133 P163 V219 D223	K133-Y221 HydrophobicContact CD-CD1 3.81Å; K133-Y221 HydrophobicContact CD-CE1 4.13Å; K133-Y221 HydrophobicContact CD-CG 4.01Å; K133-Y221 HydrophobicContact CG-CD1 4.25Å; K133-Y221 HydrophobicContact CG-CD2 4.42Å; K133-Y221 HydrophobicContact CG-CE1 4.26Å; K133-Y221 HydrophobicContact CG-CG 4.22Å; P163-Y221 HydrophobicContact CB-CD2 3.58Å; P163-Y221 HydrophobicContact CB-CE2 3.18Å; P163-Y221 HydrophobicContact CG-CE2 4.26Å; V219-Y221 PolarHBondContact O-N 3.25Å; Y221-D223 WeakPolarHBondContact CD1-OD1 3.45Å; Y221-D223 HydrophobicContact CE1-CB 4.19Å; Y221-D223 WeakPolarHBondContact CE1-OD1 3.37Å
222	N	54.1	Low	66	Low	75 Å²	75	41.5 Å²	41.5	40%	0.401	25%	0.246	S	C	.	.			trans	-95.1	117.9	164	179.2	10.2	0	0	0	107.4	I220 T224 S225	I220-N222 PolarHBondContact O-N 2.9Å; N222-T224 PolarHBondContact ND2-OG1 2.87Å; N222-T224 PolarHBondContact O-N 2.9Å; N222-T224 PolarHBondContact OD1-N 3.09Å; N222-T224 PolarHBondContact OD1-OG1 2.81Å; N222-T224 VanDerWaalsContact OD1-OG1 3.08Å; N222-S225 WeakPolarHBondContact CB-OG 3.24Å; N222-S225 PolarHBondContact ND2-OG 2.87Å; N222-S225 PolarHBondContact O-N 2.82Å; N222-S225 VanDerWaalsContact O-N 3.13Å
223	D	48.9	Very low	65.4	Low	97 Å²	97	40 Å²	40	52%	0.519	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-20.2	-177.5	-70.6	1.6	0	0	0	112.4	K133 Y221	K133-D223 IonicContact NZ-OD1 2.75Å; K133-D223 PolarHBondContact NZ-OD1 2.91Å; Y221-D223 WeakPolarHBondContact CD1-OD1 3.45Å; Y221-D223 HydrophobicContact CE1-CB 4.19Å; Y221-D223 WeakPolarHBondContact CE1-OD1 3.37Å
224	T	44.7	Very low	64.9	Low	116 Å²	116	40 Å²	40	71%	0.712	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-21.9	-178.9	66.5	0	0	0	0	115	N222	N222-T224 PolarHBondContact ND2-OG1 2.87Å; N222-T224 PolarHBondContact O-N 2.9Å; N222-T224 PolarHBondContact OD1-N 3.09Å; N222-T224 PolarHBondContact OD1-OG1 2.81Å; N222-T224 VanDerWaalsContact OD1-OG1 3.08Å
225	S	52	Low	64.6	Low	31 Å²	31	40.1 Å²	40.1	22%	0.217	24%	0.236	C	C	.	.	S	Bend	trans	-100.2	105	-179.6	62.1	0	0	0	0	109.2	N222 Q227	N222-S225 WeakPolarHBondContact CB-OG 3.24Å; N222-S225 PolarHBondContact ND2-OG 2.87Å; N222-S225 PolarHBondContact O-N 2.82Å; N222-S225 VanDerWaalsContact O-N 3.13Å; S225-Q227 PolarHBondContact O-N 2.82Å; S225-Q227 PolarHBondContact OG-OE1 3.09Å
226	E	68.2	Low	64	Low	51 Å²	51	42.6 Å²	42.6	24%	0.238	26%	0.264	C	S	.	.			trans	-64.8	64.7	179.6	-57	177.4	165.8	0	0	111.5	T35 I201 V202	T35-E226 WeakPolarHBondContact CB-OE1 3.44Å; T35-E226 HydrophobicContact CG2-CG 4.22Å; T35-E226 VanDerWaalsContact CG2-OE1 3.22Å; T35-E226 WeakPolarHBondContact CG2-OE1 3.17Å; T35-E226 WeakPolarHBondContact CG2-OE2 3.13Å; T35-E226 PolarHBondContact OG1-OE1 3.03Å; I201-E226 CarbonylContact C-O 3.46Å; I201-E226 WeakPolarHBondContact CA-O 3.36Å; V202-E226 HydrophobicContact CB-CB 4.04Å; V202-E226 HydrophobicContact CG2-CB 4.13Å; V202-E226 WeakPolarHBondContact CG2-O 3.49Å; V202-E226 PolarHBondContact N-O 2.96Å
227	Q	75.2	Confident	63.7	Low	39 Å²	39	48.3 Å²	48.3	18%	0.182	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	143.7	-177.3	-73.2	155.1	-15.6	0	0	108.7	G164 L165 Y200 I201 S225	G164-Q227 PolarHBondContact N-O 2.91Å; G164-Q227 CarbonylContact O-C 3.48Å; L165-Q227 HydrophobicContact CD1-CB 4.41Å; L165-Q227 HydrophobicContact CD1-CG 4.11Å; L165-Q227 HydrophobicContact CD2-CB 3.93Å; L165-Q227 HydrophobicContact CD2-CG 4.18Å; L165-Q227 HydrophobicContact CG-CB 3.64Å; L165-Q227 VanDerWaalsContact CG-CD 3.44Å; L165-Q227 HydrophobicContact CG-CG 3.88Å; Y200-Q227 CarbonylContact O-C 3.56Å; Y200-Q227 WeakPolarHBondContact O-CA 3.4Å; I201-Q227 HydrophobicContact CG1-CG 3.91Å; S225-Q227 PolarHBondContact O-N 2.82Å; S225-Q227 PolarHBondContact OG-OE1 3.09Å
228	M	78.4	Confident	63.2	Low	2 Å²	2	47.8 Å²	47.8	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	138.4	-179.5	-60.9	-62.1	-56.1	0	0	107.2	L32 V161 P163 G164 S199 Y200 V202	L32-M228 HydrophobicContact CD1-CE 3.29Å; L32-M228 HydrophobicContact CD1-CG 4.33Å; L32-M228 HydrophobicContact CD1-SD 3.44Å; L32-M228 WeakPolarHBondContact CD1-SD 3.33Å; V161-M228 HydrophobicContact CG1-CB 3.76Å; V161-M228 HydrophobicContact CG1-CE 3.6Å; P163-M228 HydrophobicContact CB-CE 4.33Å; P163-M228 HydrophobicContact CB-SD 3.93Å; P163-M228 HydrophobicContact CG-CE 4Å; P163-M228 HydrophobicContact CG-SD 4.09Å; G164-M228 CarbonylContact O-C 3.58Å; S199-M228 CarbonylContact C-O 3.48Å; S199-M228 WeakPolarHBondContact CA-O 3.49Å; S199-M228 WeakPolarHBondContact CB-O 3.45Å; Y200-M228 HydrophobicContact CD1-CB 3.93Å; Y200-M228 HydrophobicContact CD2-CB 4.19Å; Y200-M228 HydrophobicContact CD2-CG 4.42Å; Y200-M228 HydrophobicContact CE1-CB 3.44Å; Y200-M228 VanDerWaalsContact CE1-CB 3.44Å; Y200-M228 HydrophobicContact CE1-CG 4.26Å; Y200-M228 HydrophobicContact CE2-CB 3.75Å; Y200-M228 HydrophobicContact CE2-CG 3.74Å; Y200-M228 HydrophobicContact CG-CB 4.29Å; Y200-M228 PolarHBondContact N-O 3.17Å; Y200-M228 PolarHBondContact O-N 3.34Å; V202-M228 HydrophobicContact CG2-CG 3.51Å; V202-M228 HydrophobicContact CG2-SD 4.1Å
229	T	83.6	Confident	62.1	Low	1 Å²	1	48.7 Å²	48.7	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.2	175.3	-59.2	0	0	0	0	109.5	V161 K162 G164 L165 P166 T197 F198 M215 V219	V161-T229 WeakPolarHBondContact CA-O 3.29Å; K162-T229 PolarHBondContact N-O 2.87Å; K162-T229 PolarHBondContact O-N 3.41Å; G164-T229 PolarHBondContact O-N 2.94Å; G164-T229 PolarHBondContact O-OG1 3.45Å; L165-T229 WeakPolarHBondContact CA-OG1 3.5Å; P166-T229 WeakPolarHBondContact CD-OG1 3.41Å; P166-T229 HydrophobicContact CG-CG2 4.03Å; T197-T229 HydrophobicContact CG2-CG2 3.59Å; F198-T229 CarbonylContact O-C 3.52Å; F198-T229 VanDerWaalsContact O-CA 3.31Å; F198-T229 WeakPolarHBondContact O-CA 3.19Å; F198-T229 WeakPolarHBondContact O-CG2 2.98Å; M215-T229 HydrophobicContact CE-CG2 3.54Å; M215-T229 HydrophobicContact SD-CG2 3.38Å; M215-T229 WeakPolarHBondContact SD-CG2 3.41Å; V219-T229 HydrophobicContact CG1-CG2 4.36Å
230	G	82.5	Confident	60.7	Low	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	136.3	172.1	0	0	0	0	0	111.5	I160 T197 F198	I160-G230 CarbonylContact O-C 3.49Å; I160-G230 VanDerWaalsContact O-CA 3.26Å; I160-G230 WeakPolarHBondContact O-CA 3.49Å; T197-G230 CarbonylContact C-O 3.6Å; T197-G230 WeakPolarHBondContact CA-O 3.17Å; T197-G230 WeakPolarHBondContact CG2-O 3.37Å; F198-G230 PolarHBondContact N-O 3.22Å; F198-G230 PolarHBondContact O-N 3.17Å
231	G	82.2	Confident	59.3	Low	1 Å²	1	56.1 Å²	56.1	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	150.4	172.7	0	0	0	0	0	110.9	I160	I160-G231 PolarHBondContact N-O 3.03Å; I160-G231 PolarHBondContact O-N 3.29Å
232	K	80.2	Confident	58	Low	23 Å²	23	61.7 Å²	61.7	10%	0.1	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	143.3	173.6	-70.4	-170	-179.1	-172.9	0	111.1	C145 M152 T157 Y158 Y159 L196	C145-K232 PolarHBondContact SG-NZ 3.41Å; C145-K232 VanDerWaalsContact SG-NZ 3.41Å; M152-K232 HydrophobicContact CE-CB 4.2Å; M152-K232 WeakPolarHBondContact CE-O 3.12Å; M152-K232 HydrophobicContact SD-CB 3.96Å; T157-K232 HydrophobicContact CG2-CB 4.43Å; Y158-K232 CarbonylContact O-C 3.46Å; Y158-K232 WeakPolarHBondContact O-CA 3.32Å; Y159-K232 HydrophobicContact CD1-CG 3.94Å; Y159-K232 HydrophobicContact CE1-CB 4.49Å; Y159-K232 HydrophobicContact CE1-CD 4.45Å; Y159-K232 HydrophobicContact CE1-CG 3.45Å; Y159-K232 VanDerWaalsContact CE1-CG 3.45Å; Y159-K232 HydrophobicContact CE2-CG 4.15Å; Y159-K232 HydrophobicContact CG-CG 4.48Å; Y159-K232 VanDerWaalsContact CZ-CE 3.41Å; Y159-K232 WeakPolarHBondContact OH-CE 3.06Å; L196-K232 HydrophobicContact CD2-CD 3.9Å; L196-K232 PolarHBondContact O-N 2.02Å
233	V	75.6	Confident	56.7	Low	9 Å²	9	65.2 Å²	65.2	6%	0.055	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149.7	169.8	-85	0	0	0	0	110.1	T157 Y158 I160 L247	T157-V233 CarbonylContact C-O 3.43Å; T157-V233 WeakPolarHBondContact CA-O 3.43Å; T157-V233 VanDerWaalsContact CB-O 3.3Å; T157-V233 WeakPolarHBondContact CB-O 3.36Å; Y158-V233 HydrophobicContact CD1-CG2 3.78Å; Y158-V233 HydrophobicContact CD2-CG2 3.78Å; Y158-V233 HydrophobicContact CE1-CB 4.2Å; Y158-V233 HydrophobicContact CE1-CG2 3.5Å; Y158-V233 HydrophobicContact CE2-CG2 3.54Å; Y158-V233 HydrophobicContact CG-CG2 3.91Å; Y158-V233 PolarHBondContact N-O 2.81Å; Y158-V233 WeakPolarHBondContact O-CG2 3.17Å; Y158-V233 PolarHBondContact O-N 3.46Å; I160-V233 HydrophobicContact CB-CG2 4.04Å; I160-V233 HydrophobicContact CD1-CB 4.36Å; I160-V233 HydrophobicContact CD1-CG1 4.15Å; I160-V233 HydrophobicContact CD1-CG2 3.51Å; I160-V233 HydrophobicContact CG1-CG2 3.49Å; I160-V233 VanDerWaalsContact CG1-CG2 3.49Å; V233-L247 HydrophobicContact CG1-CD1 4.04Å; V233-L247 HydrophobicContact CG1-CG 3.71Å
234	C	74.7	Confident	55.6	Low	6 Å²	6	65 Å²	65	4%	0.041	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	133.1	179.9	-62.2	0	0	0	0	112.3	M152 C154	M152-C234 PolarHBondContact O-SG 2.8Å; C154-C234 HydrophobicContact CB-CB 3.57Å; C154-C234 WeakPolarHBondContact CB-SG 3.45Å; C154-C234 WeakPolarHBondContact SG-CA 3.44Å; C154-C234 WeakPolarHBondContact SG-CB 2.98Å; C154-C234 CovalentContact SG-SG 2.04Å; C154-C234 PolarHBondContact SG-SG 3.05Å
235	C	70.4	Confident	55	Low	25 Å²	25	63.1 Å²	63.1	17%	0.169	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	138.4	168	-63.7	0	0	0	0	110.3	C142 Q156 T157 K237	C142-C235 WeakPolarHBondContact CA-SG 3.41Å; C142-C235 HydrophobicContact CB-CB 4.03Å; C142-C235 WeakPolarHBondContact CB-SG 3.3Å; C142-C235 WeakPolarHBondContact SG-CB 3.24Å; C142-C235 CovalentContact SG-SG 2.02Å; C142-C235 PolarHBondContact SG-SG 2.76Å; Q156-C235 VanDerWaalsContact C-SG 3.53Å; Q156-C235 HydrophobicContact CB-CB 3.75Å; Q156-C235 PolarHBondContact O-N 2.6Å; T157-C235 VanDerWaalsContact C-SG 3.53Å; T157-C235 PolarHBondContact N-SG 3.05Å; C235-K237 PolarHBondContact O-N 2.87Å
236	G	55.7	Low	53.8	Low	60 Å²	60	66 Å²	66	62%	0.619	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-9.2	176.6	0	0	0	0	0	116.6	S238	G236-S238 VanDerWaalsContact C-N 3.34Å
237	K	50.6	Low	52	Low	141 Å²	141	64.3 Å²	64.3	61%	0.613	35%	0.353	S	S	*	.	S	Bend	trans	-88.9	4.5	168.1	-80.8	-169.7	175.6	179.2	0	114	C235	C235-K237 PolarHBondContact O-N 2.87Å
238	S	39.6	Very low	49.6	Very low	67 Å²	67	64.4 Å²	64.4	47%	0.469	36%	0.358	S	S	.	.			trans	-102.6	5.2	-174	-177.7	0	0	0	0	114.7	Y158 G236 N240	Y158-S238 WeakPolarHBondContact OH-CB 3.44Å; Y158-S238 PolarHBondContact OH-OG 2.83Å; G236-S238 VanDerWaalsContact C-N 3.34Å; S238-N240 PolarHBondContact O-N 3.28Å
239	T	25.6	Very low	47.2	Very low	111 Å²	111	66.8 Å²	66.8	68%	0.681	37%	0.37	S	S	*	.			trans	-87.4	1.2	-164.7	42.4	0	0	0	0	116.7
240	N	24.2	Very low	44.3	Very low	133 Å²	133	69.8 Å²	69.8	71%	0.711	39%	0.386	S	S	*	.	S	Bend	trans	-134.7	112.2	-179.8	-81.4	-32.4	0	0	0	112.9	S238	S238-N240 PolarHBondContact O-N 3.28Å
241	H	26.2	Very low	41.5	Very low	144 Å²	144	78.9 Å²	78.9	67%	0.667	42%	0.422	S	S	*	.			trans	64.1	115.1	158.2	-59.9	-69.7	0	0	0	117.7	H243	H241-H243 PolarHBondContact O-N 3.39Å
242	I	25.7	Very low	38.7	Very low	163 Å²	163	85.3 Å²	85.3	84%	0.836	46%	0.456	S	S	*	.	S	Bend		34.9	-9.3	127.1	-64.1	172	0	0	0	120.9
243	H	25.7	Very low	35.8	Very low	150 Å²	150	92.4 Å²	92.4	69%	0.694	49%	0.489	S	S	*	.	S	Bend	trans	-112.1	111.2	-177.5	-70.6	-69.2	0	0	0	109.6	H241	H241-H243 PolarHBondContact O-N 3.39Å
244	T	27.3	Very low	33.3	Very low	93 Å²	93	96.9 Å²	96.9	57%	0.571	52%	0.521	S	S	*	.			trans	50.7	104.2	156.9	51.7	0	0	0	0	114.6	T246	T244-T246 PolarHBondContact O-N 3.11Å; T244-T246 PolarHBondContact O-OG1 3.26Å
245	H	31.3	Very low	31	Very low	76 Å²	76	107.4 Å²	107.4	35%	0.352	58%	0.577	S	S	.	*			trans	-61.6	79.9	162.9	-69.6	-99.4	0	0	0	109.4	I160 K162 L247	I160-H245 WeakPolarHBondContact CD1-ND1 3.32Å; K162-H245 PolarHBondContact NZ-O 2.89Å; H245-L247 PolarHBondContact O-N 3.06Å; H245-L247 VanDerWaalsContact O-N 3.16Å
246	T	27.3	Very low	29	Very low	92 Å²	92	111.5 Å²	111.5	56%	0.564	60%	0.597	S	S	*	*			trans	-74.8	102.9	172.7	-52.6	0	0	0	0	105	T244 C248	T244-T246 PolarHBondContact O-N 3.11Å; T244-T246 PolarHBondContact O-OG1 3.26Å; T246-C248 PolarHBondContact O-N 3.06Å
247	L	30.8	Very low	27.6	Very low	14 Å²	14	114.2 Å²	114.2	7%	0.073	60%	0.596	C	S	.	*			trans	-52.9	110.3	166.4	-117.4	93.5	0	0	0	106.3	I160 M215 V233 H245 I249	I160-L247 HydrophobicContact CG2-CD1 4.48Å; M215-L247 HydrophobicContact CB-CD2 4.36Å; M215-L247 WeakPolarHBondContact O-CD2 3.48Å; V233-L247 HydrophobicContact CG1-CD1 4.04Å; V233-L247 HydrophobicContact CG1-CG 3.71Å; H245-L247 PolarHBondContact O-N 3.06Å; H245-L247 VanDerWaalsContact O-N 3.16Å; L247-I249 PolarHBondContact O-N 2.82Å
248	C	24.3	Very low	26.3	Very low	42 Å²	42	112.7 Å²	112.7	28%	0.284	60%	0.595	S	S	.	*			trans	-67.5	107.3	-179.3	-75.3	0	0	0	0	108.5	T246	T246-C248 PolarHBondContact O-N 3.06Å
249	I	27	Very low	25.6	Very low	52 Å²	52	115.4 Å²	115.4	27%	0.267	60%	0.602	S	S	.	*			trans	-97	127.9	158.2	-71.5	-154.5	0	0	0	108.7	V214 G216 L247 Y251	V214-I249 HydrophobicContact CG1-CG1 4.32Å; V214-I249 WeakPolarHBondContact O-CD1 3.4Å; G216-I249 VanDerWaalsContact N-CD1 3.31Å; L247-I249 PolarHBondContact O-N 2.82Å; I249-Y251 HydrophobicContact CB-CE2 4.48Å; I249-Y251 HydrophobicContact CG2-CD1 4.28Å; I249-Y251 HydrophobicContact CG2-CD2 3.59Å; I249-Y251 HydrophobicContact CG2-CE1 4.34Å; I249-Y251 HydrophobicContact CG2-CE2 3.66Å; I249-Y251 HydrophobicContact CG2-CG 3.92Å
250	L	23.2	Very low	25.6	Very low	63 Å²	63	115.7 Å²	115.7	33%	0.33	60%	0.598	S	S	.	*			trans	-97.9	114	153.3	-78.4	143.1	0	0	0	106.4	M152 Q153 N252	M152-L250 WeakPolarHBondContact O-CD1 3.47Å; Q153-L250 HydrophobicContact CB-CD1 3.7Å; Q153-L250 VanDerWaalsContact CD-CD1 3.45Å; Q153-L250 HydrophobicContact CG-CD1 3.7Å; L250-N252 PolarHBondContact O-N 3.47Å
251	Y	23.5	Very low	25.6	Very low	192 Å²	192	114.5 Å²	114.5	75%	0.753	59%	0.59	S	S	*	*			trans	-72.2	121.1	169.5	-74.3	-87.2	0	0	0	107.6	I249	I249-Y251 HydrophobicContact CB-CE2 4.48Å; I249-Y251 HydrophobicContact CG2-CD1 4.28Å; I249-Y251 HydrophobicContact CG2-CD2 3.59Å; I249-Y251 HydrophobicContact CG2-CE1 4.34Å; I249-Y251 HydrophobicContact CG2-CE2 3.66Å; I249-Y251 HydrophobicContact CG2-CG 3.92Å
252	N	23	Very low	25.6	Very low	135 Å²	135	112.4 Å²	112.4	72%	0.722	58%	0.584	S	S	*	*			trans	-94.3	100.2	155.2	-159.4	16.2	0	0	0	107.1	L250 S254	L250-N252 PolarHBondContact O-N 3.47Å; N252-S254 VanDerWaalsContact C-N 3.26Å; N252-S254 PolarHBondContact O-N 3.28Å; N252-S254 VanDerWaalsContact O-N 3.09Å
253	Q	21.1	Very low	25.6	Very low	173 Å²	173	108.5 Å²	108.5	81%	0.808	57%	0.565	S	S	*	*			trans	-72.6	91.2	159.8	-82.3	-175.5	-26.6	0	0	106.7	N255	Q253-N255 PolarHBondContact O-N 2.76Å
254	S	22.3	Very low	25.6	Very low	103 Å²	103	105.1 Å²	105.1	72%	0.72	55%	0.554	S	S	*	*			trans	-75.1	101.7	157	47.3	0	0	0	0	107.2	N252	N252-S254 VanDerWaalsContact C-N 3.26Å; N252-S254 PolarHBondContact O-N 3.28Å; N252-S254 VanDerWaalsContact O-N 3.09Å
255	N	25.9	Very low	25.4	Very low	226 Å²	226	106.2 Å²	106.2	100%	1.209	55%	0.553	S	S	*	*			trans	-55.6	0	152.3	-80.4	-18.2	0	0	0	110.1	Q253	Q253-N255 PolarHBondContact O-N 2.76Å

Retrieved 255 of 255 residues in 218.4 ms (Link to these results)

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