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Src-like-adapter

Adapter protein, which negatively regulates T-cell receptor (TCR) signaling. Inhibits T-cell antigen-receptor induced activation of nuclear factor of activated T-cells. Involved in the negative regulation of positive selection and mitosis of T-cells. May act by linking signaling proteins such as ZAP70 with CBL, leading to a CBL dependent degradation of signaling proteins.

AlphaFold DB (A0A2K6CJB8), UniProt , Accession A0A096MZG0, Species PAPAN (Papio anubis, Olive baboon), Gene SLA, Length 293 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	35.9	Very low	225 Å²	225	141.7 Å²	141.7	100%	1.108	78%	0.78	S	S	*	*				0	108.4	0	-78.8	173.3	177.6	0	0	106.8
2	L	37.1	Very low	36.4	Very low	148 Å²	148	140.9 Å²	140.9	78%	0.775	79%	0.787	S	S	*	*				65.3	117	107.1	-64.4	165.3	0	0	0	109.7
3	H	34.9	Very low	36.2	Very low	141 Å²	141	135.5 Å²	135.5	65%	0.653	78%	0.782	S	S	*	*				-179.2	133	52	-113.4	-160.5	0	0	0	107.3
4	R	38.5	Very low	36.5	Very low	194 Å²	194	141.3 Å²	141.3	73%	0.732	79%	0.794	S	S	*	*				74.7	123.8	95.5	-88.5	-175.8	165.7	-151.5	3.2	115.9
5	L	36.9	Very low	36.7	Very low	132 Å²	132	145.2 Å²	145.2	69%	0.691	80%	0.799	S	S	*	*				65.7	151.8	129.8	-62	163.6	0	0	0	117.4
6	W	31	Very low	36.8	Very low	218 Å²	218	148.8 Å²	148.8	83%	0.826	80%	0.804	S	S	*	*			cis	173.8	139.2	-7.2	163.4	-85.2	0	0	0	103.4
7	A	34.4	Very low	37	Very low	87 Å²	87	151.7 Å²	151.7	72%	0.719	81%	0.811	S	S	*	*			trans	163.6	111.5	137.9	0	0	0	0	0	113.5
8	S	33.7	Very low	37	Very low	96 Å²	96	153.1 Å²	153.1	67%	0.671	81%	0.814	S	S	*	*			trans	-48.7	174.4	147.7	-61.4	0	0	0	0	112.7
9	P	43.8	Very low	37	Very low	125 Å²	125	148.6 Å²	148.6	81%	0.812	81%	0.808	S	S	*	*			cis	-153.6	171.2	33.7	40.4	-17.2	0	0	0	119
10	A	33.6	Very low	37	Very low	100 Å²	100	148.2 Å²	148.2	83%	0.826	81%	0.805	S	S	*	*				151.5	119.2	121.1	0	0	0	0	0	112
11	A	36.4	Very low	37	Very low	93 Å²	93	146.1 Å²	146.1	77%	0.769	80%	0.802	S	S	*	*			trans	-85.3	169.1	163.3	0	0	0	0	0	109.8
12	P	41.4	Very low	37.3	Very low	132 Å²	132	143.7 Å²	143.7	86%	0.857	79%	0.79	S	S	*	*				-142.2	163.2	82.2	31.7	-11.6	0	0	0	115.1
13	G	34.5	Very low	37.4	Very low	71 Å²	71	146 Å²	146	73%	0.732	79%	0.794	S	S	*	*			trans	-75.3	169.4	-162.2	0	0	0	0	0	117.7
14	K	40.6	Very low	37.7	Very low	216 Å²	216	144.7 Å²	144.7	94%	0.939	80%	0.8	S	S	*	*			trans	-135.7	140.1	148.7	-77.6	-166.2	176.5	179.6	0	110.3
15	K	38.3	Very low	38	Very low	200 Å²	200	139.6 Å²	139.6	87%	0.87	80%	0.8	S	S	*	*			trans	-74.4	143.6	-174.2	-74.5	169.5	171	173.4	0	111.7
16	K	39.4	Very low	38.3	Very low	203 Å²	203	139.4 Å²	139.4	88%	0.883	81%	0.807	S	S	*	*			trans	35.9	118.6	139	-63.3	-175.8	175.6	-175.4	0	118.6
17	E	39	Very low	39	Very low	198 Å²	198	133.3 Å²	133.3	93%	0.925	80%	0.803	S	S	*	*			trans	-147.1	119.6	131.1	-144.6	171.3	166.3	0	0	109.8	G19	E17-G19 PolarHBondContact O-N 2.77Å
18	M	38.6	Very low	39.6	Very low	177 Å²	177	135 Å²	135	87%	0.872	81%	0.806	S	S	*	*			trans	-92.6	90.2	178.3	-174.4	86.9	175.8	0	0	107
19	G	36.8	Very low	40.2	Very low	68 Å²	68	135.1 Å²	135.1	70%	0.701	81%	0.813	S	S	*	*			trans	-98.4	105.9	170.9	0	0	0	0	0	110.1	E17 S21	E17-G19 PolarHBondContact O-N 2.77Å; G19-S21 PolarHBondContact O-N 3.35Å
20	N	37.1	Very low	40.1	Very low	139 Å²	139	138.2 Å²	138.2	74%	0.743	82%	0.817	S	S	*	*			trans	-63.3	103.2	168.1	-95.3	-6.5	0	0	0	109	M22	N20-M22 PolarHBondContact O-N 3.49Å
21	S	37	Very low	41.1	Very low	106 Å²	106	144.3 Å²	144.3	74%	0.741	82%	0.818	S	S	*	*			trans	-83.1	92.9	169.4	-166.1	0	0	0	0	108.7	G19 K23	G19-S21 PolarHBondContact O-N 3.35Å; S21-K23 VanDerWaalsContact C-N 3.32Å; S21-K23 PolarHBondContact O-N 3.38Å; S21-K23 VanDerWaalsContact O-N 3.08Å
22	M	40.3	Very low	41.4	Very low	174 Å²	174	145.9 Å²	145.9	86%	0.857	82%	0.821	S	S	*	*			trans	-72	92.9	160.9	-72.4	-177.2	171.1	0	0	107.5	N20 S24	N20-M22 PolarHBondContact O-N 3.49Å; M22-S24 PolarHBondContact O-N 2.85Å
23	K	39.5	Very low	41.6	Very low	196 Å²	196	147.2 Å²	147.2	85%	0.852	82%	0.82	S	S	*	*			trans	-65.3	99.1	163.8	-95.1	178.5	172.2	179.6	0	107.8	S21 A25	S21-K23 VanDerWaalsContact C-N 3.32Å; S21-K23 PolarHBondContact O-N 3.38Å; S21-K23 VanDerWaalsContact O-N 3.08Å; K23-A25 PolarHBondContact O-N 2.81Å
24	S	40.8	Very low	42	Very low	113 Å²	113	148.6 Å²	148.6	79%	0.79	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-60.3	123.9	163.7	47.7	0	0	0	0	109	M22	M22-S24 PolarHBondContact O-N 2.85Å
25	A	44.2	Very low	41.6	Very low	88 Å²	88	143.7 Å²	143.7	73%	0.727	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-58.1	143.7	172.8	0	0	0	0	0	110.5	K23	K23-A25 PolarHBondContact O-N 2.81Å
26	P	44.4	Very low	42	Very low	128 Å²	128	138.9 Å²	138.9	83%	0.831	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-68.4	136.7	171.7	16.9	-9.7	0	0	0	109.5
27	A	44.3	Very low	42	Very low	89 Å²	89	137.6 Å²	137.6	74%	0.736	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-55.5	147.8	175	0	0	0	0	0	111.2
28	P	47.8	Very low	42.2	Very low	122 Å²	122	130.4 Å²	130.4	79%	0.792	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-62	139.7	176	26	-31.9	0	0	0	109.9	E30	P28-E30 PolarHBondContact O-N 3.03Å
29	A	46.3	Very low	42.8	Very low	100 Å²	100	126.3 Å²	126.3	83%	0.826	75%	0.747	S	S	*	*			trans	-48.4	114.3	-179.1	0	0	0	0	0	111.3	R31	A29-R31 PolarHBondContact O-N 3.38Å
30	E	41.1	Very low	43.9	Very low	189 Å²	189	130 Å²	130	88%	0.883	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-56.8	122.8	164.9	-76.9	-176	136.4	0	0	107.8	P28	P28-E30 PolarHBondContact O-N 3.03Å
31	R	55	Low	45.5	Very low	228 Å²	228	126.2 Å²	126.2	86%	0.86	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-59.1	137.2	169.3	-62.3	179.3	-161.5	156.2	5.2	107.1	A29 L33	A29-R31 PolarHBondContact O-N 3.38Å; R31-L33 PolarHBondContact O-N 3.4Å
32	P	42.4	Very low	48	Very low	127 Å²	127	124.1 Å²	124.1	83%	0.825	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-56.1	120	174.4	-19.8	30.2	0	0	0	109
33	L	46.2	Very low	50.5	Low	160 Å²	160	116.6 Å²	116.6	84%	0.838	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-59.4	137.2	166.6	-69.9	167.9	0	0	0	108	R31 N35	R31-L33 PolarHBondContact O-N 3.4Å; L33-N35 PolarHBondContact O-N 3.11Å
34	P	43.9	Very low	53.1	Low	100 Å²	100	107.4 Å²	107.4	65%	0.649	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-63.5	127.6	175.5	25.3	-30.2	0	0	0	109.1
35	N	32.1	Very low	55.6	Low	113 Å²	113	102 Å²	102	60%	0.604	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-54.7	126.3	177.3	-165.7	25.6	0	0	0	110.1	L33 E37	L33-N35 PolarHBondContact O-N 3.11Å; N35-E37 PolarHBondContact O-N 3.12Å
36	P	45.5	Very low	58.1	Low	99 Å²	99	97.8 Å²	97.8	64%	0.643	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-74.3	-9.6	-173.7	27.6	-33.2	0	0	0	114.4	G38	P36-G38 VanDerWaalsContact C-N 3.32Å; P36-G38 PolarHBondContact O-N 3Å
37	E	39.8	Very low	60.4	Low	175 Å²	175	92.1 Å²	92.1	82%	0.818	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-82.3	-3.5	-171.6	-61.1	-172.9	147	0	0	114.6	N35	N35-E37 PolarHBondContact O-N 3.12Å
38	G	42.7	Very low	62.7	Low	48 Å²	48	89.6 Å²	89.6	50%	0.495	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-116.5	-5.4	178	0	0	0	0	0	115.9	P36 D40	P36-G38 VanDerWaalsContact C-N 3.32Å; P36-G38 PolarHBondContact O-N 3Å; G38-D40 VanDerWaalsContact C-N 3.35Å; G38-D40 PolarHBondContact O-N 2.99Å
39	L	51.6	Low	64.8	Low	90 Å²	90	86.9 Å²	86.9	47%	0.471	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-77.3	-13.4	-168.9	-81.2	164.7	0	0	0	114.8	S41 D42	L39-S41 PolarHBondContact O-N 3.43Å; L39-D42 PolarHBondContact O-N 3.03Å
40	D	59.6	Low	67.1	Low	145 Å²	145	84.6 Å²	84.6	78%	0.775	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-73.5	-17	-178.6	-78.9	-25.9	0	0	0	113.4	G38	G38-D40 VanDerWaalsContact C-N 3.35Å; G38-D40 PolarHBondContact O-N 2.99Å
41	S	70.8	Confident	69.5	Low	60 Å²	60	76.4 Å²	76.4	42%	0.42	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-92.2	-11.4	177	-62.6	0	0	0	0	113.5	L39 F43 G100	L39-S41 PolarHBondContact O-N 3.43Å; S41-F43 WeakPolarHBondContact O-CD1 3.31Å; S41-G100 PolarHBondContact O-N 2.98Å; S41-G100 VanDerWaalsContact O-N 3.09Å
42	D	89.9	Confident	71.2	Confident	63 Å²	63	67.7 Å²	67.7	34%	0.337	39%	0.392	S	S	.	.			trans	-100.3	119.1	-177.7	-72.1	7.7	0	0	0	109.9	L39 V97 Y98 H99	L39-D42 PolarHBondContact O-N 3.03Å; D42-V97 VanDerWaalsContact CA-O 3.24Å; D42-V97 WeakPolarHBondContact CA-O 3.39Å; D42-Y98 VanDerWaalsContact OD1-CA 3.31Å; D42-Y98 WeakPolarHBondContact OD1-CA 3.35Å; D42-H99 PolarHBondContact OD1-N 2.83Å
43	F	92.8	Very high	73.4	Confident	16 Å²	16	65.3 Å²	65.3	7%	0.07	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	169.8	-176.6	63.1	-90.5	0	0	0	111.5	S41 A45 K65 V97 L193	S41-F43 WeakPolarHBondContact O-CD1 3.31Å; F43-A45 HydrophobicContact CE2-CB 4.15Å; F43-K65 HydrophobicContact CD1-CD 4.3Å; F43-K65 HydrophobicContact CD2-CB 3.74Å; F43-K65 HydrophobicContact CD2-CD 4.03Å; F43-K65 HydrophobicContact CD2-CG 3.7Å; F43-K65 HydrophobicContact CE1-CD 4.14Å; F43-K65 HydrophobicContact CE2-CB 4.16Å; F43-K65 HydrophobicContact CE2-CD 3.89Å; F43-K65 HydrophobicContact CE2-CG 3.59Å; F43-K65 HydrophobicContact CG-CB 4.25Å; F43-K65 HydrophobicContact CG-CD 4.25Å; F43-K65 HydrophobicContact CG-CG 4.35Å; F43-K65 HydrophobicContact CZ-CD 3.95Å; F43-K65 HydrophobicContact CZ-CG 4.14Å; F43-V97 HydrophobicContact CD1-CB 4.23Å; F43-V97 HydrophobicContact CD1-CG1 4.44Å; F43-V97 HydrophobicContact CD2-CB 4.15Å; F43-V97 HydrophobicContact CD2-CG2 4.07Å; F43-V97 HydrophobicContact CE1-CB 4Å; F43-V97 HydrophobicContact CE1-CG1 3.79Å; F43-V97 HydrophobicContact CE2-CB 3.9Å; F43-V97 HydrophobicContact CE2-CG1 4.25Å; F43-V97 HydrophobicContact CE2-CG2 3.64Å; F43-V97 HydrophobicContact CG-CB 4.3Å; F43-V97 HydrophobicContact CZ-CB 3.82Å; F43-V97 HydrophobicContact CZ-CG1 3.67Å; F43-V97 HydrophobicContact CZ-CG2 3.94Å; F43-V97 PolarHBondContact N-O 3.34Å; F43-V97 VanDerWaalsContact N-O 3.09Å; F43-V97 WeakPolarHBondContact O-CB 3.36Å; F43-V97 PolarHBondContact O-N 3.22Å; F43-L193 HydrophobicContact CE2-CD1 4.23Å
44	L	93.9	Very high	75.5	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.7	167.7	-65.4	179.9	0	0	0	110.2	K65 L66 V68 W76 A78 V94 A95 R96	L44-K65 CarbonylContact O-C 3.58Å; L44-K65 WeakPolarHBondContact O-CA 3.42Å; L44-L66 HydrophobicContact CB-CB 4.15Å; L44-L66 PolarHBondContact N-O 3.41Å; L44-L66 PolarHBondContact O-N 3.44Å; L44-V68 HydrophobicContact CD1-CG2 3.63Å; L44-V68 HydrophobicContact CD2-CG2 4.21Å; L44-V68 HydrophobicContact CG-CG2 3.6Å; L44-W76 HydrophobicContact CD1-CB 4.16Å; L44-W76 HydrophobicContact CD1-CD2 3.89Å; L44-W76 HydrophobicContact CD1-CE3 3.72Å; L44-W76 HydrophobicContact CD1-CG 4.1Å; L44-W76 HydrophobicContact CD1-CZ3 4.42Å; L44-W76 HydrophobicContact CD2-CE3 4.47Å; L44-W76 HydrophobicContact CD2-CZ3 4.45Å; L44-A78 HydrophobicContact CD1-CB 4.48Å; L44-V94 HydrophobicContact CB-CB 4.35Å; L44-V94 HydrophobicContact CD1-CB 4.43Å; L44-V94 HydrophobicContact CD1-CG2 4.27Å; L44-V94 HydrophobicContact CD2-CG2 4.45Å; L44-A95 CarbonylContact C-O 3.55Å; L44-A95 WeakPolarHBondContact CA-O 3.36Å; L44-R96 HydrophobicContact CD2-CB 4.39Å; L44-R96 HydrophobicContact CD2-CG 3.69Å
45	A	94.1	Very high	77.8	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	128.1	169.8	0	0	0	0	0	110.2	F43 L47 V94 A95 V97 F103 L193	F43-A45 HydrophobicContact CE2-CB 4.15Å; A45-L47 PolarHBondContact O-N 2.82Å; A45-V94 CarbonylContact O-C 3.45Å; A45-V94 VanDerWaalsContact O-CA 3.29Å; A45-V94 WeakPolarHBondContact O-CA 3.36Å; A45-A95 PolarHBondContact N-O 2.92Å; A45-A95 PolarHBondContact O-N 3.49Å; A45-V97 HydrophobicContact CB-CG2 3.64Å; A45-F103 HydrophobicContact CB-CD1 4.28Å; A45-F103 HydrophobicContact CB-CE1 3.69Å; A45-L193 HydrophobicContact CB-CD1 3.57Å
46	V	94.9	Very high	80.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	120.2	175.1	-178.7	0	0	0	0	109.8	S48 F60 R61 G63 E64 L66 I89	V46-S48 WeakPolarHBondContact CG1-O 3.24Å; V46-F60 HydrophobicContact CG1-CB 4.21Å; V46-F60 HydrophobicContact CG2-CB 4.05Å; V46-R61 VanDerWaalsContact CB-O 3.31Å; V46-R61 WeakPolarHBondContact CB-O 3.25Å; V46-R61 WeakPolarHBondContact CG1-O 3.44Å; V46-G63 PolarHBondContact O-N 2.85Å; V46-E64 HydrophobicContact CB-CB 4.48Å; V46-E64 HydrophobicContact CG2-CB 4.06Å; V46-E64 WeakPolarHBondContact CG2-O 3.49Å; V46-E64 PolarHBondContact N-O 2.63Å; V46-L66 HydrophobicContact CG2-CD1 3.62Å; V46-L66 HydrophobicContact CG2-CD2 3.83Å; V46-L66 HydrophobicContact CG2-CG 3.64Å; V46-I89 HydrophobicContact CG1-CD1 4.28Å; V46-I89 HydrophobicContact CG2-CD1 4.37Å
47	L	93.2	Very high	82.8	Confident	9 Å²	9	64 Å²	64	5%	0.047	37%	0.367	C	S	.	.			trans	-86.1	-25.1	-175.3	-55.9	-172.5	0	0	0	113.2	A45 R62 C93 A95 L106 K110 L114	A45-L47 PolarHBondContact O-N 2.82Å; L47-R62 WeakPolarHBondContact O-CG 3.29Å; L47-C93 WeakPolarHBondContact CB-O 3.33Å; L47-C93 PolarHBondContact N-O 2.87Å; L47-A95 HydrophobicContact CD1-CB 4.2Å; L47-A95 HydrophobicContact CD2-CB 3.73Å; L47-A95 HydrophobicContact CG-CB 4.27Å; L47-L106 HydrophobicContact CD1-CD1 4.29Å; L47-L106 HydrophobicContact CD2-CD1 3.35Å; L47-L106 HydrophobicContact CG-CD1 4.42Å; L47-K110 HydrophobicContact CB-CD 4.42Å; L47-L114 HydrophobicContact CD2-CD1 4Å
48	S	92.6	Very high	85.3	Confident	35 Å²	35	57.1 Å²	57.1	25%	0.245	34%	0.338	C	S	.	.	S	Bend	trans	-155.2	152.6	-178.4	-62.8	0	0	0	0	109.7	V46 Y50 K110	V46-S48 WeakPolarHBondContact CG1-O 3.24Å; S48-Y50 PolarHBondContact O-N 3.01Å; S48-K110 WeakPolarHBondContact OG-CE 3.41Å; S48-K110 PolarHBondContact OG-NZ 3.14Å
49	D	93.3	Very high	87.7	Confident	66 Å²	66	57.5 Å²	57.5	35%	0.353	33%	0.328	S	S	.	.			trans	-57.6	127.6	178.1	-71	-10.7	0	0	0	110.3	P51 P53 P58 R61 R62	D49-P51 CarbonylContact C-O 3.6Å; D49-P53 HydrophobicContact CB-CG 4.17Å; D49-P58 HydrophobicContact CB-CB 3.95Å; D49-P58 HydrophobicContact CB-CG 4.34Å; D49-R61 WeakPolarHBondContact OD1-CA 3.42Å; D49-R62 PolarHBondContact OD1-N 3.41Å
50	Y	92.7	Very high	89.7	Confident	51 Å²	51	53.2 Å²	53.2	20%	0.2	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-133.3	130.5	-177.5	-174.9	-95.4	0	0	0	112.1	S48 I59 F60 W75 Y88 I89 P90	S48-Y50 PolarHBondContact O-N 3.01Å; Y50-I59 PolarHBondContact O-N 2.78Å; Y50-F60 HydrophobicContact CD1-CD2 4.49Å; Y50-F60 PolarHBondContact N-O 2.8Å; Y50-F60 PolarHBondContact O-N 2.91Å; Y50-W75 WeakPolarHBondContact OH-CZ3 3.46Å; Y50-Y88 WeakPolarHBondContact CE1-O 3.24Å; Y50-I89 HydrophobicContact CD1-CB 4.3Å; Y50-I89 HydrophobicContact CD1-CD1 4.47Å; Y50-I89 HydrophobicContact CD1-CG1 4.01Å; Y50-I89 HydrophobicContact CG-CD1 4.38Å; Y50-I89 HydrophobicContact CG-CG1 4.1Å; Y50-P90 HydrophobicContact CD2-CG 4.24Å; Y50-P90 VanDerWaalsContact CE2-CD 3.43Å; Y50-P90 HydrophobicContact CE2-CG 3.63Å; Y50-P90 VanDerWaalsContact CZ-CD 3.41Å
51	P	93.2	Very high	91.2	Very high	18 Å²	18	54 Å²	54	12%	0.117	30%	0.297	C	S	.	.	S	Bend	cis	-59.9	165.7	-11.8	-22.8	35.7	0	0	0	112.3	D49 S56 I59	D49-P51 CarbonylContact C-O 3.6Å; P51-S56 WeakPolarHBondContact CB-OG 3.25Å; P51-S56 WeakPolarHBondContact CG-OG 3.35Å; P51-I59 HydrophobicContact CG-CD1 4.32Å
52	S	89.5	Confident	92.3	Very high	44 Å²	44	54.8 Å²	54.8	31%	0.308	29%	0.291	S	S	.	.			trans	-54.1	138	176.3	-175.4	0	0	0	0	109.6	D54 I55 S56	S52-D54 PolarHBondContact O-N 3.06Å; S52-D54 PolarHBondContact OG-OD2 3.3Å; S52-I55 PolarHBondContact O-N 3.45Å; S52-S56 PolarHBondContact O-N 3.45Å
53	P	89.6	Confident	92.3	Very high	77 Å²	77	52.6 Å²	52.6	50%	0.5	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-24.9	176.6	-27.2	35	0	0	0	114.1	D49 I55 S56	D49-P53 HydrophobicContact CB-CG 4.17Å; P53-I55 VanDerWaalsContact C-N 3.28Å; P53-I55 PolarHBondContact O-N 3.23Å; P53-S56 WeakPolarHBondContact CA-O 3.19Å
54	D	90.6	Very high	92.3	Very high	151 Å²	151	53.1 Å²	53.1	81%	0.807	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-24.7	177.4	-52.9	-44.6	0	0	0	113.3	S52	S52-D54 PolarHBondContact O-N 3.06Å; S52-D54 PolarHBondContact OG-OD2 3.3Å
55	I	90.6	Very high	92.3	Very high	139 Å²	139	54.8 Å²	54.8	71%	0.713	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-49.8	-177	-58.4	170.5	0	0	0	109.5	S52 P53	S52-I55 PolarHBondContact O-N 3.45Å; P53-I55 VanDerWaalsContact C-N 3.28Å; P53-I55 PolarHBondContact O-N 3.23Å
56	S	92.4	Very high	92.3	Very high	42 Å²	42	54.8 Å²	54.8	29%	0.294	29%	0.294	S	S	.	.	S	Bend	trans	-161.1	164.8	-178.9	63.6	0	0	0	0	110.9	P51 S52 P53	P51-S56 WeakPolarHBondContact CB-OG 3.25Å; P51-S56 WeakPolarHBondContact CG-OG 3.35Å; S52-S56 PolarHBondContact O-N 3.45Å; P53-S56 WeakPolarHBondContact CA-O 3.19Å
57	P	91.7	Very high	92.2	Very high	112 Å²	112	61.5 Å²	61.5	73%	0.727	32%	0.319	S	S	*	.			trans	-55	130.1	170.6	-25.8	35.5	0	0	0	110.8	I59	P57-I59 PolarHBondContact O-N 2.86Å
58	P	91.1	Very high	92.2	Very high	32 Å²	32	64 Å²	64	21%	0.208	34%	0.335	C	S	.	.			trans	-65.1	132.1	-174.7	24.2	-33	0	0	0	110.9	D49 R61	D49-P58 HydrophobicContact CB-CB 3.95Å; D49-P58 HydrophobicContact CB-CG 4.34Å; P58-R61 HydrophobicContact CG-CG 4.44Å
59	I	92.9	Very high	92.2	Very high	56 Å²	56	66.2 Å²	66.2	29%	0.287	34%	0.343	S	S	.	.	S	Bend	trans	-76.6	-42.4	174.7	-57.7	168.9	0	0	0	109.1	Y50 P51 P57	Y50-I59 PolarHBondContact O-N 2.78Å; P51-I59 HydrophobicContact CG-CD1 4.32Å; P57-I59 PolarHBondContact O-N 2.86Å
60	F	93.7	Very high	92.2	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-116.7	130.2	176	-60.6	-53	0	0	0	109.3	V46 Y50 L66 I89	V46-F60 HydrophobicContact CG1-CB 4.21Å; V46-F60 HydrophobicContact CG2-CB 4.05Å; Y50-F60 HydrophobicContact CD1-CD2 4.49Å; Y50-F60 PolarHBondContact N-O 2.8Å; Y50-F60 PolarHBondContact O-N 2.91Å; F60-L66 HydrophobicContact CD1-CD1 4.24Å; F60-L66 HydrophobicContact CD1-CD2 3.48Å; F60-L66 VanDerWaalsContact CD1-CD2 3.48Å; F60-L66 HydrophobicContact CD2-CD1 4.25Å; F60-L66 HydrophobicContact CE1-CD1 4.28Å; F60-L66 HydrophobicContact CE1-CD2 3.66Å; F60-L66 HydrophobicContact CE2-CD1 4.28Å; F60-L66 HydrophobicContact CG-CD1 4.21Å; F60-L66 HydrophobicContact CG-CD2 4.13Å; F60-L66 HydrophobicContact CZ-CD1 4.28Å; F60-L66 HydrophobicContact CZ-CD2 4.42Å; F60-I89 HydrophobicContact CB-CD1 4.32Å; F60-I89 HydrophobicContact CD2-CB 3.94Å; F60-I89 HydrophobicContact CD2-CD1 3.83Å; F60-I89 HydrophobicContact CD2-CG1 4.33Å; F60-I89 HydrophobicContact CE2-CB 3.94Å; F60-I89 HydrophobicContact CE2-CG2 4.3Å; F60-I89 HydrophobicContact CG-CD1 4.42Å
61	R	92.5	Very high	92.1	Very high	160 Å²	160	67.2 Å²	67.2	60%	0.604	36%	0.356	S	S	*	.			trans	-97.7	148.7	177.8	-64.3	-177	176.5	-171.7	-1.5	111.5	V46 D49 P58 G63 E64	V46-R61 VanDerWaalsContact CB-O 3.31Å; V46-R61 WeakPolarHBondContact CB-O 3.25Å; V46-R61 WeakPolarHBondContact CG1-O 3.44Å; D49-R61 WeakPolarHBondContact OD1-CA 3.42Å; P58-R61 HydrophobicContact CG-CG 4.44Å; R61-G63 PolarHBondContact O-N 3Å; R61-E64 HydrophobicContact CB-CG 4.1Å; R61-E64 VanDerWaalsContact O-CB 3.27Å; R61-E64 WeakPolarHBondContact O-CB 3.23Å; R61-E64 WeakPolarHBondContact O-CG 3.1Å; R61-E64 PolarHBondContact O-N 2.95Å
62	R	92.6	Very high	92	Very high	77 Å²	77	71.2 Å²	71.2	29%	0.291	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	129.1	173.5	-173.8	-178.6	79.4	168.1	8	110.6	L47 D49 E64 E113 L114	L47-R62 WeakPolarHBondContact O-CG 3.29Å; D49-R62 PolarHBondContact OD1-N 3.41Å; R62-E64 VanDerWaalsContact C-N 3.35Å; R62-E113 IonicContact CZ-OE2 4Å; R62-E113 VanDerWaalsContact NH1-CB 3.27Å; R62-E113 IonicContact NH1-OE2 3.57Å; R62-E113 PolarHBondContact NH1-OE2 2.95Å; R62-E113 PolarHBondContact NH2-O 2.63Å; R62-L114 HydrophobicContact CG-CD2 3.85Å
63	G	91	Very high	91.5	Very high	18 Å²	18	72.8 Å²	72.8	19%	0.186	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	-4.4	-177.5	0	0	0	0	0	114.8	V46 R61	V46-G63 PolarHBondContact O-N 2.85Å; R61-G63 PolarHBondContact O-N 3Å
64	E	92.4	Very high	91.3	Very high	27 Å²	27	71 Å²	71	13%	0.126	39%	0.391	C	S	.	.			trans	-67	148.7	170.3	-74.8	-172.2	-171	0	0	111.6	V46 R61 R62 L66 S80	V46-E64 HydrophobicContact CB-CB 4.48Å; V46-E64 HydrophobicContact CG2-CB 4.06Å; V46-E64 WeakPolarHBondContact CG2-O 3.49Å; V46-E64 PolarHBondContact N-O 2.63Å; R61-E64 HydrophobicContact CB-CG 4.1Å; R61-E64 VanDerWaalsContact O-CB 3.27Å; R61-E64 WeakPolarHBondContact O-CB 3.23Å; R61-E64 WeakPolarHBondContact O-CG 3.1Å; R61-E64 PolarHBondContact O-N 2.95Å; R62-E64 VanDerWaalsContact C-N 3.35Å; E64-L66 HydrophobicContact CB-CD2 4.4Å; E64-S80 PolarHBondContact OE2-OG 2.86Å
65	K	93	Very high	91.5	Very high	36 Å²	36	69.7 Å²	69.7	16%	0.157	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.9	172.6	-55.7	-174	-177.6	173.9	0	109.5	F43 L44 L81 L193	F43-K65 HydrophobicContact CD1-CD 4.3Å; F43-K65 HydrophobicContact CD2-CB 3.74Å; F43-K65 HydrophobicContact CD2-CD 4.03Å; F43-K65 HydrophobicContact CD2-CG 3.7Å; F43-K65 HydrophobicContact CE1-CD 4.14Å; F43-K65 HydrophobicContact CE2-CB 4.16Å; F43-K65 HydrophobicContact CE2-CD 3.89Å; F43-K65 HydrophobicContact CE2-CG 3.59Å; F43-K65 HydrophobicContact CG-CB 4.25Å; F43-K65 HydrophobicContact CG-CD 4.25Å; F43-K65 HydrophobicContact CG-CG 4.35Å; F43-K65 HydrophobicContact CZ-CD 3.95Å; F43-K65 HydrophobicContact CZ-CG 4.14Å; L44-K65 CarbonylContact O-C 3.58Å; L44-K65 WeakPolarHBondContact O-CA 3.42Å; K65-L81 HydrophobicContact CB-CB 4.33Å; K65-L81 HydrophobicContact CB-CD1 3.87Å; K65-L81 HydrophobicContact CB-CG 4.37Å; K65-L81 WeakPolarHBondContact O-CB 3.48Å; K65-L81 PolarHBondContact O-N 3.47Å; K65-L193 WeakPolarHBondContact CE-O 3.41Å; K65-L193 PolarHBondContact NZ-O 3.19Å
66	L	94.2	Very high	91.6	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142.5	175.8	-37.8	177.4	0	0	0	110.3	L44 V46 F60 E64 A78 I79 I89 V94	L44-L66 HydrophobicContact CB-CB 4.15Å; L44-L66 PolarHBondContact N-O 3.41Å; L44-L66 PolarHBondContact O-N 3.44Å; V46-L66 HydrophobicContact CG2-CD1 3.62Å; V46-L66 HydrophobicContact CG2-CD2 3.83Å; V46-L66 HydrophobicContact CG2-CG 3.64Å; F60-L66 HydrophobicContact CD1-CD1 4.24Å; F60-L66 HydrophobicContact CD1-CD2 3.48Å; F60-L66 VanDerWaalsContact CD1-CD2 3.48Å; F60-L66 HydrophobicContact CD2-CD1 4.25Å; F60-L66 HydrophobicContact CE1-CD1 4.28Å; F60-L66 HydrophobicContact CE1-CD2 3.66Å; F60-L66 HydrophobicContact CE2-CD1 4.28Å; F60-L66 HydrophobicContact CG-CD1 4.21Å; F60-L66 HydrophobicContact CG-CD2 4.13Å; F60-L66 HydrophobicContact CZ-CD1 4.28Å; F60-L66 HydrophobicContact CZ-CD2 4.42Å; E64-L66 HydrophobicContact CB-CD2 4.4Å; L66-A78 HydrophobicContact CB-CB 3.78Å; L66-A78 HydrophobicContact CD1-CB 3.99Å; L66-I79 CarbonylContact C-O 3.57Å; L66-I79 VanDerWaalsContact CA-O 3.29Å; L66-I79 WeakPolarHBondContact CA-O 3.35Å; L66-I89 HydrophobicContact CD1-CD1 4.32Å; L66-I89 HydrophobicContact CD1-CG2 4.05Å; L66-V94 HydrophobicContact CD1-CG1 4.33Å
67	R	93.9	Very high	91.7	Very high	141 Å²	141	65.1 Å²	65.1	53%	0.532	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	131.1	166.7	-178.4	-178.2	-65.9	172.7	-3.4	108.9	A78 I79 L81	R67-A78 VanDerWaalsContact O-CA 3.26Å; R67-A78 WeakPolarHBondContact O-CA 3.15Å; R67-A78 WeakPolarHBondContact O-CB 3.35Å; R67-I79 HydrophobicContact CB-CG2 3.85Å; R67-I79 PolarHBondContact N-O 2.99Å; R67-I79 PolarHBondContact O-N 3.5Å; R67-L81 HydrophobicContact CB-CD2 3.96Å
68	V	92.8	Very high	91.9	Very high	63 Å²	63	59.8 Å²	59.8	38%	0.382	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	132.6	178	179.8	0	0	0	0	110.1	L44 W76	L44-V68 HydrophobicContact CD1-CG2 3.63Å; L44-V68 HydrophobicContact CD2-CG2 4.21Å; L44-V68 HydrophobicContact CG-CG2 3.6Å; V68-W76 HydrophobicContact CB-CE3 4.38Å; V68-W76 HydrophobicContact CB-CZ3 4.37Å; V68-W76 HydrophobicContact CG1-CE3 3.71Å; V68-W76 HydrophobicContact CG1-CZ3 3.73Å; V68-W76 HydrophobicContact CG2-CE3 3.75Å; V68-W76 HydrophobicContact CG2-CZ3 3.67Å
69	I	93.3	Very high	92	Very high	81 Å²	81	60.7 Å²	60.7	42%	0.415	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-46.2	169.2	-60.4	168.6	0	0	0	109.7	K77 I79 E86	I69-K77 WeakPolarHBondContact CA-O 3.39Å; I69-K77 HydrophobicContact CB-CB 4.35Å; I69-K77 HydrophobicContact CB-CG 4.46Å; I69-K77 WeakPolarHBondContact CB-O 3.43Å; I69-K77 HydrophobicContact CG2-CD 4.21Å; I69-K77 PolarHBondContact N-O 2.95Å; I69-I79 HydrophobicContact CD1-CB 4.06Å; I69-I79 HydrophobicContact CD1-CG2 4.26Å; I69-I79 HydrophobicContact CG1-CG2 4.36Å; I69-E86 HydrophobicContact CD1-CB 4.43Å; I69-E86 VanDerWaalsContact CD1-CD 3.44Å; I69-E86 HydrophobicContact CD1-CG 3.6Å
70	S	92.6	Very high	92.1	Very high	50 Å²	50	58 Å²	58	35%	0.35	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	145.9	179.5	-165.4	0	0	0	0	111.8	K77	S70-K77 PolarHBondContact N-O 3.33Å; S70-K77 VanDerWaalsContact N-O 3.12Å; S70-K77 PolarHBondContact O-N 3.02Å
71	D	90.6	Very high	91.9	Very high	88 Å²	88	62 Å²	62	47%	0.471	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	111.6	173.2	178.4	0.2	0	0	0	108.5	G73 W76	D71-G73 PolarHBondContact OD1-N 3.01Å; D71-W76 HydrophobicContact CB-CE3 4.3Å; D71-W76 HydrophobicContact CB-CH2 4.29Å; D71-W76 HydrophobicContact CB-CZ3 4.05Å
72	E	90.2	Very high	91.7	Very high	102 Å²	102	57.1 Å²	57.1	48%	0.477	31%	0.309	S	S	.	.			trans	-105.8	30.6	-178.3	-62.2	172.9	-173.9	0	0	111.3	G74 W75 Y88	E72-G74 VanDerWaalsContact C-N 3.31Å; E72-G74 PolarHBondContact O-N 3.08Å; E72-W75 WeakPolarHBondContact CB-O 3.39Å; E72-W75 PolarHBondContact N-O 3.06Å; E72-Y88 VanDerWaalsContact OE1-CE1 3.27Å; E72-Y88 WeakPolarHBondContact OE1-CE1 3.42Å; E72-Y88 PolarHBondContact OE1-OH 2.97Å; E72-Y88 VanDerWaalsContact OE1-OH 3.05Å; E72-Y88 VanDerWaalsContact OE2-CE1 3.3Å; E72-Y88 WeakPolarHBondContact OE2-CE1 3.42Å
73	G	79.6	Confident	91.5	Very high	77 Å²	77	56.5 Å²	56.5	79%	0.794	31%	0.314	S	S	*	.	S	Bend	trans	69.3	25.1	168.5	0	0	0	0	0	114.8	D71	D71-G73 PolarHBondContact OD1-N 3.01Å
74	G	86.5	Confident	91.5	Very high	38 Å²	38	58.1 Å²	58.1	39%	0.392	33%	0.331	S	S	.	.	S	Bend	trans	157.6	-25.4	-179.1	0	0	0	0	0	112.6	E72 G91	E72-G74 VanDerWaalsContact C-N 3.31Å; E72-G74 PolarHBondContact O-N 3.08Å; G74-G91 PolarHBondContact O-N 3.42Å
75	W	93	Very high	91.4	Very high	124 Å²	124	64 Å²	64	47%	0.47	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	141	170.2	-67.9	87.1	0	0	0	109.9	Y50 E72 P90	Y50-W75 WeakPolarHBondContact OH-CZ3 3.46Å; E72-W75 WeakPolarHBondContact CB-O 3.39Å; E72-W75 PolarHBondContact N-O 3.06Å; W75-P90 HydrophobicContact CE3-CB 4.42Å; W75-P90 HydrophobicContact CE3-CG 4.01Å; W75-P90 HydrophobicContact CH2-CG 3.66Å; W75-P90 HydrophobicContact CZ2-CG 4.34Å; W75-P90 HydrophobicContact CZ3-CB 4.32Å; W75-P90 HydrophobicContact CZ3-CG 3.47Å; W75-P90 VanDerWaalsContact CZ3-CG 3.47Å
76	W	93.2	Very high	91.5	Very high	28 Å²	28	67 Å²	67	11%	0.106	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.6	177.4	-66	77.5	0	0	0	108.4	L44 V68 D71 Y88 I89 V94	L44-W76 HydrophobicContact CD1-CB 4.16Å; L44-W76 HydrophobicContact CD1-CD2 3.89Å; L44-W76 HydrophobicContact CD1-CE3 3.72Å; L44-W76 HydrophobicContact CD1-CG 4.1Å; L44-W76 HydrophobicContact CD1-CZ3 4.42Å; L44-W76 HydrophobicContact CD2-CE3 4.47Å; L44-W76 HydrophobicContact CD2-CZ3 4.45Å; V68-W76 HydrophobicContact CB-CE3 4.38Å; V68-W76 HydrophobicContact CB-CZ3 4.37Å; V68-W76 HydrophobicContact CG1-CE3 3.71Å; V68-W76 HydrophobicContact CG1-CZ3 3.73Å; V68-W76 HydrophobicContact CG2-CE3 3.75Å; V68-W76 HydrophobicContact CG2-CZ3 3.67Å; D71-W76 HydrophobicContact CB-CE3 4.3Å; D71-W76 HydrophobicContact CB-CH2 4.29Å; D71-W76 HydrophobicContact CB-CZ3 4.05Å; W76-Y88 CarbonylContact O-C 3.55Å; W76-Y88 VanDerWaalsContact O-CA 3.31Å; W76-Y88 WeakPolarHBondContact O-CA 3.36Å; W76-I89 HydrophobicContact CB-CG2 3.98Å; W76-I89 PolarHBondContact N-O 3.28Å; W76-I89 PolarHBondContact O-N 2.83Å; W76-V94 HydrophobicContact CG-CG2 4.37Å
77	K	94.8	Very high	91.5	Very high	57 Å²	57	68.3 Å²	68.3	25%	0.248	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	119.7	163.3	-157.9	-173.9	-155.9	-151.8	0	107.5	I69 S70 E86 Y88	I69-K77 WeakPolarHBondContact CA-O 3.39Å; I69-K77 HydrophobicContact CB-CB 4.35Å; I69-K77 HydrophobicContact CB-CG 4.46Å; I69-K77 WeakPolarHBondContact CB-O 3.43Å; I69-K77 HydrophobicContact CG2-CD 4.21Å; I69-K77 PolarHBondContact N-O 2.95Å; S70-K77 PolarHBondContact N-O 3.33Å; S70-K77 VanDerWaalsContact N-O 3.12Å; S70-K77 PolarHBondContact O-N 3.02Å; K77-E86 WeakPolarHBondContact CD-OE1 3.39Å; K77-E86 WeakPolarHBondContact CE-OE1 3.4Å; K77-E86 IonicContact NZ-OE1 2.64Å; K77-E86 PolarHBondContact NZ-OE1 2.99Å; K77-Y88 HydrophobicContact CB-CD1 4.09Å; K77-Y88 HydrophobicContact CB-CE1 3.66Å; K77-Y88 HydrophobicContact CD-CE1 4.28Å; K77-Y88 HydrophobicContact CD-CE2 4.31Å; K77-Y88 WeakPolarHBondContact CE-OH 3.48Å; K77-Y88 HydrophobicContact CG-CD1 4.29Å; K77-Y88 HydrophobicContact CG-CE1 3.82Å; K77-Y88 HydrophobicContact CG-CE2 4.11Å
78	A	95.2	Very high	91.6	Very high	0 Å²	0	66 Å²	66	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	156	-174.6	0	0	0	0	0	112	L44 L66 R67 E86 S87	L44-A78 HydrophobicContact CD1-CB 4.48Å; L66-A78 HydrophobicContact CB-CB 3.78Å; L66-A78 HydrophobicContact CD1-CB 3.99Å; R67-A78 VanDerWaalsContact O-CA 3.26Å; R67-A78 WeakPolarHBondContact O-CA 3.15Å; R67-A78 WeakPolarHBondContact O-CB 3.35Å; A78-E86 WeakPolarHBondContact O-CA 3.31Å; A78-S87 PolarHBondContact N-O 3.48Å; A78-S87 PolarHBondContact O-N 3.13Å; A78-S87 VanDerWaalsContact O-O 3.1Å
79	I	94.7	Very high	91.6	Very high	51 Å²	51	63 Å²	63	26%	0.262	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.4	173.9	-174.7	168.5	0	0	0	110	L66 R67 I69 L81 G84 R85	L66-I79 CarbonylContact C-O 3.57Å; L66-I79 VanDerWaalsContact CA-O 3.29Å; L66-I79 WeakPolarHBondContact CA-O 3.35Å; R67-I79 HydrophobicContact CB-CG2 3.85Å; R67-I79 PolarHBondContact N-O 2.99Å; R67-I79 PolarHBondContact O-N 3.5Å; I69-I79 HydrophobicContact CD1-CB 4.06Å; I69-I79 HydrophobicContact CD1-CG2 4.26Å; I69-I79 HydrophobicContact CG1-CG2 4.36Å; I79-L81 PolarHBondContact O-N 3.1Å; I79-G84 WeakPolarHBondContact CD1-O 3.19Å; I79-R85 WeakPolarHBondContact CA-O 3.46Å
80	S	93.9	Very high	91.7	Very high	1 Å²	1	60 Å²	60	1%	0.007	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	125.8	176.1	170.8	0	0	0	0	110.3	E64 S82 T83 G84 R85	E64-S80 PolarHBondContact OE2-OG 2.86Å; S80-S82 PolarHBondContact O-N 2.98Å; S80-S82 PolarHBondContact OG-OG 2.67Å; S80-T83 WeakPolarHBondContact CB-OG1 3.31Å; S80-T83 PolarHBondContact OG-N 2.82Å; S80-T83 PolarHBondContact OG-OG1 3.43Å; S80-T83 VanDerWaalsContact OG-OG1 3.06Å; S80-G84 VanDerWaalsContact O-CA 3.22Å; S80-G84 WeakPolarHBondContact O-CA 3.17Å; S80-G84 PolarHBondContact O-N 3.37Å; S80-R85 PolarHBondContact N-O 3.05Å
81	L	90.4	Very high	91.6	Very high	82 Å²	82	58.8 Å²	58.8	43%	0.429	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-19.8	178.5	-65.7	-179.1	0	0	0	112.4	K65 R67 I79	K65-L81 HydrophobicContact CB-CB 4.33Å; K65-L81 HydrophobicContact CB-CD1 3.87Å; K65-L81 HydrophobicContact CB-CG 4.37Å; K65-L81 WeakPolarHBondContact O-CB 3.48Å; K65-L81 PolarHBondContact O-N 3.47Å; R67-L81 HydrophobicContact CB-CD2 3.96Å; I79-L81 PolarHBondContact O-N 3.1Å
82	S	87.6	Confident	91.7	Very high	58 Å²	58	61.7 Å²	61.7	41%	0.406	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-41	177.4	56	0	0	0	0	112.4	S80	S80-S82 PolarHBondContact O-N 2.98Å; S80-S82 PolarHBondContact OG-OG 2.67Å
83	T	89.4	Confident	91.8	Very high	64 Å²	64	58 Å²	58	39%	0.393	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-14.1	-173.6	65.3	0	0	0	0	114.4	S80 R85	S80-T83 WeakPolarHBondContact CB-OG1 3.31Å; S80-T83 PolarHBondContact OG-N 2.82Å; S80-T83 PolarHBondContact OG-OG1 3.43Å; S80-T83 VanDerWaalsContact OG-OG1 3.06Å; T83-R85 PolarHBondContact O-N 3.18Å; T83-R85 PolarHBondContact OG1-N 3.27Å
84	G	90.3	Very high	92.5	Very high	52 Å²	52	54.8 Å²	54.8	54%	0.536	30%	0.295	S	S	.	.			trans	67.8	9.6	-173.4	0	0	0	0	0	114.1	I79 S80	I79-G84 WeakPolarHBondContact CD1-O 3.19Å; S80-G84 VanDerWaalsContact O-CA 3.22Å; S80-G84 WeakPolarHBondContact O-CA 3.17Å; S80-G84 PolarHBondContact O-N 3.37Å
85	R	90.6	Very high	92.8	Very high	151 Å²	151	53 Å²	53	57%	0.57	28%	0.277	S	S	*	.			trans	-83.5	129.6	-178.6	-67.5	179.7	177.7	-178.8	-1.7	111	I79 S80 T83	I79-R85 WeakPolarHBondContact CA-O 3.46Å; S80-R85 PolarHBondContact N-O 3.05Å; T83-R85 PolarHBondContact O-N 3.18Å; T83-R85 PolarHBondContact OG1-N 3.27Å
86	E	94.7	Very high	92.8	Very high	100 Å²	100	52.2 Å²	52.2	47%	0.467	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	128.9	172.3	178.3	175.9	166	0	0	110.2	I69 K77 A78	I69-E86 HydrophobicContact CD1-CB 4.43Å; I69-E86 VanDerWaalsContact CD1-CD 3.44Å; I69-E86 HydrophobicContact CD1-CG 3.6Å; K77-E86 WeakPolarHBondContact CD-OE1 3.39Å; K77-E86 WeakPolarHBondContact CE-OE1 3.4Å; K77-E86 IonicContact NZ-OE1 2.64Å; K77-E86 PolarHBondContact NZ-OE1 2.99Å; A78-E86 WeakPolarHBondContact O-CA 3.31Å
87	S	94.9	Very high	92.9	Very high	27 Å²	27	51 Å²	51	19%	0.189	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	167.8	175.1	-175.1	0	0	0	0	111.2	A78	A78-S87 PolarHBondContact N-O 3.48Å; A78-S87 PolarHBondContact O-N 3.13Å; A78-S87 VanDerWaalsContact O-O 3.1Å
88	Y	94.5	Very high	92.7	Very high	92 Å²	92	50.9 Å²	50.9	36%	0.361	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	142.9	170.9	-73.2	-84.3	0	0	0	111.4	Y50 E72 W76 K77	Y50-Y88 WeakPolarHBondContact CE1-O 3.24Å; E72-Y88 VanDerWaalsContact OE1-CE1 3.27Å; E72-Y88 WeakPolarHBondContact OE1-CE1 3.42Å; E72-Y88 PolarHBondContact OE1-OH 2.97Å; E72-Y88 VanDerWaalsContact OE1-OH 3.05Å; E72-Y88 VanDerWaalsContact OE2-CE1 3.3Å; E72-Y88 WeakPolarHBondContact OE2-CE1 3.42Å; W76-Y88 CarbonylContact O-C 3.55Å; W76-Y88 VanDerWaalsContact O-CA 3.31Å; W76-Y88 WeakPolarHBondContact O-CA 3.36Å; K77-Y88 HydrophobicContact CB-CD1 4.09Å; K77-Y88 HydrophobicContact CB-CE1 3.66Å; K77-Y88 HydrophobicContact CD-CE1 4.28Å; K77-Y88 HydrophobicContact CD-CE2 4.31Å; K77-Y88 WeakPolarHBondContact CE-OH 3.48Å; K77-Y88 HydrophobicContact CG-CD1 4.29Å; K77-Y88 HydrophobicContact CG-CE1 3.82Å; K77-Y88 HydrophobicContact CG-CE2 4.11Å
89	I	94.6	Very high	92.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	136.5	173.7	-173.3	164.4	0	0	0	110.2	V46 Y50 F60 L66 W76 C93 V94	V46-I89 HydrophobicContact CG1-CD1 4.28Å; V46-I89 HydrophobicContact CG2-CD1 4.37Å; Y50-I89 HydrophobicContact CD1-CB 4.3Å; Y50-I89 HydrophobicContact CD1-CD1 4.47Å; Y50-I89 HydrophobicContact CD1-CG1 4.01Å; Y50-I89 HydrophobicContact CG-CD1 4.38Å; Y50-I89 HydrophobicContact CG-CG1 4.1Å; F60-I89 HydrophobicContact CB-CD1 4.32Å; F60-I89 HydrophobicContact CD2-CB 3.94Å; F60-I89 HydrophobicContact CD2-CD1 3.83Å; F60-I89 HydrophobicContact CD2-CG1 4.33Å; F60-I89 HydrophobicContact CE2-CB 3.94Å; F60-I89 HydrophobicContact CE2-CG2 4.3Å; F60-I89 HydrophobicContact CG-CD1 4.42Å; L66-I89 HydrophobicContact CD1-CD1 4.32Å; L66-I89 HydrophobicContact CD1-CG2 4.05Å; W76-I89 HydrophobicContact CB-CG2 3.98Å; W76-I89 PolarHBondContact N-O 3.28Å; W76-I89 PolarHBondContact O-N 2.83Å; I89-C93 HydrophobicContact CD1-CB 3.92Å; I89-C93 HydrophobicContact CG1-CB 3.81Å; I89-V94 HydrophobicContact CB-CG1 4.5Å; I89-V94 HydrophobicContact CD1-CG1 3.45Å; I89-V94 VanDerWaalsContact CD1-CG1 3.45Å; I89-V94 HydrophobicContact CG1-CG1 3.89Å; I89-V94 HydrophobicContact CG2-CG1 3.8Å
90	P	94.2	Very high	92.3	Very high	18 Å²	18	54.4 Å²	54.4	12%	0.117	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	144.1	174.5	-19.8	29.1	0	0	0	111.8	Y50 W75 I92 C93	Y50-P90 HydrophobicContact CD2-CG 4.24Å; Y50-P90 VanDerWaalsContact CE2-CD 3.43Å; Y50-P90 HydrophobicContact CE2-CG 3.63Å; Y50-P90 VanDerWaalsContact CZ-CD 3.41Å; W75-P90 HydrophobicContact CE3-CB 4.42Å; W75-P90 HydrophobicContact CE3-CG 4.01Å; W75-P90 HydrophobicContact CH2-CG 3.66Å; W75-P90 HydrophobicContact CZ2-CG 4.34Å; W75-P90 HydrophobicContact CZ3-CB 4.32Å; W75-P90 HydrophobicContact CZ3-CG 3.47Å; W75-P90 VanDerWaalsContact CZ3-CG 3.47Å; P90-I92 HydrophobicContact CB-CG2 3.96Å; P90-I92 PolarHBondContact O-N 2.96Å; P90-I92 VanDerWaalsContact O-N 3.16Å; P90-C93 WeakPolarHBondContact O-CB 3.3Å; P90-C93 PolarHBondContact O-N 3.02Å
91	G	91.2	Very high	92.4	Very high	24 Å²	24	55.6 Å²	55.6	25%	0.247	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-56.9	-31.2	176.8	0	0	0	0	0	114	G74 C93 V94	G74-G91 PolarHBondContact O-N 3.42Å; G91-C93 PolarHBondContact O-N 3.21Å; G91-V94 WeakPolarHBondContact O-CG2 3.27Å; G91-V94 PolarHBondContact O-N 3.45Å
92	I	91.8	Very high	92.6	Very high	150 Å²	150	53 Å²	53	77%	0.769	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-68.8	-19.5	177.6	-167.9	161.2	0	0	0	113.6	P90	P90-I92 HydrophobicContact CB-CG2 3.96Å; P90-I92 PolarHBondContact O-N 2.96Å; P90-I92 VanDerWaalsContact O-N 3.16Å
93	C	92.9	Very high	92.9	Very high	24 Å²	24	50.2 Å²	50.2	16%	0.162	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-91.6	-1.4	179.5	-63.2	0	0	0	0	112.6	L47 I89 P90 G91	L47-C93 WeakPolarHBondContact CB-O 3.33Å; L47-C93 PolarHBondContact N-O 2.87Å; I89-C93 HydrophobicContact CD1-CB 3.92Å; I89-C93 HydrophobicContact CG1-CB 3.81Å; P90-C93 WeakPolarHBondContact O-CB 3.3Å; P90-C93 PolarHBondContact O-N 3.02Å; G91-C93 PolarHBondContact O-N 3.21Å
94	V	93.8	Very high	93	Very high	10 Å²	10	49.6 Å²	49.6	6%	0.061	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	151.7	-176	-66	0	0	0	0	111.6	L44 A45 L66 W76 I89 G91	L44-V94 HydrophobicContact CB-CB 4.35Å; L44-V94 HydrophobicContact CD1-CB 4.43Å; L44-V94 HydrophobicContact CD1-CG2 4.27Å; L44-V94 HydrophobicContact CD2-CG2 4.45Å; A45-V94 CarbonylContact O-C 3.45Å; A45-V94 VanDerWaalsContact O-CA 3.29Å; A45-V94 WeakPolarHBondContact O-CA 3.36Å; L66-V94 HydrophobicContact CD1-CG1 4.33Å; W76-V94 HydrophobicContact CG-CG2 4.37Å; I89-V94 HydrophobicContact CB-CG1 4.5Å; I89-V94 HydrophobicContact CD1-CG1 3.45Å; I89-V94 VanDerWaalsContact CD1-CG1 3.45Å; I89-V94 HydrophobicContact CG1-CG1 3.89Å; I89-V94 HydrophobicContact CG2-CG1 3.8Å; G91-V94 WeakPolarHBondContact O-CG2 3.27Å; G91-V94 PolarHBondContact O-N 3.45Å
95	A	93.8	Very high	92.9	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.9	166.8	0	0	0	0	0	109.8	L44 A45 L47 F103 E104 L106	L44-A95 CarbonylContact C-O 3.55Å; L44-A95 WeakPolarHBondContact CA-O 3.36Å; A45-A95 PolarHBondContact N-O 2.92Å; A45-A95 PolarHBondContact O-N 3.49Å; L47-A95 HydrophobicContact CD1-CB 4.2Å; L47-A95 HydrophobicContact CD2-CB 3.73Å; L47-A95 HydrophobicContact CG-CB 4.27Å; A95-F103 HydrophobicContact CB-CD1 4.33Å; A95-E104 WeakPolarHBondContact CA-O 3.49Å; A95-E104 WeakPolarHBondContact CB-O 3.44Å; A95-L106 HydrophobicContact CB-CB 4.12Å
96	R	92.9	Very high	93	Very high	106 Å²	106	42 Å²	42	40%	0.4	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	132.2	171.8	-64.6	174.7	69.7	131.4	3.6	108.4	L44 Y98 F103 E104	L44-R96 HydrophobicContact CD2-CB 4.39Å; L44-R96 HydrophobicContact CD2-CG 3.69Å; R96-Y98 HydrophobicContact CB-CE2 4.12Å; R96-Y98 PolarHBondContact NE-OH 2.82Å; R96-Y98 PolarHBondContact NH2-OH 2.84Å; R96-F103 CarbonylContact O-C 3.58Å; R96-F103 WeakPolarHBondContact O-CA 3.41Å; R96-E104 HydrophobicContact CB-CB 4.3Å; R96-E104 PolarHBondContact N-O 3.22Å; R96-E104 VanDerWaalsContact N-O 3.12Å; R96-E104 PolarHBondContact O-N 2.68Å
97	V	93.8	Very high	92.9	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.012	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	128.5	177.2	-170.9	0	0	0	0	108.4	D42 F43 A45 L102 F103	D42-V97 VanDerWaalsContact CA-O 3.24Å; D42-V97 WeakPolarHBondContact CA-O 3.39Å; F43-V97 HydrophobicContact CD1-CB 4.23Å; F43-V97 HydrophobicContact CD1-CG1 4.44Å; F43-V97 HydrophobicContact CD2-CB 4.15Å; F43-V97 HydrophobicContact CD2-CG2 4.07Å; F43-V97 HydrophobicContact CE1-CB 4Å; F43-V97 HydrophobicContact CE1-CG1 3.79Å; F43-V97 HydrophobicContact CE2-CB 3.9Å; F43-V97 HydrophobicContact CE2-CG1 4.25Å; F43-V97 HydrophobicContact CE2-CG2 3.64Å; F43-V97 HydrophobicContact CG-CB 4.3Å; F43-V97 HydrophobicContact CZ-CB 3.82Å; F43-V97 HydrophobicContact CZ-CG1 3.67Å; F43-V97 HydrophobicContact CZ-CG2 3.94Å; F43-V97 PolarHBondContact N-O 3.34Å; F43-V97 VanDerWaalsContact N-O 3.09Å; F43-V97 WeakPolarHBondContact O-CB 3.36Å; F43-V97 PolarHBondContact O-N 3.22Å; A45-V97 HydrophobicContact CB-CG2 3.64Å; V97-L102 CarbonylContact C-O 3.53Å; V97-L102 VanDerWaalsContact CA-O 3.26Å; V97-L102 WeakPolarHBondContact CA-O 2.67Å; V97-F103 HydrophobicContact CG1-CD2 4.24Å; V97-F103 HydrophobicContact CG1-CE1 4.45Å; V97-F103 HydrophobicContact CG1-CE2 3.95Å; V97-F103 HydrophobicContact CG1-CZ 4.07Å; V97-F103 HydrophobicContact CG2-CD1 3.54Å; V97-F103 HydrophobicContact CG2-CD2 4.49Å; V97-F103 HydrophobicContact CG2-CE1 3.41Å; V97-F103 VanDerWaalsContact CG2-CE1 3.41Å; V97-F103 HydrophobicContact CG2-CE2 4.35Å; V97-F103 HydrophobicContact CG2-CG 4.11Å; V97-F103 HydrophobicContact CG2-CZ 3.83Å
98	Y	92.1	Very high	92.8	Very high	56 Å²	56	42.8 Å²	42.8	22%	0.22	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	145.1	173.6	-52.5	-84	0	0	0	109.8	D42 R96 G100 W101 L102 E104	D42-Y98 VanDerWaalsContact OD1-CA 3.31Å; D42-Y98 WeakPolarHBondContact OD1-CA 3.35Å; R96-Y98 HydrophobicContact CB-CE2 4.12Å; R96-Y98 PolarHBondContact NE-OH 2.82Å; R96-Y98 PolarHBondContact NH2-OH 2.84Å; Y98-G100 PolarHBondContact O-N 2.73Å; Y98-W101 PolarHBondContact O-N 3.09Å; Y98-L102 HydrophobicContact CD2-CD2 4.42Å; Y98-L102 HydrophobicContact CD2-CG 4.45Å; Y98-L102 PolarHBondContact N-O 2.77Å; Y98-L102 WeakPolarHBondContact O-CB 3.27Å; Y98-L102 PolarHBondContact O-N 3.39Å; Y98-E104 HydrophobicContact CE2-CB 3.96Å; Y98-E104 WeakPolarHBondContact CE2-OE2 3.26Å; Y98-E104 PolarHBondContact OH-OE2 2.74Å
99	H	90.5	Very high	92.7	Very high	110 Å²	110	44 Å²	44	51%	0.509	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	16.2	-179.8	-51.8	-69.1	0	0	0	114.2	D42 W101	D42-H99 PolarHBondContact OD1-N 2.83Å; H99-W101 HydrophobicContact CB-CD2 4.45Å; H99-W101 HydrophobicContact CB-CZ2 3.95Å; H99-W101 PolarHBondContact O-N 3.48Å; H99-W101 PolarHBondContact O-NE1 2.96Å
100	G	91.4	Very high	92.6	Very high	15 Å²	15	46.9 Å²	46.9	16%	0.155	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	-8.3	-175.4	0	0	0	0	0	117.3	S41 Y98 P191	S41-G100 PolarHBondContact O-N 2.98Å; S41-G100 VanDerWaalsContact O-N 3.09Å; Y98-G100 PolarHBondContact O-N 2.73Å; G100-P191 WeakPolarHBondContact O-CB 3.21Å
101	W	94.1	Very high	92.6	Very high	26 Å²	26	46 Å²	46	10%	0.098	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-11.7	-177.3	50.1	-100	0	0	0	115	Y98 H99 F103 F125 I127 L170 E171 V174 P191	Y98-W101 PolarHBondContact O-N 3.09Å; H99-W101 HydrophobicContact CB-CD2 4.45Å; H99-W101 HydrophobicContact CB-CZ2 3.95Å; H99-W101 PolarHBondContact O-N 3.48Å; H99-W101 PolarHBondContact O-NE1 2.96Å; W101-F103 WeakPolarHBondContact O-CD2 3.29Å; W101-F125 HydrophobicContact CB-CE2 3.82Å; W101-F125 HydrophobicContact CB-CZ 4.26Å; W101-F125 HydrophobicContact CG-CE2 4.17Å; W101-I127 HydrophobicContact CE3-CB 4.14Å; W101-I127 HydrophobicContact CE3-CD1 3.92Å; W101-I127 HydrophobicContact CE3-CG1 4.18Å; W101-I127 HydrophobicContact CZ3-CB 4.36Å; W101-I127 HydrophobicContact CZ3-CD1 3.77Å; W101-I127 HydrophobicContact CZ3-CG1 4.42Å; W101-I127 PolarHBondContact O-N 3.49Å; W101-L170 HydrophobicContact CH2-CB 3.72Å; W101-L170 HydrophobicContact CZ3-CB 3.92Å; W101-L170 HydrophobicContact CZ3-CD1 4.44Å; W101-E171 HydrophobicContact CZ2-CB 4.3Å; W101-V174 HydrophobicContact CD2-CG2 4.24Å; W101-V174 HydrophobicContact CE3-CG2 4.14Å; W101-V174 HydrophobicContact CH2-CG2 4.48Å; W101-V174 HydrophobicContact CZ3-CG2 4.28Å; W101-P191 HydrophobicContact CB-CB 3.99Å; W101-P191 HydrophobicContact CB-CG 4.25Å
102	L	94.8	Very high	92.8	Very high	26 Å²	26	47.2 Å²	47.2	14%	0.136	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	112.7	179.5	178.8	61.8	0	0	0	110.6	V97 Y98 I127 Y137 L170	V97-L102 CarbonylContact C-O 3.53Å; V97-L102 VanDerWaalsContact CA-O 3.26Å; V97-L102 WeakPolarHBondContact CA-O 2.67Å; Y98-L102 HydrophobicContact CD2-CD2 4.42Å; Y98-L102 HydrophobicContact CD2-CG 4.45Å; Y98-L102 PolarHBondContact N-O 2.77Å; Y98-L102 WeakPolarHBondContact O-CB 3.27Å; Y98-L102 PolarHBondContact O-N 3.39Å; L102-I127 CarbonylContact C-O 3.57Å; L102-I127 WeakPolarHBondContact CA-O 3.45Å; L102-I127 HydrophobicContact CD1-CB 4.16Å; L102-I127 HydrophobicContact CD1-CG2 3.79Å; L102-Y137 HydrophobicContact CD1-CD1 4.08Å; L102-Y137 HydrophobicContact CD1-CE1 3.98Å; L102-L170 HydrophobicContact CD1-CD1 4.17Å
103	F	94.5	Very high	92.9	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.5	-176.3	-69.7	-112.3	0	0	0	111	A45 A95 R96 V97 W101 L106 L114 M126 I127 R128 E129 C192 L193	A45-F103 HydrophobicContact CB-CD1 4.28Å; A45-F103 HydrophobicContact CB-CE1 3.69Å; A95-F103 HydrophobicContact CB-CD1 4.33Å; R96-F103 CarbonylContact O-C 3.58Å; R96-F103 WeakPolarHBondContact O-CA 3.41Å; V97-F103 HydrophobicContact CG1-CD2 4.24Å; V97-F103 HydrophobicContact CG1-CE1 4.45Å; V97-F103 HydrophobicContact CG1-CE2 3.95Å; V97-F103 HydrophobicContact CG1-CZ 4.07Å; V97-F103 HydrophobicContact CG2-CD1 3.54Å; V97-F103 HydrophobicContact CG2-CD2 4.49Å; V97-F103 HydrophobicContact CG2-CE1 3.41Å; V97-F103 VanDerWaalsContact CG2-CE1 3.41Å; V97-F103 HydrophobicContact CG2-CE2 4.35Å; V97-F103 HydrophobicContact CG2-CG 4.11Å; V97-F103 HydrophobicContact CG2-CZ 3.83Å; W101-F103 WeakPolarHBondContact O-CD2 3.29Å; F103-L106 HydrophobicContact CB-CB 3.82Å; F103-L106 HydrophobicContact CB-CD2 3.74Å; F103-L106 HydrophobicContact CB-CG 4.44Å; F103-L106 HydrophobicContact CD1-CD2 3.68Å; F103-L106 HydrophobicContact CE1-CD2 4.45Å; F103-L106 HydrophobicContact CG-CD2 3.79Å; F103-L114 HydrophobicContact CE1-CD1 4.41Å; F103-M126 HydrophobicContact CD2-CB 3.65Å; F103-M126 HydrophobicContact CD2-SD 4.49Å; F103-M126 HydrophobicContact CE1-CE 4.4Å; F103-M126 HydrophobicContact CE2-CB 3.61Å; F103-M126 HydrophobicContact CE2-CE 4.26Å; F103-M126 HydrophobicContact CZ-CE 4.11Å; F103-I127 PolarHBondContact N-O 2.9Å; F103-R128 WeakPolarHBondContact O-CA 2.94Å; F103-E129 PolarHBondContact O-N 2.7Å; F103-C192 HydrophobicContact CZ-CB 4.36Å; F103-L193 HydrophobicContact CE1-CD1 4.18Å; F103-L193 HydrophobicContact CZ-CD1 4.24Å
104	E	92.4	Very high	93	Very high	51 Å²	51	41.8 Å²	41.8	24%	0.238	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	134	172.1	-177	-178.8	-166.6	0	0	109.6	A95 R96 Y98 K134	A95-E104 WeakPolarHBondContact CA-O 3.49Å; A95-E104 WeakPolarHBondContact CB-O 3.44Å; R96-E104 HydrophobicContact CB-CB 4.3Å; R96-E104 PolarHBondContact N-O 3.22Å; R96-E104 VanDerWaalsContact N-O 3.12Å; R96-E104 PolarHBondContact O-N 2.68Å; Y98-E104 HydrophobicContact CE2-CB 3.96Å; Y98-E104 WeakPolarHBondContact CE2-OE2 3.26Å; Y98-E104 PolarHBondContact OH-OE2 2.74Å; E104-K134 IonicContact OE1-NZ 3.52Å
105	G	87.6	Confident	93	Very high	44 Å²	44	41.3 Å²	41.3	45%	0.454	20%	0.203	S	C	.	.	S	Bend	trans	78.3	19	-176.8	0	0	0	0	0	114.5
106	L	92.1	Very high	92.9	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.			trans	-105.6	114.3	179.4	-176.5	72.4	0	0	0	112.3	L47 A95 F103 K110 A111 L114 M126 R128	L47-L106 HydrophobicContact CD1-CD1 4.29Å; L47-L106 HydrophobicContact CD2-CD1 3.35Å; L47-L106 HydrophobicContact CG-CD1 4.42Å; A95-L106 HydrophobicContact CB-CB 4.12Å; F103-L106 HydrophobicContact CB-CB 3.82Å; F103-L106 HydrophobicContact CB-CD2 3.74Å; F103-L106 HydrophobicContact CB-CG 4.44Å; F103-L106 HydrophobicContact CD1-CD2 3.68Å; F103-L106 HydrophobicContact CE1-CD2 4.45Å; F103-L106 HydrophobicContact CG-CD2 3.79Å; L106-K110 HydrophobicContact CD1-CB 3.55Å; L106-A111 HydrophobicContact CD2-CB 3.81Å; L106-A111 HydrophobicContact CG-CB 4.17Å; L106-L114 HydrophobicContact CD1-CD1 3.97Å; L106-L114 HydrophobicContact CD2-CD1 4.37Å; L106-M126 HydrophobicContact CD2-CE 4.22Å; L106-M126 HydrophobicContact CD2-SD 3.29Å; L106-M126 WeakPolarHBondContact CD2-SD 3.44Å; L106-R128 HydrophobicContact CB-CB 4.42Å
107	G	91.9	Very high	92.8	Very high	13 Å²	13	42.2 Å²	42.2	13%	0.134	21%	0.212	C	C	.	.			trans	-71.6	166.4	174.4	0	0	0	0	0	114.1	D109 A111 E131	G107-D109 PolarHBondContact O-N 3.19Å; G107-A111 WeakPolarHBondContact O-CB 3.37Å; G107-A111 PolarHBondContact O-N 2.74Å; G107-E131 WeakPolarHBondContact CA-OE1 3.47Å; G107-E131 PolarHBondContact N-OE1 2.99Å
108	R	93	Very high	92.5	Very high	130 Å²	130	47.7 Å²	47.7	49%	0.491	25%	0.248	S	C	.	.	H	α-helix	trans	-58.3	-49	178.9	-176	-173.1	175.8	136.6	-2.5	111.7	K110 A111 E112 H148	R108-K110 PolarHBondContact O-N 3.48Å; R108-A111 WeakPolarHBondContact O-CB 3.22Å; R108-A111 PolarHBondContact O-N 3.31Å; R108-E112 IonicContact CZ-OE1 3.68Å; R108-E112 IonicContact NE-OE1 2.83Å; R108-E112 PolarHBondContact NE-OE1 3.46Å; R108-E112 VanDerWaalsContact NE-OE1 3.09Å; R108-E112 IonicContact NH2-OE1 3.35Å; R108-E112 WeakPolarHBondContact O-CG 3.19Å; R108-E112 PolarHBondContact O-N 2.83Å; R108-H148 PolarHBondContact NH2-CD2 3.28Å
109	D	93.4	Very high	92	Very high	117 Å²	117	50.4 Å²	50.4	63%	0.626	27%	0.266	S	S	*	.	H	α-helix	trans	-66.5	-41.6	-173.5	-53	-33.3	0	0	0	110.9	G107 A111 E112 E113	G107-D109 PolarHBondContact O-N 3.19Å; D109-A111 PolarHBondContact O-N 3.44Å; D109-E112 PolarHBondContact O-N 3.35Å; D109-E113 PolarHBondContact O-N 2.83Å
110	K	93.1	Very high	92	Very high	62 Å²	62	46.2 Å²	46.2	27%	0.27	25%	0.248	S	C	.	.	H	α-helix	trans	-66.7	-34.9	175	-65.4	-61	175.7	-165.3	0	113	L47 S48 L106 R108 E113 L114	L47-K110 HydrophobicContact CB-CD 4.42Å; S48-K110 WeakPolarHBondContact OG-CE 3.41Å; S48-K110 PolarHBondContact OG-NZ 3.14Å; L106-K110 HydrophobicContact CD1-CB 3.55Å; R108-K110 PolarHBondContact O-N 3.48Å; K110-E113 IonicContact NZ-OE1 2.89Å; K110-E113 PolarHBondContact NZ-OE1 2.98Å; K110-E113 IonicContact NZ-OE2 3.34Å; K110-E113 PolarHBondContact NZ-OE2 3.22Å; K110-E113 WeakPolarHBondContact O-CB 3.34Å; K110-E113 PolarHBondContact O-N 3Å; K110-L114 WeakPolarHBondContact O-CG 3.29Å; K110-L114 PolarHBondContact O-N 3.48Å
111	A	94.3	Very high	92	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-41.9	171.9	0	0	0	0	0	112	L106 G107 R108 D109 L114 L115 M126	L106-A111 HydrophobicContact CD2-CB 3.81Å; L106-A111 HydrophobicContact CG-CB 4.17Å; G107-A111 WeakPolarHBondContact O-CB 3.37Å; G107-A111 PolarHBondContact O-N 2.74Å; R108-A111 WeakPolarHBondContact O-CB 3.22Å; R108-A111 PolarHBondContact O-N 3.31Å; D109-A111 PolarHBondContact O-N 3.44Å; A111-L114 PolarHBondContact O-N 3.39Å; A111-L115 WeakPolarHBondContact O-CB 3.4Å; A111-L115 WeakPolarHBondContact O-CG 3.42Å; A111-L115 PolarHBondContact O-N 2.75Å; A111-M126 HydrophobicContact CB-SD 3.56Å; A111-M126 VanDerWaalsContact CB-SD 3.56Å
112	E	95.2	Very high	92	Very high	48 Å²	48	54.9 Å²	54.9	22%	0.224	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-43.6	176.4	-66.7	-175.7	-170.4	0	0	111.6	R108 D109 L115 Q116 V146 H148	R108-E112 IonicContact CZ-OE1 3.68Å; R108-E112 IonicContact NE-OE1 2.83Å; R108-E112 PolarHBondContact NE-OE1 3.46Å; R108-E112 VanDerWaalsContact NE-OE1 3.09Å; R108-E112 IonicContact NH2-OE1 3.35Å; R108-E112 WeakPolarHBondContact O-CG 3.19Å; R108-E112 PolarHBondContact O-N 2.83Å; D109-E112 PolarHBondContact O-N 3.35Å; E112-L115 PolarHBondContact O-N 2.89Å; E112-Q116 VanDerWaalsContact O-CB 3.3Å; E112-Q116 WeakPolarHBondContact O-CB 3.37Å; E112-Q116 WeakPolarHBondContact O-CG 3.45Å; E112-Q116 PolarHBondContact O-N 2.81Å; E112-V146 HydrophobicContact CB-CB 4.49Å; E112-V146 HydrophobicContact CB-CG2 4.43Å; E112-V146 HydrophobicContact CG-CB 3.98Å; E112-V146 HydrophobicContact CG-CG1 4Å; E112-V146 HydrophobicContact CG-CG2 4.45Å; E112-H148 WeakPolarHBondContact CG-NE2 3.44Å; E112-H148 IonicContact OE1-CD2 2.77Å; E112-H148 IonicContact OE1-CE1 3.87Å; E112-H148 IonicContact OE1-NE2 3.09Å; E112-H148 PolarHBondContact OE1-NE2 2.78Å
113	E	94	Very high	91.9	Very high	61 Å²	61	53.6 Å²	53.6	29%	0.285	28%	0.283	S	S	.	.	H	α-helix	trans	-57.2	-47.3	174.8	-84.2	-171.6	-134.9	0	0	113.1	R62 D109 K110 Q116 L117	R62-E113 IonicContact CZ-OE2 4Å; R62-E113 VanDerWaalsContact NH1-CB 3.27Å; R62-E113 IonicContact NH1-OE2 3.57Å; R62-E113 PolarHBondContact NH1-OE2 2.95Å; R62-E113 PolarHBondContact NH2-O 2.63Å; D109-E113 PolarHBondContact O-N 2.83Å; K110-E113 IonicContact NZ-OE1 2.89Å; K110-E113 PolarHBondContact NZ-OE1 2.98Å; K110-E113 IonicContact NZ-OE2 3.34Å; K110-E113 PolarHBondContact NZ-OE2 3.22Å; K110-E113 WeakPolarHBondContact O-CB 3.34Å; K110-E113 PolarHBondContact O-N 3Å; E113-Q116 PolarHBondContact O-N 3.11Å; E113-L117 PolarHBondContact O-N 3.34Å
114	L	93.6	Very high	92	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-68.3	-43	179.9	-70.9	176.6	0	0	0	112	L47 R62 F103 L106 K110 A111 Q116 L117 M126 L193	L47-L114 HydrophobicContact CD2-CD1 4Å; R62-L114 HydrophobicContact CG-CD2 3.85Å; F103-L114 HydrophobicContact CE1-CD1 4.41Å; L106-L114 HydrophobicContact CD1-CD1 3.97Å; L106-L114 HydrophobicContact CD2-CD1 4.37Å; K110-L114 WeakPolarHBondContact O-CG 3.29Å; K110-L114 PolarHBondContact O-N 3.48Å; A111-L114 PolarHBondContact O-N 3.39Å; L114-Q116 PolarHBondContact O-N 3.35Å; L114-L117 HydrophobicContact CD2-CD1 3.93Å; L114-L117 VanDerWaalsContact O-CB 3.31Å; L114-L117 WeakPolarHBondContact O-CB 3.48Å; L114-L117 WeakPolarHBondContact O-CG 3.48Å; L114-L117 PolarHBondContact O-N 2.89Å; L114-M126 HydrophobicContact CB-CE 4.01Å; L114-M126 HydrophobicContact CD1-CE 4.33Å; L114-L193 HydrophobicContact CD2-CD2 4.48Å
115	L	93.9	Very high	92.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-71.8	-9.4	177	-73.9	172	0	0	0	113.7	A111 E112 T120 M126 R142 V146 C192	A111-L115 WeakPolarHBondContact O-CB 3.4Å; A111-L115 WeakPolarHBondContact O-CG 3.42Å; A111-L115 PolarHBondContact O-N 2.75Å; E112-L115 PolarHBondContact O-N 2.89Å; L115-T120 PolarHBondContact O-OG1 3.21Å; L115-M126 HydrophobicContact CD1-CE 4.44Å; L115-M126 HydrophobicContact CD1-CG 4.1Å; L115-M126 HydrophobicContact CD1-SD 4.35Å; L115-M126 HydrophobicContact CD2-CE 4.11Å; L115-M126 HydrophobicContact CG-CE 3.83Å; L115-M126 HydrophobicContact CG-CG 4.42Å; L115-M126 HydrophobicContact CG-SD 4.36Å; L115-R142 HydrophobicContact CB-CB 4.38Å; L115-R142 HydrophobicContact CD2-CB 4.3Å; L115-R142 WeakPolarHBondContact O-CD 3.4Å; L115-R142 WeakPolarHBondContact O-CG 3.46Å; L115-R142 PolarHBondContact O-NE 2.88Å; L115-V146 HydrophobicContact CB-CG2 3.85Å; L115-V146 HydrophobicContact CD1-CG1 3.7Å; L115-V146 HydrophobicContact CD1-CG2 4.42Å; L115-C192 HydrophobicContact CD2-CB 3.86Å
116	Q	93	Very high	92.6	Very high	99 Å²	99	49.5 Å²	49.5	46%	0.463	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	2.1	174.1	-71.8	177.4	43.3	0	0	112.7	E112 E113 L114 V146	E112-Q116 VanDerWaalsContact O-CB 3.3Å; E112-Q116 WeakPolarHBondContact O-CB 3.37Å; E112-Q116 WeakPolarHBondContact O-CG 3.45Å; E112-Q116 PolarHBondContact O-N 2.81Å; E113-Q116 PolarHBondContact O-N 3.11Å; L114-Q116 PolarHBondContact O-N 3.35Å; Q116-V146 HydrophobicContact CG-CG2 4.04Å
117	L	90.5	Very high	92.9	Very high	26 Å²	26	49.5 Å²	49.5	14%	0.136	25%	0.252	C	S	.	.	S	Bend	trans	-57.8	144.6	171.3	-75.2	169.3	0	0	0	110.6	E113 L114 D119 T120 L193	E113-L117 PolarHBondContact O-N 3.34Å; L114-L117 HydrophobicContact CD2-CD1 3.93Å; L114-L117 VanDerWaalsContact O-CB 3.31Å; L114-L117 WeakPolarHBondContact O-CB 3.48Å; L114-L117 WeakPolarHBondContact O-CG 3.48Å; L114-L117 PolarHBondContact O-N 2.89Å; L117-D119 PolarHBondContact O-N 2.96Å; L117-D119 VanDerWaalsContact O-N 3.08Å; L117-T120 HydrophobicContact CB-CG2 4.26Å; L117-T120 PolarHBondContact O-N 3.47Å; L117-T120 PolarHBondContact O-OG1 3.24Å; L117-L193 HydrophobicContact CD1-CD2 4.16Å
118	P	86.3	Confident	93	Very high	118 Å²	118	50.2 Å²	50.2	77%	0.766	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-24.3	-175.6	24.1	-34.3	0	0	0	113.4	T120	P118-T120 VanDerWaalsContact C-N 3.26Å; P118-T120 PolarHBondContact O-N 2.9Å
119	D	82.9	Confident	93	Very high	113 Å²	113	45.4 Å²	45.4	60%	0.604	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-5.2	-179.9	-59.7	-33.1	0	0	0	113.7	L117 Q195	L117-D119 PolarHBondContact O-N 2.96Å; L117-D119 VanDerWaalsContact O-N 3.08Å; D119-Q195 PolarHBondContact O-NE2 2.9Å
120	T	89.2	Confident	92.6	Very high	21 Å²	21	41.3 Å²	41.3	13%	0.129	21%	0.214	C	C	.	.			trans	-93.8	142.6	179	64.8	0	0	0	0	111.2	L115 L117 P118	L115-T120 PolarHBondContact O-OG1 3.21Å; L117-T120 HydrophobicContact CB-CG2 4.26Å; L117-T120 PolarHBondContact O-N 3.47Å; L117-T120 PolarHBondContact O-OG1 3.24Å; P118-T120 VanDerWaalsContact C-N 3.26Å; P118-T120 PolarHBondContact O-N 2.9Å
121	K	92.1	Very high	91.8	Very high	135 Å²	135	45 Å²	45	59%	0.587	23%	0.232	S	C	*	.			trans	-110.5	167.6	-177.3	-64.5	-179.8	-176.9	173.2	0	110.3	G123 S124 R142	K121-G123 PolarHBondContact O-N 2.73Å; K121-S124 PolarHBondContact N-OG 2.8Å; K121-S124 WeakPolarHBondContact O-CB 3.33Å; K121-S124 PolarHBondContact O-N 2.95Å; K121-S124 PolarHBondContact O-OG 2.78Å; K121-R142 VanDerWaalsContact O-CG 3.25Å; K121-R142 WeakPolarHBondContact O-CG 3.39Å
122	V	93.9	Very high	90.9	Very high	88 Å²	88	51.2 Å²	51.2	53%	0.533	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	136.2	170.2	176.7	0	0	0	0	109.3	S124 R142 T189	V122-S124 VanDerWaalsContact C-N 3.29Å; V122-R142 WeakPolarHBondContact CA-O 3.33Å; V122-T189 PolarHBondContact O-OG1 3.23Å; V122-T189 VanDerWaalsContact O-OG1 3.12Å
123	G	93.7	Very high	90	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-6.9	-172	0	0	0	0	0	114.1	K121 F125 R142 V187 T189	K121-G123 PolarHBondContact O-N 2.73Å; G123-F125 PolarHBondContact O-N 3.09Å; G123-R142 PolarHBondContact N-O 3.2Å; G123-V187 WeakPolarHBondContact CA-O 3.01Å; G123-T189 WeakPolarHBondContact CA-OG1 3.36Å; G123-T189 PolarHBondContact O-N 2.83Å; G123-T189 PolarHBondContact O-OG1 3.36Å
124	S	95.9	Very high	89.2	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.021	30%	0.304	C	S	.	.			trans	-62.6	138.7	172.8	-64.7	0	0	0	0	110.3	K121 V122 R142 T189 T190	K121-S124 PolarHBondContact N-OG 2.8Å; K121-S124 WeakPolarHBondContact O-CB 3.33Å; K121-S124 PolarHBondContact O-N 2.95Å; K121-S124 PolarHBondContact O-OG 2.78Å; V122-S124 VanDerWaalsContact C-N 3.29Å; S124-R142 WeakPolarHBondContact O-CB 3.26Å; S124-R142 PolarHBondContact O-N 2.95Å; S124-T189 PolarHBondContact N-OG1 3.26Å; S124-T190 CarbonylContact C-O 3.57Å; S124-T190 WeakPolarHBondContact CA-O 3.37Å; S124-T190 PolarHBondContact OG-OG1 2.85Å; S124-T190 VanDerWaalsContact OG-OG1 3.06Å
125	F	96.9	Very high	88.6	Confident	6 Å²	6	59.8 Å²	59.8	3%	0.026	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	164.8	-168.8	74.7	-82.4	0	0	0	113.7	W101 G123 L139 S140 V141 V174 L188 T190 P191 C192	W101-F125 HydrophobicContact CB-CE2 3.82Å; W101-F125 HydrophobicContact CB-CZ 4.26Å; W101-F125 HydrophobicContact CG-CE2 4.17Å; G123-F125 PolarHBondContact O-N 3.09Å; F125-L139 HydrophobicContact CB-CD1 4.24Å; F125-L139 HydrophobicContact CD2-CD1 3.94Å; F125-L139 HydrophobicContact CG-CD1 4.5Å; F125-S140 CarbonylContact C-O 3.57Å; F125-S140 VanDerWaalsContact CA-O 3.24Å; F125-S140 WeakPolarHBondContact CA-O 3.47Å; F125-V141 HydrophobicContact CB-CG2 4.33Å; F125-V174 HydrophobicContact CE1-CG1 4.49Å; F125-V174 HydrophobicContact CE2-CB 4.45Å; F125-V174 HydrophobicContact CE2-CG1 3.63Å; F125-V174 HydrophobicContact CE2-CG2 3.92Å; F125-V174 HydrophobicContact CZ-CG1 3.43Å; F125-V174 VanDerWaalsContact CZ-CG1 3.43Å; F125-L188 HydrophobicContact CB-CD2 3.77Å; F125-L188 HydrophobicContact CD1-CB 3.66Å; F125-L188 HydrophobicContact CD1-CD1 4.45Å; F125-L188 HydrophobicContact CD1-CD2 4.29Å; F125-L188 HydrophobicContact CD1-CG 4.33Å; F125-L188 HydrophobicContact CD2-CD1 4.07Å; F125-L188 HydrophobicContact CE1-CB 3.87Å; F125-L188 HydrophobicContact CE2-CD1 4.26Å; F125-L188 HydrophobicContact CG-CB 4.12Å; F125-L188 HydrophobicContact CG-CD1 4.18Å; F125-L188 HydrophobicContact CG-CD2 3.95Å; F125-L188 HydrophobicContact CG-CG 4.3Å; F125-T190 VanDerWaalsContact CD1-O 3.31Å; F125-T190 WeakPolarHBondContact CD1-O 3.41Å; F125-T190 VanDerWaalsContact CE1-C 3.49Å; F125-T190 PolarHBondContact N-O 2.91Å; F125-P191 HydrophobicContact CE1-CG 4.29Å; F125-P191 HydrophobicContact CZ-CG 4.16Å; F125-P191 CarbonylContact O-C 3.53Å; F125-C192 WeakPolarHBondContact O-CB 3.45Å; F125-C192 PolarHBondContact O-N 2.96Å
126	M	96.4	Very high	88.3	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	152.4	168.7	57.4	178.2	59.9	0	0	109.6	F103 L106 A111 L114 L115 S140 C192	F103-M126 HydrophobicContact CD2-CB 3.65Å; F103-M126 HydrophobicContact CD2-SD 4.49Å; F103-M126 HydrophobicContact CE1-CE 4.4Å; F103-M126 HydrophobicContact CE2-CB 3.61Å; F103-M126 HydrophobicContact CE2-CE 4.26Å; F103-M126 HydrophobicContact CZ-CE 4.11Å; L106-M126 HydrophobicContact CD2-CE 4.22Å; L106-M126 HydrophobicContact CD2-SD 3.29Å; L106-M126 WeakPolarHBondContact CD2-SD 3.44Å; A111-M126 HydrophobicContact CB-SD 3.56Å; A111-M126 VanDerWaalsContact CB-SD 3.56Å; L114-M126 HydrophobicContact CB-CE 4.01Å; L114-M126 HydrophobicContact CD1-CE 4.33Å; L115-M126 HydrophobicContact CD1-CE 4.44Å; L115-M126 HydrophobicContact CD1-CG 4.1Å; L115-M126 HydrophobicContact CD1-SD 4.35Å; L115-M126 HydrophobicContact CD2-CE 4.11Å; L115-M126 HydrophobicContact CG-CE 3.83Å; L115-M126 HydrophobicContact CG-CG 4.42Å; L115-M126 HydrophobicContact CG-SD 4.36Å; M126-S140 PolarHBondContact N-O 3.43Å; M126-S140 PolarHBondContact O-N 2.81Å; M126-C192 HydrophobicContact CB-CB 4.2Å; M126-C192 HydrophobicContact CE-CB 3.3Å; M126-C192 WeakPolarHBondContact CE-SG 3.42Å
127	I	96.9	Very high	88.4	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	125.4	167.3	-64.1	-179.3	0	0	0	107.1	W101 L102 F103 Y137 S138 L139 I151 L170 L173 V174	W101-I127 HydrophobicContact CE3-CB 4.14Å; W101-I127 HydrophobicContact CE3-CD1 3.92Å; W101-I127 HydrophobicContact CE3-CG1 4.18Å; W101-I127 HydrophobicContact CZ3-CB 4.36Å; W101-I127 HydrophobicContact CZ3-CD1 3.77Å; W101-I127 HydrophobicContact CZ3-CG1 4.42Å; W101-I127 PolarHBondContact O-N 3.49Å; L102-I127 CarbonylContact C-O 3.57Å; L102-I127 WeakPolarHBondContact CA-O 3.45Å; L102-I127 HydrophobicContact CD1-CB 4.16Å; L102-I127 HydrophobicContact CD1-CG2 3.79Å; F103-I127 PolarHBondContact N-O 2.9Å; I127-Y137 HydrophobicContact CG2-CD1 4.06Å; I127-Y137 HydrophobicContact CG2-CG 4.3Å; I127-S138 WeakPolarHBondContact CA-O 3.33Å; I127-L139 HydrophobicContact CG1-CB 4.47Å; I127-L139 HydrophobicContact CG1-CD1 3.81Å; I127-I151 HydrophobicContact CD1-CD1 3.94Å; I127-I151 HydrophobicContact CG1-CD1 4.22Å; I127-I151 HydrophobicContact CG2-CD1 3.98Å; I127-L170 HydrophobicContact CD1-CB 4.46Å; I127-L170 HydrophobicContact CD1-CD2 4.38Å; I127-L170 HydrophobicContact CG2-CD1 4.39Å; I127-L173 HydrophobicContact CD1-CD2 4.43Å; I127-V174 HydrophobicContact CD1-CG2 3.64Å
128	R	95.6	Very high	88.6	Confident	28 Å²	28	59.5 Å²	59.5	11%	0.106	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.6	175.1	59.4	-178.4	177.7	77	4.5	110.8	F103 L106 Y137 S138 H148	F103-R128 WeakPolarHBondContact O-CA 2.94Å; L106-R128 HydrophobicContact CB-CB 4.42Å; R128-Y137 CarbonylContact O-C 3.57Å; R128-Y137 WeakPolarHBondContact O-CA 3.27Å; R128-S138 WeakPolarHBondContact CG-O 3.31Å; R128-S138 PolarHBondContact N-O 3.46Å; R128-S138 PolarHBondContact O-N 2.94Å; R128-H148 PolarHBondContact NH2-ND1 2.92Å
129	E	92.4	Very high	89.1	Confident	28 Å²	28	53.9 Å²	53.9	13%	0.131	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	142.2	166.8	-168.4	173.9	-161	0	0	110.2	F103 E131 K134 G135 Y137	F103-E129 PolarHBondContact O-N 2.7Å; E129-E131 PolarHBondContact O-N 3.26Å; E129-K134 WeakPolarHBondContact OE1-CA 3.39Å; E129-G135 PolarHBondContact OE1-N 2.98Å; E129-Y137 HydrophobicContact CB-CD1 4.07Å; E129-Y137 HydrophobicContact CB-CE1 3.95Å; E129-Y137 HydrophobicContact CG-CD1 4.27Å; E129-Y137 HydrophobicContact CG-CE1 3.95Å
130	S	84.3	Confident	89.8	Confident	31 Å²	31	48.5 Å²	48.5	22%	0.217	24%	0.242	C	C	.	.			trans	-68.8	124.1	176.8	-172	0	0	0	0	111	T132 K133 F136	S130-T132 PolarHBondContact O-N 2.97Å; S130-T132 PolarHBondContact OG-OG1 2.75Å; S130-K133 CarbonylContact O-C 3.55Å; S130-K133 PolarHBondContact O-N 3.31Å; S130-F136 WeakPolarHBondContact CB-O 3.41Å; S130-F136 PolarHBondContact N-O 2.79Å
131	E	76.6	Confident	90.2	Very high	139 Å²	139	47.5 Å²	47.5	65%	0.65	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-36.2	177.1	-66.5	174.8	-150.3	0	0	112.9	G107 E129	G107-E131 WeakPolarHBondContact CA-OE1 3.47Å; G107-E131 PolarHBondContact N-OE1 2.99Å; E129-E131 PolarHBondContact O-N 3.26Å
132	T	75.2	Confident	90.4	Very high	131 Å²	131	43.9 Å²	43.9	80%	0.804	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-20.3	-175.3	53.1	0	0	0	0	114.4	S130	S130-T132 PolarHBondContact O-N 2.97Å; S130-T132 PolarHBondContact OG-OG1 2.75Å
133	K	76.7	Confident	90.4	Very high	119 Å²	119	42.5 Å²	42.5	52%	0.517	21%	0.207	S	C	.	.	S	Bend	trans	-152.4	106.5	-171.8	-162	172.9	179.7	-168.3	0	111.3	S130 F136	S130-K133 CarbonylContact O-C 3.55Å; S130-K133 PolarHBondContact O-N 3.31Å; K133-F136 HydrophobicContact CB-CD2 3.82Å; K133-F136 HydrophobicContact CB-CE2 4.45Å; K133-F136 HydrophobicContact CB-CG 4.36Å; K133-F136 HydrophobicContact CD-CD2 3.43Å; K133-F136 VanDerWaalsContact CD-CD2 3.43Å; K133-F136 HydrophobicContact CD-CE1 4.49Å; K133-F136 HydrophobicContact CD-CE2 3.19Å; K133-F136 HydrophobicContact CD-CG 4.25Å; K133-F136 HydrophobicContact CD-CZ 3.77Å; K133-F136 HydrophobicContact CG-CD2 3.43Å; K133-F136 VanDerWaalsContact CG-CD2 3.43Å; K133-F136 HydrophobicContact CG-CE2 3.62Å; K133-F136 HydrophobicContact CG-CG 4.37Å; K133-F136 VanDerWaalsContact NZ-CZ 3.25Å; K133-F136 PolarHBondContact O-N 2.86Å
134	K	78.2	Confident	90.2	Very high	159 Å²	159	53.2 Å²	53.2	69%	0.691	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	140.9	175.6	-66.2	-155	173.1	-142.8	0	111.6	E104 E129 F136	E104-K134 IonicContact OE1-NZ 3.52Å; E129-K134 WeakPolarHBondContact OE1-CA 3.39Å; K134-F136 VanDerWaalsContact C-N 3.34Å
135	G	79.1	Confident	90	Very high	12 Å²	12	59.6 Å²	59.6	12%	0.124	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	6.5	-177.7	0	0	0	0	0	115.7	E129	E129-G135 PolarHBondContact OE1-N 2.98Å
136	F	88.2	Confident	90	Very high	64 Å²	64	60 Å²	60	28%	0.281	28%	0.28	S	S	.	.			trans	-103.2	121.2	168.3	-74.4	-103	0	0	0	108.7	S130 K133 K134	S130-F136 WeakPolarHBondContact CB-O 3.41Å; S130-F136 PolarHBondContact N-O 2.79Å; K133-F136 HydrophobicContact CB-CD2 3.82Å; K133-F136 HydrophobicContact CB-CE2 4.45Å; K133-F136 HydrophobicContact CB-CG 4.36Å; K133-F136 HydrophobicContact CD-CD2 3.43Å; K133-F136 VanDerWaalsContact CD-CD2 3.43Å; K133-F136 HydrophobicContact CD-CE1 4.49Å; K133-F136 HydrophobicContact CD-CE2 3.19Å; K133-F136 HydrophobicContact CD-CG 4.25Å; K133-F136 HydrophobicContact CD-CZ 3.77Å; K133-F136 HydrophobicContact CG-CD2 3.43Å; K133-F136 VanDerWaalsContact CG-CD2 3.43Å; K133-F136 HydrophobicContact CG-CE2 3.62Å; K133-F136 HydrophobicContact CG-CG 4.37Å; K133-F136 VanDerWaalsContact NZ-CZ 3.25Å; K133-F136 PolarHBondContact O-N 2.86Å; K134-F136 VanDerWaalsContact C-N 3.34Å
137	Y	95.1	Very high	90	Very high	33 Å²	33	64.5 Å²	64.5	13%	0.129	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	154	-176.9	-58.9	-78.3	0	0	0	111.1	L102 I127 R128 E129 I151 Y159 L170	L102-Y137 HydrophobicContact CD1-CD1 4.08Å; L102-Y137 HydrophobicContact CD1-CE1 3.98Å; I127-Y137 HydrophobicContact CG2-CD1 4.06Å; I127-Y137 HydrophobicContact CG2-CG 4.3Å; R128-Y137 CarbonylContact O-C 3.57Å; R128-Y137 WeakPolarHBondContact O-CA 3.27Å; E129-Y137 HydrophobicContact CB-CD1 4.07Å; E129-Y137 HydrophobicContact CB-CE1 3.95Å; E129-Y137 HydrophobicContact CG-CD1 4.27Å; E129-Y137 HydrophobicContact CG-CE1 3.95Å; Y137-I151 PolarHBondContact O-N 3.26Å; Y137-Y159 HydrophobicContact CD2-CD1 4.35Å; Y137-Y159 AromaticContact CD2-CE1 3.82Å; Y137-Y159 HydrophobicContact CD2-CE1 3.82Å; Y137-Y159 AromaticContact CE2-CE1 3.71Å; Y137-Y159 HydrophobicContact CE2-CE1 3.71Å; Y137-L170 HydrophobicContact CD1-CD1 4.1Å; Y137-L170 HydrophobicContact CD2-CD1 4.13Å; Y137-L170 HydrophobicContact CD2-CD2 4.34Å; Y137-L170 HydrophobicContact CE1-CD1 4.06Å; Y137-L170 HydrophobicContact CE2-CD1 4.07Å; Y137-L170 HydrophobicContact CG-CD1 4.13Å
138	S	95.8	Very high	89.9	Confident	21 Å²	21	66.5 Å²	66.5	15%	0.147	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	126.9	171.9	-64.3	0	0	0	0	109.8	I127 R128 Y149	I127-S138 WeakPolarHBondContact CA-O 3.33Å; R128-S138 WeakPolarHBondContact CG-O 3.31Å; R128-S138 PolarHBondContact N-O 3.46Å; R128-S138 PolarHBondContact O-N 2.94Å; S138-Y149 CarbonylContact C-O 3.5Å; S138-Y149 VanDerWaalsContact CA-O 3.29Å; S138-Y149 WeakPolarHBondContact CA-O 3.14Å
139	L	96.9	Very high	89.9	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	124.3	171.9	174.2	67.9	0	0	0	108.7	F125 I127 V141 H148 Y149 I151 I161 L184 L188	F125-L139 HydrophobicContact CB-CD1 4.24Å; F125-L139 HydrophobicContact CD2-CD1 3.94Å; F125-L139 HydrophobicContact CG-CD1 4.5Å; I127-L139 HydrophobicContact CG1-CB 4.47Å; I127-L139 HydrophobicContact CG1-CD1 3.81Å; L139-V141 HydrophobicContact CD1-CG2 4.2Å; L139-V141 HydrophobicContact CD2-CG2 4.03Å; L139-V141 HydrophobicContact CG-CG2 3.77Å; L139-H148 CarbonylContact O-C 3.58Å; L139-H148 WeakPolarHBondContact O-CA 3.35Å; L139-Y149 HydrophobicContact CD2-CD2 4.41Å; L139-Y149 PolarHBondContact N-O 3.31Å; L139-Y149 PolarHBondContact O-N 3.33Å; L139-I151 HydrophobicContact CB-CD1 4.12Å; L139-I151 HydrophobicContact CB-CG1 4.32Å; L139-I161 HydrophobicContact CB-CD1 4.36Å; L139-I161 HydrophobicContact CD2-CD1 3.72Å; L139-L184 HydrophobicContact CD2-CD1 3.78Å; L139-L184 HydrophobicContact CD2-CD2 4.46Å; L139-L188 HydrophobicContact CD1-CD1 4.3Å; L139-L188 HydrophobicContact CD1-CD2 4.36Å; L139-L188 HydrophobicContact CD2-CD1 4.41Å; L139-L188 HydrophobicContact CD2-CD2 4.28Å
140	S	97.3	Very high	90	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.9	176.1	-49.1	0	0	0	0	108.6	F125 M126 K147 H148	F125-S140 CarbonylContact C-O 3.57Å; F125-S140 VanDerWaalsContact CA-O 3.24Å; F125-S140 WeakPolarHBondContact CA-O 3.47Å; M126-S140 PolarHBondContact N-O 3.43Å; M126-S140 PolarHBondContact O-N 2.81Å; S140-K147 CarbonylContact C-O 3.58Å; S140-K147 WeakPolarHBondContact CA-O 3.47Å; S140-H148 PolarHBondContact OG-ND1 2.81Å
141	V	96.9	Very high	90.6	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132	-173.8	-170.6	0	0	0	0	110.6	F125 L139 H143 V146 K147 Y149 L188	F125-V141 HydrophobicContact CB-CG2 4.33Å; L139-V141 HydrophobicContact CD1-CG2 4.2Å; L139-V141 HydrophobicContact CD2-CG2 4.03Å; L139-V141 HydrophobicContact CG-CG2 3.77Å; V141-H143 PolarHBondContact O-N 2.93Å; V141-V146 WeakPolarHBondContact O-CA 3.4Å; V141-K147 PolarHBondContact N-O 2.81Å; V141-K147 PolarHBondContact O-N 3.41Å; V141-Y149 HydrophobicContact CG2-CD2 4.27Å; V141-Y149 HydrophobicContact CG2-CE2 4.2Å; V141-L188 HydrophobicContact CG1-CD2 4.14Å; V141-L188 HydrophobicContact CG2-CD2 3.7Å
142	R	95.9	Very high	91.4	Very high	59 Å²	59	67.8 Å²	67.8	22%	0.223	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	115	174	178.6	50.9	167	146.4	-7.8	110.4	L115 K121 V122 G123 S124 R144	L115-R142 HydrophobicContact CB-CB 4.38Å; L115-R142 HydrophobicContact CD2-CB 4.3Å; L115-R142 WeakPolarHBondContact O-CD 3.4Å; L115-R142 WeakPolarHBondContact O-CG 3.46Å; L115-R142 PolarHBondContact O-NE 2.88Å; K121-R142 VanDerWaalsContact O-CG 3.25Å; K121-R142 WeakPolarHBondContact O-CG 3.39Å; V122-R142 WeakPolarHBondContact CA-O 3.33Å; G123-R142 PolarHBondContact N-O 3.2Å; S124-R142 WeakPolarHBondContact O-CB 3.26Å; S124-R142 PolarHBondContact O-N 2.95Å; R142-R144 PolarHBondContact NH1-O 3.34Å
143	H	93.5	Very high	92.2	Very high	60 Å²	60	67.3 Å²	67.3	28%	0.278	29%	0.287	S	S	.	.	S	Bend	trans	-127.9	-140.8	167.8	-171.6	-112.3	0	0	0	109	V141 Q145	V141-H143 PolarHBondContact O-N 2.93Å; H143-Q145 VanDerWaalsContact C-N 3.3Å; H143-Q145 PolarHBondContact N-O 3.16Å; H143-Q145 PolarHBondContact O-N 2.99Å
144	R	90.8	Very high	92.9	Very high	224 Å²	224	64.2 Å²	64.2	85%	0.845	28%	0.276	S	S	*	.	S	Bend	trans	-57.6	-44.7	168.3	-68.7	-175	178.9	-173	-0.8	112	R142	R142-R144 PolarHBondContact NH1-O 3.34Å
145	Q	92.1	Very high	93.6	Very high	138 Å²	138	62.8 Å²	62.8	65%	0.645	28%	0.283	S	S	*	.	S	Bend	trans	-125.2	156.9	167.2	-68.5	173.9	-2.3	0	0	107.3	H143 K147	H143-Q145 VanDerWaalsContact C-N 3.3Å; H143-Q145 PolarHBondContact N-O 3.16Å; H143-Q145 PolarHBondContact O-N 2.99Å; Q145-K147 PolarHBondContact O-N 3.04Å
146	V	95.9	Very high	94.3	Very high	14 Å²	14	66.3 Å²	66.3	9%	0.085	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	128.2	177	179.3	0	0	0	0	109.2	E112 L115 Q116 V141	E112-V146 HydrophobicContact CB-CB 4.49Å; E112-V146 HydrophobicContact CB-CG2 4.43Å; E112-V146 HydrophobicContact CG-CB 3.98Å; E112-V146 HydrophobicContact CG-CG1 4Å; E112-V146 HydrophobicContact CG-CG2 4.45Å; L115-V146 HydrophobicContact CB-CG2 3.85Å; L115-V146 HydrophobicContact CD1-CG1 3.7Å; L115-V146 HydrophobicContact CD1-CG2 4.42Å; Q116-V146 HydrophobicContact CG-CG2 4.04Å; V141-V146 WeakPolarHBondContact O-CA 3.4Å
147	K	96.1	Very high	94.5	Very high	95 Å²	95	67.5 Å²	67.5	41%	0.413	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	138.1	176.6	-66.8	-61.3	-173.7	-177.4	0	109.6	S140 V141 Q145 Y149 C185	S140-K147 CarbonylContact C-O 3.58Å; S140-K147 WeakPolarHBondContact CA-O 3.47Å; V141-K147 PolarHBondContact N-O 2.81Å; V141-K147 PolarHBondContact O-N 3.41Å; Q145-K147 PolarHBondContact O-N 3.04Å; K147-Y149 HydrophobicContact CB-CE2 3.81Å; K147-C185 HydrophobicContact CG-CB 4.26Å
148	H	95.8	Very high	94.5	Very high	41 Å²	41	70.3 Å²	70.3	19%	0.19	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.4	-179.1	-61.5	-97.2	0	0	0	109.5	R108 E112 R128 L139 S140	R108-H148 PolarHBondContact NH2-CD2 3.28Å; E112-H148 WeakPolarHBondContact CG-NE2 3.44Å; E112-H148 IonicContact OE1-CD2 2.77Å; E112-H148 IonicContact OE1-CE1 3.87Å; E112-H148 IonicContact OE1-NE2 3.09Å; E112-H148 PolarHBondContact OE1-NE2 2.78Å; R128-H148 PolarHBondContact NH2-ND1 2.92Å; L139-H148 CarbonylContact O-C 3.58Å; L139-H148 WeakPolarHBondContact O-CA 3.35Å; S140-H148 PolarHBondContact OG-ND1 2.81Å
149	Y	95.7	Very high	94.5	Very high	46 Å²	46	70.5 Å²	70.5	18%	0.18	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129	176.2	-59.4	-88.9	0	0	0	109	S138 L139 V141 K147 I161 L184 C185	S138-Y149 CarbonylContact C-O 3.5Å; S138-Y149 VanDerWaalsContact CA-O 3.29Å; S138-Y149 WeakPolarHBondContact CA-O 3.14Å; L139-Y149 HydrophobicContact CD2-CD2 4.41Å; L139-Y149 PolarHBondContact N-O 3.31Å; L139-Y149 PolarHBondContact O-N 3.33Å; V141-Y149 HydrophobicContact CG2-CD2 4.27Å; V141-Y149 HydrophobicContact CG2-CE2 4.2Å; K147-Y149 HydrophobicContact CB-CE2 3.81Å; Y149-I161 HydrophobicContact CD1-CG2 4.22Å; Y149-I161 HydrophobicContact CG-CG2 4.48Å; Y149-L184 HydrophobicContact CD1-CD2 3.57Å; Y149-L184 HydrophobicContact CD2-CD2 3.82Å; Y149-L184 HydrophobicContact CE1-CD2 3.59Å; Y149-L184 HydrophobicContact CE2-CD2 3.85Å; Y149-L184 HydrophobicContact CG-CD2 3.68Å; Y149-C185 WeakPolarHBondContact OH-CB 3.35Å; Y149-C185 PolarHBondContact OH-N 2.96Å
150	R	94.3	Very high	94.4	Very high	138 Å²	138	72.9 Å²	72.9	52%	0.521	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	127	176.4	-172.8	168.9	178	-176	2.7	109	F152	R150-F152 HydrophobicContact CB-CE2 4.07Å; R150-F152 HydrophobicContact CB-CZ 4.21Å; R150-F152 VanDerWaalsContact CD-CZ 3.49Å; R150-F152 HydrophobicContact CG-CD2 4.44Å; R150-F152 HydrophobicContact CG-CE1 4.09Å; R150-F152 HydrophobicContact CG-CE2 4.01Å; R150-F152 HydrophobicContact CG-CZ 3.84Å
151	I	95.8	Very high	94.3	Very high	2 Å²	2	74.2 Å²	74.2	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	121.2	172.2	-53.8	175.5	0	0	0	107	I127 Y137 L139 Y159 Y160 I161 L170 L173	I127-I151 HydrophobicContact CD1-CD1 3.94Å; I127-I151 HydrophobicContact CG1-CD1 4.22Å; I127-I151 HydrophobicContact CG2-CD1 3.98Å; Y137-I151 PolarHBondContact O-N 3.26Å; L139-I151 HydrophobicContact CB-CD1 4.12Å; L139-I151 HydrophobicContact CB-CG1 4.32Å; I151-Y159 HydrophobicContact CG2-CD1 4.01Å; I151-Y159 HydrophobicContact CG2-CG 4.45Å; I151-Y160 WeakPolarHBondContact CA-O 3.44Å; I151-I161 HydrophobicContact CG1-CD1 4.28Å; I151-I161 HydrophobicContact CG1-CG1 3.97Å; I151-L170 HydrophobicContact CD1-CD2 4.07Å; I151-L170 HydrophobicContact CG2-CD2 4.17Å; I151-L173 HydrophobicContact CD1-CD1 4.38Å; I151-L173 HydrophobicContact CG2-CD1 4.07Å
152	F	93.3	Very high	94.1	Very high	67 Å²	67	76.1 Å²	76.1	29%	0.294	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	149.7	176.4	-64.5	-84.6	0	0	0	110.1	R150 Y159 Y160	R150-F152 HydrophobicContact CB-CE2 4.07Å; R150-F152 HydrophobicContact CB-CZ 4.21Å; R150-F152 VanDerWaalsContact CD-CZ 3.49Å; R150-F152 HydrophobicContact CG-CD2 4.44Å; R150-F152 HydrophobicContact CG-CE1 4.09Å; R150-F152 HydrophobicContact CG-CE2 4.01Å; R150-F152 HydrophobicContact CG-CZ 3.84Å; F152-Y159 WeakPolarHBondContact O-CA 3.45Å; F152-Y160 HydrophobicContact CB-CD1 3.91Å; F152-Y160 HydrophobicContact CB-CD2 4.25Å; F152-Y160 HydrophobicContact CB-CE1 3.4Å; F152-Y160 VanDerWaalsContact CB-CE1 3.4Å; F152-Y160 HydrophobicContact CB-CE2 3.78Å; F152-Y160 HydrophobicContact CB-CG 4.32Å; F152-Y160 HydrophobicContact CD2-CD2 4.33Å; F152-Y160 AromaticContact CD2-CE2 3.77Å; F152-Y160 HydrophobicContact CD2-CE2 3.77Å; F152-Y160 HydrophobicContact CG-CE1 4.4Å; F152-Y160 HydrophobicContact CG-CE2 4.02Å; F152-Y160 AromaticContact CG-CZ 3.86Å; F152-Y160 PolarHBondContact N-O 2.96Å; F152-Y160 PolarHBondContact O-N 3.41Å
153	R	92.9	Very high	93.8	Very high	122 Å²	122	78.2 Å²	78.2	46%	0.46	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.8	174.9	-166.8	179.7	-174.9	-178.1	-0.3	109.3	N157 W158 Y159	R153-N157 VanDerWaalsContact CZ-OD1 3.3Å; R153-N157 PolarHBondContact NE-OD1 3.21Å; R153-N157 PolarHBondContact NH2-OD1 2.91Å; R153-W158 CarbonylContact C-O 3.51Å; R153-W158 WeakPolarHBondContact CA-O 3.47Å; R153-Y159 HydrophobicContact CB-CD1 4.33Å; R153-Y159 HydrophobicContact CB-CE1 4.23Å; R153-Y159 HydrophobicContact CG-CD1 4.28Å; R153-Y159 HydrophobicContact CG-CE1 3.9Å
154	L	92.3	Very high	93.7	Very high	54 Å²	54	86.6 Å²	86.6	28%	0.283	40%	0.396	S	S	.	.			trans	-79.7	161.2	176	-75.5	149.5	0	0	0	111	N156 N157 W158 Y160 T166	L154-N156 WeakPolarHBondContact CB-OD1 3.41Å; L154-N156 PolarHBondContact O-N 2.69Å; L154-N157 WeakPolarHBondContact O-CA 3.37Å; L154-N157 PolarHBondContact O-N 3.28Å; L154-W158 HydrophobicContact CB-CB 4.44Å; L154-W158 HydrophobicContact CD1-CB 3.92Å; L154-W158 PolarHBondContact N-O 3.06Å; L154-Y160 HydrophobicContact CD1-CD1 3.71Å; L154-Y160 HydrophobicContact CD1-CE1 4.13Å; L154-Y160 HydrophobicContact CD2-CD1 4.47Å; L154-Y160 HydrophobicContact CD2-CE1 4.05Å; L154-Y160 HydrophobicContact CG-CD1 3.78Å; L154-Y160 HydrophobicContact CG-CE1 3.71Å; L154-T166 HydrophobicContact CD1-CG2 3.85Å
155	P	92.1	Very high	93.9	Very high	129 Å²	129	78 Å²	78	84%	0.838	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.7	175.8	-24.6	35	0	0	0	114.3	N157	P155-N157 PolarHBondContact O-N 3.41Å
156	N	93.2	Very high	94.1	Very high	85 Å²	85	74 Å²	74	46%	0.455	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	11.6	173.8	69.6	-10.4	0	0	0	113.3	L154 W158	L154-N156 WeakPolarHBondContact CB-OD1 3.41Å; L154-N156 PolarHBondContact O-N 2.69Å; N156-W158 VanDerWaalsContact C-N 3.27Å; N156-W158 PolarHBondContact O-N 3.35Å; N156-W158 WeakPolarHBondContact OD1-CB 3.38Å; N156-W158 PolarHBondContact OD1-N 3.39Å; N156-W158 VanDerWaalsContact OD1-N 3.11Å
157	N	92.3	Very high	94.1	Very high	89 Å²	89	74.1 Å²	74.1	48%	0.476	35%	0.351	S	S	.	.	S	Bend	trans	69.3	7.4	-177	-60.8	-58.1	0	0	0	116.7	R153 L154 P155 Y159	R153-N157 VanDerWaalsContact CZ-OD1 3.3Å; R153-N157 PolarHBondContact NE-OD1 3.21Å; R153-N157 PolarHBondContact NH2-OD1 2.91Å; L154-N157 WeakPolarHBondContact O-CA 3.37Å; L154-N157 PolarHBondContact O-N 3.28Å; P155-N157 PolarHBondContact O-N 3.41Å; N157-Y159 WeakPolarHBondContact O-CE2 3.37Å
158	W	95.1	Very high	94.1	Very high	92 Å²	92	76 Å²	76	35%	0.348	36%	0.361	S	S	.	.			trans	-78.4	154.8	176.4	-69.3	19.9	0	0	0	111.9	R153 L154 N156 F167 Q168	R153-W158 CarbonylContact C-O 3.51Å; R153-W158 WeakPolarHBondContact CA-O 3.47Å; L154-W158 HydrophobicContact CB-CB 4.44Å; L154-W158 HydrophobicContact CD1-CB 3.92Å; L154-W158 PolarHBondContact N-O 3.06Å; N156-W158 VanDerWaalsContact C-N 3.27Å; N156-W158 PolarHBondContact O-N 3.35Å; N156-W158 WeakPolarHBondContact OD1-CB 3.38Å; N156-W158 PolarHBondContact OD1-N 3.39Å; N156-W158 VanDerWaalsContact OD1-N 3.11Å; W158-F167 CarbonylContact C-O 3.55Å; W158-F167 WeakPolarHBondContact CA-O 3.45Å; W158-F167 WeakPolarHBondContact CB-O 3.45Å; W158-Q168 HydrophobicContact CD2-CG 4.32Å; W158-Q168 HydrophobicContact CH2-CG 4.44Å; W158-Q168 HydrophobicContact CZ2-CG 3.83Å
159	Y	95.7	Very high	94.1	Very high	25 Å²	25	76.1 Å²	76.1	10%	0.098	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	146.1	-177.7	-60.7	-81.6	0	0	0	111.6	Y137 I151 F152 R153 N157 T166 F167 L170	Y137-Y159 HydrophobicContact CD2-CD1 4.35Å; Y137-Y159 AromaticContact CD2-CE1 3.82Å; Y137-Y159 HydrophobicContact CD2-CE1 3.82Å; Y137-Y159 AromaticContact CE2-CE1 3.71Å; Y137-Y159 HydrophobicContact CE2-CE1 3.71Å; I151-Y159 HydrophobicContact CG2-CD1 4.01Å; I151-Y159 HydrophobicContact CG2-CG 4.45Å; F152-Y159 WeakPolarHBondContact O-CA 3.45Å; R153-Y159 HydrophobicContact CB-CD1 4.33Å; R153-Y159 HydrophobicContact CB-CE1 4.23Å; R153-Y159 HydrophobicContact CG-CD1 4.28Å; R153-Y159 HydrophobicContact CG-CE1 3.9Å; N157-Y159 WeakPolarHBondContact O-CE2 3.37Å; Y159-T166 CarbonylContact O-C 3.59Å; Y159-T166 WeakPolarHBondContact O-CA 3.29Å; Y159-F167 PolarHBondContact N-O 2.81Å; Y159-F167 PolarHBondContact O-N 3.45Å; Y159-L170 HydrophobicContact CD1-CD2 3.86Å; Y159-L170 HydrophobicContact CD2-CD2 4.33Å; Y159-L170 HydrophobicContact CD2-CG 4.43Å; Y159-L170 HydrophobicContact CE1-CD2 4.23Å; Y159-L170 HydrophobicContact CE1-CG 4.48Å; Y159-L170 HydrophobicContact CE2-CG 4.42Å; Y159-L170 HydrophobicContact CG-CD2 3.9Å; Y159-L170 HydrophobicContact CG-CG 4.47Å
160	Y	95.3	Very high	94	Very high	51 Å²	51	74.6 Å²	74.6	20%	0.2	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	154	172.3	71.6	-87.3	0	0	0	112.5	I151 F152 L154 P163 L165	I151-Y160 WeakPolarHBondContact CA-O 3.44Å; F152-Y160 HydrophobicContact CB-CD1 3.91Å; F152-Y160 HydrophobicContact CB-CD2 4.25Å; F152-Y160 HydrophobicContact CB-CE1 3.4Å; F152-Y160 VanDerWaalsContact CB-CE1 3.4Å; F152-Y160 HydrophobicContact CB-CE2 3.78Å; F152-Y160 HydrophobicContact CB-CG 4.32Å; F152-Y160 HydrophobicContact CD2-CD2 4.33Å; F152-Y160 AromaticContact CD2-CE2 3.77Å; F152-Y160 HydrophobicContact CD2-CE2 3.77Å; F152-Y160 HydrophobicContact CG-CE1 4.4Å; F152-Y160 HydrophobicContact CG-CE2 4.02Å; F152-Y160 AromaticContact CG-CZ 3.86Å; F152-Y160 PolarHBondContact N-O 2.96Å; F152-Y160 PolarHBondContact O-N 3.41Å; L154-Y160 HydrophobicContact CD1-CD1 3.71Å; L154-Y160 HydrophobicContact CD1-CE1 4.13Å; L154-Y160 HydrophobicContact CD2-CD1 4.47Å; L154-Y160 HydrophobicContact CD2-CE1 4.05Å; L154-Y160 HydrophobicContact CG-CD1 3.78Å; L154-Y160 HydrophobicContact CG-CE1 3.71Å; Y160-P163 HydrophobicContact CD2-CG 4.33Å; Y160-P163 HydrophobicContact CE2-CB 4.43Å; Y160-P163 HydrophobicContact CE2-CG 3.94Å; Y160-L165 VanDerWaalsContact CB-O 3.27Å; Y160-L165 WeakPolarHBondContact CB-O 3.17Å
161	I	95.4	Very high	94.1	Very high	28 Å²	28	73.2 Å²	73.2	14%	0.144	36%	0.361	C	S	.	.	S	Bend	trans	-104.4	-48.1	165.4	-64.9	172.9	0	0	0	108.9	L139 Y149 I151 L173 Y177 L184	L139-I161 HydrophobicContact CB-CD1 4.36Å; L139-I161 HydrophobicContact CD2-CD1 3.72Å; Y149-I161 HydrophobicContact CD1-CG2 4.22Å; Y149-I161 HydrophobicContact CG-CG2 4.48Å; I151-I161 HydrophobicContact CG1-CD1 4.28Å; I151-I161 HydrophobicContact CG1-CG1 3.97Å; I161-L173 HydrophobicContact CD1-CD1 4.45Å; I161-L173 HydrophobicContact CD1-CD2 4.27Å; I161-L173 HydrophobicContact CG1-CD1 4.32Å; I161-Y177 HydrophobicContact CD1-CD2 4.4Å; I161-Y177 HydrophobicContact CD1-CE2 3.85Å; I161-L184 HydrophobicContact CD1-CD2 4.2Å; I161-L184 HydrophobicContact CG2-CD2 4.41Å
162	S	92.6	Very high	94.1	Very high	39 Å²	39	76.4 Å²	76.4	27%	0.273	38%	0.378	S	S	.	.	S	Bend	trans	-104.5	131	171.9	177	0	0	0	0	109.5	R164 L165	S162-R164 PolarHBondContact O-N 2.86Å; S162-L165 PolarHBondContact O-N 2.87Å
163	P	89.8	Confident	94.3	Very high	103 Å²	103	73.2 Å²	73.2	67%	0.669	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.9	-179.8	-24.9	33.2	0	0	0	115	Y160 L165	Y160-P163 HydrophobicContact CD2-CG 4.33Å; Y160-P163 HydrophobicContact CE2-CB 4.43Å; Y160-P163 HydrophobicContact CE2-CG 3.94Å; P163-L165 VanDerWaalsContact C-N 3.28Å
164	R	92.3	Very high	94.4	Very high	236 Å²	236	67.9 Å²	67.9	89%	0.891	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-19.4	177.9	-59.8	-179	-177.8	-179.3	-0.4	113	S162	S162-R164 PolarHBondContact O-N 2.86Å
165	L	94.3	Very high	94.6	Very high	45 Å²	45	69 Å²	69	24%	0.236	35%	0.351	C	S	.	.			trans	-136.9	116.2	-172.5	-175	64.3	0	0	0	110.2	Y160 S162 P163 F167 H176	Y160-L165 VanDerWaalsContact CB-O 3.27Å; Y160-L165 WeakPolarHBondContact CB-O 3.17Å; S162-L165 PolarHBondContact O-N 2.87Å; P163-L165 VanDerWaalsContact C-N 3.28Å; L165-F167 HydrophobicContact CD1-CE1 4.32Å; L165-F167 HydrophobicContact CD1-CZ 4.19Å; L165-F167 HydrophobicContact CD2-CE1 4.2Å; L165-F167 HydrophobicContact CD2-CE2 3.99Å; L165-F167 HydrophobicContact CD2-CZ 3.38Å; L165-F167 HydrophobicContact CG-CE1 4.07Å; L165-F167 HydrophobicContact CG-CE2 3.81Å; L165-F167 HydrophobicContact CG-CZ 3.45Å; L165-F167 VanDerWaalsContact CG-CZ 3.45Å; L165-H176 VanDerWaalsContact CD2-CD2 3.49Å; L165-H176 WeakPolarHBondContact CD2-CD2 3.37Å; L165-H176 WeakPolarHBondContact CD2-NE2 3.29Å
166	T	96.2	Very high	94.9	Very high	53 Å²	53	65.2 Å²	65.2	33%	0.325	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.8	-173.8	59	0	0	0	0	110.3	L154 Y159	L154-T166 HydrophobicContact CD1-CG2 3.85Å; Y159-T166 CarbonylContact O-C 3.59Å; Y159-T166 WeakPolarHBondContact O-CA 3.29Å
167	F	96.8	Very high	95	Very high	16 Å²	16	61.2 Å²	61.2	7%	0.07	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.6	-172	-56.5	-79.1	0	0	0	111	W158 Y159 L165 D172 L173 H176 Y177	W158-F167 CarbonylContact C-O 3.55Å; W158-F167 WeakPolarHBondContact CA-O 3.45Å; W158-F167 WeakPolarHBondContact CB-O 3.45Å; Y159-F167 PolarHBondContact N-O 2.81Å; Y159-F167 PolarHBondContact O-N 3.45Å; L165-F167 HydrophobicContact CD1-CE1 4.32Å; L165-F167 HydrophobicContact CD1-CZ 4.19Å; L165-F167 HydrophobicContact CD2-CE1 4.2Å; L165-F167 HydrophobicContact CD2-CE2 3.99Å; L165-F167 HydrophobicContact CD2-CZ 3.38Å; L165-F167 HydrophobicContact CG-CE1 4.07Å; L165-F167 HydrophobicContact CG-CE2 3.81Å; L165-F167 HydrophobicContact CG-CZ 3.45Å; L165-F167 VanDerWaalsContact CG-CZ 3.45Å; F167-D172 HydrophobicContact CB-CB 4.15Å; F167-D172 HydrophobicContact CD1-CB 4.04Å; F167-L173 HydrophobicContact CB-CB 4.13Å; F167-L173 HydrophobicContact CD1-CB 4.38Å; F167-L173 HydrophobicContact CD2-CB 3.62Å; F167-L173 HydrophobicContact CD2-CD1 3.81Å; F167-L173 HydrophobicContact CD2-CG 3.73Å; F167-L173 HydrophobicContact CE2-CB 4Å; F167-L173 HydrophobicContact CE2-CD1 4.13Å; F167-L173 HydrophobicContact CE2-CG 3.78Å; F167-L173 HydrophobicContact CG-CB 3.79Å; F167-L173 HydrophobicContact CG-CG 4.42Å; F167-L173 HydrophobicContact CZ-CG 4.5Å; F167-H176 HydrophobicContact CE1-CB 3.45Å; F167-H176 VanDerWaalsContact CE1-CB 3.45Å; F167-H176 AromaticContact CE1-CG 3.75Å; F167-H176 HydrophobicContact CZ-CB 3.69Å; F167-H176 AromaticContact CZ-CD2 3.98Å; F167-H176 AromaticContact CZ-CG 3.73Å; F167-Y177 AromaticContact CE2-CE2 3.88Å; F167-Y177 HydrophobicContact CE2-CE2 3.88Å; F167-Y177 HydrophobicContact CZ-CE2 4.11Å
168	Q	95.9	Very high	95.2	Very high	135 Å²	135	59.3 Å²	59.3	63%	0.631	30%	0.295	S	S	*	.	S	Bend	trans	-78	-33.4	-178.7	-59.6	-174.9	35.8	0	0	111.8	W158	W158-Q168 HydrophobicContact CD2-CG 4.32Å; W158-Q168 HydrophobicContact CH2-CG 4.44Å; W158-Q168 HydrophobicContact CZ2-CG 3.83Å
169	C	94.6	Very high	95.2	Very high	44 Å²	44	62.3 Å²	62.3	30%	0.297	31%	0.312	S	S	.	.	S	Bend	trans	-136.8	171.1	175.7	69	0	0	0	0	111.7	E171 D172 L173	C169-E171 VanDerWaalsContact C-N 3.29Å; C169-D172 PolarHBondContact SG-N 3.21Å; C169-D172 VanDerWaalsContact SG-N 3.39Å; C169-D172 PolarHBondContact SG-OD2 2.95Å; C169-L173 PolarHBondContact O-N 2.82Å
170	L	95.1	Very high	95.2	Very high	14 Å²	14	64.3 Å²	64.3	7%	0.073	33%	0.327	C	S	.	.	H	α-helix	trans	-69.8	-27.7	176.8	-68.6	176.2	0	0	0	112.5	W101 L102 I127 Y137 I151 Y159 L173 V174	W101-L170 HydrophobicContact CH2-CB 3.72Å; W101-L170 HydrophobicContact CZ3-CB 3.92Å; W101-L170 HydrophobicContact CZ3-CD1 4.44Å; L102-L170 HydrophobicContact CD1-CD1 4.17Å; I127-L170 HydrophobicContact CD1-CB 4.46Å; I127-L170 HydrophobicContact CD1-CD2 4.38Å; I127-L170 HydrophobicContact CG2-CD1 4.39Å; Y137-L170 HydrophobicContact CD1-CD1 4.1Å; Y137-L170 HydrophobicContact CD2-CD1 4.13Å; Y137-L170 HydrophobicContact CD2-CD2 4.34Å; Y137-L170 HydrophobicContact CE1-CD1 4.06Å; Y137-L170 HydrophobicContact CE2-CD1 4.07Å; Y137-L170 HydrophobicContact CG-CD1 4.13Å; I151-L170 HydrophobicContact CD1-CD2 4.07Å; I151-L170 HydrophobicContact CG2-CD2 4.17Å; Y159-L170 HydrophobicContact CD1-CD2 3.86Å; Y159-L170 HydrophobicContact CD2-CD2 4.33Å; Y159-L170 HydrophobicContact CD2-CG 4.43Å; Y159-L170 HydrophobicContact CE1-CD2 4.23Å; Y159-L170 HydrophobicContact CE1-CG 4.48Å; Y159-L170 HydrophobicContact CE2-CG 4.42Å; Y159-L170 HydrophobicContact CG-CD2 3.9Å; Y159-L170 HydrophobicContact CG-CG 4.47Å; L170-L173 WeakPolarHBondContact O-CB 3.24Å; L170-L173 PolarHBondContact O-N 3.09Å; L170-V174 WeakPolarHBondContact O-CG2 3.33Å; L170-V174 PolarHBondContact O-N 3.38Å
171	E	95.5	Very high	95.1	Very high	109 Å²	109	63.1 Å²	63.1	51%	0.509	33%	0.328	S	S	.	.	H	α-helix	trans	-65.4	-46.5	177.6	-173.5	178.1	-179.5	0	0	111.2	W101 C169 L173 V174 N175	W101-E171 HydrophobicContact CZ2-CB 4.3Å; C169-E171 VanDerWaalsContact C-N 3.29Å; E171-L173 VanDerWaalsContact C-N 3.25Å; E171-L173 PolarHBondContact O-N 3.34Å; E171-V174 PolarHBondContact O-N 2.92Å; E171-V174 VanDerWaalsContact O-N 3.1Å; E171-N175 WeakPolarHBondContact O-CB 3.49Å; E171-N175 VanDerWaalsContact O-CG 3.29Å; E171-N175 PolarHBondContact O-N 2.85Å; E171-N175 PolarHBondContact O-ND2 2.94Å
172	D	96.4	Very high	94.9	Very high	68 Å²	68	66.1 Å²	66.1	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-57.2	-40.5	173.7	-67.5	-21.1	0	0	0	111.9	F167 C169 N175 H176	F167-D172 HydrophobicContact CB-CB 4.15Å; F167-D172 HydrophobicContact CD1-CB 4.04Å; C169-D172 PolarHBondContact SG-N 3.21Å; C169-D172 VanDerWaalsContact SG-N 3.39Å; C169-D172 PolarHBondContact SG-OD2 2.95Å; D172-N175 PolarHBondContact O-N 2.79Å; D172-H176 WeakPolarHBondContact O-CB 3.49Å; D172-H176 PolarHBondContact O-N 3.12Å
173	L	96.4	Very high	94.9	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-61.9	-47	176.4	-177.6	156.1	0	0	0	110.8	I127 I151 I161 F167 C169 L170 E171 Y177	I127-L173 HydrophobicContact CD1-CD2 4.43Å; I151-L173 HydrophobicContact CD1-CD1 4.38Å; I151-L173 HydrophobicContact CG2-CD1 4.07Å; I161-L173 HydrophobicContact CD1-CD1 4.45Å; I161-L173 HydrophobicContact CD1-CD2 4.27Å; I161-L173 HydrophobicContact CG1-CD1 4.32Å; F167-L173 HydrophobicContact CB-CB 4.13Å; F167-L173 HydrophobicContact CD1-CB 4.38Å; F167-L173 HydrophobicContact CD2-CB 3.62Å; F167-L173 HydrophobicContact CD2-CD1 3.81Å; F167-L173 HydrophobicContact CD2-CG 3.73Å; F167-L173 HydrophobicContact CE2-CB 4Å; F167-L173 HydrophobicContact CE2-CD1 4.13Å; F167-L173 HydrophobicContact CE2-CG 3.78Å; F167-L173 HydrophobicContact CG-CB 3.79Å; F167-L173 HydrophobicContact CG-CG 4.42Å; F167-L173 HydrophobicContact CZ-CG 4.5Å; C169-L173 PolarHBondContact O-N 2.82Å; L170-L173 WeakPolarHBondContact O-CB 3.24Å; L170-L173 PolarHBondContact O-N 3.09Å; E171-L173 VanDerWaalsContact C-N 3.25Å; E171-L173 PolarHBondContact O-N 3.34Å; L173-Y177 HydrophobicContact CD2-CD2 3.75Å; L173-Y177 HydrophobicContact CD2-CE2 4.11Å; L173-Y177 HydrophobicContact CG-CD2 3.93Å; L173-Y177 HydrophobicContact CG-CE2 3.93Å; L173-Y177 WeakPolarHBondContact O-CD2 3.31Å; L173-Y177 PolarHBondContact O-N 2.98Å; L173-Y177 VanDerWaalsContact O-N 3.13Å
174	V	96.2	Very high	95.1	Very high	10 Å²	10	63.6 Å²	63.6	6%	0.061	34%	0.339	C	S	.	.	H	α-helix	trans	-63.3	-46.1	178.7	168.7	0	0	0	0	110.8	W101 F125 I127 L170 E171 H176 Y177 S178	W101-V174 HydrophobicContact CD2-CG2 4.24Å; W101-V174 HydrophobicContact CE3-CG2 4.14Å; W101-V174 HydrophobicContact CH2-CG2 4.48Å; W101-V174 HydrophobicContact CZ3-CG2 4.28Å; F125-V174 HydrophobicContact CE1-CG1 4.49Å; F125-V174 HydrophobicContact CE2-CB 4.45Å; F125-V174 HydrophobicContact CE2-CG1 3.63Å; F125-V174 HydrophobicContact CE2-CG2 3.92Å; F125-V174 HydrophobicContact CZ-CG1 3.43Å; F125-V174 VanDerWaalsContact CZ-CG1 3.43Å; I127-V174 HydrophobicContact CD1-CG2 3.64Å; L170-V174 WeakPolarHBondContact O-CG2 3.33Å; L170-V174 PolarHBondContact O-N 3.38Å; E171-V174 PolarHBondContact O-N 2.92Å; E171-V174 VanDerWaalsContact O-N 3.1Å; V174-H176 PolarHBondContact O-N 2.81Å; V174-Y177 PolarHBondContact O-N 3.31Å; V174-S178 WeakPolarHBondContact O-CB 3.47Å; V174-S178 PolarHBondContact O-N 3.16Å
175	N	96.3	Very high	95.2	Very high	78 Å²	78	54.3 Å²	54.3	42%	0.417	31%	0.31	S	S	.	.	H	α-helix	trans	-59	-49.2	179.5	-71.5	-17.5	0	0	0	111.2	E171 D172 Y177 S178 E179	E171-N175 WeakPolarHBondContact O-CB 3.49Å; E171-N175 VanDerWaalsContact O-CG 3.29Å; E171-N175 PolarHBondContact O-N 2.85Å; E171-N175 PolarHBondContact O-ND2 2.94Å; D172-N175 PolarHBondContact O-N 2.79Å; N175-Y177 PolarHBondContact O-N 3.21Å; N175-S178 WeakPolarHBondContact O-CB 3.33Å; N175-S178 PolarHBondContact O-N 3.28Å; N175-S178 PolarHBondContact O-OG 3.38Å; N175-E179 PolarHBondContact O-N 3.13Å
176	H	96.7	Very high	95.3	Very high	49 Å²	49	53.2 Å²	53.2	23%	0.227	31%	0.306	C	S	.	.	H	α-helix	trans	-56.9	-51.2	176.1	-178.7	93	0	0	0	112.6	L165 F167 D172 V174 S178 E179 V180 D182	L165-H176 VanDerWaalsContact CD2-CD2 3.49Å; L165-H176 WeakPolarHBondContact CD2-CD2 3.37Å; L165-H176 WeakPolarHBondContact CD2-NE2 3.29Å; F167-H176 HydrophobicContact CE1-CB 3.45Å; F167-H176 VanDerWaalsContact CE1-CB 3.45Å; F167-H176 AromaticContact CE1-CG 3.75Å; F167-H176 HydrophobicContact CZ-CB 3.69Å; F167-H176 AromaticContact CZ-CD2 3.98Å; F167-H176 AromaticContact CZ-CG 3.73Å; D172-H176 WeakPolarHBondContact O-CB 3.49Å; D172-H176 PolarHBondContact O-N 3.12Å; V174-H176 PolarHBondContact O-N 2.81Å; H176-S178 PolarHBondContact O-N 2.87Å; H176-E179 PolarHBondContact O-N 2.96Å; H176-E179 VanDerWaalsContact O-N 3.11Å; H176-V180 PolarHBondContact O-N 2.83Å; H176-D182 IonicContact CD2-OD2 2.73Å; H176-D182 IonicContact CE1-OD2 3.83Å; H176-D182 PolarHBondContact CE1-OD2 3.4Å; H176-D182 IonicContact NE2-OD2 3.66Å; H176-D182 PolarHBondContact NE2-OD2 3.47Å
177	Y	96.8	Very high	95.3	Very high	1 Å²	1	53.4 Å²	53.4	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-72.7	-11.7	-176.9	-74.4	-64.2	0	0	0	113.9	I161 F167 L173 V174 N175 V180 A181 D182 L184 V187 L188	I161-Y177 HydrophobicContact CD1-CD2 4.4Å; I161-Y177 HydrophobicContact CD1-CE2 3.85Å; F167-Y177 AromaticContact CE2-CE2 3.88Å; F167-Y177 HydrophobicContact CE2-CE2 3.88Å; F167-Y177 HydrophobicContact CZ-CE2 4.11Å; L173-Y177 HydrophobicContact CD2-CD2 3.75Å; L173-Y177 HydrophobicContact CD2-CE2 4.11Å; L173-Y177 HydrophobicContact CG-CD2 3.93Å; L173-Y177 HydrophobicContact CG-CE2 3.93Å; L173-Y177 WeakPolarHBondContact O-CD2 3.31Å; L173-Y177 PolarHBondContact O-N 2.98Å; L173-Y177 VanDerWaalsContact O-N 3.13Å; V174-Y177 PolarHBondContact O-N 3.31Å; N175-Y177 PolarHBondContact O-N 3.21Å; Y177-V180 VanDerWaalsContact CA-O 3.29Å; Y177-V180 WeakPolarHBondContact CA-O 3.22Å; Y177-A181 WeakPolarHBondContact CD1-O 3.44Å; Y177-A181 WeakPolarHBondContact CE1-O 3.46Å; Y177-D182 HydrophobicContact CE1-CB 3.97Å; Y177-L184 HydrophobicContact CD1-CD1 3.29Å; Y177-L184 HydrophobicContact CD1-CG 3.55Å; Y177-L184 HydrophobicContact CD2-CD1 4.11Å; Y177-L184 HydrophobicContact CE1-CD1 3.83Å; Y177-L184 HydrophobicContact CE1-CD2 4.26Å; Y177-L184 HydrophobicContact CE1-CG 3.61Å; Y177-L184 HydrophobicContact CG-CD1 3.45Å; Y177-L184 VanDerWaalsContact CG-CD1 3.45Å; Y177-L184 HydrophobicContact CG-CG 4.2Å; Y177-V187 WeakPolarHBondContact O-CA 3.4Å; Y177-L188 PolarHBondContact O-N 3.24Å
178	S	95.7	Very high	95.3	Very high	50 Å²	50	52.8 Å²	52.8	35%	0.35	30%	0.304	S	S	.	.	H	α-helix	trans	-76.7	-29.4	170.1	78.1	0	0	0	0	113.3	V174 N175 H176 L188	V174-S178 WeakPolarHBondContact O-CB 3.47Å; V174-S178 PolarHBondContact O-N 3.16Å; N175-S178 WeakPolarHBondContact O-CB 3.33Å; N175-S178 PolarHBondContact O-N 3.28Å; N175-S178 PolarHBondContact O-OG 3.38Å; H176-S178 PolarHBondContact O-N 2.87Å; S178-L188 VanDerWaalsContact CA-O 3.25Å; S178-L188 WeakPolarHBondContact CA-O 3.26Å; S178-L188 WeakPolarHBondContact CB-O 3.49Å
179	E	95.7	Very high	95.2	Very high	155 Å²	155	49.9 Å²	49.9	72%	0.724	30%	0.296	S	S	*	.	H	α-helix	trans	-87.2	-43.7	177	-64.5	-179.3	-174.4	0	0	111.1	N175 H176	N175-E179 PolarHBondContact O-N 3.13Å; H176-E179 PolarHBondContact O-N 2.96Å; H176-E179 VanDerWaalsContact O-N 3.11Å
180	V	95.3	Very high	95.1	Very high	67 Å²	67	50 Å²	50	41%	0.406	30%	0.295	S	S	.	.			trans	-137.2	134.9	-172.4	-174.4	0	0	0	0	111.4	H176 Y177 D182	H176-V180 PolarHBondContact O-N 2.83Å; Y177-V180 VanDerWaalsContact CA-O 3.29Å; Y177-V180 WeakPolarHBondContact CA-O 3.22Å; V180-D182 HydrophobicContact CG1-CB 4.33Å; V180-D182 WeakPolarHBondContact CG1-OD1 3.27Å
181	A	92.9	Very high	95	Very high	26 Å²	26	51 Å²	51	22%	0.215	30%	0.302	C	S	.	.			trans	-71.3	-35	-177.5	0	0	0	0	0	113.5	Y177 G183 L184 V187	Y177-A181 WeakPolarHBondContact CD1-O 3.44Å; Y177-A181 WeakPolarHBondContact CE1-O 3.46Å; A181-G183 PolarHBondContact O-N 2.76Å; A181-L184 VanDerWaalsContact O-CB 3.24Å; A181-L184 WeakPolarHBondContact O-CB 3.45Å; A181-L184 VanDerWaalsContact O-CG 3.31Å; A181-L184 WeakPolarHBondContact O-CG 3.22Å; A181-L184 PolarHBondContact O-N 3.12Å; A181-V187 HydrophobicContact CB-CG1 4.16Å
182	D	92.4	Very high	94.7	Very high	91 Å²	91	45.9 Å²	45.9	49%	0.487	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.8	44.3	174.8	-89.2	-6.1	0	0	0	115.9	H176 Y177 V180	H176-D182 IonicContact CD2-OD2 2.73Å; H176-D182 IonicContact CE1-OD2 3.83Å; H176-D182 PolarHBondContact CE1-OD2 3.4Å; H176-D182 IonicContact NE2-OD2 3.66Å; H176-D182 PolarHBondContact NE2-OD2 3.47Å; Y177-D182 HydrophobicContact CE1-CB 3.97Å; V180-D182 HydrophobicContact CG1-CB 4.33Å; V180-D182 WeakPolarHBondContact CG1-OD1 3.27Å
183	G	91.1	Very high	94.2	Very high	73 Å²	73	43.4 Å²	43.4	75%	0.753	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.1	-5.2	179.6	0	0	0	0	0	114.9	A181	A181-G183 PolarHBondContact O-N 2.76Å
184	L	95	Very high	92.9	Very high	15 Å²	15	46.7 Å²	46.7	8%	0.079	29%	0.286	C	S	.	.	S	Bend	trans	-72	162.4	162.3	-57	-170.7	0	0	0	111	L139 Y149 I161 Y177 A181 C186 L188	L139-L184 HydrophobicContact CD2-CD1 3.78Å; L139-L184 HydrophobicContact CD2-CD2 4.46Å; Y149-L184 HydrophobicContact CD1-CD2 3.57Å; Y149-L184 HydrophobicContact CD2-CD2 3.82Å; Y149-L184 HydrophobicContact CE1-CD2 3.59Å; Y149-L184 HydrophobicContact CE2-CD2 3.85Å; Y149-L184 HydrophobicContact CG-CD2 3.68Å; I161-L184 HydrophobicContact CD1-CD2 4.2Å; I161-L184 HydrophobicContact CG2-CD2 4.41Å; Y177-L184 HydrophobicContact CD1-CD1 3.29Å; Y177-L184 HydrophobicContact CD1-CG 3.55Å; Y177-L184 HydrophobicContact CD2-CD1 4.11Å; Y177-L184 HydrophobicContact CE1-CD1 3.83Å; Y177-L184 HydrophobicContact CE1-CD2 4.26Å; Y177-L184 HydrophobicContact CE1-CG 3.61Å; Y177-L184 HydrophobicContact CG-CD1 3.45Å; Y177-L184 VanDerWaalsContact CG-CD1 3.45Å; Y177-L184 HydrophobicContact CG-CG 4.2Å; A181-L184 VanDerWaalsContact O-CB 3.24Å; A181-L184 WeakPolarHBondContact O-CB 3.45Å; A181-L184 VanDerWaalsContact O-CG 3.31Å; A181-L184 WeakPolarHBondContact O-CG 3.22Å; A181-L184 PolarHBondContact O-N 3.12Å; L184-C186 VanDerWaalsContact C-N 3.26Å; L184-C186 PolarHBondContact O-N 2.88Å; L184-L188 HydrophobicContact CD1-CD2 4.25Å
185	C	94.3	Very high	91	Very high	42 Å²	42	51.4 Å²	51.4	28%	0.284	31%	0.307	S	S	.	.	S	Bend	trans	-67.4	-26.5	-179.5	59.8	0	0	0	0	113.5	K147 Y149	K147-C185 HydrophobicContact CG-CB 4.26Å; Y149-C185 WeakPolarHBondContact OH-CB 3.35Å; Y149-C185 PolarHBondContact OH-N 2.96Å
186	C	95.3	Very high	88.6	Confident	22 Å²	22	50.3 Å²	50.3	15%	0.149	31%	0.305	C	S	.	.	S	Bend	trans	-162.7	168.4	174.4	58.6	0	0	0	0	109.3	L184	L184-C186 VanDerWaalsContact C-N 3.26Å; L184-C186 PolarHBondContact O-N 2.88Å
187	V	96.9	Very high	85.9	Confident	57 Å²	57	54.4 Å²	54.4	35%	0.345	33%	0.334	S	S	.	.			trans	-65.3	148.8	169.3	-66.2	0	0	0	0	111	G123 Y177 A181 T189	G123-V187 WeakPolarHBondContact CA-O 3.01Å; Y177-V187 WeakPolarHBondContact O-CA 3.4Å; A181-V187 HydrophobicContact CB-CG1 4.16Å; V187-T189 HydrophobicContact CG2-CG2 4.37Å
188	L	96.6	Very high	83.1	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.016	37%	0.371	C	S	.	.			trans	-76.4	121.7	173.9	-54.5	-176.1	0	0	0	109.1	F125 L139 V141 Y177 S178 L184	F125-L188 HydrophobicContact CB-CD2 3.77Å; F125-L188 HydrophobicContact CD1-CB 3.66Å; F125-L188 HydrophobicContact CD1-CD1 4.45Å; F125-L188 HydrophobicContact CD1-CD2 4.29Å; F125-L188 HydrophobicContact CD1-CG 4.33Å; F125-L188 HydrophobicContact CD2-CD1 4.07Å; F125-L188 HydrophobicContact CE1-CB 3.87Å; F125-L188 HydrophobicContact CE2-CD1 4.26Å; F125-L188 HydrophobicContact CG-CB 4.12Å; F125-L188 HydrophobicContact CG-CD1 4.18Å; F125-L188 HydrophobicContact CG-CD2 3.95Å; F125-L188 HydrophobicContact CG-CG 4.3Å; L139-L188 HydrophobicContact CD1-CD1 4.3Å; L139-L188 HydrophobicContact CD1-CD2 4.36Å; L139-L188 HydrophobicContact CD2-CD1 4.41Å; L139-L188 HydrophobicContact CD2-CD2 4.28Å; V141-L188 HydrophobicContact CG1-CD2 4.14Å; V141-L188 HydrophobicContact CG2-CD2 3.7Å; Y177-L188 PolarHBondContact O-N 3.24Å; S178-L188 VanDerWaalsContact CA-O 3.25Å; S178-L188 WeakPolarHBondContact CA-O 3.26Å; S178-L188 WeakPolarHBondContact CB-O 3.49Å; L184-L188 HydrophobicContact CD1-CD2 4.25Å
189	T	93.9	Very high	80.2	Confident	74 Å²	74	60 Å²	60	45%	0.454	38%	0.383	S	S	.	.			trans	-101.6	-59.3	-175.1	54.1	0	0	0	0	111.3	V122 G123 S124 V187	V122-T189 PolarHBondContact O-OG1 3.23Å; V122-T189 VanDerWaalsContact O-OG1 3.12Å; G123-T189 WeakPolarHBondContact CA-OG1 3.36Å; G123-T189 PolarHBondContact O-N 2.83Å; G123-T189 PolarHBondContact O-OG1 3.36Å; S124-T189 PolarHBondContact N-OG1 3.26Å; V187-T189 HydrophobicContact CG2-CG2 4.37Å
190	T	93.4	Very high	77.7	Confident	46 Å²	46	57.9 Å²	57.9	28%	0.282	38%	0.383	S	S	.	.			trans	-139.3	141.1	-174.8	61.4	0	0	0	0	111.7	S124 F125 T194	S124-T190 CarbonylContact C-O 3.57Å; S124-T190 WeakPolarHBondContact CA-O 3.37Å; S124-T190 PolarHBondContact OG-OG1 2.85Å; S124-T190 VanDerWaalsContact OG-OG1 3.06Å; F125-T190 VanDerWaalsContact CD1-O 3.31Å; F125-T190 WeakPolarHBondContact CD1-O 3.41Å; F125-T190 VanDerWaalsContact CE1-C 3.49Å; F125-T190 PolarHBondContact N-O 2.91Å; T190-T194 HydrophobicContact CG2-CG2 4.25Å
191	P	93.1	Very high	75.1	Confident	35 Å²	35	59 Å²	59	23%	0.227	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-53.1	144.6	167.4	-27.9	36.8	0	0	0	112	G100 W101 F125 T194	G100-P191 WeakPolarHBondContact O-CB 3.21Å; W101-P191 HydrophobicContact CB-CB 3.99Å; W101-P191 HydrophobicContact CB-CG 4.25Å; F125-P191 HydrophobicContact CE1-CG 4.29Å; F125-P191 HydrophobicContact CZ-CG 4.16Å; F125-P191 CarbonylContact O-C 3.53Å; P191-T194 VanDerWaalsContact O-CB 3.27Å; P191-T194 WeakPolarHBondContact O-CB 3.38Å; P191-T194 WeakPolarHBondContact O-CG2 3.39Å; P191-T194 PolarHBondContact O-N 2.86Å; P191-T194 VanDerWaalsContact O-N 3.14Å
192	C	89.3	Confident	72.7	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.007	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	142.9	171.6	-168.9	0	0	0	0	109.3	F103 L115 F125 M126 T194	F103-C192 HydrophobicContact CZ-CB 4.36Å; L115-C192 HydrophobicContact CD2-CB 3.86Å; F125-C192 WeakPolarHBondContact O-CB 3.45Å; F125-C192 PolarHBondContact O-N 2.96Å; M126-C192 HydrophobicContact CB-CB 4.2Å; M126-C192 HydrophobicContact CE-CB 3.3Å; M126-C192 WeakPolarHBondContact CE-SG 3.42Å; C192-T194 PolarHBondContact O-N 2.99Å
193	L	85.2	Confident	70.2	Confident	17 Å²	17	69.8 Å²	69.8	9%	0.089	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	13.5	-175.7	-43.5	179.3	0	0	0	113.8	F43 A45 K65 F103 L114 L117 Q195	F43-L193 HydrophobicContact CE2-CD1 4.23Å; A45-L193 HydrophobicContact CB-CD1 3.57Å; K65-L193 WeakPolarHBondContact CE-O 3.41Å; K65-L193 PolarHBondContact NZ-O 3.19Å; F103-L193 HydrophobicContact CE1-CD1 4.18Å; F103-L193 HydrophobicContact CZ-CD1 4.24Å; L114-L193 HydrophobicContact CD2-CD2 4.48Å; L117-L193 HydrophobicContact CD1-CD2 4.16Å; L193-Q195 PolarHBondContact O-N 3.46Å
194	T	69.3	Low	67.9	Low	69 Å²	69	70.5 Å²	70.5	42%	0.423	44%	0.44	S	S	.	.			trans	-54.9	-27	177.2	-168.9	0	0	0	0	112.8	T190 P191 C192	T190-T194 HydrophobicContact CG2-CG2 4.25Å; P191-T194 VanDerWaalsContact O-CB 3.27Å; P191-T194 WeakPolarHBondContact O-CB 3.38Å; P191-T194 WeakPolarHBondContact O-CG2 3.39Å; P191-T194 PolarHBondContact O-N 2.86Å; P191-T194 VanDerWaalsContact O-N 3.14Å; C192-T194 PolarHBondContact O-N 2.99Å
195	Q	55.1	Low	65.6	Low	108 Å²	108	74.7 Å²	74.7	51%	0.505	47%	0.47	S	S	.	.			trans	-94.5	110.7	-177.4	-52.7	-167.9	82.2	0	0	112	D119 L193	D119-Q195 PolarHBondContact O-NE2 2.9Å; L193-Q195 PolarHBondContact O-N 3.46Å
196	S	46.6	Very low	63.6	Low	55 Å²	55	79.8 Å²	79.8	39%	0.385	50%	0.495	S	S	.	.			trans	-145.1	72.7	153.1	176.7	0	0	0	0	108.2
197	T	40.7	Very low	61.2	Low	136 Å²	136	83.7 Å²	83.7	83%	0.834	52%	0.522	S	S	*	.			trans	-166.1	75.2	147.7	-60.1	0	0	0	0	107
198	A	37	Very low	58.5	Low	95 Å²	95	86.1 Å²	86.1	79%	0.785	54%	0.539	S	S	*	.			trans	-107	98.3	133.1	0	0	0	0	0	103.7
199	A	36	Very low	56.4	Low	73 Å²	73	92.7 Å²	92.7	60%	0.603	58%	0.579	S	S	*	*			trans	-44	133.3	146.2	0	0	0	0	0	105.4	A201	A199-A201 VanDerWaalsContact C-N 3.27Å; A199-A201 PolarHBondContact O-N 2.86Å
200	P	41.8	Very low	54.3	Low	111 Å²	111	94.7 Å²	94.7	72%	0.721	59%	0.591	S	S	*	*			trans	-53.8	112.2	164.5	23.6	-28.9	0	0	0	103.6	V202	P200-V202 PolarHBondContact O-N 2.88Å
201	A	41.7	Very low	52.1	Low	90 Å²	90	99.2 Å²	99.2	74%	0.744	61%	0.613	S	S	*	*			trans	-58	93.2	155.4	0	0	0	0	0	101.8	A199 R203	A199-A201 VanDerWaalsContact C-N 3.27Å; A199-A201 PolarHBondContact O-N 2.86Å; A201-R203 PolarHBondContact O-N 2.84Å
202	V	42.8	Very low	50.1	Low	121 Å²	121	108.2 Å²	108.2	73%	0.733	64%	0.642	S	S	*	*			trans	-50.4	98.1	156.7	175.1	0	0	0	0	100.8	P200 A204	P200-V202 PolarHBondContact O-N 2.88Å; V202-A204 PolarHBondContact O-N 3.45Å
203	R	39	Very low	48	Very low	222 Å²	222	115.8 Å²	115.8	84%	0.838	68%	0.678	S	S	*	*			trans	-51	106.5	157.9	-77.9	-176.7	176.4	174.4	-0.9	101.2	A201 S205	A201-R203 PolarHBondContact O-N 2.84Å; R203-S205 PolarHBondContact O-N 3.29Å
204	A	42.4	Very low	46.1	Very low	88 Å²	88	123.6 Å²	123.6	73%	0.727	71%	0.711	S	S	*	*			trans	-60.2	81	166.1	0	0	0	0	0	104.4	V202 N206	V202-A204 PolarHBondContact O-N 3.45Å; A204-N206 PolarHBondContact O-N 3.13Å
205	S	46.8	Very low	45	Very low	104 Å²	104	126.3 Å²	126.3	73%	0.727	73%	0.728	S	S	*	*			trans	-69.4	92.4	159.9	41.9	0	0	0	0	102.8	R203	R203-S205 PolarHBondContact O-N 3.29Å
206	N	52.3	Low	44.9	Very low	149 Å²	149	125.4 Å²	125.4	80%	0.797	73%	0.729	S	S	*	*	S	Bend	trans	21.7	122.7	149.4	-57.7	-27.4	0	0	0	116.3	A204	A204-N206 PolarHBondContact O-N 3.13Å
207	S	45.2	Very low	45.1	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	74%	0.743	S	S	*	*			trans	82.8	109.3	172.7	73.6	0	0	0	0	115.2	V209	S207-V209 PolarHBondContact O-N 3.01Å
208	P	41.1	Very low	45.2	Very low	108 Å²	108	131.1 Å²	131.1	70%	0.701	74%	0.737	S	S	*	*			trans	-62.2	134.2	156.1	29.1	-29.1	0	0	0	106.1	T210	P208-T210 PolarHBondContact O-N 2.94Å
209	V	51.9	Low	45.8	Very low	141 Å²	141	137.1 Å²	137.1	86%	0.855	74%	0.739	S	S	*	*			trans	-58.1	95	156.3	174.1	0	0	0	0	104.7	S207 L211	S207-V209 PolarHBondContact O-N 3.01Å; V209-L211 VanDerWaalsContact C-N 3.31Å; V209-L211 PolarHBondContact O-N 3.15Å
210	T	49.4	Very low	46.2	Very low	115 Å²	115	144.6 Å²	144.6	71%	0.706	75%	0.752	S	S	*	*			trans	-63.7	105.5	167.5	12.8	0	0	0	0	103.3	P208 R212	P208-T210 PolarHBondContact O-N 2.94Å; T210-R212 PolarHBondContact O-N 3.12Å
211	L	47.3	Very low	46.1	Very low	141 Å²	141	145.7 Å²	145.7	74%	0.738	75%	0.749	S	S	*	*			trans	-52.6	104.7	157.6	-164.8	145.9	0	0	0	103.8	V209 Q213	V209-L211 VanDerWaalsContact C-N 3.31Å; V209-L211 PolarHBondContact O-N 3.15Å; L211-Q213 HydrophobicContact CD2-CG 3.74Å; L211-Q213 PolarHBondContact O-N 3.12Å
212	R	51.6	Low	45.9	Very low	224 Å²	224	146.7 Å²	146.7	85%	0.845	75%	0.75	S	S	*	*			trans	-67.2	82.4	178.8	-167.7	-177.9	-176	-159.4	3	104.9	T210 K214	T210-R212 PolarHBondContact O-N 3.12Å; R212-K214 PolarHBondContact O-N 2.56Å
213	Q	44.5	Very low	45.8	Very low	161 Å²	161	151.2 Å²	151.2	75%	0.752	75%	0.754	S	S	*	*			trans	-60	99.4	165.9	-83	-171.2	-38.9	0	0	104.6	L211 T215	L211-Q213 HydrophobicContact CD2-CG 3.74Å; L211-Q213 PolarHBondContact O-N 3.12Å; Q213-T215 PolarHBondContact O-N 2.97Å
214	K	46	Very low	45.8	Very low	180 Å²	180	149 Å²	149	78%	0.783	76%	0.758	S	S	*	*			trans	-61.6	99.8	161.8	-123.3	176.7	173.1	-176.9	0	103.7	R212 V216	R212-K214 PolarHBondContact O-N 2.56Å; K214-V216 PolarHBondContact O-N 2.75Å
215	T	46	Very low	45.7	Very low	126 Å²	126	153.5 Å²	153.5	77%	0.773	76%	0.763	S	S	*	*			trans	-55.8	106.8	171	23.7	0	0	0	0	106.9	Q213 D217	Q213-T215 PolarHBondContact O-N 2.97Å; T215-D217 PolarHBondContact O-N 2.9Å; T215-D217 VanDerWaalsContact O-N 3.13Å
216	V	52.5	Low	45	Very low	89 Å²	89	157.1 Å²	157.1	54%	0.539	77%	0.769	S	S	.	*			trans	-71.8	107	173.3	-172.5	0	0	0	0	105.9	K214 W218	K214-V216 PolarHBondContact O-N 2.75Å; V216-W218 HydrophobicContact CB-CZ2 4.34Å; V216-W218 HydrophobicContact CG1-CD2 4.2Å; V216-W218 HydrophobicContact CG1-CE3 4.39Å; V216-W218 HydrophobicContact CG1-CH2 4.27Å; V216-W218 HydrophobicContact CG1-CZ2 4.06Å; V216-W218 HydrophobicContact CG1-CZ3 4.42Å; V216-W218 VanDerWaalsContact O-CD1 3.28Å; V216-W218 PolarHBondContact O-N 3.27Å; V216-W218 VanDerWaalsContact O-N 3.15Å
217	D	50.9	Low	44.1	Very low	127 Å²	127	156.8 Å²	156.8	68%	0.679	77%	0.767	S	S	*	*			trans	-84.9	86.1	-175.8	-140.5	-12.8	0	0	0	109	T215 R219 R220	T215-D217 PolarHBondContact O-N 2.9Å; T215-D217 VanDerWaalsContact O-N 3.13Å; D217-R219 PolarHBondContact O-N 3.06Å; D217-R220 PolarHBondContact O-N 3.39Å; D217-R220 VanDerWaalsContact O-N 3.13Å
218	W	43.2	Very low	44.3	Very low	185 Å²	185	156.8 Å²	156.8	70%	0.701	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-57.9	-19.2	-173.9	-60.6	102.8	0	0	0	114	V216 R220 M221	V216-W218 HydrophobicContact CB-CZ2 4.34Å; V216-W218 HydrophobicContact CG1-CD2 4.2Å; V216-W218 HydrophobicContact CG1-CE3 4.39Å; V216-W218 HydrophobicContact CG1-CH2 4.27Å; V216-W218 HydrophobicContact CG1-CZ2 4.06Å; V216-W218 HydrophobicContact CG1-CZ3 4.42Å; V216-W218 VanDerWaalsContact O-CD1 3.28Å; V216-W218 PolarHBondContact O-N 3.27Å; V216-W218 VanDerWaalsContact O-N 3.15Å; W218-R220 PolarHBondContact O-N 2.95Å; W218-M221 HydrophobicContact CE3-SD 4.02Å; W218-M221 HydrophobicContact CZ3-SD 4.18Å; W218-M221 PolarHBondContact O-N 3.26Å
219	R	48.8	Very low	43.9	Very low	221 Å²	221	161.1 Å²	161.1	83%	0.834	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-71.2	-10.6	177.6	-75.6	-170.6	-161.8	-141.3	3.2	114.7	D217	D217-R219 PolarHBondContact O-N 3.06Å
220	R	45.9	Very low	43	Very low	230 Å²	230	157.7 Å²	157.7	87%	0.868	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-84.1	-11.3	174.9	-151	177.3	-139.4	-174.9	5.4	113.4	D217 W218	D217-R220 PolarHBondContact O-N 3.39Å; D217-R220 VanDerWaalsContact O-N 3.13Å; W218-R220 PolarHBondContact O-N 2.95Å
221	M	37.7	Very low	42.4	Very low	134 Å²	134	158.3 Å²	158.3	66%	0.66	77%	0.773	S	S	*	*	S	Bend	trans	-85.2	-18.1	-178.4	-77.5	-178.3	168	0	0	114.6	W218 R223	W218-M221 HydrophobicContact CE3-SD 4.02Å; W218-M221 HydrophobicContact CZ3-SD 4.18Å; W218-M221 PolarHBondContact O-N 3.26Å; M221-R223 PolarHBondContact O-N 2.9Å
222	S	37.8	Very low	42.1	Very low	110 Å²	110	159.9 Å²	159.9	77%	0.769	78%	0.776	S	S	*	*	S	Bend	trans	-95.8	26.7	-173.7	-54.7	0	0	0	0	114.9
223	R	41.8	Very low	41.3	Very low	217 Å²	217	156.9 Å²	156.9	82%	0.819	78%	0.777	S	S	*	*			trans	-136	33.9	-175.7	-113.6	-166.4	-66.3	-139	3.2	117.2	M221	M221-R223 PolarHBondContact O-N 2.9Å
224	L	37.8	Very low	41.4	Very low	174 Å²	174	154.6 Å²	154.6	91%	0.911	78%	0.776	S	S	*	*			trans	-131.8	76.4	161.2	-71.1	174.1	0	0	0	109.9
225	H	41.3	Very low	41.3	Very low	183 Å²	183	154 Å²	154	85%	0.847	78%	0.781	S	S	*	*			trans	-146.9	80	154.7	-173.6	-81.5	0	0	0	109.6
226	E	31.1	Very low	41.3	Very low	180 Å²	180	151.8 Å²	151.8	84%	0.841	78%	0.784	S	S	*	*			trans	-162.5	130.2	150.1	-65.5	-161.3	126.6	0	0	104
227	N	33.5	Very low	41.4	Very low	142 Å²	142	152.6 Å²	152.6	76%	0.759	79%	0.788	S	S	*	*			cis	-162.4	-170	12.8	-141.3	-18.4	0	0	0	107.3
228	P	50.8	Low	41.7	Very low	105 Å²	105	151.1 Å²	151.1	68%	0.682	78%	0.781	S	S	*	*				-104.5	179.8	-125.8	37.7	-20.9	0	0	0	115.4
229	E	31.5	Very low	42.4	Very low	198 Å²	198	146.7 Å²	146.7	93%	0.925	77%	0.768	S	S	*	*			trans	108.7	117	164.9	-62	-172.1	139.3	0	0	116.9
230	G	34.7	Very low	42.8	Very low	70 Å²	70	140.5 Å²	140.5	72%	0.722	76%	0.758	S	S	*	*			trans	109.7	84.1	147.4	0	0	0	0	0	118.1
231	T	35.1	Very low	43.8	Very low	128 Å²	128	135.8 Å²	135.8	79%	0.785	75%	0.749	S	S	*	*			trans	76.2	87.3	140.5	-43.3	0	0	0	0	119.3
232	E	40.8	Very low	45.4	Very low	173 Å²	173	133.4 Å²	133.4	81%	0.808	74%	0.735	S	S	*	*			trans	36.9	104.1	132.1	-3.6	-173	179.8	0	0	120.2
233	N	35.6	Very low	47.2	Very low	161 Å²	161	132 Å²	132	86%	0.861	73%	0.726	S	S	*	*			trans	-168.8	123	136.3	-95.3	-32.4	0	0	0	109.1
234	P	46.2	Very low	48.7	Very low	113 Å²	113	129.9 Å²	129.9	73%	0.734	72%	0.719	S	S	*	*			trans	-85.9	145.7	176.7	33.4	-28.5	0	0	0	110.1
235	L	44.3	Very low	50.8	Low	167 Å²	167	123.7 Å²	123.7	87%	0.874	70%	0.697	S	S	*	*			trans	88.6	58.2	173	-45.7	176	0	0	0	116.6
236	G	45.3	Very low	52.7	Low	81 Å²	81	118.7 Å²	118.7	84%	0.835	68%	0.677	S	S	*	*			trans	-104.9	74.6	159.9	0	0	0	0	0	111.1
237	V	56.1	Low	55.2	Low	106 Å²	106	114.7 Å²	114.7	64%	0.642	65%	0.654	S	S	*	*			trans	-79.5	119.1	167.3	-176.3	0	0	0	0	107	E239 F242	V237-E239 PolarHBondContact O-N 2.71Å; V237-F242 HydrophobicContact CG1-CE2 4.22Å
238	D	55.7	Low	57.4	Low	96 Å²	96	112.3 Å²	112.3	51%	0.513	64%	0.638	S	S	.	*			trans	-59.6	104.7	-178.6	-178.9	8.6	0	0	0	111.1	S240 L241	D238-S240 PolarHBondContact O-N 2.81Å; D238-S240 VanDerWaalsContact O-N 3.12Å; D238-S240 VanDerWaalsContact OD1-CB 3.27Å; D238-S240 WeakPolarHBondContact OD1-CB 3.3Å; D238-S240 PolarHBondContact OD1-N 2.94Å; D238-S240 VanDerWaalsContact OD1-N 3.12Å; D238-S240 PolarHBondContact OD1-OG 2.92Å; D238-S240 PolarHBondContact OD2-OG 3.38Å; D238-L241 PolarHBondContact O-N 2.98Å
239	E	58.6	Low	58.8	Low	92 Å²	92	110.8 Å²	110.8	43%	0.43	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-69.7	-2.3	-177.9	-85.4	-164.8	127.1	0	0	114.2	V237 L241 R247	V237-E239 PolarHBondContact O-N 2.71Å; E239-L241 VanDerWaalsContact C-N 3.27Å; E239-L241 PolarHBondContact O-N 3.28Å; E239-R247 VanDerWaalsContact CD-CZ 3.47Å; E239-R247 WeakPolarHBondContact OE1-CD 3.45Å; E239-R247 WeakPolarHBondContact OE1-CG 3.38Å; E239-R247 IonicContact OE1-CZ 3.64Å; E239-R247 IonicContact OE1-NE 2.75Å; E239-R247 PolarHBondContact OE1-NE 3.28Å; E239-R247 IonicContact OE1-NH2 3.77Å; E239-R247 IonicContact OE2-CZ 2.94Å; E239-R247 IonicContact OE2-NE 2.9Å; E239-R247 PolarHBondContact OE2-NE 3.04Å; E239-R247 IonicContact OE2-NH2 2.56Å; E239-R247 PolarHBondContact OE2-NH2 3.12Å
240	S	58.2	Low	61.1	Low	91 Å²	91	104.6 Å²	104.6	64%	0.636	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-76.4	-11.9	174.8	75.3	0	0	0	0	113.9	D238	D238-S240 PolarHBondContact O-N 2.81Å; D238-S240 VanDerWaalsContact O-N 3.12Å; D238-S240 VanDerWaalsContact OD1-CB 3.27Å; D238-S240 WeakPolarHBondContact OD1-CB 3.3Å; D238-S240 PolarHBondContact OD1-N 2.94Å; D238-S240 VanDerWaalsContact OD1-N 3.12Å; D238-S240 PolarHBondContact OD1-OG 2.92Å; D238-S240 PolarHBondContact OD2-OG 3.38Å
241	L	65.1	Low	63.2	Low	130 Å²	130	103.2 Å²	103.2	68%	0.681	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-83.9	-13	-179.7	-73.3	168.7	0	0	0	114.1	D238 E239	D238-L241 PolarHBondContact O-N 2.98Å; E239-L241 VanDerWaalsContact C-N 3.27Å; E239-L241 PolarHBondContact O-N 3.28Å
242	F	71.3	Confident	65.2	Low	84 Å²	84	100.2 Å²	100.2	37%	0.368	57%	0.568	S	S	.	*	S	Bend	trans	-111.2	139.8	-176.9	-57.2	-72	0	0	0	110.8	V237 L246 I250	V237-F242 HydrophobicContact CG1-CE2 4.22Å; F242-L246 HydrophobicContact CB-CD2 4.36Å; F242-L246 HydrophobicContact CB-CG 4.47Å; F242-L246 HydrophobicContact CD1-CD2 3.68Å; F242-L246 HydrophobicContact CD1-CG 4.31Å; F242-L246 HydrophobicContact CG-CD2 4.45Å; F242-I250 HydrophobicContact CD1-CD1 4.48Å
243	S	76.7	Confident	67.1	Low	82 Å²	82	99.3 Å²	99.3	57%	0.573	56%	0.559	S	S	*	*			trans	-61.2	146.3	170.1	64.8	0	0	0	0	109.9	G245 L246 R247	S243-G245 PolarHBondContact O-N 2.89Å; S243-G245 VanDerWaalsContact O-N 3.12Å; S243-L246 WeakPolarHBondContact O-CA 3.27Å; S243-L246 WeakPolarHBondContact O-CB 3.37Å; S243-L246 PolarHBondContact O-N 3.42Å; S243-L246 WeakPolarHBondContact OG-CB 3.31Å; S243-R247 PolarHBondContact O-N 3.32Å
244	Y	73	Confident	69.2	Low	172 Å²	172	96.5 Å²	96.5	68%	0.675	54%	0.543	S	S	*	.	H	α-helix	trans	-47.2	-45	-179.5	-177.7	-94.3	0	0	0	113.2	L246 R247 E248	Y244-L246 VanDerWaalsContact C-N 3.34Å; Y244-L246 PolarHBondContact O-N 2.96Å; Y244-R247 WeakPolarHBondContact O-CB 3.45Å; Y244-R247 PolarHBondContact O-N 2.89Å; Y244-E248 HydrophobicContact CD1-CG 4.16Å; Y244-E248 HydrophobicContact CE1-CG 3.78Å; Y244-E248 HydrophobicContact CE2-CG 4.49Å; Y244-E248 WeakPolarHBondContact O-CG 3.47Å; Y244-E248 PolarHBondContact O-N 2.64Å
245	G	82.6	Confident	70.6	Confident	44 Å²	44	95.3 Å²	95.3	45%	0.454	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-34.5	178.2	0	0	0	0	0	114.4	S243 S249	S243-G245 PolarHBondContact O-N 2.89Å; S243-G245 VanDerWaalsContact O-N 3.12Å; G245-S249 WeakPolarHBondContact O-CB 3.24Å; G245-S249 PolarHBondContact O-N 3.05Å; G245-S249 PolarHBondContact O-OG 3.29Å
246	L	81.1	Confident	72	Confident	78 Å²	78	94 Å²	94	41%	0.408	53%	0.531	S	S	.	.	H	α-helix	trans	-73.1	-39	175.8	-179.2	58.1	0	0	0	111.1	F242 S243 Y244 S249 I250	F242-L246 HydrophobicContact CB-CD2 4.36Å; F242-L246 HydrophobicContact CB-CG 4.47Å; F242-L246 HydrophobicContact CD1-CD2 3.68Å; F242-L246 HydrophobicContact CD1-CG 4.31Å; F242-L246 HydrophobicContact CG-CD2 4.45Å; S243-L246 WeakPolarHBondContact O-CA 3.27Å; S243-L246 WeakPolarHBondContact O-CB 3.37Å; S243-L246 PolarHBondContact O-N 3.42Å; S243-L246 WeakPolarHBondContact OG-CB 3.31Å; Y244-L246 VanDerWaalsContact C-N 3.34Å; Y244-L246 PolarHBondContact O-N 2.96Å; L246-S249 PolarHBondContact O-N 3.05Å; L246-I250 HydrophobicContact CD1-CD1 4.01Å; L246-I250 HydrophobicContact CD1-CG1 4.19Å; L246-I250 HydrophobicContact CG-CD1 3.86Å; L246-I250 HydrophobicContact CG-CG1 4.46Å; L246-I250 VanDerWaalsContact O-CG1 3.24Å; L246-I250 WeakPolarHBondContact O-CG1 2.9Å; L246-I250 PolarHBondContact O-N 3.49Å
247	R	84.1	Confident	73.1	Confident	96 Å²	96	93.2 Å²	93.2	36%	0.362	51%	0.51	S	S	.	.	H	α-helix	trans	-58.3	-49.6	173.4	-176	-177.6	172.7	-167.4	-0.4	111.2	E239 S243 Y244 S249 I250 A251	E239-R247 VanDerWaalsContact CD-CZ 3.47Å; E239-R247 WeakPolarHBondContact OE1-CD 3.45Å; E239-R247 WeakPolarHBondContact OE1-CG 3.38Å; E239-R247 IonicContact OE1-CZ 3.64Å; E239-R247 IonicContact OE1-NE 2.75Å; E239-R247 PolarHBondContact OE1-NE 3.28Å; E239-R247 IonicContact OE1-NH2 3.77Å; E239-R247 IonicContact OE2-CZ 2.94Å; E239-R247 IonicContact OE2-NE 2.9Å; E239-R247 PolarHBondContact OE2-NE 3.04Å; E239-R247 IonicContact OE2-NH2 2.56Å; E239-R247 PolarHBondContact OE2-NH2 3.12Å; S243-R247 PolarHBondContact O-N 3.32Å; Y244-R247 WeakPolarHBondContact O-CB 3.45Å; Y244-R247 PolarHBondContact O-N 2.89Å; R247-S249 VanDerWaalsContact C-N 3.31Å; R247-S249 PolarHBondContact O-N 2.88Å; R247-I250 PolarHBondContact O-N 2.79Å; R247-A251 WeakPolarHBondContact O-CB 3.45Å; R247-A251 PolarHBondContact O-N 3.44Å
248	E	78.7	Confident	73	Confident	91 Å²	91	91.7 Å²	91.7	43%	0.425	50%	0.504	S	S	.	.	H	α-helix	trans	-62.4	-37.4	176.6	-69.4	-56.1	132.4	0	0	112.5	Y244 S252	Y244-E248 HydrophobicContact CD1-CG 4.16Å; Y244-E248 HydrophobicContact CE1-CG 3.78Å; Y244-E248 HydrophobicContact CE2-CG 4.49Å; Y244-E248 WeakPolarHBondContact O-CG 3.47Å; Y244-E248 PolarHBondContact O-N 2.64Å; E248-S252 VanDerWaalsContact O-CB 3.28Å; E248-S252 WeakPolarHBondContact O-CB 3.45Å; E248-S252 PolarHBondContact O-N 3.09Å
249	S	79.4	Confident	72.6	Confident	73 Å²	73	95.8 Å²	95.8	51%	0.51	52%	0.52	S	S	.	.	H	α-helix	trans	-67.6	-42.2	177.6	-58.7	0	0	0	0	112	G245 L246 R247 S252 Y253	G245-S249 WeakPolarHBondContact O-CB 3.24Å; G245-S249 PolarHBondContact O-N 3.05Å; G245-S249 PolarHBondContact O-OG 3.29Å; L246-S249 PolarHBondContact O-N 3.05Å; R247-S249 VanDerWaalsContact C-N 3.31Å; R247-S249 PolarHBondContact O-N 2.88Å; S249-S252 PolarHBondContact O-N 3.16Å; S249-Y253 WeakPolarHBondContact O-CB 3.28Å; S249-Y253 PolarHBondContact O-N 3.4Å
250	I	80	Confident	72	Confident	68 Å²	68	98.1 Å²	98.1	35%	0.349	54%	0.535	S	S	.	.	H	α-helix	trans	-66.6	-46.6	176.8	-67.5	165.3	0	0	0	109.9	F242 L246 R247 S252 Y253 L254	F242-I250 HydrophobicContact CD1-CD1 4.48Å; L246-I250 HydrophobicContact CD1-CD1 4.01Å; L246-I250 HydrophobicContact CD1-CG1 4.19Å; L246-I250 HydrophobicContact CG-CD1 3.86Å; L246-I250 HydrophobicContact CG-CG1 4.46Å; L246-I250 VanDerWaalsContact O-CG1 3.24Å; L246-I250 WeakPolarHBondContact O-CG1 2.9Å; L246-I250 PolarHBondContact O-N 3.49Å; R247-I250 PolarHBondContact O-N 2.79Å; I250-S252 VanDerWaalsContact C-N 3.31Å; I250-S252 PolarHBondContact O-N 2.91Å; I250-Y253 PolarHBondContact O-N 3.44Å; I250-Y253 VanDerWaalsContact O-N 3.16Å; I250-L254 HydrophobicContact CG2-CD1 3.84Å; I250-L254 HydrophobicContact CG2-CG 4.3Å; I250-L254 WeakPolarHBondContact O-CB 3.36Å; I250-L254 WeakPolarHBondContact O-CG 3.5Å; I250-L254 PolarHBondContact O-N 2.95Å
251	A	79	Confident	71.4	Confident	41 Å²	41	101.7 Å²	101.7	34%	0.339	55%	0.547	S	S	.	.	H	α-helix	trans	-59.8	-41.9	177.1	0	0	0	0	0	111.8	R247 S255	R247-A251 WeakPolarHBondContact O-CB 3.45Å; R247-A251 PolarHBondContact O-N 3.44Å; A251-S255 WeakPolarHBondContact O-CB 3.36Å; A251-S255 PolarHBondContact O-N 2.75Å; A251-S255 PolarHBondContact O-OG 3.5Å
252	S	78.5	Confident	70	Confident	65 Å²	65	101.2 Å²	101.2	46%	0.455	55%	0.55	S	S	.	.	H	α-helix	trans	-63.9	-41.9	174.8	-178.9	0	0	0	0	112.1	E248 S249 I250 S255 L256	E248-S252 VanDerWaalsContact O-CB 3.28Å; E248-S252 WeakPolarHBondContact O-CB 3.45Å; E248-S252 PolarHBondContact O-N 3.09Å; S249-S252 PolarHBondContact O-N 3.16Å; I250-S252 VanDerWaalsContact C-N 3.31Å; I250-S252 PolarHBondContact O-N 2.91Å; S252-S255 PolarHBondContact O-N 2.72Å; S252-L256 VanDerWaalsContact O-CG 3.23Å; S252-L256 WeakPolarHBondContact O-CG 3.23Å; S252-L256 PolarHBondContact O-N 2.94Å; S252-L256 VanDerWaalsContact O-N 3.1Å
253	Y	79.9	Confident	68.4	Low	154 Å²	154	101.7 Å²	101.7	60%	0.604	56%	0.564	S	S	*	*	H	α-helix	trans	-67	-44.6	179.1	-176.3	-96.2	0	0	0	111.6	S249 I250 S255 L256 T257	S249-Y253 WeakPolarHBondContact O-CB 3.28Å; S249-Y253 PolarHBondContact O-N 3.4Å; I250-Y253 PolarHBondContact O-N 3.44Å; I250-Y253 VanDerWaalsContact O-N 3.16Å; Y253-S255 VanDerWaalsContact C-N 3.31Å; Y253-S255 PolarHBondContact O-N 2.89Å; Y253-L256 PolarHBondContact O-N 3.07Å; Y253-L256 VanDerWaalsContact O-N 3.09Å; Y253-T257 HydrophobicContact CD1-CG2 4.21Å; Y253-T257 HydrophobicContact CD2-CG2 4.38Å; Y253-T257 HydrophobicContact CE1-CG2 3.8Å; Y253-T257 HydrophobicContact CE2-CG2 3.98Å; Y253-T257 HydrophobicContact CG-CG2 4.49Å; Y253-T257 WeakPolarHBondContact O-CB 3.2Å; Y253-T257 WeakPolarHBondContact O-CG2 3.42Å; Y253-T257 PolarHBondContact O-N 3.1Å; Y253-T257 PolarHBondContact O-OG1 3.36Å
254	L	78.8	Confident	66.3	Low	102 Å²	102	106.5 Å²	106.5	53%	0.534	57%	0.574	S	S	.	*	H	α-helix	trans	-63.3	-37.4	175.9	-67.9	174.6	0	0	0	111.5	I250 L256 T257 S258	I250-L254 HydrophobicContact CG2-CD1 3.84Å; I250-L254 HydrophobicContact CG2-CG 4.3Å; I250-L254 WeakPolarHBondContact O-CB 3.36Å; I250-L254 WeakPolarHBondContact O-CG 3.5Å; I250-L254 PolarHBondContact O-N 2.95Å; L254-L256 VanDerWaalsContact C-N 3.26Å; L254-L256 PolarHBondContact O-N 3.22Å; L254-T257 PolarHBondContact O-N 3.16Å; L254-S258 WeakPolarHBondContact O-CB 3.44Å; L254-S258 PolarHBondContact O-N 3.28Å; L254-S258 PolarHBondContact O-OG 3.36Å
255	S	75.3	Confident	64.5	Low	89 Å²	89	105.3 Å²	105.3	62%	0.622	58%	0.58	S	S	*	*	H	α-helix	trans	-67.2	-25.4	173.8	-58.9	0	0	0	0	113.6	A251 S252 Y253 S258	A251-S255 WeakPolarHBondContact O-CB 3.36Å; A251-S255 PolarHBondContact O-N 2.75Å; A251-S255 PolarHBondContact O-OG 3.5Å; S252-S255 PolarHBondContact O-N 2.72Å; Y253-S255 VanDerWaalsContact C-N 3.31Å; Y253-S255 PolarHBondContact O-N 2.89Å; S255-S258 PolarHBondContact O-OG 3.39Å
256	L	74.1	Confident	62.4	Low	140 Å²	140	115 Å²	115	73%	0.733	60%	0.603	S	S	*	*	H	α-helix	trans	-87.8	-20.3	177	-71.4	170.5	0	0	0	112.8	S252 Y253 L254	S252-L256 VanDerWaalsContact O-CG 3.23Å; S252-L256 WeakPolarHBondContact O-CG 3.23Å; S252-L256 PolarHBondContact O-N 2.94Å; S252-L256 VanDerWaalsContact O-N 3.1Å; Y253-L256 PolarHBondContact O-N 3.07Å; Y253-L256 VanDerWaalsContact O-N 3.09Å; L254-L256 VanDerWaalsContact C-N 3.26Å; L254-L256 PolarHBondContact O-N 3.22Å
257	T	69.2	Low	60.3	Low	64 Å²	64	120.3 Å²	120.3	39%	0.393	62%	0.623	S	S	.	*	H	α-helix	trans	-115.1	-5.4	-174.6	56.4	0	0	0	0	113.6	Y253 L254 E259	Y253-T257 HydrophobicContact CD1-CG2 4.21Å; Y253-T257 HydrophobicContact CD2-CG2 4.38Å; Y253-T257 HydrophobicContact CE1-CG2 3.8Å; Y253-T257 HydrophobicContact CE2-CG2 3.98Å; Y253-T257 HydrophobicContact CG-CG2 4.49Å; Y253-T257 WeakPolarHBondContact O-CB 3.2Å; Y253-T257 WeakPolarHBondContact O-CG2 3.42Å; Y253-T257 PolarHBondContact O-N 3.1Å; Y253-T257 PolarHBondContact O-OG1 3.36Å; L254-T257 PolarHBondContact O-N 3.16Å; T257-E259 VanDerWaalsContact C-N 3.28Å; T257-E259 PolarHBondContact O-N 3.36Å
258	S	53.9	Low	58.3	Low	74 Å²	74	125.3 Å²	125.3	52%	0.517	65%	0.647	S	S	.	*			trans	-67.3	92.7	165.5	58.6	0	0	0	0	107.9	L254 S255 D260	L254-S258 WeakPolarHBondContact O-CB 3.44Å; L254-S258 PolarHBondContact O-N 3.28Å; L254-S258 PolarHBondContact O-OG 3.36Å; S255-S258 PolarHBondContact O-OG 3.39Å; S258-D260 VanDerWaalsContact C-N 3.25Å; S258-D260 PolarHBondContact O-N 2.81Å
259	E	46.9	Very low	56.3	Low	182 Å²	182	129.9 Å²	129.9	85%	0.85	67%	0.665	S	S	*	*			trans	-67.5	87.4	167.1	-66.1	-162.3	135.6	0	0	109	T257 N261	T257-E259 VanDerWaalsContact C-N 3.28Å; T257-E259 PolarHBondContact O-N 3.36Å; E259-N261 PolarHBondContact O-N 3.38Å
260	D	46.4	Very low	54.3	Low	140 Å²	140	132 Å²	132	75%	0.749	68%	0.68	S	S	*	*			trans	-78.5	107.7	157.5	-86.4	-26.6	0	0	0	108.4	S258 T262	S258-D260 VanDerWaalsContact C-N 3.25Å; S258-D260 PolarHBondContact O-N 2.81Å; D260-T262 PolarHBondContact O-N 3.03Å
261	N	46.5	Very low	52.4	Low	166 Å²	166	134.9 Å²	134.9	89%	0.888	70%	0.701	S	S	*	*			trans	-59.2	77.5	161.7	-95.8	-46	0	0	0	110	E259	E259-N261 PolarHBondContact O-N 3.38Å
262	T	35	Very low	50.3	Low	120 Å²	120	137.8 Å²	137.8	74%	0.736	72%	0.719	S	S	*	*			trans	-148.1	110.6	159.4	52.3	0	0	0	0	110.5	D260	D260-T262 PolarHBondContact O-N 3.03Å
263	S	36.9	Very low	48.2	Very low	94 Å²	94	142.5 Å²	142.5	66%	0.657	74%	0.738	S	S	*	*			trans	-42.2	131.6	158.4	159.4	0	0	0	0	111.4
264	F	32.6	Very low	46	Very low	183 Å²	183	143.5 Å²	143.5	80%	0.803	75%	0.75	S	S	*	*				172.3	131.2	124	-95.7	-74	0	0	0	112.3
265	D	35.1	Very low	43.7	Very low	147 Å²	147	149.1 Å²	149.1	79%	0.786	77%	0.766	S	S	*	*			trans	37.1	102.9	158.7	-88.7	-58.2	0	0	0	122
266	R	38.3	Very low	41.9	Very low	249 Å²	249	150.2 Å²	150.2	94%	0.94	77%	0.773	S	S	*	*			trans	-96.6	97.3	159.5	-95.8	-178.5	163.2	174.1	-2.6	111.2	K268	R266-K268 PolarHBondContact O-N 3.08Å
267	K	37.5	Very low	40	Very low	189 Å²	189	146.4 Å²	146.4	82%	0.822	77%	0.768	S	S	*	*			trans	-84.4	99.4	163.8	-158	166.7	-171.6	167.4	0	109.7	K269	K267-K269 PolarHBondContact O-N 3.27Å
268	K	42.9	Very low	38.4	Very low	201 Å²	201	148.9 Å²	148.9	87%	0.874	79%	0.788	S	S	*	*			trans	-58.7	122.6	169.9	-82.9	173.4	172.7	172.4	0	110.1	R266	R266-K268 PolarHBondContact O-N 3.08Å
269	K	36.9	Very low	37.6	Very low	186 Å²	186	155.1 Å²	155.1	81%	0.809	81%	0.805	S	S	*	*			trans	-118.6	102	156.7	-75.4	-176.1	178	178.5	0	108	K267	K267-K269 PolarHBondContact O-N 3.27Å
270	S	37.2	Very low	37.3	Very low	117 Å²	117	158.1 Å²	158.1	82%	0.818	81%	0.809	S	S	*	*			trans	-75.2	115	165.5	55.1	0	0	0	0	108.4
271	V	38.6	Very low	36.8	Very low	130 Å²	130	161.2 Å²	161.2	79%	0.788	82%	0.816	S	S	*	*			trans	-95.3	106.9	169	169.8	0	0	0	0	107.1
272	S	35.2	Very low	36.3	Very low	102 Å²	102	159.1 Å²	159.1	71%	0.713	81%	0.814	S	S	*	*			trans	-89.3	123	167.7	53.8	0	0	0	0	109.1
273	L	36	Very low	36.3	Very low	163 Å²	163	157.7 Å²	157.7	85%	0.853	81%	0.809	S	S	*	*			trans	-92.2	105.7	174.8	-150	90.4	0	0	0	108
274	M	33.2	Very low	36.3	Very low	175 Å²	175	162.1 Å²	162.1	86%	0.862	82%	0.817	S	S	*	*			trans	-82.8	118.3	172.4	-67.7	-67.1	-134.2	0	0	109.3
275	Y	31	Very low	36.5	Very low	221 Å²	221	163.8 Å²	163.8	87%	0.867	82%	0.824	S	S	*	*			trans	-87.3	110.6	170.5	-173.5	-99.4	0	0	0	109.3
276	S	37.5	Very low	36.7	Very low	111 Å²	111	162.2 Å²	162.2	78%	0.776	83%	0.825	S	S	*	*			trans	-83.9	108.4	171.3	54.7	0	0	0	0	109.9
277	G	33.4	Very low	37	Very low	60 Å²	60	155.5 Å²	155.5	62%	0.619	82%	0.816	S	S	*	*			trans	-88.7	110	174	0	0	0	0	0	111.8	K279	G277-K279 PolarHBondContact O-N 3.02Å
278	S	36.5	Very low	37.9	Very low	117 Å²	117	152.2 Å²	152.2	82%	0.818	81%	0.814	S	S	*	*			trans	-64.6	121.4	172.3	-59.6	0	0	0	0	112.2	R280	S278-R280 PolarHBondContact O-N 3.47Å
279	K	36.9	Very low	38.4	Very low	204 Å²	204	148.5 Å²	148.5	89%	0.887	81%	0.81	S	S	*	*			trans	-75.6	109.6	167.2	-77.8	-173.4	175.9	176.7	0	110.1	G277	G277-K279 PolarHBondContact O-N 3.02Å
280	R	38.9	Very low	38.6	Very low	246 Å²	246	149.2 Å²	149.2	93%	0.928	81%	0.809	S	S	*	*			trans	-84.6	113.9	158.5	-73.1	-173.6	178.4	-177.8	0.2	108.4	S278	S278-R280 PolarHBondContact O-N 3.47Å
281	K	36.8	Very low	39.1	Very low	204 Å²	204	152.9 Å²	152.9	89%	0.887	81%	0.811	S	S	*	*			trans	-86.7	116	165	-86.9	177.1	170.5	178.7	0	107.8
282	S	35.6	Very low	39.4	Very low	123 Å²	123	153.6 Å²	153.6	86%	0.86	81%	0.806	S	S	*	*			trans	-90.4	117.2	164.4	50.8	0	0	0	0	108.9
283	S	36.1	Very low	40	Very low	89 Å²	89	159.9 Å²	159.9	62%	0.622	83%	0.831	S	S	*	*			trans	-96	164.4	159.6	52.8	0	0	0	0	109.5
284	F	36.8	Very low	40.2	Very low	187 Å²	187	159.7 Å²	159.7	82%	0.82	83%	0.83	S	S	*	*			trans	94.2	91	173.1	-55.9	-73.9	0	0	0	115.9
285	F	37.1	Very low	40.5	Very low	219 Å²	219	158.9 Å²	158.9	96%	0.961	83%	0.828	S	S	*	*				-140.6	132	127.4	-96.4	-78	0	0	0	109.5
286	S	38.6	Very low	41.1	Very low	114 Å²	114	155.4 Å²	155.4	80%	0.797	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-80.9	141.6	-173.9	-175.5	0	0	0	0	111.5
287	S	44.8	Very low	41.3	Very low	108 Å²	108	158.1 Å²	158.1	76%	0.755	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-72.4	145.8	164.8	-50.5	0	0	0	0	110.5
288	P	55.7	Low	41.8	Very low	119 Å²	119	164.2 Å²	164.2	77%	0.773	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-86.4	153.7	168.6	33	-29.9	0	0	0	111.5
289	P	54.8	Low	42.1	Very low	124 Å²	124	167.3 Å²	167.3	81%	0.805	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-83.7	151.1	-176.1	33.7	-32.9	0	0	0	113.1
290	Y	39.3	Very low	42.5	Very low	200 Å²	200	164.7 Å²	164.7	78%	0.784	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-51.8	139.6	160.1	-137.8	-106.3	0	0	0	111.2	E292	Y290-E292 HydrophobicContact CE1-CG 4.28Å
291	F	48.8	Very low	42.8	Very low	194 Å²	194	158.5 Å²	158.5	85%	0.851	83%	0.834	S	S	*	*			trans	-134.7	119.1	160.3	-148.4	-90.4	0	0	0	108.4
292	E	45.4	Very low	43.3	Very low	146 Å²	146	154.7 Å²	154.7	68%	0.682	83%	0.83	S	S	*	*			trans	-92.1	158.4	166	-103.7	172.9	111.1	0	0	109.2	Y290	Y290-E292 HydrophobicContact CE1-CG 4.28Å
293	D	46.3	Very low	44	Very low	233 Å²	233	157.5 Å²	157.5	100%	1.246	83%	0.827	S	S	*	*			trans	80.5	0	-176.8	-78.7	-65.9	0	0	0	117.9

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