A0A674ENJ6_SALTR Loading...

Dual specificity mitogen-activated protein kinase kinase 2

AlphaFold DB , UniProt , Accession A0A674ENJ6, Species SALTR (Salmo trutta, Brown trout), Gene MAP2K2, Length 401 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.9	Very low	37.4	Very low	254 Å²	254	170.3 Å²	170.3	100%	1.251	88%	0.884	S	S	*	*				0	113.2	0	-93.3	177.3	158.5	0	0	109.1
2	A	35.8	Very low	36.9	Very low	96 Å²	96	168.8 Å²	168.8	79%	0.793	88%	0.875	S	S	*	*			trans	-156.9	127.5	156.1	0	0	0	0	0	106.1
3	P	39.3	Very low	36.6	Very low	126 Å²	126	164.7 Å²	164.7	82%	0.818	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-83.4	139.6	-164.9	30.9	-32.4	0	0	0	112.8	R5	P3-R5 PolarHBondContact O-N 3.5Å
4	K	39.7	Very low	36.1	Very low	212 Å²	212	161.8 Å²	161.8	92%	0.922	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-63.9	117.7	168.3	-74.9	179.5	174.8	179.4	0	109.6
5	R	42.1	Very low	36	Very low	248 Å²	248	162.3 Å²	162.3	94%	0.936	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-74.5	127.8	170.5	-75	-176.3	175.8	-176.7	-1.2	109.8	P3	P3-R5 PolarHBondContact O-N 3.5Å
6	R	39.7	Very low	35.6	Very low	232 Å²	232	156.2 Å²	156.2	88%	0.875	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-75.6	149.8	171.3	-69.5	-179.7	177.7	-172.4	-1.6	110.1
7	P	37.8	Very low	35.7	Very low	127 Å²	127	158.9 Å²	158.9	83%	0.825	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-72	144.9	173.4	16	-9.5	0	0	0	111.8
8	V	39.8	Very low	36	Very low	131 Å²	131	154.1 Å²	154.1	79%	0.794	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-81.2	140.2	176.6	-174.1	0	0	0	0	109
9	P	30.6	Very low	35.6	Very low	118 Å²	118	155.7 Å²	155.7	77%	0.766	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-73.5	137.1	178.6	1.8	12.8	0	0	0	111.3	N11	P9-N11 PolarHBondContact O-N 3.42Å
10	L	32.3	Very low	35.7	Very low	172 Å²	172	151.6 Å²	151.6	90%	0.901	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-68.2	120.8	167	-85.5	152.6	0	0	0	109.1	I12	L10-I12 PolarHBondContact O-N 3.14Å
11	N	30.1	Very low	35.7	Very low	157 Å²	157	151 Å²	151	84%	0.84	83%	0.826	S	S	*	*			trans	-80.2	112.4	176.4	-149	15	0	0	0	108.4	P9	P9-N11 PolarHBondContact O-N 3.42Å
12	I	31.8	Very low	35.1	Very low	152 Å²	152	142.9 Å²	142.9	78%	0.779	79%	0.793	S	S	*	*			trans	-93.3	110.6	174	-58.3	172.9	0	0	0	107.1	L10	L10-I12 PolarHBondContact O-N 3.14Å
13	T	33	Very low	35	Very low	116 Å²	116	142.2 Å²	142.2	71%	0.712	78%	0.78	S	S	*	*			trans	-76.9	133.9	164.5	32.8	0	0	0	0	109.6	I15	T13-I15 PolarHBondContact O-N 3.45Å
14	P	29.9	Very low	34.9	Very low	124 Å²	124	140.8 Å²	140.8	81%	0.805	77%	0.769	S	S	*	*			trans	-73.9	125.4	176.8	28.5	-27.9	0	0	0	109.3	G16	P14-G16 PolarHBondContact O-N 3.29Å
15	I	34.5	Very low	34.9	Very low	169 Å²	169	135.9 Å²	135.9	87%	0.867	75%	0.752	S	S	*	*			trans	-72.6	114	169.7	-65.5	173.9	0	0	0	106.8	T13	T13-I15 PolarHBondContact O-N 3.45Å
16	G	29.6	Very low	34.9	Very low	65 Å²	65	128.3 Å²	128.3	67%	0.67	73%	0.73	S	S	*	*			trans	-64.3	141.4	172.2	0	0	0	0	0	111.5	P14	P14-G16 PolarHBondContact O-N 3.29Å
17	E	36.4	Very low	34.7	Very low	202 Å²	202	119.9 Å²	119.9	94%	0.944	71%	0.71	S	S	*	*	S	Bend	trans	-60.5	140.9	174	-65.1	176.7	141.6	0	0	111.7
18	G	41.4	Very low	35.1	Very low	72 Å²	72	116.5 Å²	116.5	74%	0.742	69%	0.693	S	S	*	*			trans	102	77.7	155.9	0	0	0	0	0	116.5
19	Q	29.7	Very low	35.6	Very low	185 Å²	185	113.2 Å²	113.2	86%	0.864	68%	0.676	S	S	*	*			trans	-156.5	110.8	150.6	-109.3	162.6	21.5	0	0	112
20	S	36.8	Very low	36.4	Very low	74 Å²	74	113.9 Å²	113.9	52%	0.517	67%	0.668	S	S	.	*			trans	33.5	89.7	155.6	63.5	0	0	0	0	119.6	T23	S20-T23 WeakPolarHBondContact CB-OG1 3.36Å; S20-T23 PolarHBondContact O-OG1 2.9Å; S20-T23 PolarHBondContact OG-OG1 2.75Å
21	I	35.4	Very low	37.4	Very low	140 Å²	140	108.4 Å²	108.4	72%	0.718	65%	0.648	S	S	*	*	S	Bend	trans	-75.1	-13.3	160.9	-65.2	169.2	0	0	0	111.5	T24 I25	I21-T24 PolarHBondContact O-OG1 3.43Å; I21-I25 HydrophobicContact CG2-CD1 4.21Å
22	S	32.3	Very low	38.8	Very low	82 Å²	82	106.6 Å²	106.6	57%	0.573	64%	0.638	S	S	*	*	H	α-helix	trans	-71.5	-39	-179.5	-168.8	0	0	0	0	113.5	D26	S22-D26 PolarHBondContact O-N 3.48Å
23	T	32.9	Very low	40.2	Very low	83 Å²	83	103.5 Å²	103.5	51%	0.509	62%	0.623	S	S	.	*	H	α-helix	trans	-80	-21.1	-170.8	34	0	0	0	0	114.2	S20 A27	S20-T23 WeakPolarHBondContact CB-OG1 3.36Å; S20-T23 PolarHBondContact O-OG1 2.9Å; S20-T23 PolarHBondContact OG-OG1 2.75Å; T23-A27 PolarHBondContact O-N 3.43Å
24	T	36.8	Very low	41.8	Very low	96 Å²	96	104.6 Å²	104.6	59%	0.589	62%	0.62	S	S	*	*	H	α-helix	trans	-83.8	-28.7	178.8	41.1	0	0	0	0	113.3	I21 A28	I21-T24 PolarHBondContact O-OG1 3.43Å; T24-A28 WeakPolarHBondContact O-CB 3.41Å; T24-A28 PolarHBondContact O-N 3.29Å
25	I	40.8	Very low	43.6	Very low	109 Å²	109	101 Å²	101	56%	0.559	60%	0.601	S	S	*	*	H	α-helix	trans	-73.2	-42.3	174.2	-62.2	173.3	0	0	0	109.9	I21 A28 S29	I21-I25 HydrophobicContact CG2-CD1 4.21Å; I25-A28 PolarHBondContact O-N 3.38Å; I25-S29 VanDerWaalsContact O-CB 3.32Å; I25-S29 WeakPolarHBondContact O-CB 3.32Å; I25-S29 PolarHBondContact O-N 3.38Å; I25-S29 PolarHBondContact O-OG 2.95Å
26	D	41.3	Very low	45	Very low	88 Å²	88	95.1 Å²	95.1	47%	0.471	57%	0.571	S	S	.	*	H	α-helix	trans	-63.6	-47.2	179.3	-71.7	-22.5	0	0	0	111.5	S22 A28 S29 E30	S22-D26 PolarHBondContact O-N 3.48Å; D26-A28 PolarHBondContact O-N 3.2Å; D26-S29 PolarHBondContact O-N 3.42Å; D26-S29 PolarHBondContact O-OG 3.45Å; D26-E30 PolarHBondContact O-N 3.06Å
27	A	35.8	Very low	46.8	Very low	55 Å²	55	97.1 Å²	97.1	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-66	-35.6	178.8	0	0	0	0	0	113.7	T23 A31	T23-A27 PolarHBondContact O-N 3.43Å; A27-A31 VanDerWaalsContact O-CB 3.26Å; A27-A31 WeakPolarHBondContact O-CB 3.37Å; A27-A31 PolarHBondContact O-N 3.4Å
28	A	44.8	Very low	48.5	Very low	57 Å²	57	94.8 Å²	94.8	47%	0.471	55%	0.55	S	S	.	.	H	α-helix	trans	-71.9	-32.8	175.2	0	0	0	0	0	112	T24 I25 D26 N32	T24-A28 WeakPolarHBondContact O-CB 3.41Å; T24-A28 PolarHBondContact O-N 3.29Å; I25-A28 PolarHBondContact O-N 3.38Å; D26-A28 PolarHBondContact O-N 3.2Å; A28-N32 WeakPolarHBondContact O-CB 3.14Å; A28-N32 PolarHBondContact O-N 2.76Å; A28-N32 VanDerWaalsContact O-N 3.08Å
29	S	51.2	Low	49.8	Very low	62 Å²	62	97.2 Å²	97.2	43%	0.434	54%	0.539	S	S	.	.	H	α-helix	trans	-72.1	-39.9	175.5	78	0	0	0	0	112.4	I25 D26 N32 L33	I25-S29 VanDerWaalsContact O-CB 3.32Å; I25-S29 WeakPolarHBondContact O-CB 3.32Å; I25-S29 PolarHBondContact O-N 3.38Å; I25-S29 PolarHBondContact O-OG 2.95Å; D26-S29 PolarHBondContact O-N 3.42Å; D26-S29 PolarHBondContact O-OG 3.45Å; S29-N32 PolarHBondContact O-N 2.87Å; S29-L33 WeakPolarHBondContact O-CB 3.49Å; S29-L33 PolarHBondContact O-N 3.09Å
30	E	47.2	Very low	51.8	Low	131 Å²	131	88.8 Å²	88.8	61%	0.612	50%	0.501	S	S	*	.	H	α-helix	trans	-67.4	-45.5	174.8	-77.6	-177.9	161.1	0	0	111.7	D26 N32 L33 E34	D26-E30 PolarHBondContact O-N 3.06Å; E30-N32 VanDerWaalsContact C-N 3.28Å; E30-N32 PolarHBondContact O-N 2.71Å; E30-L33 PolarHBondContact O-N 3.03Å; E30-E34 PolarHBondContact O-N 3.06Å
31	A	53.9	Low	53.3	Low	57 Å²	57	88.5 Å²	88.5	47%	0.471	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-36.1	175.5	0	0	0	0	0	112.4	A27 A35	A27-A31 VanDerWaalsContact O-CB 3.26Å; A27-A31 WeakPolarHBondContact O-CB 3.37Å; A27-A31 PolarHBondContact O-N 3.4Å; A31-A35 VanDerWaalsContact O-CB 3.29Å; A31-A35 WeakPolarHBondContact O-CB 3.4Å; A31-A35 PolarHBondContact O-N 3.45Å
32	N	59.2	Low	55.2	Low	119 Å²	119	87.5 Å²	87.5	64%	0.636	50%	0.502	S	S	*	.	H	α-helix	trans	-66.7	-39.6	172.3	-99.7	-7.9	0	0	0	111.9	A28 S29 E30 L36	A28-N32 WeakPolarHBondContact O-CB 3.14Å; A28-N32 PolarHBondContact O-N 2.76Å; A28-N32 VanDerWaalsContact O-N 3.08Å; S29-N32 PolarHBondContact O-N 2.87Å; E30-N32 VanDerWaalsContact C-N 3.28Å; E30-N32 PolarHBondContact O-N 2.71Å; N32-L36 VanDerWaalsContact O-CB 3.31Å; N32-L36 WeakPolarHBondContact O-CB 3.36Å; N32-L36 PolarHBondContact O-N 3.42Å
33	L	61.4	Low	57.3	Low	87 Å²	87	85.2 Å²	85.2	46%	0.455	48%	0.482	S	S	.	.	H	α-helix	trans	-68.7	-41.9	179.7	-162.6	74.8	0	0	0	111.9	S29 E30 L36 Q37	S29-L33 WeakPolarHBondContact O-CB 3.49Å; S29-L33 PolarHBondContact O-N 3.09Å; E30-L33 PolarHBondContact O-N 3.03Å; L33-L36 VanDerWaalsContact O-CB 3.24Å; L33-L36 WeakPolarHBondContact O-CB 3.25Å; L33-L36 PolarHBondContact O-N 2.83Å; L33-Q37 WeakPolarHBondContact O-CG 3.34Å; L33-Q37 PolarHBondContact O-N 3.48Å
34	E	65.3	Low	59.6	Low	139 Å²	139	89.1 Å²	89.1	65%	0.65	50%	0.5	S	S	*	.	H	α-helix	trans	-65.1	-43.2	174.6	-76.4	-171.7	160.6	0	0	112.1	E30 L36 Q37 K38	E30-E34 PolarHBondContact O-N 3.06Å; E34-L36 PolarHBondContact O-N 2.97Å; E34-Q37 PolarHBondContact O-N 2.89Å; E34-K38 WeakPolarHBondContact O-CB 3.34Å; E34-K38 PolarHBondContact O-N 2.9Å
35	A	68	Low	61.9	Low	50 Å²	50	86.1 Å²	86.1	41%	0.413	48%	0.481	S	S	.	.	H	α-helix	trans	-62.3	-35.3	174.3	0	0	0	0	0	111.7	A31 K39	A31-A35 VanDerWaalsContact O-CB 3.29Å; A31-A35 WeakPolarHBondContact O-CB 3.4Å; A31-A35 PolarHBondContact O-N 3.45Å; A35-K39 WeakPolarHBondContact O-CG 3.36Å; A35-K39 PolarHBondContact O-N 3.14Å
36	L	64.1	Low	64.2	Low	44 Å²	44	84.5 Å²	84.5	23%	0.23	47%	0.473	C	S	.	.	H	α-helix	trans	-64.3	-50.2	173.7	-148.6	98.8	0	0	0	111.3	N32 L33 E34 K38 K39 L40 L57	N32-L36 VanDerWaalsContact O-CB 3.31Å; N32-L36 WeakPolarHBondContact O-CB 3.36Å; N32-L36 PolarHBondContact O-N 3.42Å; L33-L36 VanDerWaalsContact O-CB 3.24Å; L33-L36 WeakPolarHBondContact O-CB 3.25Å; L33-L36 PolarHBondContact O-N 2.83Å; E34-L36 PolarHBondContact O-N 2.97Å; L36-K38 VanDerWaalsContact C-N 3.3Å; L36-K38 PolarHBondContact O-N 2.78Å; L36-K39 PolarHBondContact O-N 3.25Å; L36-K39 VanDerWaalsContact O-N 3.14Å; L36-L40 HydrophobicContact CD2-CD1 4.27Å; L36-L40 HydrophobicContact CG-CD1 4.08Å; L36-L40 WeakPolarHBondContact O-CD1 3.48Å; L36-L40 PolarHBondContact O-N 3.11Å; L36-L57 HydrophobicContact CD1-CB 4Å; L36-L57 HydrophobicContact CD1-CD1 3.82Å; L36-L57 HydrophobicContact CD1-CD2 4.31Å; L36-L57 HydrophobicContact CD1-CG 4.24Å; L36-L57 HydrophobicContact CD2-CB 3.71Å; L36-L57 HydrophobicContact CD2-CD1 3.62Å; L36-L57 HydrophobicContact CD2-CG 4.27Å; L36-L57 HydrophobicContact CG-CB 4.34Å; L36-L57 HydrophobicContact CG-CD1 3.71Å
37	Q	68.4	Low	66.4	Low	107 Å²	107	84.7 Å²	84.7	50%	0.5	47%	0.471	S	S	.	.	H	α-helix	trans	-60.3	-41.3	179.4	-75.7	177.5	-6.1	0	0	111.5	L33 E34 L40 G41	L33-Q37 WeakPolarHBondContact O-CG 3.34Å; L33-Q37 PolarHBondContact O-N 3.48Å; E34-Q37 PolarHBondContact O-N 2.89Å; Q37-L40 PolarHBondContact O-N 3.25Å; Q37-G41 PolarHBondContact O-N 3.38Å
38	K	71.9	Confident	68.9	Low	154 Å²	154	87 Å²	87	67%	0.67	47%	0.472	S	S	*	.	H	α-helix	trans	-62	-44.7	174.3	-172	178.7	177.2	-177.8	0	111.9	E34 L36 L40 G41 E42	E34-K38 WeakPolarHBondContact O-CB 3.34Å; E34-K38 PolarHBondContact O-N 2.9Å; L36-K38 VanDerWaalsContact C-N 3.3Å; L36-K38 PolarHBondContact O-N 2.78Å; K38-L40 VanDerWaalsContact C-N 3.34Å; K38-L40 PolarHBondContact O-N 2.99Å; K38-G41 PolarHBondContact O-N 2.89Å; K38-E42 PolarHBondContact O-N 3.26Å
39	K	69	Low	71.2	Confident	122 Å²	122	85.9 Å²	85.9	53%	0.53	46%	0.457	S	S	.	.	H	α-helix	trans	-62.8	-38.4	176	-81.7	-175.6	176.9	-174.8	0	112.6	A35 L36	A35-K39 WeakPolarHBondContact O-CG 3.36Å; A35-K39 PolarHBondContact O-N 3.14Å; L36-K39 PolarHBondContact O-N 3.25Å; L36-K39 VanDerWaalsContact O-N 3.14Å
40	L	70.9	Confident	73	Confident	9 Å²	9	87.2 Å²	87.2	5%	0.047	45%	0.453	C	S	.	.	H	α-helix	trans	-70.1	-34.4	176.7	-90.4	81.7	0	0	0	112.3	L36 Q37 K38 E42 L43 R50 L53 E54 L57	L36-L40 HydrophobicContact CD2-CD1 4.27Å; L36-L40 HydrophobicContact CG-CD1 4.08Å; L36-L40 WeakPolarHBondContact O-CD1 3.48Å; L36-L40 PolarHBondContact O-N 3.11Å; Q37-L40 PolarHBondContact O-N 3.25Å; K38-L40 VanDerWaalsContact C-N 3.34Å; K38-L40 PolarHBondContact O-N 2.99Å; L40-E42 PolarHBondContact O-N 3.07Å; L40-L43 PolarHBondContact O-N 2.88Å; L40-R50 HydrophobicContact CD2-CG 3.84Å; L40-L53 HydrophobicContact CD1-CD2 4.34Å; L40-L53 HydrophobicContact CD2-CB 4.18Å; L40-L53 HydrophobicContact CD2-CD2 4.14Å; L40-L53 HydrophobicContact CD2-CG 4.22Å; L40-L53 HydrophobicContact CG-CD2 3.98Å; L40-L53 HydrophobicContact CG-CG 4.44Å; L40-E54 HydrophobicContact CD2-CG 3.46Å; L40-E54 VanDerWaalsContact CD2-CG 3.46Å; L40-L57 HydrophobicContact CD1-CD1 3.72Å
41	G	68.2	Low	75.1	Confident	68 Å²	68	86.8 Å²	86.8	70%	0.701	45%	0.449	S	S	*	.	H	α-helix	trans	-67.6	-17.9	177.4	0	0	0	0	0	114.7	Q37 K38 L43	Q37-G41 PolarHBondContact O-N 3.38Å; K38-G41 PolarHBondContact O-N 2.89Å; G41-L43 VanDerWaalsContact C-N 3.3Å
42	E	75.9	Confident	76.9	Confident	119 Å²	119	87 Å²	87	56%	0.556	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-4.2	174.8	-68.6	-178.7	-168.7	0	0	113.9	K38 L40 K186	K38-E42 PolarHBondContact O-N 3.26Å; L40-E42 PolarHBondContact O-N 3.07Å; E42-K186 IonicContact OE2-NZ 3.01Å
43	L	75.6	Confident	78.4	Confident	33 Å²	33	82 Å²	82	17%	0.173	41%	0.411	C	S	.	.	S	Bend	trans	-103.4	136	177.6	-61.3	175.6	0	0	0	108.8	L40 G41 L45 L53 Y182	L40-L43 PolarHBondContact O-N 2.88Å; G41-L43 VanDerWaalsContact C-N 3.3Å; L43-L45 HydrophobicContact CB-CD1 3.8Å; L43-L45 HydrophobicContact CB-CD2 3.97Å; L43-L45 HydrophobicContact CB-CG 3.53Å; L43-L45 HydrophobicContact CD1-CD1 4.06Å; L43-L45 PolarHBondContact O-N 2.96Å; L43-L53 HydrophobicContact CD1-CD2 4.32Å; L43-Y182 HydrophobicContact CD2-CD2 3.94Å; L43-Y182 HydrophobicContact CD2-CE2 3.83Å
44	D	82.6	Confident	79.7	Confident	165 Å²	165	80 Å²	80	88%	0.882	40%	0.399	S	S	*	.			trans	-75.7	80	173.4	-170.7	25	0	0	0	109.3
45	L	85.1	Confident	81	Confident	34 Å²	34	75.8 Å²	75.8	18%	0.178	39%	0.388	C	S	.	.			trans	-111.3	139.2	-175.2	-57.9	179.6	0	0	0	110.8	L43 Q49 L53 P127	L43-L45 HydrophobicContact CB-CD1 3.8Å; L43-L45 HydrophobicContact CB-CD2 3.97Å; L43-L45 HydrophobicContact CB-CG 3.53Å; L43-L45 HydrophobicContact CD1-CD1 4.06Å; L43-L45 PolarHBondContact O-N 2.96Å; L45-Q49 HydrophobicContact CB-CB 4.25Å; L45-Q49 HydrophobicContact CD2-CB 4.36Å; L45-L53 HydrophobicContact CD1-CD2 4.08Å; L45-P127 VanDerWaalsContact CD2-CD 3.49Å; L45-P127 HydrophobicContact CD2-CG 3.49Å; L45-P127 VanDerWaalsContact CD2-CG 3.49Å
46	D	88.6	Confident	82.2	Confident	75 Å²	75	74.1 Å²	74.1	40%	0.401	37%	0.371	S	S	.	.			trans	-71.3	164	163	70.5	59.7	0	0	0	111.3	Q48 Q49 R50	D46-Q48 PolarHBondContact O-N 3.42Å; D46-Q48 WeakPolarHBondContact OD1-CA 3.34Å; D46-Q48 WeakPolarHBondContact OD1-CB 3.5Å; D46-Q48 PolarHBondContact OD1-N 3.37Å; D46-Q49 PolarHBondContact O-N 3.37Å; D46-Q49 WeakPolarHBondContact OD1-CG 3.42Å; D46-Q49 PolarHBondContact OD1-N 3.14Å; D46-Q49 VanDerWaalsContact OD2-CG 3.26Å; D46-Q49 WeakPolarHBondContact OD2-CG 3.14Å; D46-Q49 PolarHBondContact OD2-NE2 3.36Å; D46-Q49 PolarHBondContact OD2-OE1 3.43Å; D46-R50 WeakPolarHBondContact O-CB 3.24Å; D46-R50 PolarHBondContact O-N 2.82Å
47	E	87.8	Confident	83.5	Confident	92 Å²	92	72.9 Å²	72.9	43%	0.43	37%	0.365	S	S	.	.	H	α-helix	trans	-61.9	-31.3	-176.4	-178.3	60.6	-167.4	0	0	112.9	R50 K51	E47-R50 IonicContact OE1-CZ 3.71Å; E47-R50 IonicContact OE1-NE 3.83Å; E47-R50 IonicContact OE1-NH2 3.21Å; E47-R50 PolarHBondContact OE1-NH2 3.08Å; E47-R50 IonicContact OE2-CZ 3Å; E47-R50 VanDerWaalsContact OE2-CZ 3.28Å; E47-R50 IonicContact OE2-NE 3.36Å; E47-R50 PolarHBondContact OE2-NE 3.01Å; E47-R50 IonicContact OE2-NH2 3.78Å; E47-R50 PolarHBondContact OE2-NH2 2.61Å; E47-K51 WeakPolarHBondContact O-CB 3.26Å; E47-K51 WeakPolarHBondContact O-CG 3.28Å; E47-K51 PolarHBondContact O-N 2.87Å; E47-K51 VanDerWaalsContact O-N 3.1Å; E47-K51 WeakPolarHBondContact OE1-CE 3.38Å; E47-K51 IonicContact OE1-NZ 3.67Å
48	Q	88.4	Confident	84.6	Confident	102 Å²	102	71.1 Å²	71.1	48%	0.477	36%	0.361	S	S	.	.	H	α-helix	trans	-74.2	-42.1	179	-168	179.7	25.1	0	0	111	D46 K51 R52	D46-Q48 PolarHBondContact O-N 3.42Å; D46-Q48 WeakPolarHBondContact OD1-CA 3.34Å; D46-Q48 WeakPolarHBondContact OD1-CB 3.5Å; D46-Q48 PolarHBondContact OD1-N 3.37Å; Q48-K51 PolarHBondContact O-N 2.88Å; Q48-R52 VanDerWaalsContact O-CG 3.3Å; Q48-R52 WeakPolarHBondContact O-CG 3.37Å; Q48-R52 PolarHBondContact O-N 2.87Å
49	Q	91.8	Very high	85.5	Confident	34 Å²	34	67.7 Å²	67.7	16%	0.159	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-46	173.6	-72.9	178.7	-10.6	0	0	111.1	L45 D46 R52 L53 P127 Y128	L45-Q49 HydrophobicContact CB-CB 4.25Å; L45-Q49 HydrophobicContact CD2-CB 4.36Å; D46-Q49 PolarHBondContact O-N 3.37Å; D46-Q49 WeakPolarHBondContact OD1-CG 3.42Å; D46-Q49 PolarHBondContact OD1-N 3.14Å; D46-Q49 VanDerWaalsContact OD2-CG 3.26Å; D46-Q49 WeakPolarHBondContact OD2-CG 3.14Å; D46-Q49 PolarHBondContact OD2-NE2 3.36Å; D46-Q49 PolarHBondContact OD2-OE1 3.43Å; Q49-R52 PolarHBondContact O-N 3.38Å; Q49-L53 WeakPolarHBondContact O-CB 3.38Å; Q49-L53 PolarHBondContact O-N 3.28Å; Q49-P127 HydrophobicContact CB-CB 4.24Å; Q49-P127 HydrophobicContact CG-CB 4.11Å; Q49-P127 HydrophobicContact CG-CG 4.48Å; Q49-Y128 PolarHBondContact NE2-OH 2.84Å
50	R	89.4	Confident	86.6	Confident	90 Å²	90	63.1 Å²	63.1	34%	0.34	33%	0.328	S	S	.	.	H	α-helix	trans	-56.8	-52	176.5	-170.9	175.9	71.9	102.8	-11.1	111.3	L40 D46 E47 R52 L53 E54	L40-R50 HydrophobicContact CD2-CG 3.84Å; D46-R50 WeakPolarHBondContact O-CB 3.24Å; D46-R50 PolarHBondContact O-N 2.82Å; E47-R50 IonicContact OE1-CZ 3.71Å; E47-R50 IonicContact OE1-NE 3.83Å; E47-R50 IonicContact OE1-NH2 3.21Å; E47-R50 PolarHBondContact OE1-NH2 3.08Å; E47-R50 IonicContact OE2-CZ 3Å; E47-R50 VanDerWaalsContact OE2-CZ 3.28Å; E47-R50 IonicContact OE2-NE 3.36Å; E47-R50 PolarHBondContact OE2-NE 3.01Å; E47-R50 IonicContact OE2-NH2 3.78Å; E47-R50 PolarHBondContact OE2-NH2 2.61Å; R50-R52 PolarHBondContact O-N 3.16Å; R50-L53 PolarHBondContact O-N 3.15Å; R50-E54 WeakPolarHBondContact CG-OE1 3.33Å; R50-E54 IonicContact CZ-OE1 3.96Å; R50-E54 IonicContact NH1-OE1 3.97Å; R50-E54 PolarHBondContact NH1-OE1 3.38Å; R50-E54 WeakPolarHBondContact O-CG 3.44Å; R50-E54 PolarHBondContact O-N 3.38Å
51	K	91.1	Very high	87.5	Confident	123 Å²	123	66.9 Å²	66.9	54%	0.535	36%	0.36	S	S	.	.	H	α-helix	trans	-58.3	-42.4	177.4	-77.5	176.6	177.9	167.4	0	113.3	E47 Q48 A55	E47-K51 WeakPolarHBondContact O-CB 3.26Å; E47-K51 WeakPolarHBondContact O-CG 3.28Å; E47-K51 PolarHBondContact O-N 2.87Å; E47-K51 VanDerWaalsContact O-N 3.1Å; E47-K51 WeakPolarHBondContact OE1-CE 3.38Å; E47-K51 IonicContact OE1-NZ 3.67Å; Q48-K51 PolarHBondContact O-N 2.88Å; K51-A55 WeakPolarHBondContact O-CB 3.49Å; K51-A55 PolarHBondContact O-N 3.16Å
52	R	91.8	Very high	88.5	Confident	62 Å²	62	69.7 Å²	69.7	23%	0.234	36%	0.355	C	S	.	.	H	α-helix	trans	-65.1	-42.4	178.4	-72.8	173.9	-174.6	-168.9	1.4	111.3	Q48 Q49 R50 A55 F56 R204	Q48-R52 VanDerWaalsContact O-CG 3.3Å; Q48-R52 WeakPolarHBondContact O-CG 3.37Å; Q48-R52 PolarHBondContact O-N 2.87Å; Q49-R52 PolarHBondContact O-N 3.38Å; R50-R52 PolarHBondContact O-N 3.16Å; R52-A55 PolarHBondContact O-N 3.09Å; R52-F56 PolarHBondContact O-N 3.05Å; R52-R204 PolarHBondContact NH1-O 2.89Å; R52-R204 PolarHBondContact NH2-O 3.33Å
53	L	90.7	Very high	89.3	Confident	12 Å²	12	65 Å²	65	6%	0.063	33%	0.334	C	S	.	.	H	α-helix	trans	-68.6	-43.1	179.1	-171.9	58.4	0	0	0	111.7	L40 L43 L45 Q49 R50 A55 F56 L57 N125	L40-L53 HydrophobicContact CD1-CD2 4.34Å; L40-L53 HydrophobicContact CD2-CB 4.18Å; L40-L53 HydrophobicContact CD2-CD2 4.14Å; L40-L53 HydrophobicContact CD2-CG 4.22Å; L40-L53 HydrophobicContact CG-CD2 3.98Å; L40-L53 HydrophobicContact CG-CG 4.44Å; L43-L53 HydrophobicContact CD1-CD2 4.32Å; L45-L53 HydrophobicContact CD1-CD2 4.08Å; Q49-L53 WeakPolarHBondContact O-CB 3.38Å; Q49-L53 PolarHBondContact O-N 3.28Å; R50-L53 PolarHBondContact O-N 3.15Å; L53-A55 PolarHBondContact O-N 2.7Å; L53-F56 PolarHBondContact O-N 3.48Å; L53-L57 HydrophobicContact CD1-CD1 4.32Å; L53-L57 HydrophobicContact CG-CD1 4Å; L53-L57 WeakPolarHBondContact O-CB 3.3Å; L53-L57 VanDerWaalsContact O-CG 3.25Å; L53-L57 WeakPolarHBondContact O-CG 3.37Å; L53-L57 PolarHBondContact O-N 2.85Å; L53-N125 HydrophobicContact CD1-CB 4.26Å
54	E	90.1	Very high	90	Very high	47 Å²	47	66 Å²	66	22%	0.22	35%	0.353	C	S	.	.	H	α-helix	trans	-56.6	-49	172.1	-72.2	175	-176.7	0	0	110.8	L40 R50 F56 L57 T58	L40-E54 HydrophobicContact CD2-CG 3.46Å; L40-E54 VanDerWaalsContact CD2-CG 3.46Å; R50-E54 WeakPolarHBondContact CG-OE1 3.33Å; R50-E54 IonicContact CZ-OE1 3.96Å; R50-E54 IonicContact NH1-OE1 3.97Å; R50-E54 PolarHBondContact NH1-OE1 3.38Å; R50-E54 WeakPolarHBondContact O-CG 3.44Å; R50-E54 PolarHBondContact O-N 3.38Å; E54-F56 VanDerWaalsContact C-N 3.35Å; E54-F56 PolarHBondContact O-N 3.32Å; E54-L57 PolarHBondContact O-N 3.38Å; E54-L57 VanDerWaalsContact O-N 3.15Å; E54-T58 PolarHBondContact O-N 2.89Å; E54-T58 PolarHBondContact O-OG1 3.29Å; E54-T58 VanDerWaalsContact O-OG1 3.11Å
55	A	91.8	Very high	90.4	Very high	49 Å²	49	65.4 Å²	65.4	41%	0.405	35%	0.345	S	S	.	.	H	α-helix	trans	-59.6	-42.6	178.5	0	0	0	0	0	112.7	K51 R52 L53 Q59	K51-A55 WeakPolarHBondContact O-CB 3.49Å; K51-A55 PolarHBondContact O-N 3.16Å; R52-A55 PolarHBondContact O-N 3.09Å; L53-A55 PolarHBondContact O-N 2.7Å; A55-Q59 WeakPolarHBondContact O-CG 3.4Å; A55-Q59 PolarHBondContact O-N 2.81Å
56	F	93.7	Very high	90.9	Very high	16 Å²	16	64.7 Å²	64.7	7%	0.07	34%	0.341	C	S	.	.	H	α-helix	trans	-61.4	-44.9	175	172.9	-99.1	0	0	0	111.6	R52 L53 E54 Q59 K60 G131 Y133 E147	R52-F56 PolarHBondContact O-N 3.05Å; L53-F56 PolarHBondContact O-N 3.48Å; E54-F56 VanDerWaalsContact C-N 3.35Å; E54-F56 PolarHBondContact O-N 3.32Å; F56-Q59 WeakPolarHBondContact O-CB 3.19Å; F56-Q59 PolarHBondContact O-N 3.03Å; F56-K60 HydrophobicContact CE1-CD 3.96Å; F56-K60 HydrophobicContact CZ-CD 4.31Å; F56-K60 WeakPolarHBondContact O-CB 3.39Å; F56-K60 PolarHBondContact O-N 3.1Å; F56-G131 VanDerWaalsContact CZ-C 3.46Å; F56-Y133 HydrophobicContact CE2-CD1 4.43Å; F56-Y133 AromaticContact CE2-CE1 3.77Å; F56-Y133 HydrophobicContact CE2-CE1 3.77Å; F56-Y133 AromaticContact CE2-CE2 3.99Å; F56-Y133 HydrophobicContact CE2-CE2 3.99Å; F56-Y133 AromaticContact CE2-CZ 3.51Å; F56-Y133 HydrophobicContact CZ-CD1 4.42Å; F56-Y133 HydrophobicContact CZ-CE1 4.15Å; F56-E147 HydrophobicContact CD2-CB 4.39Å; F56-E147 HydrophobicContact CE2-CB 3.91Å
57	L	90.9	Very high	91.2	Very high	17 Å²	17	66.4 Å²	66.4	9%	0.089	35%	0.345	C	S	.	.	H	α-helix	trans	-67.9	-37.2	-178.6	-70.1	167.7	0	0	0	112.3	L36 L40 L53 E54 K60 A61 N125	L36-L57 HydrophobicContact CD1-CB 4Å; L36-L57 HydrophobicContact CD1-CD1 3.82Å; L36-L57 HydrophobicContact CD1-CD2 4.31Å; L36-L57 HydrophobicContact CD1-CG 4.24Å; L36-L57 HydrophobicContact CD2-CB 3.71Å; L36-L57 HydrophobicContact CD2-CD1 3.62Å; L36-L57 HydrophobicContact CD2-CG 4.27Å; L36-L57 HydrophobicContact CG-CB 4.34Å; L36-L57 HydrophobicContact CG-CD1 3.71Å; L40-L57 HydrophobicContact CD1-CD1 3.72Å; L53-L57 HydrophobicContact CD1-CD1 4.32Å; L53-L57 HydrophobicContact CG-CD1 4Å; L53-L57 WeakPolarHBondContact O-CB 3.3Å; L53-L57 VanDerWaalsContact O-CG 3.25Å; L53-L57 WeakPolarHBondContact O-CG 3.37Å; L53-L57 PolarHBondContact O-N 2.85Å; E54-L57 PolarHBondContact O-N 3.38Å; E54-L57 VanDerWaalsContact O-N 3.15Å; L57-K60 HydrophobicContact CD2-CD 4.38Å; L57-K60 PolarHBondContact O-N 2.92Å; L57-A61 PolarHBondContact O-N 3.25Å; L57-N125 HydrophobicContact CD2-CB 4.43Å; L57-N125 WeakPolarHBondContact CD2-OD1 3.46Å
58	T	90.9	Very high	91.6	Very high	70 Å²	70	64.9 Å²	64.9	43%	0.429	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-43.6	171.4	-58.7	0	0	0	0	111.5	E54 K60 A61	E54-T58 PolarHBondContact O-N 2.89Å; E54-T58 PolarHBondContact O-OG1 3.29Å; E54-T58 VanDerWaalsContact O-OG1 3.11Å; T58-K60 VanDerWaalsContact C-N 3.35Å; T58-A61 PolarHBondContact O-N 3.25Å
59	Q	91.7	Very high	91.9	Very high	82 Å²	82	66.2 Å²	66.2	38%	0.383	35%	0.35	S	S	.	.	H	α-helix	trans	-63.1	-42.4	174.6	-72.5	175.5	-0.8	0	0	111.6	A55 F56 A61 Q62 L95	A55-Q59 WeakPolarHBondContact O-CG 3.4Å; A55-Q59 PolarHBondContact O-N 2.81Å; F56-Q59 WeakPolarHBondContact O-CB 3.19Å; F56-Q59 PolarHBondContact O-N 3.03Å; Q59-A61 VanDerWaalsContact C-N 3.33Å; Q59-A61 PolarHBondContact O-N 3.37Å; Q59-Q62 WeakPolarHBondContact O-CB 3.47Å; Q59-Q62 PolarHBondContact O-N 3.47Å; Q59-Q62 VanDerWaalsContact O-N 3.14Å; Q59-L95 HydrophobicContact CB-CD1 4.1Å; Q59-L95 HydrophobicContact CB-CD2 4.26Å; Q59-L95 HydrophobicContact CG-CD2 4.19Å
60	K	92.4	Very high	92.1	Very high	27 Å²	27	66.6 Å²	66.6	12%	0.117	35%	0.353	C	S	.	.	H	α-helix	trans	-61.8	-38.1	177.6	178.4	176	172.9	172.4	0	112.2	F56 L57 T58 Q62 V63 H122 F132 Y133	F56-K60 HydrophobicContact CE1-CD 3.96Å; F56-K60 HydrophobicContact CZ-CD 4.31Å; F56-K60 WeakPolarHBondContact O-CB 3.39Å; F56-K60 PolarHBondContact O-N 3.1Å; L57-K60 HydrophobicContact CD2-CD 4.38Å; L57-K60 PolarHBondContact O-N 2.92Å; T58-K60 VanDerWaalsContact C-N 3.35Å; K60-Q62 PolarHBondContact O-N 2.76Å; K60-V63 WeakPolarHBondContact O-CB 3.45Å; K60-V63 PolarHBondContact O-N 3.44Å; K60-H122 WeakPolarHBondContact CE-ND1 3.46Å; K60-H122 PolarHBondContact NZ-O 2.94Å; K60-H122 VanDerWaalsContact NZ-O 3.14Å; K60-F132 WeakPolarHBondContact CD-O 3.49Å; K60-F132 WeakPolarHBondContact CE-O 3.3Å; K60-F132 PolarHBondContact NZ-O 2.89Å; K60-Y133 HydrophobicContact CB-CD1 4.08Å; K60-Y133 HydrophobicContact CB-CE1 4.09Å; K60-Y133 HydrophobicContact CG-CD1 4.18Å
61	A	89.6	Confident	92.5	Very high	87 Å²	87	63 Å²	63	72%	0.719	34%	0.34	S	S	*	.	H	α-helix	trans	-63.7	-23.5	176.4	0	0	0	0	0	113.4	L57 T58 Q59 V63	L57-A61 PolarHBondContact O-N 3.25Å; T58-A61 PolarHBondContact O-N 3.25Å; Q59-A61 VanDerWaalsContact C-N 3.33Å; Q59-A61 PolarHBondContact O-N 3.37Å; A61-V63 VanDerWaalsContact C-N 3.31Å
62	Q	88.4	Confident	92.8	Very high	128 Å²	128	61.9 Å²	61.9	60%	0.598	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-11.2	174.2	-59.8	171.7	9.7	0	0	112.6	Q59 K60 G64	Q59-Q62 WeakPolarHBondContact O-CB 3.47Å; Q59-Q62 PolarHBondContact O-N 3.47Å; Q59-Q62 VanDerWaalsContact O-N 3.14Å; K60-Q62 PolarHBondContact O-N 2.76Å; Q62-G64 PolarHBondContact O-N 2.97Å
63	V	92.2	Very high	93.1	Very high	19 Å²	19	63.3 Å²	63.3	12%	0.115	35%	0.354	C	S	.	.			trans	-84.8	107.3	175.3	-177	0	0	0	0	107.7	K60 A61 L66 L95 M97 Y133	K60-V63 WeakPolarHBondContact O-CB 3.45Å; K60-V63 PolarHBondContact O-N 3.44Å; A61-V63 VanDerWaalsContact C-N 3.31Å; V63-L66 HydrophobicContact CG1-CD2 3.41Å; V63-L66 VanDerWaalsContact CG1-CD2 3.41Å; V63-L66 HydrophobicContact CG1-CG 4.14Å; V63-L95 HydrophobicContact CG2-CD1 3.57Å; V63-M97 HydrophobicContact CG1-CE 4.2Å; V63-M97 HydrophobicContact CG2-CE 3.83Å; V63-Y133 HydrophobicContact CB-CD1 4.45Å; V63-Y133 HydrophobicContact CG2-CD1 3.81Å; V63-Y133 HydrophobicContact CG2-CE1 4.09Å
64	G	90.4	Very high	93.4	Very high	55 Å²	55	66.2 Å²	66.2	57%	0.567	37%	0.369	S	S	*	.			trans	-72.3	-157.4	171.6	0	0	0	0	0	112.5	Q62 L66	Q62-G64 PolarHBondContact O-N 2.97Å; G64-L66 PolarHBondContact O-N 3.49Å
65	E	92.5	Very high	93.7	Very high	153 Å²	153	67 Å²	67	72%	0.715	38%	0.378	S	S	*	.	S	Bend	trans	-60.7	130.2	172.7	-172.7	-177	-152.4	0	0	110.7	K67	E65-K67 VanDerWaalsContact OE2-CE 3.27Å; E65-K67 WeakPolarHBondContact OE2-CE 3.3Å; E65-K67 IonicContact OE2-NZ 2.7Å
66	L	95.1	Very high	94	Very high	18 Å²	18	70.4 Å²	70.4	9%	0.094	39%	0.386	C	S	.	.			trans	-86.9	132.4	180	-63.8	178.8	0	0	0	111	V63 G64 F71 F136 C145	V63-L66 HydrophobicContact CG1-CD2 3.41Å; V63-L66 VanDerWaalsContact CG1-CD2 3.41Å; V63-L66 HydrophobicContact CG1-CG 4.14Å; G64-L66 PolarHBondContact O-N 3.49Å; L66-F71 HydrophobicContact CB-CE2 4.44Å; L66-F71 HydrophobicContact CB-CZ 4.37Å; L66-F71 HydrophobicContact CD1-CZ 4.36Å; L66-F71 HydrophobicContact CD2-CZ 3.83Å; L66-F71 HydrophobicContact CG-CZ 4.42Å; L66-F136 HydrophobicContact CB-CD1 3.71Å; L66-F136 HydrophobicContact CB-CE1 3.92Å; L66-C145 HydrophobicContact CD1-CB 3.75Å
67	K	94.6	Very high	94	Very high	112 Å²	112	72.6 Å²	72.6	49%	0.487	40%	0.398	S	S	.	.			trans	-129.8	155.4	174.6	-58.2	176.7	-176.9	175.1	0	110.5	E65 D69 D70 F71	E65-K67 VanDerWaalsContact OE2-CE 3.27Å; E65-K67 WeakPolarHBondContact OE2-CE 3.3Å; E65-K67 IonicContact OE2-NZ 2.7Å; K67-D69 VanDerWaalsContact C-N 3.33Å; K67-D69 PolarHBondContact O-N 2.87Å; K67-D70 WeakPolarHBondContact CB-OD2 3.27Å; K67-D70 PolarHBondContact N-OD2 3.15Å; K67-D70 WeakPolarHBondContact O-CB 3.33Å; K67-D70 PolarHBondContact O-N 3.21Å; K67-D70 VanDerWaalsContact O-N 3.15Å; K67-F71 WeakPolarHBondContact O-CD2 3.33Å; K67-F71 VanDerWaalsContact O-CE2 3.22Å; K67-F71 WeakPolarHBondContact O-CE2 3.22Å
68	D	95.7	Very high	93.9	Very high	60 Å²	60	73 Å²	73	32%	0.321	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-58.1	-45.9	-176.9	-173.7	55.7	0	0	0	112.6	D70 F71 R99 F136	D68-D70 PolarHBondContact O-N 3.01Å; D68-F71 PolarHBondContact O-N 2.98Å; D68-F71 VanDerWaalsContact O-N 3.16Å; D68-R99 IonicContact OD1-CZ 2.81Å; D68-R99 IonicContact OD1-NH1 3.28Å; D68-R99 PolarHBondContact OD1-NH1 3.36Å; D68-R99 IonicContact OD1-NH2 3.56Å; D68-R99 PolarHBondContact OD1-NH2 3.39Å; D68-F136 HydrophobicContact CB-CE2 4.09Å
69	D	96.1	Very high	93.7	Very high	130 Å²	130	73 Å²	73	70%	0.695	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-61.7	-16.9	-179.8	-69.8	-35.1	0	0	0	114.1	K67 F71 K91	K67-D69 VanDerWaalsContact C-N 3.33Å; K67-D69 PolarHBondContact O-N 2.87Å; D69-F71 PolarHBondContact O-N 3.38Å; D69-K91 WeakPolarHBondContact O-CE 3.47Å; D69-K91 PolarHBondContact O-NZ 3.35Å
70	D	95.6	Very high	92.9	Very high	41 Å²	41	71.4 Å²	71.4	22%	0.219	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-79.2	-6.4	-179.5	-68	-39.5	0	0	0	112.9	K67 D68 K91 P92	K67-D70 WeakPolarHBondContact CB-OD2 3.27Å; K67-D70 PolarHBondContact N-OD2 3.15Å; K67-D70 WeakPolarHBondContact O-CB 3.33Å; K67-D70 PolarHBondContact O-N 3.21Å; K67-D70 VanDerWaalsContact O-N 3.15Å; D68-D70 PolarHBondContact O-N 3.01Å; D70-K91 WeakPolarHBondContact O-CB 3.46Å; D70-K91 VanDerWaalsContact O-CG 3.25Å; D70-K91 WeakPolarHBondContact O-CG 3.29Å; D70-K91 PolarHBondContact O-N 3.42Å; D70-P92 HydrophobicContact CB-CG 4.29Å
71	F	97.6	Very high	91.7	Very high	14 Å²	14	73.8 Å²	73.8	6%	0.061	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.3	-176.5	-64.5	-77	0	0	0	112.6	L66 K67 D68 D69 V88 H90 M97 F136 C145	L66-F71 HydrophobicContact CB-CE2 4.44Å; L66-F71 HydrophobicContact CB-CZ 4.37Å; L66-F71 HydrophobicContact CD1-CZ 4.36Å; L66-F71 HydrophobicContact CD2-CZ 3.83Å; L66-F71 HydrophobicContact CG-CZ 4.42Å; K67-F71 WeakPolarHBondContact O-CD2 3.33Å; K67-F71 VanDerWaalsContact O-CE2 3.22Å; K67-F71 WeakPolarHBondContact O-CE2 3.22Å; D68-F71 PolarHBondContact O-N 2.98Å; D68-F71 VanDerWaalsContact O-N 3.16Å; D69-F71 PolarHBondContact O-N 3.38Å; F71-V88 HydrophobicContact CB-CB 4.37Å; F71-V88 HydrophobicContact CD1-CB 4.07Å; F71-V88 HydrophobicContact CD1-CG2 3.52Å; F71-V88 HydrophobicContact CE1-CG2 4.02Å; F71-V88 HydrophobicContact CG-CG2 4.36Å; F71-H90 HydrophobicContact CD1-CB 4.29Å; F71-H90 HydrophobicContact CE1-CB 4.01Å; F71-H90 AromaticContact CE1-CD2 3.82Å; F71-H90 AromaticContact CZ-CD2 3.97Å; F71-M97 HydrophobicContact CE1-SD 3.98Å; F71-F136 HydrophobicContact CD2-CZ 4.21Å; F71-F136 AromaticContact CE2-CE1 3.63Å; F71-F136 HydrophobicContact CE2-CE1 3.63Å; F71-F136 AromaticContact CE2-CZ 3.72Å; F71-F136 HydrophobicContact CE2-CZ 3.72Å; F71-F136 HydrophobicContact CZ-CE1 4.25Å; F71-C145 VanDerWaalsContact CZ-SG 3.52Å
72	H	97.8	Very high	90.8	Very high	101 Å²	101	70.3 Å²	70.3	47%	0.468	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118	165.2	-175.8	74	0	0	0	108.8	V88 R89	H72-V88 CarbonylContact O-C 3.56Å; H72-V88 WeakPolarHBondContact O-CA 3.36Å; H72-R89 HydrophobicContact CB-CB 4.48Å; H72-R89 PolarHBondContact N-O 2.86Å; H72-R89 PolarHBondContact O-N 3.31Å
73	P	96.8	Very high	90.6	Very high	91 Å²	91	65.2 Å²	65.2	59%	0.591	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	142.4	177.5	28.6	-33.7	0	0	0	110.7
74	I	97.9	Very high	90.6	Very high	74 Å²	74	66.8 Å²	66.8	38%	0.379	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-60.4	176	-62.3	169	0	0	0	109.6	K87 R89 V96	I74-K87 HydrophobicContact CB-CB 4.3Å; I74-K87 HydrophobicContact CB-CD 4.46Å; I74-K87 HydrophobicContact CB-CG 4.2Å; I74-K87 WeakPolarHBondContact CB-O 3.41Å; I74-K87 HydrophobicContact CD1-CD 4.47Å; I74-K87 HydrophobicContact CD1-CG 4.08Å; I74-K87 HydrophobicContact CG2-CD 4.23Å; I74-K87 PolarHBondContact N-O 2.93Å; I74-R89 HydrophobicContact CD1-CB 4.08Å; I74-V96 HydrophobicContact CD1-CG1 4.37Å; I74-V96 HydrophobicContact CD1-CG2 4.43Å
75	C	96.8	Very high	90.9	Very high	62 Å²	62	65.7 Å²	65.7	42%	0.419	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	160.7	178.9	65.5	0	0	0	0	110.4	K87	C75-K87 PolarHBondContact N-O 2.91Å; C75-K87 WeakPolarHBondContact O-CB 3.49Å; C75-K87 PolarHBondContact O-N 3.05Å
76	E	96.8	Very high	91.1	Very high	122 Å²	122	60.1 Å²	60.1	57%	0.57	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	138.8	167.7	-168.7	177.3	126.9	0	0	109.7	V84 N86	E76-V84 HydrophobicContact CG-CG1 3.98Å; E76-N86 WeakPolarHBondContact CA-OD1 3.35Å
77	L	94.3	Very high	91.3	Very high	61 Å²	61	61.8 Å²	61.8	32%	0.319	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-30.3	175	-66.2	173.8	0	0	0	111.7	V85 K87 A98 Q156	L77-V85 HydrophobicContact CB-CB 4.46Å; L77-V85 HydrophobicContact CB-CG1 4.33Å; L77-V85 HydrophobicContact CD1-CG1 4.19Å; L77-V85 PolarHBondContact N-O 2.89Å; L77-K87 HydrophobicContact CD1-CB 3.98Å; L77-K87 HydrophobicContact CD2-CB 3.96Å; L77-K87 HydrophobicContact CD2-CD 4.49Å; L77-K87 HydrophobicContact CG-CB 3.87Å; L77-A98 HydrophobicContact CD1-CB 3.96Å; L77-Q156 PolarHBondContact O-NE2 2.93Å
78	G	89.2	Confident	91.4	Very high	26 Å²	26	56.7 Å²	56.7	27%	0.268	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170.3	162.3	173.7	0	0	0	0	0	112.3	V85	G78-V85 PolarHBondContact N-O 3.37Å; G78-V85 PolarHBondContact O-N 3.14Å
79	A	86.4	Confident	91.6	Very high	69 Å²	69	59 Å²	59	57%	0.57	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.1	175.1	0	0	0	0	0	109.8	V84	A79-V84 HydrophobicContact CB-CG2 4.07Å
80	G	74.9	Confident	91.6	Very high	50 Å²	50	53 Å²	53	52%	0.515	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	-169.3	178	0	0	0	0	0	112.8	G82 G83	G80-G82 PolarHBondContact O-N 3.4Å; G80-G83 PolarHBondContact N-O 3.33Å; G80-G83 PolarHBondContact O-N 2.94Å
81	N	66.4	Low	91.7	Very high	76 Å²	76	55.7 Å²	55.7	41%	0.406	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.7	-176.2	-60.4	-19.8	0	0	0	113.6	F226 T229	N81-F226 HydrophobicContact CB-CB 4.34Å; N81-F226 HydrophobicContact CB-CD1 4.44Å; N81-F226 HydrophobicContact CB-CD2 4.19Å; N81-F226 HydrophobicContact CB-CG 4.06Å; N81-F226 VanDerWaalsContact O-CE2 3.3Å; N81-F226 WeakPolarHBondContact O-CE2 3.36Å; N81-T229 PolarHBondContact ND2-OG1 2.95Å
82	G	70.6	Confident	91.7	Very high	15 Å²	15	59 Å²	59	16%	0.155	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	12.2	-180	0	0	0	0	0	114.5	G80 K100 I102	G80-G82 PolarHBondContact O-N 3.4Å; G82-K100 WeakPolarHBondContact O-CE 3.12Å; G82-I102 WeakPolarHBondContact O-CG1 3.25Å
83	G	85.2	Confident	91.6	Very high	20 Å²	20	55.3 Å²	55.3	21%	0.206	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	109.6	-167.9	-178.4	0	0	0	0	0	114.3	G80 L101	G80-G83 PolarHBondContact N-O 3.33Å; G80-G83 PolarHBondContact O-N 2.94Å; G83-L101 VanDerWaalsContact CA-O 3.22Å; G83-L101 WeakPolarHBondContact CA-O 3.46Å
84	V	92.3	Very high	91.5	Very high	52 Å²	52	59.7 Å²	59.7	32%	0.315	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	137.2	-178.5	-177.6	0	0	0	0	109.7	E76 A79 K100 L101	E76-V84 HydrophobicContact CG-CG1 3.98Å; A79-V84 HydrophobicContact CB-CG2 4.07Å; V84-K100 CarbonylContact O-C 3.59Å; V84-K100 WeakPolarHBondContact O-CA 3.25Å; V84-L101 PolarHBondContact N-O 3.28Å; V84-L101 VanDerWaalsContact N-O 3.09Å; V84-L101 PolarHBondContact O-N 3.24Å
85	V	95.9	Very high	91.5	Very high	32 Å²	32	57.3 Å²	57.3	19%	0.194	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	121	176.6	-169.8	0	0	0	0	109.2	L77 G78 A98 R99 K100	L77-V85 HydrophobicContact CB-CB 4.46Å; L77-V85 HydrophobicContact CB-CG1 4.33Å; L77-V85 HydrophobicContact CD1-CG1 4.19Å; L77-V85 PolarHBondContact N-O 2.89Å; G78-V85 PolarHBondContact N-O 3.37Å; G78-V85 PolarHBondContact O-N 3.14Å; V85-A98 HydrophobicContact CG1-CB 4.15Å; V85-R99 WeakPolarHBondContact CA-O 3.48Å; V85-K100 HydrophobicContact CG2-CB 4.05Å; V85-K100 HydrophobicContact CG2-CD 4.18Å; V85-K100 HydrophobicContact CG2-CG 3.96Å
86	N	97.1	Very high	91.5	Very high	36 Å²	36	56.8 Å²	56.8	19%	0.193	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	139.8	178.8	-70.6	-45.4	0	0	0	111.1	E76 V88 R99 L101	E76-N86 WeakPolarHBondContact CA-OD1 3.35Å; N86-V88 HydrophobicContact CB-CG1 4.07Å; N86-R99 PolarHBondContact N-O 2.95Å; N86-R99 PolarHBondContact O-N 3.03Å; N86-L101 VanDerWaalsContact ND2-CD1 3.3Å; N86-L101 WeakPolarHBondContact ND2-CD1 3.38Å
87	K	98.3	Very high	91.6	Very high	54 Å²	54	51 Å²	51	24%	0.235	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	123.9	162.6	-170.5	175.5	-173.8	159.7	0	108.1	I74 C75 L77 V96 H148	I74-K87 HydrophobicContact CB-CB 4.3Å; I74-K87 HydrophobicContact CB-CD 4.46Å; I74-K87 HydrophobicContact CB-CG 4.2Å; I74-K87 WeakPolarHBondContact CB-O 3.41Å; I74-K87 HydrophobicContact CD1-CD 4.47Å; I74-K87 HydrophobicContact CD1-CG 4.08Å; I74-K87 HydrophobicContact CG2-CD 4.23Å; I74-K87 PolarHBondContact N-O 2.93Å; C75-K87 PolarHBondContact N-O 2.91Å; C75-K87 WeakPolarHBondContact O-CB 3.49Å; C75-K87 PolarHBondContact O-N 3.05Å; L77-K87 HydrophobicContact CD1-CB 3.98Å; L77-K87 HydrophobicContact CD2-CB 3.96Å; L77-K87 HydrophobicContact CD2-CD 4.49Å; L77-K87 HydrophobicContact CG-CB 3.87Å; K87-V96 HydrophobicContact CD-CG1 4.33Å; K87-V96 HydrophobicContact CG-CG1 3.88Å; K87-H148 WeakPolarHBondContact CD-NE2 3.46Å; K87-H148 VanDerWaalsContact CE-NE2 3.28Å; K87-H148 WeakPolarHBondContact CE-NE2 3.11Å; K87-H148 PolarHBondContact NZ-CE1 3.07Å; K87-H148 VanDerWaalsContact NZ-CE1 3.28Å; K87-H148 PolarHBondContact NZ-NE2 3.36Å; K87-H148 VanDerWaalsContact NZ-NE2 3.14Å
88	V	98.4	Very high	91.7	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.03	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	155	-177.3	-59.3	0	0	0	0	110.6	F71 H72 N86 V96 M97 R99	F71-V88 HydrophobicContact CB-CB 4.37Å; F71-V88 HydrophobicContact CD1-CB 4.07Å; F71-V88 HydrophobicContact CD1-CG2 3.52Å; F71-V88 HydrophobicContact CE1-CG2 4.02Å; F71-V88 HydrophobicContact CG-CG2 4.36Å; H72-V88 CarbonylContact O-C 3.56Å; H72-V88 WeakPolarHBondContact O-CA 3.36Å; N86-V88 HydrophobicContact CB-CG1 4.07Å; V88-V96 CarbonylContact O-C 3.54Å; V88-V96 WeakPolarHBondContact O-CA 3.49Å; V88-M97 HydrophobicContact CG2-CB 4.01Å; V88-M97 PolarHBondContact N-O 3.47Å; V88-M97 PolarHBondContact O-N 2.97Å; V88-R99 HydrophobicContact CG1-CB 3.97Å; V88-R99 HydrophobicContact CG2-CB 3.7Å
89	R	98.3	Very high	92.1	Very high	108 Å²	108	48 Å²	48	41%	0.408	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.9	167.2	-177.5	173.1	-68.1	137.8	0.2	109.1	H72 I74 K91 L95	H72-R89 HydrophobicContact CB-CB 4.48Å; H72-R89 PolarHBondContact N-O 2.86Å; H72-R89 PolarHBondContact O-N 3.31Å; I74-R89 HydrophobicContact CD1-CB 4.08Å; R89-K91 PolarHBondContact O-N 3.01Å; R89-L95 WeakPolarHBondContact CA-O 3.39Å
90	H	97.9	Very high	92.5	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.019	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	117.3	170.9	-176	-123.3	0	0	0	109	F71 S93 R94 L95 M97	F71-H90 HydrophobicContact CD1-CB 4.29Å; F71-H90 HydrophobicContact CE1-CB 4.01Å; F71-H90 AromaticContact CE1-CD2 3.82Å; F71-H90 AromaticContact CZ-CD2 3.97Å; H90-S93 PolarHBondContact ND1-N 3.42Å; H90-S93 PolarHBondContact ND1-OG 3.45Å; H90-R94 WeakPolarHBondContact O-CA 3.31Å; H90-R94 PolarHBondContact O-N 3.01Å; H90-L95 PolarHBondContact N-O 2.76Å; H90-M97 HydrophobicContact CB-CE 3.83Å; H90-M97 HydrophobicContact CB-SD 4.25Å
91	K	96.9	Very high	93.4	Very high	97 Å²	97	44.5 Å²	44.5	42%	0.422	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-45.7	-172.1	-63.7	165.5	-171.4	168.5	0	112.5	D69 D70 R89 R94	D69-K91 WeakPolarHBondContact O-CE 3.47Å; D69-K91 PolarHBondContact O-NZ 3.35Å; D70-K91 WeakPolarHBondContact O-CB 3.46Å; D70-K91 VanDerWaalsContact O-CG 3.25Å; D70-K91 WeakPolarHBondContact O-CG 3.29Å; D70-K91 PolarHBondContact O-N 3.42Å; R89-K91 PolarHBondContact O-N 3.01Å; K91-R94 WeakPolarHBondContact O-CD 3.3Å; K91-R94 PolarHBondContact O-NE 3.5Å
92	P	96.6	Very high	94.5	Very high	84 Å²	84	41.2 Å²	41.2	55%	0.545	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-51.3	-178.4	-22.8	34.4	0	0	0	113.6	D70	D70-P92 HydrophobicContact CB-CG 4.29Å
93	S	95.9	Very high	95.3	Very high	23 Å²	23	45.8 Å²	45.8	16%	0.161	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-7.6	-176.2	70.7	0	0	0	0	114.2	H90 L95	H90-S93 PolarHBondContact ND1-N 3.42Å; H90-S93 PolarHBondContact ND1-OG 3.45Å; S93-L95 PolarHBondContact O-N 2.9Å; S93-L95 WeakPolarHBondContact OG-CG 3.47Å
94	R	95.8	Very high	95.1	Very high	183 Å²	183	45.8 Å²	45.8	69%	0.691	22%	0.222	S	C	*	.			trans	61.1	4.4	-174.1	-54.2	-63.3	-174.2	170.8	0.8	115.3	H90 K91	H90-R94 WeakPolarHBondContact O-CA 3.31Å; H90-R94 PolarHBondContact O-N 3.01Å; K91-R94 WeakPolarHBondContact O-CD 3.3Å; K91-R94 PolarHBondContact O-NE 3.5Å
95	L	96.4	Very high	94.5	Very high	25 Å²	25	52 Å²	52	13%	0.131	25%	0.247	C	C	.	.			trans	-66.8	143.6	178.8	-64.3	175.4	0	0	0	111.2	Q59 V63 R89 H90 S93 M97 Y133	Q59-L95 HydrophobicContact CB-CD1 4.1Å; Q59-L95 HydrophobicContact CB-CD2 4.26Å; Q59-L95 HydrophobicContact CG-CD2 4.19Å; V63-L95 HydrophobicContact CG2-CD1 3.57Å; R89-L95 WeakPolarHBondContact CA-O 3.39Å; H90-L95 PolarHBondContact N-O 2.76Å; S93-L95 PolarHBondContact O-N 2.9Å; S93-L95 WeakPolarHBondContact OG-CG 3.47Å; L95-M97 HydrophobicContact CB-CE 3.97Å; L95-M97 HydrophobicContact CD1-CE 4.14Å; L95-Y133 HydrophobicContact CD1-CE1 3.91Å
96	V	97.6	Very high	93.7	Very high	51 Å²	51	52.1 Å²	52.1	31%	0.309	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	129.1	169.9	176.4	0	0	0	0	108.1	I74 K87 V88 H148	I74-V96 HydrophobicContact CD1-CG1 4.37Å; I74-V96 HydrophobicContact CD1-CG2 4.43Å; K87-V96 HydrophobicContact CD-CG1 4.33Å; K87-V96 HydrophobicContact CG-CG1 3.88Å; V88-V96 CarbonylContact O-C 3.54Å; V88-V96 WeakPolarHBondContact O-CA 3.49Å; V96-H148 HydrophobicContact CG1-CB 4.21Å
97	M	98.2	Very high	93.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	158.1	-175.9	-56.8	-178.2	-178.7	0	0	110.4	V63 F71 V88 H90 L95 Y133 C145 M146	V63-M97 HydrophobicContact CG1-CE 4.2Å; V63-M97 HydrophobicContact CG2-CE 3.83Å; F71-M97 HydrophobicContact CE1-SD 3.98Å; V88-M97 HydrophobicContact CG2-CB 4.01Å; V88-M97 PolarHBondContact N-O 3.47Å; V88-M97 PolarHBondContact O-N 2.97Å; H90-M97 HydrophobicContact CB-CE 3.83Å; H90-M97 HydrophobicContact CB-SD 4.25Å; L95-M97 HydrophobicContact CB-CE 3.97Å; L95-M97 HydrophobicContact CD1-CE 4.14Å; M97-Y133 HydrophobicContact CB-CD2 4.47Å; M97-Y133 HydrophobicContact CE-CD1 4.1Å; M97-Y133 HydrophobicContact CE-CD2 3.8Å; M97-Y133 HydrophobicContact CE-CE1 4.39Å; M97-Y133 HydrophobicContact CE-CE2 4.09Å; M97-Y133 HydrophobicContact CE-CG 3.81Å; M97-Y133 HydrophobicContact CG-CD2 3.74Å; M97-Y133 HydrophobicContact CG-CE2 3.77Å; M97-Y133 HydrophobicContact SD-CD2 3.67Å; M97-Y133 HydrophobicContact SD-CE2 4.22Å; M97-Y133 HydrophobicContact SD-CG 4.05Å; M97-C145 HydrophobicContact SD-CB 4.07Å; M97-M146 WeakPolarHBondContact CA-O 3.43Å; M97-M146 WeakPolarHBondContact CB-O 3.38Å
98	A	98.1	Very high	92.7	Very high	9 Å²	9	59 Å²	59	7%	0.074	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.5	160.5	0	0	0	0	0	108.2	L77 V85 M146	L77-A98 HydrophobicContact CD1-CB 3.96Å; V85-A98 HydrophobicContact CG1-CB 4.15Å; A98-M146 PolarHBondContact N-O 2.9Å; A98-M146 PolarHBondContact O-N 2.8Å
99	R	97.4	Very high	92.2	Very high	16 Å²	16	62.1 Å²	62.1	6%	0.06	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	111.6	178.8	-179.5	178	176.6	-166.5	-5.1	109.5	D68 V85 N86 V88 S143 I144	D68-R99 IonicContact OD1-CZ 2.81Å; D68-R99 IonicContact OD1-NH1 3.28Å; D68-R99 PolarHBondContact OD1-NH1 3.36Å; D68-R99 IonicContact OD1-NH2 3.56Å; D68-R99 PolarHBondContact OD1-NH2 3.39Å; V85-R99 WeakPolarHBondContact CA-O 3.48Å; N86-R99 PolarHBondContact N-O 2.95Å; N86-R99 PolarHBondContact O-N 3.03Å; V88-R99 HydrophobicContact CG1-CB 3.97Å; V88-R99 HydrophobicContact CG2-CB 3.7Å; R99-S143 PolarHBondContact NE-OG 3.37Å; R99-S143 VanDerWaalsContact NE-OG 3.15Å; R99-S143 PolarHBondContact NH2-OG 2.75Å; R99-I144 CarbonylContact C-O 3.52Å; R99-I144 WeakPolarHBondContact CA-O 3.48Å
100	K	94.9	Very high	91.6	Very high	16 Å²	16	59.6 Å²	59.6	7%	0.07	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	126.9	174.1	-177.1	169	-178.6	176	0	109.9	G82 V84 V85 I102 S143 I144 M146 D211	G82-K100 WeakPolarHBondContact O-CE 3.12Å; V84-K100 CarbonylContact O-C 3.59Å; V84-K100 WeakPolarHBondContact O-CA 3.25Å; V85-K100 HydrophobicContact CG2-CB 4.05Å; V85-K100 HydrophobicContact CG2-CD 4.18Å; V85-K100 HydrophobicContact CG2-CG 3.96Å; K100-I102 HydrophobicContact CG-CG1 4.16Å; K100-S143 CarbonylContact O-C 3.48Å; K100-S143 WeakPolarHBondContact O-CA 3.09Å; K100-I144 HydrophobicContact CB-CB 4.35Å; K100-I144 PolarHBondContact N-O 2.9Å; K100-I144 PolarHBondContact O-N 3.05Å; K100-M146 HydrophobicContact CB-CE 4.36Å; K100-D211 IonicContact NZ-OD1 2.71Å; K100-D211 PolarHBondContact NZ-OD1 3.32Å; K100-D211 IonicContact NZ-OD2 3.52Å; K100-D211 PolarHBondContact NZ-OD2 3.26Å
101	L	93.3	Very high	91.1	Very high	28 Å²	28	62.1 Å²	62.1	15%	0.147	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	116.9	-178.8	-64.6	151	0	0	0	108.2	G83 V84 N86 E141 S143	G83-L101 VanDerWaalsContact CA-O 3.22Å; G83-L101 WeakPolarHBondContact CA-O 3.46Å; V84-L101 PolarHBondContact N-O 3.28Å; V84-L101 VanDerWaalsContact N-O 3.09Å; V84-L101 PolarHBondContact O-N 3.24Å; N86-L101 VanDerWaalsContact ND2-CD1 3.3Å; N86-L101 WeakPolarHBondContact ND2-CD1 3.38Å; L101-E141 WeakPolarHBondContact CD2-OE2 3.5Å; L101-S143 WeakPolarHBondContact CD2-OG 3.34Å
102	I	89.9	Confident	90.6	Very high	8 Å²	8	61.3 Å²	61.3	4%	0.041	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	108.1	179.6	-41.2	-171.3	0	0	0	108.1	G82 K100 L104 E141 I142 I144 L218 M222	G82-I102 WeakPolarHBondContact O-CG1 3.25Å; K100-I102 HydrophobicContact CG-CG1 4.16Å; I102-L104 HydrophobicContact CG2-CD1 3.91Å; I102-L104 HydrophobicContact CG2-CG 3.95Å; I102-L104 PolarHBondContact O-N 2.98Å; I102-E141 WeakPolarHBondContact O-CA 3.43Å; I102-I142 HydrophobicContact CB-CB 4.43Å; I102-I142 PolarHBondContact N-O 3.33Å; I102-I142 PolarHBondContact O-N 3.12Å; I102-I144 HydrophobicContact CD1-CD1 4.03Å; I102-L218 HydrophobicContact CD1-CD1 4.4Å; I102-L218 HydrophobicContact CD1-CD2 4.26Å; I102-M222 HydrophobicContact CG2-SD 4.41Å
103	H	87.6	Confident	90.2	Very high	110 Å²	110	60.5 Å²	60.5	51%	0.509	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	118.5	175.9	-172	80.2	0	0	0	110.1	E141	H103-E141 HydrophobicContact CB-CG 4.47Å; H103-E141 IonicContact ND1-OE1 2.82Å
104	L	80.4	Confident	89.8	Confident	20 Å²	20	59.4 Å²	59.4	11%	0.105	29%	0.294	C	S	.	.			trans	-142.6	111	-178.3	-73.9	170	0	0	0	110.7	I102 I106 G140 I142 L218	I102-L104 HydrophobicContact CG2-CD1 3.91Å; I102-L104 HydrophobicContact CG2-CG 3.95Å; I102-L104 PolarHBondContact O-N 2.98Å; L104-I106 VanDerWaalsContact C-N 3.33Å; L104-I106 HydrophobicContact CB-CD1 4.29Å; L104-I106 HydrophobicContact CB-CG1 4.14Å; L104-I106 HydrophobicContact CB-CG2 4.3Å; L104-I106 PolarHBondContact O-N 2.8Å; L104-G140 PolarHBondContact N-O 2.87Å; L104-I142 HydrophobicContact CD1-CD1 3.92Å; L104-L218 HydrophobicContact CD1-CD1 3.47Å; L104-L218 VanDerWaalsContact CD1-CD1 3.47Å
105	E	79.6	Confident	89.4	Confident	183 Å²	183	52.3 Å²	52.3	86%	0.855	27%	0.27	S	S	*	.			trans	-79.5	81.1	169.1	-66.4	-169.5	167.8	0	0	110.4
106	I	79.3	Confident	88.9	Confident	34 Å²	34	58.5 Å²	58.5	17%	0.174	29%	0.291	C	S	.	.			trans	-123.7	152.5	-178.2	56	171.5	0	0	0	112.2	L104 I110 R111 I114	L104-I106 VanDerWaalsContact C-N 3.33Å; L104-I106 HydrophobicContact CB-CD1 4.29Å; L104-I106 HydrophobicContact CB-CG1 4.14Å; L104-I106 HydrophobicContact CB-CG2 4.3Å; L104-I106 PolarHBondContact O-N 2.8Å; I106-I110 HydrophobicContact CD1-CB 4.47Å; I106-I110 HydrophobicContact CD1-CG2 4.1Å; I106-R111 HydrophobicContact CD1-CB 3.92Å; I106-R111 HydrophobicContact CG1-CB 4.12Å; I106-I114 HydrophobicContact CD1-CD1 3.53Å
107	K	86.6	Confident	88.4	Confident	157 Å²	157	58.4 Å²	58.4	68%	0.683	29%	0.288	S	S	*	.			trans	-59	143.8	178	-65.1	-179.8	-177.3	175.1	0	110.4	A109 I110 R111	K107-A109 PolarHBondContact O-N 2.93Å; K107-I110 PolarHBondContact O-N 2.92Å; K107-R111 PolarHBondContact O-N 2.72Å; K107-R111 VanDerWaalsContact O-N 3.09Å
108	P	87.1	Confident	87.9	Confident	77 Å²	77	58.8 Å²	58.8	50%	0.5	29%	0.289	S	S	.	.	H	α-helix	trans	-51.2	-34.4	-179.3	-30.7	35.9	0	0	0	114.8	N112	P108-N112 WeakPolarHBondContact O-CB 3.42Å; P108-N112 PolarHBondContact O-N 3.3Å; P108-N112 PolarHBondContact O-OD1 2.75Å
109	A	88.1	Confident	87.2	Confident	72 Å²	72	63.8 Å²	63.8	60%	0.595	31%	0.311	S	S	*	.	H	α-helix	trans	-64.1	-45.2	177.6	0	0	0	0	0	113	K107 N112 Q113	K107-A109 PolarHBondContact O-N 2.93Å; A109-N112 PolarHBondContact O-N 3.05Å; A109-Q113 PolarHBondContact O-N 2.8Å
110	I	86.1	Confident	86.7	Confident	54 Å²	54	65.6 Å²	65.6	28%	0.277	32%	0.324	S	S	.	.	H	α-helix	trans	-68.1	-43.5	178.6	-58.9	174.9	0	0	0	109.4	I106 K107 N112 Q113 I114	I106-I110 HydrophobicContact CD1-CB 4.47Å; I106-I110 HydrophobicContact CD1-CG2 4.1Å; K107-I110 PolarHBondContact O-N 2.92Å; I110-N112 PolarHBondContact O-N 3.23Å; I110-Q113 WeakPolarHBondContact O-CA 3.45Å; I110-Q113 WeakPolarHBondContact O-CB 3.49Å; I110-Q113 PolarHBondContact O-N 2.62Å; I110-Q113 VanDerWaalsContact O-N 3.12Å; I110-I114 HydrophobicContact CG2-CD1 4.18Å; I110-I114 WeakPolarHBondContact O-CG1 3.25Å; I110-I114 PolarHBondContact O-N 2.78Å
111	R	86.7	Confident	86.5	Confident	57 Å²	57	65.8 Å²	65.8	22%	0.215	33%	0.326	C	S	.	.	H	α-helix	trans	-54.8	-51.6	174.8	177.3	-172.8	65.8	-167.3	7.3	112.2	I106 K107 Q113 I114 I115 Y137	I106-R111 HydrophobicContact CD1-CB 3.92Å; I106-R111 HydrophobicContact CG1-CB 4.12Å; K107-R111 PolarHBondContact O-N 2.72Å; K107-R111 VanDerWaalsContact O-N 3.09Å; R111-Q113 PolarHBondContact O-N 3.15Å; R111-I114 PolarHBondContact O-N 2.98Å; R111-I114 VanDerWaalsContact O-N 3.16Å; R111-I115 WeakPolarHBondContact O-CG1 3.45Å; R111-I115 PolarHBondContact O-N 2.85Å; R111-Y137 VanDerWaalsContact CD-CD1 3.48Å; R111-Y137 VanDerWaalsContact CD-CE2 3.48Å; R111-Y137 HydrophobicContact CG-CD2 3.88Å; R111-Y137 HydrophobicContact CG-CE2 4.2Å; R111-Y137 HydrophobicContact CG-CG 4.08Å
112	N	86.7	Confident	86.2	Confident	81 Å²	81	68 Å²	68	43%	0.433	34%	0.335	S	S	.	.	H	α-helix	trans	-65.1	-30.8	-179.5	-67.1	-2.4	0	0	0	111.4	P108 A109 I110 R116	P108-N112 WeakPolarHBondContact O-CB 3.42Å; P108-N112 PolarHBondContact O-N 3.3Å; P108-N112 PolarHBondContact O-OD1 2.75Å; A109-N112 PolarHBondContact O-N 3.05Å; I110-N112 PolarHBondContact O-N 3.23Å; N112-R116 VanDerWaalsContact O-CG 3.3Å; N112-R116 WeakPolarHBondContact O-CG 3.27Å; N112-R116 PolarHBondContact O-N 3.17Å; N112-R116 VanDerWaalsContact O-N 3.13Å; N112-R116 PolarHBondContact O-NE 3.1Å
113	Q	88.6	Confident	86.2	Confident	66 Å²	66	73 Å²	73	31%	0.308	36%	0.358	S	S	.	.	H	α-helix	trans	-65.8	-47.8	171.1	179.1	172.7	-7.4	0	0	111.9	A109 I110 R111 I115 R116 E117 Q217	A109-Q113 PolarHBondContact O-N 2.8Å; I110-Q113 WeakPolarHBondContact O-CA 3.45Å; I110-Q113 WeakPolarHBondContact O-CB 3.49Å; I110-Q113 PolarHBondContact O-N 2.62Å; I110-Q113 VanDerWaalsContact O-N 3.12Å; R111-Q113 PolarHBondContact O-N 3.15Å; Q113-I115 PolarHBondContact O-N 3.01Å; Q113-R116 PolarHBondContact O-N 2.74Å; Q113-E117 HydrophobicContact CG-CG 4.42Å; Q113-E117 VanDerWaalsContact CG-OE1 3.27Å; Q113-E117 WeakPolarHBondContact CG-OE1 3.11Å; Q113-E117 PolarHBondContact NE2-OE1 2.87Å; Q113-E117 WeakPolarHBondContact O-CG 3.07Å; Q113-E117 PolarHBondContact O-N 2.89Å; Q113-Q217 HydrophobicContact CG-CG 4.15Å
114	I	87.4	Confident	86.4	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58	-48.4	176.6	-67.4	171.2	0	0	0	110.7	I106 I110 R111 R116 E117 L118 I142 Q217 L218	I106-I114 HydrophobicContact CD1-CD1 3.53Å; I110-I114 HydrophobicContact CG2-CD1 4.18Å; I110-I114 WeakPolarHBondContact O-CG1 3.25Å; I110-I114 PolarHBondContact O-N 2.78Å; R111-I114 PolarHBondContact O-N 2.98Å; R111-I114 VanDerWaalsContact O-N 3.16Å; I114-R116 VanDerWaalsContact C-N 3.28Å; I114-R116 PolarHBondContact O-N 2.76Å; I114-E117 PolarHBondContact O-N 3.38Å; I114-E117 VanDerWaalsContact O-N 3.16Å; I114-L118 HydrophobicContact CG2-CD1 3.87Å; I114-L118 HydrophobicContact CG2-CG 4.2Å; I114-L118 VanDerWaalsContact O-CG 3.32Å; I114-L118 WeakPolarHBondContact O-CG 3.34Å; I114-L118 PolarHBondContact O-N 3.49Å; I114-I142 HydrophobicContact CB-CD1 4.27Å; I114-I142 HydrophobicContact CD1-CD1 4.26Å; I114-I142 HydrophobicContact CG2-CD1 3.67Å; I114-Q217 HydrophobicContact CD1-CB 4.4Å; I114-Q217 HydrophobicContact CG1-CB 3.77Å; I114-L218 HydrophobicContact CD1-CB 4.31Å; I114-L218 HydrophobicContact CD1-CD1 4.26Å; I114-L218 HydrophobicContact CG1-CB 4.37Å; I114-L218 HydrophobicContact CG2-CB 4.1Å; I114-L218 HydrophobicContact CG2-CD1 4.28Å; I114-L218 HydrophobicContact CG2-CD2 4.46Å
115	I	87	Confident	87	Confident	34 Å²	34	68 Å²	68	17%	0.174	34%	0.336	C	S	.	.	H	α-helix	trans	-59.2	-40.2	179.1	-65.1	-64.8	0	0	0	111.4	R111 Q113 L118 Q119 I142	R111-I115 WeakPolarHBondContact O-CG1 3.45Å; R111-I115 PolarHBondContact O-N 2.85Å; Q113-I115 PolarHBondContact O-N 3.01Å; I115-L118 PolarHBondContact O-N 3.15Å; I115-Q119 WeakPolarHBondContact O-CG 3.44Å; I115-Q119 PolarHBondContact O-N 3.45Å; I115-I142 HydrophobicContact CD1-CG2 4.11Å
116	R	86.3	Confident	87.7	Confident	155 Å²	155	59.6 Å²	59.6	59%	0.585	30%	0.297	S	S	*	.	H	α-helix	trans	-65.8	-44	174.5	-75.1	-177.4	-59.9	-151.7	3.3	112.6	N112 Q113 I114 L118 Q119	N112-R116 VanDerWaalsContact O-CG 3.3Å; N112-R116 WeakPolarHBondContact O-CG 3.27Å; N112-R116 PolarHBondContact O-N 3.17Å; N112-R116 VanDerWaalsContact O-N 3.13Å; N112-R116 PolarHBondContact O-NE 3.1Å; Q113-R116 PolarHBondContact O-N 2.74Å; I114-R116 VanDerWaalsContact C-N 3.28Å; I114-R116 PolarHBondContact O-N 2.76Å; R116-L118 VanDerWaalsContact C-N 3.29Å; R116-L118 PolarHBondContact O-N 3.46Å; R116-Q119 VanDerWaalsContact O-CB 3.27Å; R116-Q119 WeakPolarHBondContact O-CB 3.26Å; R116-Q119 PolarHBondContact O-N 2.95Å; R116-Q119 VanDerWaalsContact O-N 3.08Å
117	E	87.7	Confident	88.5	Confident	50 Å²	50	58.5 Å²	58.5	23%	0.234	29%	0.292	C	S	.	.	H	α-helix	trans	-62.6	-38.5	177.3	-72.1	173.8	-167.2	0	0	111.1	Q113 I114 Q119 V120 V214 S215 G216	Q113-E117 HydrophobicContact CG-CG 4.42Å; Q113-E117 VanDerWaalsContact CG-OE1 3.27Å; Q113-E117 WeakPolarHBondContact CG-OE1 3.11Å; Q113-E117 PolarHBondContact NE2-OE1 2.87Å; Q113-E117 WeakPolarHBondContact O-CG 3.07Å; Q113-E117 PolarHBondContact O-N 2.89Å; I114-E117 PolarHBondContact O-N 3.38Å; I114-E117 VanDerWaalsContact O-N 3.16Å; E117-Q119 PolarHBondContact O-N 3.14Å; E117-V120 WeakPolarHBondContact O-CG2 3.4Å; E117-V120 PolarHBondContact O-N 2.91Å; E117-V214 WeakPolarHBondContact O-CG1 3.3Å; E117-S215 WeakPolarHBondContact OE2-CA 3.17Å; E117-S215 VanDerWaalsContact OE2-CB 3.22Å; E117-S215 WeakPolarHBondContact OE2-CB 3.3Å; E117-S215 PolarHBondContact OE2-OG 2.84Å; E117-G216 PolarHBondContact OE2-N 2.69Å
118	L	88.1	Confident	89	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-18.9	174.8	-70.3	173.3	0	0	0	113.3	I114 I115 R116 V120 L121 A135 I142 I144 L218	I114-L118 HydrophobicContact CG2-CD1 3.87Å; I114-L118 HydrophobicContact CG2-CG 4.2Å; I114-L118 VanDerWaalsContact O-CG 3.32Å; I114-L118 WeakPolarHBondContact O-CG 3.34Å; I114-L118 PolarHBondContact O-N 3.49Å; I115-L118 PolarHBondContact O-N 3.15Å; R116-L118 VanDerWaalsContact C-N 3.29Å; R116-L118 PolarHBondContact O-N 3.46Å; L118-V120 PolarHBondContact O-N 3.09Å; L118-L121 HydrophobicContact CB-CD1 4.44Å; L118-L121 HydrophobicContact CD2-CD1 3.69Å; L118-L121 WeakPolarHBondContact O-CB 3.49Å; L118-L121 WeakPolarHBondContact O-CG 3.06Å; L118-L121 PolarHBondContact O-N 2.9Å; L118-A135 HydrophobicContact CB-CB 4.29Å; L118-A135 HydrophobicContact CD1-CB 4Å; L118-I142 HydrophobicContact CD1-CG2 4.07Å; L118-I144 HydrophobicContact CD1-CD1 4.14Å; L118-I144 HydrophobicContact CD1-CG1 4.19Å; L118-I144 HydrophobicContact CD2-CD1 4.21Å; L118-L218 HydrophobicContact CD2-CD2 4.43Å
119	Q	83.4	Confident	89.5	Confident	115 Å²	115	48.7 Å²	48.7	54%	0.537	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-62.8	-25.9	176.7	-67.8	177.3	-33.5	0	0	112.6	I115 R116 E117 L121 H122	I115-Q119 WeakPolarHBondContact O-CG 3.44Å; I115-Q119 PolarHBondContact O-N 3.45Å; R116-Q119 VanDerWaalsContact O-CB 3.27Å; R116-Q119 WeakPolarHBondContact O-CB 3.26Å; R116-Q119 PolarHBondContact O-N 2.95Å; R116-Q119 VanDerWaalsContact O-N 3.08Å; E117-Q119 PolarHBondContact O-N 3.14Å; Q119-L121 PolarHBondContact O-N 3.31Å; Q119-L121 VanDerWaalsContact O-N 3.14Å; Q119-H122 WeakPolarHBondContact O-CB 3.34Å; Q119-H122 PolarHBondContact O-N 3.2Å
120	V	86.9	Confident	90	Very high	54 Å²	54	45.6 Å²	45.6	33%	0.327	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-58.1	-26.9	174.5	176.9	0	0	0	0	111.5	E117 L118 H122 E123 C124 I189 V214	E117-V120 WeakPolarHBondContact O-CG2 3.4Å; E117-V120 PolarHBondContact O-N 2.91Å; L118-V120 PolarHBondContact O-N 3.09Å; V120-H122 PolarHBondContact O-N 3.48Å; V120-E123 PolarHBondContact O-N 3.35Å; V120-C124 PolarHBondContact O-N 3.12Å; V120-I189 HydrophobicContact CG1-CD1 4.02Å; V120-V214 HydrophobicContact CB-CG1 3.78Å; V120-V214 HydrophobicContact CG1-CG1 4.16Å
121	L	89.6	Confident	90.5	Very high	19 Å²	19	43.3 Å²	43.3	10%	0.099	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-62.3	-23.9	174.2	-65.7	171.4	0	0	0	113	L118 Q119 E123 C124 F132 F212 V214	L118-L121 HydrophobicContact CB-CD1 4.44Å; L118-L121 HydrophobicContact CD2-CD1 3.69Å; L118-L121 WeakPolarHBondContact O-CB 3.49Å; L118-L121 WeakPolarHBondContact O-CG 3.06Å; L118-L121 PolarHBondContact O-N 2.9Å; Q119-L121 PolarHBondContact O-N 3.31Å; Q119-L121 VanDerWaalsContact O-N 3.14Å; L121-E123 PolarHBondContact O-N 3.43Å; L121-C124 PolarHBondContact O-N 3.29Å; L121-F132 HydrophobicContact CB-CB 4.04Å; L121-F132 HydrophobicContact CB-CD1 3.57Å; L121-F132 HydrophobicContact CB-CD2 3.72Å; L121-F132 HydrophobicContact CB-CE1 3.77Å; L121-F132 HydrophobicContact CB-CE2 3.92Å; L121-F132 HydrophobicContact CB-CG 3.51Å; L121-F132 HydrophobicContact CB-CZ 3.94Å; L121-F132 HydrophobicContact CD1-CD2 3.78Å; L121-F132 HydrophobicContact CD1-CE2 3.57Å; L121-F132 HydrophobicContact CD1-CG 4.45Å; L121-F132 HydrophobicContact CD1-CZ 4.1Å; L121-F132 HydrophobicContact CG-CD2 4.36Å; L121-F132 HydrophobicContact CG-CE2 4.4Å; L121-F212 HydrophobicContact CD2-CD2 4.38Å; L121-F212 HydrophobicContact CD2-CE1 4.03Å; L121-F212 HydrophobicContact CD2-CE2 3.44Å; L121-F212 VanDerWaalsContact CD2-CE2 3.44Å; L121-F212 HydrophobicContact CD2-CZ 3.21Å; L121-V214 HydrophobicContact CD2-CB 4.35Å; L121-V214 HydrophobicContact CD2-CG2 3.46Å; L121-V214 VanDerWaalsContact CD2-CG2 3.46Å; L121-V214 HydrophobicContact CG-CB 4.46Å; L121-V214 HydrophobicContact CG-CG1 4.45Å; L121-V214 HydrophobicContact CG-CG2 4.06Å
122	H	88.2	Confident	91	Very high	76 Å²	76	40.9 Å²	40.9	35%	0.352	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-64.1	-27.9	173.8	-77.8	-76.2	0	0	0	112.6	K60 Q119 V120 N125 F132 Y133	K60-H122 WeakPolarHBondContact CE-ND1 3.46Å; K60-H122 PolarHBondContact NZ-O 2.94Å; K60-H122 VanDerWaalsContact NZ-O 3.14Å; Q119-H122 WeakPolarHBondContact O-CB 3.34Å; Q119-H122 PolarHBondContact O-N 3.2Å; V120-H122 PolarHBondContact O-N 3.48Å; H122-N125 PolarHBondContact O-ND2 3.34Å; H122-F132 HydrophobicContact CB-CD1 4.5Å; H122-F132 AromaticContact CD2-CE1 3.55Å; H122-F132 AromaticContact CE1-CE1 3.75Å; H122-F132 AromaticContact CG-CD1 3.88Å; H122-F132 AromaticContact CG-CE1 3.82Å; H122-F132 AromaticContact ND1-CD1 3.84Å; H122-F132 AromaticContact ND1-CE1 3.94Å; H122-F132 AromaticContact NE2-CE1 3.5Å; H122-Y133 PolarHBondContact CE1-O 2.8Å
123	E	88.8	Confident	91.4	Very high	112 Å²	112	37.7 Å²	37.7	52%	0.523	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-17.7	-178.2	-56.3	-174.3	179.4	0	0	112.5	V120 L121 N125 Y182 H187	V120-E123 PolarHBondContact O-N 3.35Å; L121-E123 PolarHBondContact O-N 3.43Å; E123-N125 VanDerWaalsContact C-ND2 3.26Å; E123-N125 PolarHBondContact O-N 2.96Å; E123-N125 PolarHBondContact O-ND2 3.26Å; E123-N125 VanDerWaalsContact O-ND2 3.09Å; E123-Y182 PolarHBondContact O-OH 3.07Å; E123-H187 PolarHBondContact O-CE1 2.77Å
124	C	91.4	Very high	91.7	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.014	17%	0.165	C	C	.	.			trans	-75.6	87.7	175.8	-67.5	0	0	0	0	110.9	V120 L121 I129 Y182 F212	V120-C124 PolarHBondContact O-N 3.12Å; L121-C124 PolarHBondContact O-N 3.29Å; C124-I129 HydrophobicContact CB-CG2 4.37Å; C124-Y182 HydrophobicContact CB-CE1 4.49Å; C124-F212 HydrophobicContact CB-CZ 4.05Å
125	N	92.6	Very high	92	Very high	24 Å²	24	36 Å²	36	13%	0.128	18%	0.175	C	C	.	.			trans	-125.4	105.5	179.6	-54.3	-78.3	0	0	0	109	L53 L57 H122 E123 Y182	L53-N125 HydrophobicContact CD1-CB 4.26Å; L57-N125 HydrophobicContact CD2-CB 4.43Å; L57-N125 WeakPolarHBondContact CD2-OD1 3.46Å; H122-N125 PolarHBondContact O-ND2 3.34Å; E123-N125 VanDerWaalsContact C-ND2 3.26Å; E123-N125 PolarHBondContact O-N 2.96Å; E123-N125 PolarHBondContact O-ND2 3.26Å; E123-N125 VanDerWaalsContact O-ND2 3.09Å; N125-Y182 PolarHBondContact N-OH 2.9Å; N125-Y182 PolarHBondContact O-OH 3.19Å
126	S	95.1	Very high	92.3	Very high	6 Å²	6	35.6 Å²	35.6	4%	0.042	17%	0.172	C	C	.	.			trans	-152.7	147.6	-177.4	166.2	0	0	0	0	108.8	Y128 I129	S126-Y128 PolarHBondContact O-N 3.32Å; S126-Y128 VanDerWaalsContact O-N 3.08Å; S126-Y128 PolarHBondContact OG-N 2.81Å; S126-I129 PolarHBondContact O-N 2.86Å; S126-I129 VanDerWaalsContact O-O 3.11Å
127	P	96.3	Very high	92.6	Very high	11 Å²	11	31.6 Å²	31.6	7%	0.071	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-11.7	175.5	31.3	-41	0	0	0	113.6	L45 Q49 K208	L45-P127 VanDerWaalsContact CD2-CD 3.49Å; L45-P127 HydrophobicContact CD2-CG 3.49Å; L45-P127 VanDerWaalsContact CD2-CG 3.49Å; Q49-P127 HydrophobicContact CB-CB 4.24Å; Q49-P127 HydrophobicContact CG-CB 4.11Å; Q49-P127 HydrophobicContact CG-CG 4.48Å; P127-K208 VanDerWaalsContact O-CE 3.25Å; P127-K208 WeakPolarHBondContact O-CE 3.44Å; P127-K208 WeakPolarHBondContact O-CG 3.17Å
128	Y	97.8	Very high	92.8	Very high	25 Å²	25	30.7 Å²	30.7	10%	0.098	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	5.1	-180	-48.2	-69.5	0	0	0	113.4	Q49 S126 A175 R178 K208 L209	Q49-Y128 PolarHBondContact NE2-OH 2.84Å; S126-Y128 PolarHBondContact O-N 3.32Å; S126-Y128 VanDerWaalsContact O-N 3.08Å; S126-Y128 PolarHBondContact OG-N 2.81Å; Y128-A175 HydrophobicContact CD1-CB 3.84Å; Y128-A175 HydrophobicContact CE1-CB 4.34Å; Y128-R178 HydrophobicContact CD1-CB 4.33Å; Y128-R178 HydrophobicContact CD2-CB 3.43Å; Y128-R178 VanDerWaalsContact CD2-CB 3.43Å; Y128-R178 HydrophobicContact CD2-CG 4.49Å; Y128-R178 HydrophobicContact CE1-CB 4.35Å; Y128-R178 HydrophobicContact CE2-CB 3.48Å; Y128-R178 VanDerWaalsContact CE2-CB 3.48Å; Y128-R178 HydrophobicContact CE2-CG 4.09Å; Y128-R178 HydrophobicContact CG-CB 3.89Å; Y128-R178 VanDerWaalsContact OH-CD 3.27Å; Y128-R178 WeakPolarHBondContact OH-CD 3.39Å; Y128-R178 PolarHBondContact OH-NH1 3.45Å; Y128-K208 CarbonylContact O-C 3.46Å; Y128-K208 WeakPolarHBondContact O-CA 3.42Å; Y128-L209 PolarHBondContact O-N 3Å
129	I	97.7	Very high	92.8	Very high	2 Å²	2	37 Å²	37	1%	0.01	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-122.6	131.3	178	-57.2	-61.3	0	0	0	108.6	C124 S126 G131 Y182 L183 L209 F212	C124-I129 HydrophobicContact CB-CG2 4.37Å; S126-I129 PolarHBondContact O-N 2.86Å; S126-I129 VanDerWaalsContact O-O 3.11Å; I129-G131 PolarHBondContact O-N 2.89Å; I129-Y182 HydrophobicContact CD1-CD1 4.45Å; I129-Y182 HydrophobicContact CG1-CD1 3.72Å; I129-Y182 HydrophobicContact CG1-CE1 4.1Å; I129-L183 HydrophobicContact CD1-CD1 3.95Å; I129-L183 HydrophobicContact CD1-CD2 4.01Å; I129-L183 HydrophobicContact CD1-CG 3.79Å; I129-L183 HydrophobicContact CG1-CD2 4.48Å; I129-L209 HydrophobicContact CD1-CB 4.12Å; I129-F212 HydrophobicContact CG2-CD1 4.48Å; I129-F212 HydrophobicContact CG2-CE1 3.48Å; I129-F212 VanDerWaalsContact CG2-CE1 3.48Å; I129-F212 HydrophobicContact CG2-CZ 3.81Å
130	V	97.8	Very high	92.9	Very high	8 Å²	8	32.4 Å²	32.4	5%	0.048	17%	0.174	C	C	.	.			trans	-60.5	124.2	179	173.6	0	0	0	0	109.5	F132 M146 E147 M149 L200 K208 L209 C210	V130-F132 PolarHBondContact O-N 3.46Å; V130-M146 HydrophobicContact CG1-CB 3.96Å; V130-M146 HydrophobicContact CG1-SD 4.45Å; V130-E147 WeakPolarHBondContact CA-OE1 3.44Å; V130-E147 HydrophobicContact CG1-CG 3.68Å; V130-M149 HydrophobicContact CG2-CG 4.32Å; V130-L200 HydrophobicContact CG2-CB 4.32Å; V130-L200 HydrophobicContact CG2-CD1 3.99Å; V130-L200 HydrophobicContact CG2-CG 4.33Å; V130-K208 HydrophobicContact CG2-CB 3.54Å; V130-L209 WeakPolarHBondContact CG2-O 3.38Å; V130-L209 PolarHBondContact N-O 2.8Å; V130-C210 HydrophobicContact CB-CB 4.12Å; V130-C210 HydrophobicContact CG2-CB 3.85Å
131	G	96.7	Very high	93.1	Very high	5 Å²	5	33 Å²	33	5%	0.052	17%	0.173	C	C	.	.			trans	-59.1	132.7	-178	0	0	0	0	0	112.5	F56 I129 M146 E147	F56-G131 VanDerWaalsContact CZ-C 3.46Å; I129-G131 PolarHBondContact O-N 2.89Å; G131-M146 CarbonylContact O-C 3.58Å; G131-M146 VanDerWaalsContact O-CA 3.27Å; G131-M146 WeakPolarHBondContact O-CA 3.4Å; G131-E147 PolarHBondContact N-OE1 3.36Å; G131-E147 PolarHBondContact O-N 3.06Å
132	F	96.4	Very high	93.2	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.026	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.2	-178.8	178.5	-102.6	0	0	0	111.4	K60 L121 H122 V130 G134 A135 I144	K60-F132 WeakPolarHBondContact CD-O 3.49Å; K60-F132 WeakPolarHBondContact CE-O 3.3Å; K60-F132 PolarHBondContact NZ-O 2.89Å; L121-F132 HydrophobicContact CB-CB 4.04Å; L121-F132 HydrophobicContact CB-CD1 3.57Å; L121-F132 HydrophobicContact CB-CD2 3.72Å; L121-F132 HydrophobicContact CB-CE1 3.77Å; L121-F132 HydrophobicContact CB-CE2 3.92Å; L121-F132 HydrophobicContact CB-CG 3.51Å; L121-F132 HydrophobicContact CB-CZ 3.94Å; L121-F132 HydrophobicContact CD1-CD2 3.78Å; L121-F132 HydrophobicContact CD1-CE2 3.57Å; L121-F132 HydrophobicContact CD1-CG 4.45Å; L121-F132 HydrophobicContact CD1-CZ 4.1Å; L121-F132 HydrophobicContact CG-CD2 4.36Å; L121-F132 HydrophobicContact CG-CE2 4.4Å; H122-F132 HydrophobicContact CB-CD1 4.5Å; H122-F132 AromaticContact CD2-CE1 3.55Å; H122-F132 AromaticContact CE1-CE1 3.75Å; H122-F132 AromaticContact CG-CD1 3.88Å; H122-F132 AromaticContact CG-CE1 3.82Å; H122-F132 AromaticContact ND1-CD1 3.84Å; H122-F132 AromaticContact ND1-CE1 3.94Å; H122-F132 AromaticContact NE2-CE1 3.5Å; V130-F132 PolarHBondContact O-N 3.46Å; F132-G134 VanDerWaalsContact CE1-CA 3.49Å; F132-G134 VanDerWaalsContact CZ-CA 3.49Å; F132-A135 HydrophobicContact CE2-CB 4.14Å; F132-A135 HydrophobicContact CZ-CB 3.77Å; F132-I144 HydrophobicContact CD2-CG2 4.25Å; F132-I144 HydrophobicContact CE2-CG2 3.91Å
133	Y	96.2	Very high	93.5	Very high	15 Å²	15	28.5 Å²	28.5	6%	0.059	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-44	174.8	-72.6	-66.1	0	0	0	112.2	F56 K60 V63 L95 M97 H122 C145	F56-Y133 HydrophobicContact CE2-CD1 4.43Å; F56-Y133 AromaticContact CE2-CE1 3.77Å; F56-Y133 HydrophobicContact CE2-CE1 3.77Å; F56-Y133 AromaticContact CE2-CE2 3.99Å; F56-Y133 HydrophobicContact CE2-CE2 3.99Å; F56-Y133 AromaticContact CE2-CZ 3.51Å; F56-Y133 HydrophobicContact CZ-CD1 4.42Å; F56-Y133 HydrophobicContact CZ-CE1 4.15Å; K60-Y133 HydrophobicContact CB-CD1 4.08Å; K60-Y133 HydrophobicContact CB-CE1 4.09Å; K60-Y133 HydrophobicContact CG-CD1 4.18Å; V63-Y133 HydrophobicContact CB-CD1 4.45Å; V63-Y133 HydrophobicContact CG2-CD1 3.81Å; V63-Y133 HydrophobicContact CG2-CE1 4.09Å; L95-Y133 HydrophobicContact CD1-CE1 3.91Å; M97-Y133 HydrophobicContact CB-CD2 4.47Å; M97-Y133 HydrophobicContact CE-CD1 4.1Å; M97-Y133 HydrophobicContact CE-CD2 3.8Å; M97-Y133 HydrophobicContact CE-CE1 4.39Å; M97-Y133 HydrophobicContact CE-CE2 4.09Å; M97-Y133 HydrophobicContact CE-CG 3.81Å; M97-Y133 HydrophobicContact CG-CD2 3.74Å; M97-Y133 HydrophobicContact CG-CE2 3.77Å; M97-Y133 HydrophobicContact SD-CD2 3.67Å; M97-Y133 HydrophobicContact SD-CE2 4.22Å; M97-Y133 HydrophobicContact SD-CG 4.05Å; H122-Y133 PolarHBondContact CE1-O 2.8Å; Y133-C145 PolarHBondContact N-O 2.85Å
134	G	94.8	Very high	93.8	Very high	5 Å²	5	23.7 Å²	23.7	5%	0.052	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.5	168.7	-178.7	0	0	0	0	0	113.1	F132 C145	F132-G134 VanDerWaalsContact CE1-CA 3.49Å; F132-G134 VanDerWaalsContact CZ-CA 3.49Å; G134-C145 PolarHBondContact N-O 2.97Å; G134-C145 PolarHBondContact O-N 2.87Å
135	A	94	Very high	94	Very high	25 Å²	25	23.6 Å²	23.6	21%	0.207	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	144.8	173.6	0	0	0	0	0	110.7	L118 F132 S143 I144	L118-A135 HydrophobicContact CB-CB 4.29Å; L118-A135 HydrophobicContact CD1-CB 4Å; F132-A135 HydrophobicContact CE2-CB 4.14Å; F132-A135 HydrophobicContact CZ-CB 3.77Å; A135-S143 CarbonylContact C-O 3.48Å; A135-S143 WeakPolarHBondContact CA-O 3.33Å; A135-S143 WeakPolarHBondContact CB-O 3.46Å; A135-I144 HydrophobicContact CB-CG1 4.2Å
136	F	93.3	Very high	94.2	Very high	25 Å²	25	23.5 Å²	23.5	11%	0.11	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	170.2	178.4	66.2	-85	0	0	0	110.4	L66 D68 F71 S143	L66-F136 HydrophobicContact CB-CD1 3.71Å; L66-F136 HydrophobicContact CB-CE1 3.92Å; D68-F136 HydrophobicContact CB-CE2 4.09Å; F71-F136 HydrophobicContact CD2-CZ 4.21Å; F71-F136 AromaticContact CE2-CE1 3.63Å; F71-F136 HydrophobicContact CE2-CE1 3.63Å; F71-F136 AromaticContact CE2-CZ 3.72Å; F71-F136 HydrophobicContact CE2-CZ 3.72Å; F71-F136 HydrophobicContact CZ-CE1 4.25Å; F136-S143 PolarHBondContact N-O 2.87Å; F136-S143 PolarHBondContact O-N 3.26Å
137	Y	91.8	Very high	94.3	Very high	71 Å²	71	23.7 Å²	23.7	28%	0.278	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132	175.2	175.9	-89.3	0	0	0	110.2	R111 G140 E141 I142	R111-Y137 VanDerWaalsContact CD-CD1 3.48Å; R111-Y137 VanDerWaalsContact CD-CE2 3.48Å; R111-Y137 HydrophobicContact CG-CD2 3.88Å; R111-Y137 HydrophobicContact CG-CE2 4.2Å; R111-Y137 HydrophobicContact CG-CG 4.08Å; Y137-G140 VanDerWaalsContact CE2-C 3.5Å; Y137-G140 VanDerWaalsContact OH-CA 3.26Å; Y137-G140 WeakPolarHBondContact OH-CA 3.26Å; Y137-E141 WeakPolarHBondContact CA-O 3.29Å; Y137-E141 VanDerWaalsContact CD2-O 3.24Å; Y137-E141 WeakPolarHBondContact CD2-O 3.21Å; Y137-I142 HydrophobicContact CD2-CG1 3.92Å
138	S	91.5	Very high	94.4	Very high	32 Å²	32	25.1 Å²	25.1	22%	0.224	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	139.9	172.5	-156.9	0	0	0	0	108.9	G140 E141	S138-G140 VanDerWaalsContact C-N 3.31Å; S138-G140 PolarHBondContact O-N 2.87Å; S138-G140 VanDerWaalsContact O-N 3.08Å; S138-E141 PolarHBondContact N-O 3.08Å; S138-E141 PolarHBondContact O-N 2.86Å
139	D	87.9	Confident	94.4	Very high	138 Å²	138	24.6 Å²	24.6	74%	0.738	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	40.5	166.1	-52.4	-57.9	0	0	0	116.6
140	G	86.5	Confident	94.3	Very high	19 Å²	19	27.5 Å²	27.5	20%	0.196	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	91	-4.4	179.4	0	0	0	0	0	114.6	L104 Y137 S138	L104-G140 PolarHBondContact N-O 2.87Å; Y137-G140 VanDerWaalsContact CE2-C 3.5Å; Y137-G140 VanDerWaalsContact OH-CA 3.26Å; Y137-G140 WeakPolarHBondContact OH-CA 3.26Å; S138-G140 VanDerWaalsContact C-N 3.31Å; S138-G140 PolarHBondContact O-N 2.87Å; S138-G140 VanDerWaalsContact O-N 3.08Å
141	E	90.7	Very high	94.2	Very high	67 Å²	67	27.1 Å²	27.1	31%	0.313	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.9	-171.3	-56	-168.9	145.4	0	0	112.3	L101 I102 H103 Y137 S138	L101-E141 WeakPolarHBondContact CD2-OE2 3.5Å; I102-E141 WeakPolarHBondContact O-CA 3.43Å; H103-E141 HydrophobicContact CB-CG 4.47Å; H103-E141 IonicContact ND1-OE1 2.82Å; Y137-E141 WeakPolarHBondContact CA-O 3.29Å; Y137-E141 VanDerWaalsContact CD2-O 3.24Å; Y137-E141 WeakPolarHBondContact CD2-O 3.21Å; S138-E141 PolarHBondContact N-O 3.08Å; S138-E141 PolarHBondContact O-N 2.86Å
142	I	91.4	Very high	94.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	123.8	166.3	-61	-178.2	0	0	0	107.9	I102 L104 I114 I115 L118 Y137 I144	I102-I142 HydrophobicContact CB-CB 4.43Å; I102-I142 PolarHBondContact N-O 3.33Å; I102-I142 PolarHBondContact O-N 3.12Å; L104-I142 HydrophobicContact CD1-CD1 3.92Å; I114-I142 HydrophobicContact CB-CD1 4.27Å; I114-I142 HydrophobicContact CD1-CD1 4.26Å; I114-I142 HydrophobicContact CG2-CD1 3.67Å; I115-I142 HydrophobicContact CD1-CG2 4.11Å; L118-I142 HydrophobicContact CD1-CG2 4.07Å; Y137-I142 HydrophobicContact CD2-CG1 3.92Å; I142-I144 HydrophobicContact CG2-CG1 4.29Å
143	S	94.5	Very high	94.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	127.5	174.9	-69.4	0	0	0	0	110.7	R99 K100 L101 A135 F136	R99-S143 PolarHBondContact NE-OG 3.37Å; R99-S143 VanDerWaalsContact NE-OG 3.15Å; R99-S143 PolarHBondContact NH2-OG 2.75Å; K100-S143 CarbonylContact O-C 3.48Å; K100-S143 WeakPolarHBondContact O-CA 3.09Å; L101-S143 WeakPolarHBondContact CD2-OG 3.34Å; A135-S143 CarbonylContact C-O 3.48Å; A135-S143 WeakPolarHBondContact CA-O 3.33Å; A135-S143 WeakPolarHBondContact CB-O 3.46Å; F136-S143 PolarHBondContact N-O 2.87Å; F136-S143 PolarHBondContact O-N 3.26Å
144	I	94.8	Very high	94.4	Very high	11 Å²	11	27.1 Å²	27.1	6%	0.056	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	118.1	175.1	-64.9	169.9	0	0	0	108.2	R99 K100 I102 L118 F132 A135 I142 M146	R99-I144 CarbonylContact C-O 3.52Å; R99-I144 WeakPolarHBondContact CA-O 3.48Å; K100-I144 HydrophobicContact CB-CB 4.35Å; K100-I144 PolarHBondContact N-O 2.9Å; K100-I144 PolarHBondContact O-N 3.05Å; I102-I144 HydrophobicContact CD1-CD1 4.03Å; L118-I144 HydrophobicContact CD1-CD1 4.14Å; L118-I144 HydrophobicContact CD1-CG1 4.19Å; L118-I144 HydrophobicContact CD2-CD1 4.21Å; F132-I144 HydrophobicContact CD2-CG2 4.25Å; F132-I144 HydrophobicContact CE2-CG2 3.91Å; A135-I144 HydrophobicContact CB-CG1 4.2Å; I142-I144 HydrophobicContact CG2-CG1 4.29Å; I144-M146 HydrophobicContact CG2-CG 3.83Å; I144-M146 HydrophobicContact CG2-SD 4.01Å
145	C	97.1	Very high	94.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	122.4	-177.6	-61.8	0	0	0	0	110.7	L66 F71 M97 Y133 G134	L66-C145 HydrophobicContact CD1-CB 3.75Å; F71-C145 VanDerWaalsContact CZ-SG 3.52Å; M97-C145 HydrophobicContact SD-CB 4.07Å; Y133-C145 PolarHBondContact N-O 2.85Å; G134-C145 PolarHBondContact N-O 2.97Å; G134-C145 PolarHBondContact O-N 2.87Å
146	M	96.8	Very high	94.6	Very high	22 Å²	22	30.4 Å²	30.4	11%	0.108	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	164.3	-172.2	-58.6	178.7	-66.3	0	0	111.2	M97 A98 K100 V130 G131 I144	M97-M146 WeakPolarHBondContact CA-O 3.43Å; M97-M146 WeakPolarHBondContact CB-O 3.38Å; A98-M146 PolarHBondContact N-O 2.9Å; A98-M146 PolarHBondContact O-N 2.8Å; K100-M146 HydrophobicContact CB-CE 4.36Å; V130-M146 HydrophobicContact CG1-CB 3.96Å; V130-M146 HydrophobicContact CG1-SD 4.45Å; G131-M146 CarbonylContact O-C 3.58Å; G131-M146 VanDerWaalsContact O-CA 3.27Å; G131-M146 WeakPolarHBondContact O-CA 3.4Å; I144-M146 HydrophobicContact CG2-CG 3.83Å; I144-M146 HydrophobicContact CG2-SD 4.01Å
147	E	97.1	Very high	94.8	Very high	11 Å²	11	29.2 Å²	29.2	5%	0.051	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	141.6	169.2	74.5	177	140.9	0	0	110.6	F56 V130 G131 M149 K208	F56-E147 HydrophobicContact CD2-CB 4.39Å; F56-E147 HydrophobicContact CE2-CB 3.91Å; V130-E147 WeakPolarHBondContact CA-OE1 3.44Å; V130-E147 HydrophobicContact CG1-CG 3.68Å; G131-E147 PolarHBondContact N-OE1 3.36Å; G131-E147 PolarHBondContact O-N 3.06Å; E147-M149 HydrophobicContact CG-CG 4.49Å; E147-M149 HydrophobicContact CG-SD 4.08Å; E147-K208 WeakPolarHBondContact OE1-CD 3.45Å; E147-K208 WeakPolarHBondContact OE1-CE 3.01Å; E147-K208 IonicContact OE1-NZ 3.11Å; E147-K208 PolarHBondContact OE1-NZ 3.28Å; E147-K208 IonicContact OE2-NZ 3.84Å; E147-K208 PolarHBondContact OE2-NZ 2.87Å; E147-K208 VanDerWaalsContact OE2-NZ 3.17Å
148	H	97.6	Very high	95	Very high	41 Å²	41	26.5 Å²	26.5	19%	0.19	15%	0.147	C	C	.	.			trans	-85.6	119.9	177.5	166.9	-87	0	0	0	110.3	K87 V96 D150	K87-H148 WeakPolarHBondContact CD-NE2 3.46Å; K87-H148 VanDerWaalsContact CE-NE2 3.28Å; K87-H148 WeakPolarHBondContact CE-NE2 3.11Å; K87-H148 PolarHBondContact NZ-CE1 3.07Å; K87-H148 VanDerWaalsContact NZ-CE1 3.28Å; K87-H148 PolarHBondContact NZ-NE2 3.36Å; K87-H148 VanDerWaalsContact NZ-NE2 3.14Å; V96-H148 HydrophobicContact CG1-CB 4.21Å; H148-D150 VanDerWaalsContact CE1-CA 3.43Å; H148-D150 WeakPolarHBondContact CE1-CA 3.42Å; H148-D150 VanDerWaalsContact CE1-CB 3.46Å; H148-D150 WeakPolarHBondContact CE1-CB 3.43Å
149	M	97.8	Very high	95.3	Very high	13 Å²	13	31.8 Å²	31.8	6%	0.064	17%	0.165	C	C	.	.			trans	-97.1	103.8	176.1	-60.5	-63.8	-75	0	0	109	V130 E147 G151 G152 L200 V201 N202 E206 K208	V130-M149 HydrophobicContact CG2-CG 4.32Å; E147-M149 HydrophobicContact CG-CG 4.49Å; E147-M149 HydrophobicContact CG-SD 4.08Å; M149-G151 VanDerWaalsContact C-N 3.29Å; M149-G151 PolarHBondContact O-N 3.02Å; M149-G152 PolarHBondContact O-N 2.7Å; M149-G152 VanDerWaalsContact O-N 3.12Å; M149-L200 HydrophobicContact CB-CB 3.8Å; M149-L200 HydrophobicContact CB-CD1 4.1Å; M149-L200 HydrophobicContact CE-CB 4.34Å; M149-L200 HydrophobicContact CG-CB 3.72Å; M149-L200 HydrophobicContact CG-CD1 3.88Å; M149-L200 HydrophobicContact CG-CG 4.47Å; M149-V201 WeakPolarHBondContact CB-O 2.96Å; M149-N202 HydrophobicContact CE-CB 3.91Å; M149-N202 HydrophobicContact SD-CB 4.23Å; M149-E206 HydrophobicContact CE-CB 4.39Å; M149-K208 HydrophobicContact CE-CB 4.13Å; M149-K208 HydrophobicContact CE-CD 4.01Å; M149-K208 HydrophobicContact CE-CG 3.92Å; M149-K208 HydrophobicContact SD-CD 4.23Å
150	D	96.1	Very high	95.7	Very high	63 Å²	63	31.3 Å²	31.3	34%	0.337	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-12.4	-168.5	65.5	-16.4	0	0	0	115.3	H148 G152 N202 S203	H148-D150 VanDerWaalsContact CE1-CA 3.43Å; H148-D150 WeakPolarHBondContact CE1-CA 3.42Å; H148-D150 VanDerWaalsContact CE1-CB 3.46Å; H148-D150 WeakPolarHBondContact CE1-CB 3.43Å; D150-G152 VanDerWaalsContact C-N 3.35Å; D150-N202 WeakPolarHBondContact OD1-CA 3.49Å; D150-N202 WeakPolarHBondContact OD1-CB 3.46Å; D150-S203 PolarHBondContact OD1-N 3.43Å; D150-S203 PolarHBondContact OD1-OG 3.46Å; D150-S203 VanDerWaalsContact OD2-CB 3.3Å; D150-S203 WeakPolarHBondContact OD2-CB 3.33Å; D150-S203 PolarHBondContact OD2-OG 2.86Å
151	G	96.4	Very high	96.1	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.01	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-2.8	170.4	0	0	0	0	0	113.6	M149 V201	M149-G151 VanDerWaalsContact C-N 3.29Å; M149-G151 PolarHBondContact O-N 3.02Å; G151-V201 CarbonylContact C-O 3.59Å; G151-V201 WeakPolarHBondContact CA-O 3.19Å; G151-V201 PolarHBondContact N-O 2.69Å
152	G	96.5	Very high	96.3	Very high	15 Å²	15	38.2 Å²	38.2	16%	0.155	18%	0.182	C	C	.	.			trans	70.6	-156.9	179.6	0	0	0	0	0	113.3	M149 D150 L200 V201	M149-G152 PolarHBondContact O-N 2.7Å; M149-G152 VanDerWaalsContact O-N 3.12Å; D150-G152 VanDerWaalsContact C-N 3.35Å; G152-L200 CarbonylContact O-C 3.6Å; G152-L200 WeakPolarHBondContact O-CA 3.14Å; G152-V201 PolarHBondContact N-O 2.96Å; G152-V201 PolarHBondContact O-N 3.35Å
153	S	97.5	Very high	96.6	Very high	10 Å²	10	42.6 Å²	42.6	7%	0.07	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-94.3	156.2	179	50.8	0	0	0	0	112.6	D155 Q156 V157 S197 I199	S153-D155 VanDerWaalsContact CB-OD1 3.23Å; S153-D155 WeakPolarHBondContact CB-OD1 3.25Å; S153-D155 PolarHBondContact O-N 3.24Å; S153-D155 PolarHBondContact OG-OD1 2.92Å; S153-Q156 VanDerWaalsContact N-OE1 3.11Å; S153-Q156 WeakPolarHBondContact O-CB 3.35Å; S153-Q156 PolarHBondContact O-N 2.84Å; S153-Q156 WeakPolarHBondContact OG-CG 3.27Å; S153-Q156 PolarHBondContact OG-OE1 3.29Å; S153-V157 WeakPolarHBondContact O-CG2 3.22Å; S153-V157 PolarHBondContact O-N 3.08Å; S153-S197 WeakPolarHBondContact CB-O 3.33Å; S153-I199 CarbonylContact C-O 3.59Å; S153-I199 WeakPolarHBondContact CA-O 3.37Å
154	L	98.3	Very high	96.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-22.8	179.8	-72.8	-172.8	0	0	0	113.9	Q156 V157 L158 I164 V172 P196 I199 V201 L259	L154-Q156 VanDerWaalsContact C-N 3.34Å; L154-V157 HydrophobicContact CD2-CB 4.37Å; L154-V157 HydrophobicContact CD2-CG2 4.38Å; L154-L158 VanDerWaalsContact O-CB 3.24Å; L154-L158 WeakPolarHBondContact O-CB 3.24Å; L154-L158 PolarHBondContact O-N 2.9Å; L154-I164 HydrophobicContact CD2-CD1 4.33Å; L154-V172 HydrophobicContact CD1-CB 4.48Å; L154-V172 HydrophobicContact CD1-CG1 3.63Å; L154-V172 HydrophobicContact CD1-CG2 3.93Å; L154-P196 HydrophobicContact CB-CB 4.18Å; L154-P196 PolarHBondContact N-O 3.18Å; L154-P196 VanDerWaalsContact N-O 3.08Å; L154-I199 HydrophobicContact CB-CB 4.42Å; L154-I199 HydrophobicContact CD1-CB 3.81Å; L154-I199 HydrophobicContact CD1-CD1 4.14Å; L154-I199 HydrophobicContact CD1-CG2 3.46Å; L154-I199 VanDerWaalsContact CD1-CG2 3.46Å; L154-I199 HydrophobicContact CG-CB 4.01Å; L154-I199 HydrophobicContact CG-CG2 3.86Å; L154-I199 PolarHBondContact N-O 2.78Å; L154-V201 HydrophobicContact CD2-CG1 3.63Å; L154-V201 HydrophobicContact CD2-CG2 4.49Å; L154-V201 HydrophobicContact CG-CG1 4.23Å; L154-L259 HydrophobicContact CB-CD2 4.09Å; L154-L259 HydrophobicContact CD1-CD1 3.98Å
155	D	96	Very high	96.9	Very high	37 Å²	37	44.4 Å²	44.4	20%	0.198	21%	0.211	C	C	.	.	H	α-helix	trans	-69.4	-33.1	171.4	79.9	-69.2	0	0	0	112.2	S153 K159 P196 S197	S153-D155 VanDerWaalsContact CB-OD1 3.23Å; S153-D155 WeakPolarHBondContact CB-OD1 3.25Å; S153-D155 PolarHBondContact O-N 3.24Å; S153-D155 PolarHBondContact OG-OD1 2.92Å; D155-K159 WeakPolarHBondContact O-CD 3.27Å; D155-K159 WeakPolarHBondContact O-CG 3.5Å; D155-K159 PolarHBondContact O-N 3.22Å; D155-K159 IonicContact OD2-NZ 3.17Å; D155-K159 PolarHBondContact OD2-NZ 3.32Å; D155-P196 HydrophobicContact CB-CB 3.96Å; D155-P196 PolarHBondContact N-O 2.95Å; D155-S197 VanDerWaalsContact OD1-CA 3.26Å; D155-S197 WeakPolarHBondContact OD1-CA 3.35Å; D155-S197 WeakPolarHBondContact OD1-CB 3.35Å
156	Q	96.4	Very high	97	Very high	63 Å²	63	45.8 Å²	45.8	29%	0.294	22%	0.218	S	C	.	.	H	α-helix	trans	-70.8	-45.9	173.7	-65.7	172.4	-30.2	0	0	109.8	L77 S153 L154 L158 K159 E160	L77-Q156 PolarHBondContact O-NE2 2.93Å; S153-Q156 VanDerWaalsContact N-OE1 3.11Å; S153-Q156 WeakPolarHBondContact O-CB 3.35Å; S153-Q156 PolarHBondContact O-N 2.84Å; S153-Q156 WeakPolarHBondContact OG-CG 3.27Å; S153-Q156 PolarHBondContact OG-OE1 3.29Å; L154-Q156 VanDerWaalsContact C-N 3.34Å; Q156-L158 VanDerWaalsContact C-N 3.28Å; Q156-L158 PolarHBondContact O-N 3.03Å; Q156-K159 WeakPolarHBondContact O-CB 3.45Å; Q156-K159 PolarHBondContact O-N 2.91Å; Q156-K159 VanDerWaalsContact O-N 3.17Å; Q156-E160 PolarHBondContact O-N 3.14Å
157	V	97.7	Very high	97	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-40.4	174.8	179.9	0	0	0	0	111.3	S153 L154 K159 E160 A161 I164 V201 W383 T387 M388	S153-V157 WeakPolarHBondContact O-CG2 3.22Å; S153-V157 PolarHBondContact O-N 3.08Å; L154-V157 HydrophobicContact CD2-CB 4.37Å; L154-V157 HydrophobicContact CD2-CG2 4.38Å; V157-K159 VanDerWaalsContact C-N 3.33Å; V157-K159 PolarHBondContact O-N 3.33Å; V157-E160 PolarHBondContact O-N 3.05Å; V157-A161 VanDerWaalsContact O-CB 3.27Å; V157-A161 WeakPolarHBondContact O-CB 3.46Å; V157-A161 PolarHBondContact O-N 3.27Å; V157-I164 HydrophobicContact CG1-CD1 4.47Å; V157-V201 HydrophobicContact CG2-CG2 3.86Å; V157-W383 HydrophobicContact CG1-CH2 3.55Å; V157-W383 HydrophobicContact CG1-CZ2 4.48Å; V157-W383 HydrophobicContact CG1-CZ3 3.98Å; V157-T387 HydrophobicContact CG1-CG2 4.15Å; V157-M388 HydrophobicContact CB-SD 4.25Å; V157-M388 HydrophobicContact CG2-CG 4.21Å; V157-M388 HydrophobicContact CG2-SD 3.83Å
158	L	97.6	Very high	97.1	Very high	14 Å²	14	49.2 Å²	49.2	7%	0.073	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-38.3	178	-174.7	62.1	0	0	0	112.4	L154 Q156 E160 R162 I164 E258 L259	L154-L158 VanDerWaalsContact O-CB 3.24Å; L154-L158 WeakPolarHBondContact O-CB 3.24Å; L154-L158 PolarHBondContact O-N 2.9Å; Q156-L158 VanDerWaalsContact C-N 3.28Å; Q156-L158 PolarHBondContact O-N 3.03Å; L158-E160 VanDerWaalsContact C-N 3.3Å; L158-E160 PolarHBondContact O-N 3.23Å; L158-R162 WeakPolarHBondContact O-CA 3.44Å; L158-R162 PolarHBondContact O-N 3.08Å; L158-I164 HydrophobicContact CD1-CG1 4.09Å; L158-E258 HydrophobicContact CD2-CG 3.95Å; L158-L259 HydrophobicContact CB-CD2 4.02Å; L158-L259 HydrophobicContact CD1-CD2 4.21Å; L158-L259 HydrophobicContact CD2-CD2 3.99Å; L158-L259 HydrophobicContact CG-CD2 4.3Å
159	K	96	Very high	97.2	Very high	142 Å²	142	47.3 Å²	47.3	62%	0.617	23%	0.225	S	C	*	.	H	α-helix	trans	-61.3	-40.1	177.7	-71.8	161.3	-173.6	152.8	0	111.5	D155 Q156 V157	D155-K159 WeakPolarHBondContact O-CD 3.27Å; D155-K159 WeakPolarHBondContact O-CG 3.5Å; D155-K159 PolarHBondContact O-N 3.22Å; D155-K159 IonicContact OD2-NZ 3.17Å; D155-K159 PolarHBondContact OD2-NZ 3.32Å; Q156-K159 WeakPolarHBondContact O-CB 3.45Å; Q156-K159 PolarHBondContact O-N 2.91Å; Q156-K159 VanDerWaalsContact O-N 3.17Å; V157-K159 VanDerWaalsContact C-N 3.33Å; V157-K159 PolarHBondContact O-N 3.33Å
160	E	96.6	Very high	97.2	Very high	128 Å²	128	46.7 Å²	46.7	60%	0.598	22%	0.222	S	C	*	.	H	α-helix	trans	-77.1	-45.9	177.9	-60.1	-54	145.5	0	0	112.3	Q156 V157 L158 R162 T387 M388	Q156-E160 PolarHBondContact O-N 3.14Å; V157-E160 PolarHBondContact O-N 3.05Å; L158-E160 VanDerWaalsContact C-N 3.3Å; L158-E160 PolarHBondContact O-N 3.23Å; E160-R162 VanDerWaalsContact C-N 3.29Å; E160-R162 PolarHBondContact O-N 3.35Å; E160-T387 HydrophobicContact CB-CG2 4.1Å; E160-M388 HydrophobicContact CB-SD 4.35Å; E160-M388 HydrophobicContact CG-SD 4.03Å
161	A	96.1	Very high	97.3	Very high	30 Å²	30	45.9 Å²	45.9	25%	0.248	22%	0.215	C	C	.	.	H	α-helix	trans	-72.1	-23.2	-178.1	0	0	0	0	0	113.4	V157 R163 W383 T387	V157-A161 VanDerWaalsContact O-CB 3.27Å; V157-A161 WeakPolarHBondContact O-CB 3.46Å; V157-A161 PolarHBondContact O-N 3.27Å; A161-R163 WeakPolarHBondContact CB-O 3.24Å; A161-R163 PolarHBondContact O-N 3.21Å; A161-W383 HydrophobicContact CB-CZ2 4.24Å; A161-T387 HydrophobicContact CB-CG2 3.78Å
162	R	95	Very high	97.4	Very high	201 Å²	201	45.9 Å²	45.9	76%	0.758	22%	0.215	S	C	*	.	S	Bend	trans	62.3	-37.5	-164.9	-53.5	-179.7	179.4	-174.4	-1.2	114.4	L158 E160 G262	L158-R162 WeakPolarHBondContact O-CA 3.44Å; L158-R162 PolarHBondContact O-N 3.08Å; E160-R162 VanDerWaalsContact C-N 3.29Å; E160-R162 PolarHBondContact O-N 3.35Å; R162-G262 WeakPolarHBondContact O-CA 3.27Å
163	R	96.4	Very high	97.5	Very high	92 Å²	92	45.1 Å²	45.1	35%	0.347	21%	0.207	S	C	.	.	S	Bend	trans	-147.4	148.2	172.2	-64.5	-172.8	-62	-147.3	-8.5	109.7	A161 I261 I277	A161-R163 WeakPolarHBondContact CB-O 3.24Å; A161-R163 PolarHBondContact O-N 3.21Å; R163-I261 WeakPolarHBondContact CD-O 3.37Å; R163-I261 WeakPolarHBondContact CG-O 3.38Å; R163-I277 VanDerWaalsContact NH1-C 3.34Å; R163-I277 PolarHBondContact NH1-O 2.91Å
164	I	98.3	Very high	97.6	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	21%	0.207	C	C	.	.			trans	-99.5	127.2	175.5	-57.4	-171.3	0	0	0	109.5	L154 V157 L158 I168 L169 L259 W383	L154-I164 HydrophobicContact CD2-CD1 4.33Å; V157-I164 HydrophobicContact CG1-CD1 4.47Å; L158-I164 HydrophobicContact CD1-CG1 4.09Å; I164-I168 HydrophobicContact CG2-CB 3.73Å; I164-I168 HydrophobicContact CG2-CG2 3.41Å; I164-I168 VanDerWaalsContact CG2-CG2 3.41Å; I164-L169 HydrophobicContact CB-CD2 3.89Å; I164-L169 HydrophobicContact CB-CG 4.13Å; I164-L169 HydrophobicContact CG2-CD2 3.65Å; I164-L169 HydrophobicContact CG2-CG 3.8Å; I164-L259 HydrophobicContact CB-CB 4.42Å; I164-L259 HydrophobicContact CD1-CB 4.16Å; I164-L259 HydrophobicContact CD1-CD2 3.53Å; I164-L259 HydrophobicContact CD1-CG 4.29Å; I164-L259 HydrophobicContact CG1-CB 4.4Å; I164-L259 HydrophobicContact CG1-CD2 4.36Å; I164-L259 PolarHBondContact N-O 3.41Å; I164-W383 HydrophobicContact CB-CH2 4.49Å; I164-W383 HydrophobicContact CD1-CH2 4.16Å; I164-W383 HydrophobicContact CG1-CH2 4.08Å; I164-W383 HydrophobicContact CG1-CZ2 4.34Å; I164-W383 HydrophobicContact CG2-CH2 3.86Å; I164-W383 HydrophobicContact CG2-CZ2 4.04Å
165	P	98.2	Very high	97.6	Very high	47 Å²	47	45.5 Å²	45.5	31%	0.305	21%	0.209	S	C	.	.			trans	-58.2	148.2	177.2	-25.3	34.8	0	0	0	113.3	E167 I168 L169	P165-E167 VanDerWaalsContact C-N 3.31Å; P165-E167 HydrophobicContact CB-CG 4.09Å; P165-E167 PolarHBondContact O-N 3.49Å; P165-I168 HydrophobicContact CB-CG1 4.15Å; P165-I168 HydrophobicContact CG-CG1 4.25Å; P165-I168 WeakPolarHBondContact O-CB 3.43Å; P165-I168 PolarHBondContact O-N 3.4Å; P165-I168 VanDerWaalsContact O-N 3.09Å; P165-L169 WeakPolarHBondContact O-CG 3.23Å; P165-L169 PolarHBondContact O-N 3.15Å
166	E	98.3	Very high	97.7	Very high	29 Å²	29	43.9 Å²	43.9	14%	0.136	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-41	-178.9	-177.8	177.6	143.8	0	0	113	I168 L169 G170 F339 T340 F343 F369 R372	E166-I168 VanDerWaalsContact C-N 3.29Å; E166-I168 PolarHBondContact O-N 2.81Å; E166-L169 CarbonylContact O-C 3.57Å; E166-L169 WeakPolarHBondContact O-CA 3.46Å; E166-L169 WeakPolarHBondContact O-CB 3.26Å; E166-L169 PolarHBondContact O-N 2.84Å; E166-L169 VanDerWaalsContact O-N 3.12Å; E166-G170 PolarHBondContact O-N 3.38Å; E166-F339 HydrophobicContact CB-CD1 4.36Å; E166-F339 WeakPolarHBondContact OE2-CA 3.39Å; E166-T340 VanDerWaalsContact OE1-CB 3.3Å; E166-T340 WeakPolarHBondContact OE1-CB 3.42Å; E166-T340 WeakPolarHBondContact OE1-CG2 3.37Å; E166-T340 PolarHBondContact OE1-OG1 3.28Å; E166-T340 PolarHBondContact OE2-N 3Å; E166-F343 HydrophobicContact CB-CD1 4.35Å; E166-F343 HydrophobicContact CG-CB 4.11Å; E166-F343 HydrophobicContact CG-CD1 3.57Å; E166-F343 HydrophobicContact CG-CE1 4.19Å; E166-F343 HydrophobicContact CG-CG 3.95Å; E166-F343 WeakPolarHBondContact OE1-CB 3.48Å; E166-F369 HydrophobicContact CG-CE2 3.9Å; E166-F369 HydrophobicContact CG-CZ 4.47Å; E166-R372 IonicContact OE1-CZ 3.57Å; E166-R372 IonicContact OE1-NH2 2.74Å; E166-R372 PolarHBondContact OE1-NH2 3.11Å
167	E	97.9	Very high	97.8	Very high	105 Å²	105	40.9 Å²	40.9	49%	0.491	19%	0.186	S	C	.	.	H	α-helix	trans	-59.6	-38.6	177.5	66.6	-166.5	-176.6	0	0	112.3	P165 G170 K171 V378	P165-E167 VanDerWaalsContact C-N 3.31Å; P165-E167 HydrophobicContact CB-CG 4.09Å; P165-E167 PolarHBondContact O-N 3.49Å; E167-G170 PolarHBondContact O-N 3.48Å; E167-K171 PolarHBondContact O-N 3.03Å; E167-V378 HydrophobicContact CB-CG1 4.49Å; E167-V378 HydrophobicContact CB-CG2 3.99Å; E167-V378 HydrophobicContact CG-CG1 4.15Å; E167-V378 HydrophobicContact CG-CG2 4.47Å
168	I	98.6	Very high	97.8	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-70.7	-41.8	175.7	-61.3	-67	0	0	0	109.7	I164 P165 E166 G170 K171 V172 V378 F380 W383	I164-I168 HydrophobicContact CG2-CB 3.73Å; I164-I168 HydrophobicContact CG2-CG2 3.41Å; I164-I168 VanDerWaalsContact CG2-CG2 3.41Å; P165-I168 HydrophobicContact CB-CG1 4.15Å; P165-I168 HydrophobicContact CG-CG1 4.25Å; P165-I168 WeakPolarHBondContact O-CB 3.43Å; P165-I168 PolarHBondContact O-N 3.4Å; P165-I168 VanDerWaalsContact O-N 3.09Å; E166-I168 VanDerWaalsContact C-N 3.29Å; E166-I168 PolarHBondContact O-N 2.81Å; I168-G170 PolarHBondContact O-N 2.82Å; I168-K171 PolarHBondContact O-N 3.17Å; I168-K171 VanDerWaalsContact O-N 3.14Å; I168-V172 WeakPolarHBondContact O-CG2 3.44Å; I168-V172 PolarHBondContact O-N 3.03Å; I168-V378 HydrophobicContact CD1-CG1 3.51Å; I168-V378 HydrophobicContact CG1-CG1 4.44Å; I168-F380 HydrophobicContact CD1-CD2 4.08Å; I168-F380 HydrophobicContact CG2-CD2 3.74Å; I168-F380 HydrophobicContact CG2-CE2 3.53Å; I168-W383 HydrophobicContact CD1-CB 3.84Å; I168-W383 HydrophobicContact CD1-CD2 3.72Å; I168-W383 HydrophobicContact CD1-CE3 3.89Å; I168-W383 HydrophobicContact CD1-CG 3.69Å; I168-W383 HydrophobicContact CG1-CD2 3.82Å; I168-W383 HydrophobicContact CG1-CE3 4.15Å; I168-W383 HydrophobicContact CG1-CG 4.04Å; I168-W383 HydrophobicContact CG2-CD2 4.22Å; I168-W383 HydrophobicContact CG2-CE3 3.74Å; I168-W383 HydrophobicContact CG2-CH2 3.87Å; I168-W383 HydrophobicContact CG2-CZ2 4.31Å; I168-W383 HydrophobicContact CG2-CZ3 3.56Å
169	L	98.8	Very high	97.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.5	-28.4	175.6	-66.9	178.4	0	0	0	112.9	I164 P165 E166 V172 S173 L256 L259 A260 F343	I164-L169 HydrophobicContact CB-CD2 3.89Å; I164-L169 HydrophobicContact CB-CG 4.13Å; I164-L169 HydrophobicContact CG2-CD2 3.65Å; I164-L169 HydrophobicContact CG2-CG 3.8Å; P165-L169 WeakPolarHBondContact O-CG 3.23Å; P165-L169 PolarHBondContact O-N 3.15Å; E166-L169 CarbonylContact O-C 3.57Å; E166-L169 WeakPolarHBondContact O-CA 3.46Å; E166-L169 WeakPolarHBondContact O-CB 3.26Å; E166-L169 PolarHBondContact O-N 2.84Å; E166-L169 VanDerWaalsContact O-N 3.12Å; L169-V172 PolarHBondContact O-N 2.98Å; L169-S173 VanDerWaalsContact O-CB 3.28Å; L169-S173 WeakPolarHBondContact O-CB 3.22Å; L169-S173 PolarHBondContact O-N 3.43Å; L169-S173 PolarHBondContact O-OG 3.28Å; L169-L256 HydrophobicContact CB-CD2 4.36Å; L169-L256 HydrophobicContact CD2-CD2 4.12Å; L169-L259 HydrophobicContact CD2-CB 3.69Å; L169-L259 HydrophobicContact CD2-CD1 4.08Å; L169-A260 HydrophobicContact CD1-CB 3.6Å; L169-F343 HydrophobicContact CB-CZ 4.27Å; L169-F343 HydrophobicContact CD1-CE1 3.98Å; L169-F343 HydrophobicContact CD1-CZ 3.73Å
170	G	98.7	Very high	97.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.6	-50.2	169.2	0	0	0	0	0	111.6	E166 E167 I168 S173 I174	E166-G170 PolarHBondContact O-N 3.38Å; E167-G170 PolarHBondContact O-N 3.48Å; I168-G170 PolarHBondContact O-N 2.82Å; G170-S173 PolarHBondContact O-N 3.43Å; G170-I174 WeakPolarHBondContact O-CG1 3.32Å; G170-I174 PolarHBondContact O-N 3.2Å
171	K	98.6	Very high	97.9	Very high	46 Å²	46	31.8 Å²	31.8	20%	0.2	15%	0.145	C	C	.	.	H	α-helix	trans	-64.4	-41	176.8	-59.2	-56.7	-174.8	-179.3	0	112.5	E167 I168 S173 I174 A175 I207 A373 E376 V378 F380	E167-K171 PolarHBondContact O-N 3.03Å; I168-K171 PolarHBondContact O-N 3.17Å; I168-K171 VanDerWaalsContact O-N 3.14Å; K171-S173 VanDerWaalsContact C-N 3.33Å; K171-S173 PolarHBondContact O-N 3.27Å; K171-I174 HydrophobicContact CD-CD1 4.41Å; K171-I174 PolarHBondContact O-N 3.4Å; K171-A175 PolarHBondContact O-N 3.36Å; K171-A175 VanDerWaalsContact O-N 3.13Å; K171-I207 HydrophobicContact CB-CD1 4.28Å; K171-A373 WeakPolarHBondContact CE-O 3.01Å; K171-A373 PolarHBondContact NZ-O 2.84Å; K171-E376 VanDerWaalsContact CE-O 3.25Å; K171-E376 WeakPolarHBondContact CE-O 3.46Å; K171-E376 PolarHBondContact NZ-O 3.47Å; K171-V378 HydrophobicContact CG-CB 4.18Å; K171-F380 HydrophobicContact CB-CD2 4.25Å
172	V	98.8	Very high	97.9	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-59.2	-45.5	172.7	173.6	0	0	0	0	110.8	L154 I168 L169 I174 A175 V176 I207 F380	L154-V172 HydrophobicContact CD1-CB 4.48Å; L154-V172 HydrophobicContact CD1-CG1 3.63Å; L154-V172 HydrophobicContact CD1-CG2 3.93Å; I168-V172 WeakPolarHBondContact O-CG2 3.44Å; I168-V172 PolarHBondContact O-N 3.03Å; L169-V172 PolarHBondContact O-N 2.98Å; V172-I174 PolarHBondContact O-N 3.09Å; V172-A175 PolarHBondContact O-N 3.01Å; V172-V176 HydrophobicContact CG1-CG2 4.17Å; V172-V176 WeakPolarHBondContact O-CG2 3.32Å; V172-V176 PolarHBondContact O-N 3.3Å; V172-I207 HydrophobicContact CB-CD1 4.5Å; V172-I207 HydrophobicContact CG2-CD1 3.99Å; V172-F380 HydrophobicContact CG2-CE2 4.03Å
173	S	98.8	Very high	97.8	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.1	-41.9	-178	-60.6	0	0	0	0	112.1	L169 G170 K171 L177 L256	L169-S173 VanDerWaalsContact O-CB 3.28Å; L169-S173 WeakPolarHBondContact O-CB 3.22Å; L169-S173 PolarHBondContact O-N 3.43Å; L169-S173 PolarHBondContact O-OG 3.28Å; G170-S173 PolarHBondContact O-N 3.43Å; K171-S173 VanDerWaalsContact C-N 3.33Å; K171-S173 PolarHBondContact O-N 3.27Å; S173-L177 WeakPolarHBondContact O-CB 3.26Å; S173-L177 VanDerWaalsContact O-CG 3.29Å; S173-L177 WeakPolarHBondContact O-CG 3.45Å; S173-L177 PolarHBondContact O-N 2.5Å; S173-L256 WeakPolarHBondContact OG-CD1 3.18Å; S173-L256 WeakPolarHBondContact OG-CD2 3.28Å
174	I	98.4	Very high	97.7	Very high	13 Å²	13	22.2 Å²	22.2	7%	0.067	10%	0.103	C	C	.	.	H	α-helix	trans	-57.7	-50.9	173.6	-69	161.7	0	0	0	110.5	G170 K171 V172 V176 L177 R178 I370 A373 E374	G170-I174 WeakPolarHBondContact O-CG1 3.32Å; G170-I174 PolarHBondContact O-N 3.2Å; K171-I174 HydrophobicContact CD-CD1 4.41Å; K171-I174 PolarHBondContact O-N 3.4Å; V172-I174 PolarHBondContact O-N 3.09Å; I174-V176 PolarHBondContact O-N 2.98Å; I174-L177 PolarHBondContact O-N 3.41Å; I174-R178 HydrophobicContact CG2-CG 4.38Å; I174-R178 WeakPolarHBondContact O-CB 3.35Å; I174-R178 VanDerWaalsContact O-CG 3.31Å; I174-R178 WeakPolarHBondContact O-CG 3.34Å; I174-R178 PolarHBondContact O-N 2.93Å; I174-I370 HydrophobicContact CG1-CD1 4.25Å; I174-I370 HydrophobicContact CG1-CG2 3.98Å; I174-A373 HydrophobicContact CD1-CB 3.81Å; I174-E374 HydrophobicContact CD1-CB 4.47Å; I174-E374 HydrophobicContact CD1-CG 3.74Å; I174-E374 HydrophobicContact CG1-CG 4.27Å
175	A	98.5	Very high	97.4	Very high	5 Å²	5	28.7 Å²	28.7	4%	0.041	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-44.1	-177.4	0	0	0	0	0	112.5	Y128 K171 V172 R178 G179 I207	Y128-A175 HydrophobicContact CD1-CB 3.84Å; Y128-A175 HydrophobicContact CE1-CB 4.34Å; K171-A175 PolarHBondContact O-N 3.36Å; K171-A175 VanDerWaalsContact O-N 3.13Å; V172-A175 PolarHBondContact O-N 3.01Å; A175-R178 PolarHBondContact O-N 3.09Å; A175-G179 PolarHBondContact O-N 3.36Å; A175-I207 HydrophobicContact CB-CB 3.59Å; A175-I207 HydrophobicContact CB-CD1 4.28Å; A175-I207 HydrophobicContact CB-CG1 4.5Å; A175-I207 HydrophobicContact CB-CG2 3.71Å
176	V	98.8	Very high	97	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.012	14%	0.139	C	C	.	.	H	α-helix	trans	-63.7	-46.9	177.7	175.9	0	0	0	0	110.8	V172 I174 R178 G179 L180 V194 I199 L209 M252	V172-V176 HydrophobicContact CG1-CG2 4.17Å; V172-V176 WeakPolarHBondContact O-CG2 3.32Å; V172-V176 PolarHBondContact O-N 3.3Å; I174-V176 PolarHBondContact O-N 2.98Å; V176-R178 PolarHBondContact O-N 2.88Å; V176-G179 PolarHBondContact O-N 3.08Å; V176-L180 HydrophobicContact CG1-CD1 3.97Å; V176-L180 HydrophobicContact CG1-CG 4.28Å; V176-L180 WeakPolarHBondContact O-CB 3.43Å; V176-L180 VanDerWaalsContact O-CG 3.32Å; V176-L180 WeakPolarHBondContact O-CG 3.36Å; V176-L180 PolarHBondContact O-N 2.88Å; V176-V194 HydrophobicContact CG1-CG1 4.32Å; V176-I199 HydrophobicContact CG2-CD1 3.87Å; V176-I199 HydrophobicContact CG2-CG1 4.2Å; V176-I199 HydrophobicContact CG2-CG2 4.37Å; V176-L209 HydrophobicContact CG1-CD2 4.35Å; V176-L209 HydrophobicContact CG2-CD2 4.21Å; V176-M252 HydrophobicContact CB-CE 4.4Å; V176-M252 HydrophobicContact CB-SD 4.08Å; V176-M252 HydrophobicContact CG1-CB 4.3Å; V176-M252 HydrophobicContact CG1-CG 3.89Å; V176-M252 HydrophobicContact CG1-SD 3.59Å; V176-M252 VanDerWaalsContact CG1-SD 3.59Å
177	L	98.5	Very high	96.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.4	-43.8	178.1	-72.7	172	0	0	0	112	S173 I174 L180 A181 M252 F346 L361 L364 M365 I370	S173-L177 WeakPolarHBondContact O-CB 3.26Å; S173-L177 VanDerWaalsContact O-CG 3.29Å; S173-L177 WeakPolarHBondContact O-CG 3.45Å; S173-L177 PolarHBondContact O-N 2.5Å; I174-L177 PolarHBondContact O-N 3.41Å; L177-L180 PolarHBondContact O-N 2.86Å; L177-A181 VanDerWaalsContact O-CB 3.28Å; L177-A181 WeakPolarHBondContact O-CB 3.18Å; L177-A181 PolarHBondContact O-N 3.25Å; L177-M252 HydrophobicContact CD1-CE 4.44Å; L177-M252 HydrophobicContact CD2-CE 4.28Å; L177-M252 HydrophobicContact CD2-SD 3.85Å; L177-M252 HydrophobicContact CG-CE 3.9Å; L177-M252 HydrophobicContact CG-SD 4Å; L177-F346 HydrophobicContact CD1-CE2 4.22Å; L177-F346 HydrophobicContact CD1-CZ 4.03Å; L177-L361 HydrophobicContact CD2-CD2 3.77Å; L177-L364 HydrophobicContact CD1-CB 3.93Å; L177-L364 HydrophobicContact CD2-CB 3.8Å; L177-L364 HydrophobicContact CD2-CD1 3.9Å; L177-M365 HydrophobicContact CB-CE 3.42Å; L177-M365 VanDerWaalsContact CB-CE 3.42Å; L177-M365 HydrophobicContact CB-SD 4.43Å; L177-M365 HydrophobicContact CD1-CE 4.44Å; L177-I370 HydrophobicContact CD1-CD1 3.86Å; L177-I370 HydrophobicContact CD1-CG1 3.92Å
178	R	97.7	Very high	96.2	Very high	78 Å²	78	32.4 Å²	32.4	29%	0.294	15%	0.145	S	C	.	.	H	α-helix	trans	-66.4	-37.7	177.9	-69.9	-179.6	-179.3	-178	-1.6	111.7	Y128 I174 A175 V176 Y182 M365 E374	Y128-R178 HydrophobicContact CD1-CB 4.33Å; Y128-R178 HydrophobicContact CD2-CB 3.43Å; Y128-R178 VanDerWaalsContact CD2-CB 3.43Å; Y128-R178 HydrophobicContact CD2-CG 4.49Å; Y128-R178 HydrophobicContact CE1-CB 4.35Å; Y128-R178 HydrophobicContact CE2-CB 3.48Å; Y128-R178 VanDerWaalsContact CE2-CB 3.48Å; Y128-R178 HydrophobicContact CE2-CG 4.09Å; Y128-R178 HydrophobicContact CG-CB 3.89Å; Y128-R178 VanDerWaalsContact OH-CD 3.27Å; Y128-R178 WeakPolarHBondContact OH-CD 3.39Å; Y128-R178 PolarHBondContact OH-NH1 3.45Å; I174-R178 HydrophobicContact CG2-CG 4.38Å; I174-R178 WeakPolarHBondContact O-CB 3.35Å; I174-R178 VanDerWaalsContact O-CG 3.31Å; I174-R178 WeakPolarHBondContact O-CG 3.34Å; I174-R178 PolarHBondContact O-N 2.93Å; A175-R178 PolarHBondContact O-N 3.09Å; V176-R178 PolarHBondContact O-N 2.88Å; R178-Y182 WeakPolarHBondContact O-CB 3.41Å; R178-Y182 PolarHBondContact O-N 3.41Å; R178-M365 HydrophobicContact CG-CE 3.69Å; R178-M365 HydrophobicContact CG-SD 4.29Å; R178-E374 IonicContact CZ-OE1 2.62Å; R178-E374 IonicContact NH2-OE1 2.72Å; R178-E374 PolarHBondContact NH2-OE1 2.98Å
179	G	97.8	Very high	95.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.7	-46.9	173.3	0	0	0	0	0	112.9	A175 V176 Y182 L183	A175-G179 PolarHBondContact O-N 3.36Å; V176-G179 PolarHBondContact O-N 3.08Å; G179-Y182 PolarHBondContact O-N 3.47Å; G179-L183 WeakPolarHBondContact O-CG 3.32Å; G179-L183 PolarHBondContact O-N 3.14Å
180	L	97.5	Very high	95.4	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-64.8	-41.8	176.9	-68.4	178	0	0	0	112.2	V176 L177 L183 R184 H191 V194 L209 D248 L361	V176-L180 HydrophobicContact CG1-CD1 3.97Å; V176-L180 HydrophobicContact CG1-CG 4.28Å; V176-L180 WeakPolarHBondContact O-CB 3.43Å; V176-L180 VanDerWaalsContact O-CG 3.32Å; V176-L180 WeakPolarHBondContact O-CG 3.36Å; V176-L180 PolarHBondContact O-N 2.88Å; L177-L180 PolarHBondContact O-N 2.86Å; L180-L183 PolarHBondContact O-N 3.12Å; L180-R184 WeakPolarHBondContact O-CB 3.44Å; L180-R184 PolarHBondContact O-N 3.36Å; L180-H191 HydrophobicContact CD2-CB 3.66Å; L180-V194 HydrophobicContact CD2-CG2 3.94Å; L180-L209 HydrophobicContact CD2-CD1 4.09Å; L180-L209 HydrophobicContact CG-CD1 4.14Å; L180-D248 HydrophobicContact CD1-CB 3.99Å; L180-D248 HydrophobicContact CD2-CB 3.96Å; L180-L361 HydrophobicContact CB-CD1 4.09Å; L180-L361 HydrophobicContact CB-CD2 4.01Å; L180-L361 HydrophobicContact CD1-CD2 4.24Å
181	A	96.4	Very high	95.1	Very high	14 Å²	14	35.2 Å²	35.2	12%	0.116	16%	0.158	C	C	.	.	H	α-helix	trans	-60.8	-46	175.3	0	0	0	0	0	111	L177 L183 R184 E185 L361	L177-A181 VanDerWaalsContact O-CB 3.28Å; L177-A181 WeakPolarHBondContact O-CB 3.18Å; L177-A181 PolarHBondContact O-N 3.25Å; A181-L183 PolarHBondContact O-N 2.7Å; A181-R184 PolarHBondContact O-N 2.82Å; A181-E185 VanDerWaalsContact O-CB 3.31Å; A181-E185 WeakPolarHBondContact O-CB 3.41Å; A181-E185 WeakPolarHBondContact O-CG 3.4Å; A181-E185 PolarHBondContact O-N 2.99Å; A181-L361 HydrophobicContact CB-CD1 4.19Å
182	Y	95.4	Very high	94.8	Very high	23 Å²	23	36.3 Å²	36.3	9%	0.09	16%	0.162	C	C	.	.	H	α-helix	trans	-57.1	-50.7	175.9	173.5	-94.3	0	0	0	112.5	L43 E123 C124 N125 I129 R178 G179 R184 K186 H187	L43-Y182 HydrophobicContact CD2-CD2 3.94Å; L43-Y182 HydrophobicContact CD2-CE2 3.83Å; E123-Y182 PolarHBondContact O-OH 3.07Å; C124-Y182 HydrophobicContact CB-CE1 4.49Å; N125-Y182 PolarHBondContact N-OH 2.9Å; N125-Y182 PolarHBondContact O-OH 3.19Å; I129-Y182 HydrophobicContact CD1-CD1 4.45Å; I129-Y182 HydrophobicContact CG1-CD1 3.72Å; I129-Y182 HydrophobicContact CG1-CE1 4.1Å; R178-Y182 WeakPolarHBondContact O-CB 3.41Å; R178-Y182 PolarHBondContact O-N 3.41Å; G179-Y182 PolarHBondContact O-N 3.47Å; Y182-R184 VanDerWaalsContact C-N 3.3Å; Y182-R184 PolarHBondContact O-N 3.49Å; Y182-K186 HydrophobicContact CD2-CB 4.39Å; Y182-K186 HydrophobicContact CD2-CG 3.93Å; Y182-K186 HydrophobicContact CE2-CB 4.23Å; Y182-K186 HydrophobicContact CE2-CG 3.98Å; Y182-K186 WeakPolarHBondContact O-CB 3.31Å; Y182-K186 PolarHBondContact O-N 3.07Å; Y182-H187 AromaticContact CE1-CD2 3.59Å; Y182-H187 AromaticContact CE1-NE2 3.62Å; Y182-H187 AromaticContact CZ-CD2 3.8Å; Y182-H187 AromaticContact CZ-NE2 3.43Å; Y182-H187 PolarHBondContact OH-NE2 3.17Å
183	L	94.1	Very high	94.4	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-59.7	-42.7	179.1	-70.7	174.6	0	0	0	111.6	I129 G179 L180 A181 H187 Q188 I189 F212	I129-L183 HydrophobicContact CD1-CD1 3.95Å; I129-L183 HydrophobicContact CD1-CD2 4.01Å; I129-L183 HydrophobicContact CD1-CG 3.79Å; I129-L183 HydrophobicContact CG1-CD2 4.48Å; G179-L183 WeakPolarHBondContact O-CG 3.32Å; G179-L183 PolarHBondContact O-N 3.14Å; L180-L183 PolarHBondContact O-N 3.12Å; A181-L183 PolarHBondContact O-N 2.7Å; L183-H187 CarbonylContact O-C 3.54Å; L183-H187 WeakPolarHBondContact O-CB 3.33Å; L183-H187 PolarHBondContact O-N 3.19Å; L183-Q188 PolarHBondContact O-N 3.16Å; L183-Q188 VanDerWaalsContact O-N 3.11Å; L183-I189 CarbonylContact C-O 3.57Å; L183-I189 HydrophobicContact CB-CB 4.33Å; L183-I189 PolarHBondContact O-N 2.86Å; L183-F212 HydrophobicContact CD1-CB 3.98Å; L183-F212 HydrophobicContact CD1-CD1 4.36Å; L183-F212 HydrophobicContact CD1-CD2 4.11Å; L183-F212 HydrophobicContact CD1-CG 3.91Å; L183-F212 HydrophobicContact CD2-CD2 3.69Å; L183-F212 HydrophobicContact CD2-CE1 4.43Å; L183-F212 HydrophobicContact CD2-CE2 3.52Å; L183-F212 HydrophobicContact CD2-CG 4.19Å; L183-F212 HydrophobicContact CD2-CZ 3.93Å
184	R	93	Very high	94.2	Very high	98 Å²	98	37.8 Å²	37.8	37%	0.37	17%	0.169	S	C	.	.	H	α-helix	trans	-70.6	-50.7	-178.4	178.4	56.7	-177.9	161.8	5.8	112.2	L180 A181 Y182 Q188 I189	L180-R184 WeakPolarHBondContact O-CB 3.44Å; L180-R184 PolarHBondContact O-N 3.36Å; A181-R184 PolarHBondContact O-N 2.82Å; Y182-R184 VanDerWaalsContact C-N 3.3Å; Y182-R184 PolarHBondContact O-N 3.49Å; R184-Q188 VanDerWaalsContact O-CA 3.23Å; R184-Q188 WeakPolarHBondContact O-CA 3.43Å; R184-Q188 PolarHBondContact O-N 3.25Å; R184-Q188 VanDerWaalsContact O-N 3.1Å; R184-Q188 PolarHBondContact O-NE2 2.74Å; R184-I189 PolarHBondContact N-O 3.05Å
185	E	92.3	Very high	94.1	Very high	138 Å²	138	38.4 Å²	38.4	65%	0.645	17%	0.171	S	C	*	.	H	α-helix	trans	-76.3	-45.4	-170.7	-68	175.7	-173.8	0	0	112.1	A181	A181-E185 VanDerWaalsContact O-CB 3.31Å; A181-E185 WeakPolarHBondContact O-CB 3.41Å; A181-E185 WeakPolarHBondContact O-CG 3.4Å; A181-E185 PolarHBondContact O-N 2.99Å
186	K	90.7	Very high	94	Very high	98 Å²	98	38.2 Å²	38.2	43%	0.426	17%	0.17	S	C	.	.	H	α-helix	trans	-85	-32.2	-175.1	-62.5	-66.9	-172.1	169.4	0	113	E42 Y182	E42-K186 IonicContact OE2-NZ 3.01Å; Y182-K186 HydrophobicContact CD2-CB 4.39Å; Y182-K186 HydrophobicContact CD2-CG 3.93Å; Y182-K186 HydrophobicContact CE2-CB 4.23Å; Y182-K186 HydrophobicContact CE2-CG 3.98Å; Y182-K186 WeakPolarHBondContact O-CB 3.31Å; Y182-K186 PolarHBondContact O-N 3.07Å
187	H	89.3	Confident	93.8	Very high	41 Å²	41	40.2 Å²	40.2	19%	0.19	18%	0.184	C	C	.	.	H	α-helix	trans	-121.3	-6.5	-171.9	-62.9	-73	0	0	0	114.8	E123 Y182 L183 I189	E123-H187 PolarHBondContact O-CE1 2.77Å; Y182-H187 AromaticContact CE1-CD2 3.59Å; Y182-H187 AromaticContact CE1-NE2 3.62Å; Y182-H187 AromaticContact CZ-CD2 3.8Å; Y182-H187 AromaticContact CZ-NE2 3.43Å; Y182-H187 PolarHBondContact OH-NE2 3.17Å; L183-H187 CarbonylContact O-C 3.54Å; L183-H187 WeakPolarHBondContact O-CB 3.33Å; L183-H187 PolarHBondContact O-N 3.19Å; H187-I189 HydrophobicContact CB-CB 4.38Å; H187-I189 HydrophobicContact CB-CD1 3.62Å; H187-I189 HydrophobicContact CB-CG1 3.87Å; H187-I189 PolarHBondContact O-N 3.44Å
188	Q	90.4	Very high	93.7	Very high	120 Å²	120	40.6 Å²	40.6	56%	0.561	19%	0.186	S	C	*	.			trans	57.8	27.3	-173.7	-58.7	-61.7	-50	0	0	113.8	L183 R184	L183-Q188 PolarHBondContact O-N 3.16Å; L183-Q188 VanDerWaalsContact O-N 3.11Å; R184-Q188 VanDerWaalsContact O-CA 3.23Å; R184-Q188 WeakPolarHBondContact O-CA 3.43Å; R184-Q188 PolarHBondContact O-N 3.25Å; R184-Q188 VanDerWaalsContact O-N 3.1Å; R184-Q188 PolarHBondContact O-NE2 2.74Å
189	I	89.3	Confident	93.7	Very high	21 Å²	21	37 Å²	37	11%	0.108	17%	0.173	C	C	.	.			trans	-96	141.7	-179	-66.3	169.8	0	0	0	110.1	V120 L183 R184 H187 F212 V214	V120-I189 HydrophobicContact CG1-CD1 4.02Å; L183-I189 CarbonylContact C-O 3.57Å; L183-I189 HydrophobicContact CB-CB 4.33Å; L183-I189 PolarHBondContact O-N 2.86Å; R184-I189 PolarHBondContact N-O 3.05Å; H187-I189 HydrophobicContact CB-CB 4.38Å; H187-I189 HydrophobicContact CB-CD1 3.62Å; H187-I189 HydrophobicContact CB-CG1 3.87Å; H187-I189 PolarHBondContact O-N 3.44Å; I189-F212 HydrophobicContact CG2-CD2 4.04Å; I189-V214 HydrophobicContact CD1-CG2 4.17Å
190	M	90.5	Very high	93.7	Very high	36 Å²	36	38.4 Å²	38.4	18%	0.177	18%	0.18	C	C	.	.			trans	-103	144	164.5	-67.3	176.9	-79.3	0	0	108.8	R192 Y243 S244	M190-R192 HydrophobicContact CB-CG 4.01Å; M190-Y243 HydrophobicContact CE-CE2 4.24Å; M190-Y243 HydrophobicContact SD-CD2 4.32Å; M190-Y243 HydrophobicContact SD-CE2 4.45Å; M190-S244 VanDerWaalsContact SD-CA 3.52Å
191	H	93.1	Very high	93.8	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.009	18%	0.18	C	C	.	.			trans	-71.9	-45.2	-177.5	-170.5	-48.7	0	0	0	112	L180 D193 V194 C210 F212 G213 D248	L180-H191 HydrophobicContact CD2-CB 3.66Å; H191-D193 PolarHBondContact CE1-O 2.88Å; H191-D193 PolarHBondContact ND1-N 3.22Å; H191-D193 PolarHBondContact O-N 3.48Å; H191-D193 VanDerWaalsContact O-N 3.13Å; H191-V194 HydrophobicContact CB-CG2 3.8Å; H191-C210 PolarHBondContact CE1-O 3.03Å; H191-C210 PolarHBondContact NE2-O 2.89Å; H191-F212 HydrophobicContact CB-CB 4.21Å; H191-G213 PolarHBondContact O-N 3.13Å; H191-D248 PolarHBondContact N-OD2 3.44Å
192	R	91.1	Very high	93.8	Very high	70 Å²	70	37.9 Å²	37.9	26%	0.264	18%	0.175	S	C	.	.	S	Bend	trans	67.1	-3.4	177.8	-57.3	175.4	172.1	177.6	-3.5	117	M190 R237 D248	M190-R192 HydrophobicContact CB-CG 4.01Å; R192-R237 PolarHBondContact O-NH1 2.93Å; R192-R237 PolarHBondContact O-NH2 3.49Å; R192-D248 WeakPolarHBondContact CA-OD1 3.31Å; R192-D248 PolarHBondContact N-OD1 3.1Å
193	D	90.1	Very high	93.8	Very high	32 Å²	32	37.9 Å²	37.9	17%	0.171	18%	0.178	C	C	.	.			trans	-151	43.9	-176.3	-164.1	25.1	0	0	0	111.6	H191 K195 N198 T229	H191-D193 PolarHBondContact CE1-O 2.88Å; H191-D193 PolarHBondContact ND1-N 3.22Å; H191-D193 PolarHBondContact O-N 3.48Å; H191-D193 VanDerWaalsContact O-N 3.13Å; D193-K195 PolarHBondContact O-N 3.45Å; D193-K195 IonicContact OD1-NZ 3.65Å; D193-K195 PolarHBondContact OD1-NZ 3.22Å; D193-K195 IonicContact OD2-NZ 3.95Å; D193-K195 PolarHBondContact OD2-NZ 2.87Å; D193-N198 VanDerWaalsContact CG-ND2 3.34Å; D193-N198 PolarHBondContact O-ND2 3.33Å; D193-N198 PolarHBondContact OD2-ND2 3.16Å; D193-T229 WeakPolarHBondContact OD1-CG2 3.41Å
194	V	95.9	Very high	93.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.2	C	C	.	.			trans	-70.2	123.7	173.7	-179.3	0	0	0	0	108.7	V176 L180 H191 D248 S251 M252	V176-V194 HydrophobicContact CG1-CG1 4.32Å; L180-V194 HydrophobicContact CD2-CG2 3.94Å; H191-V194 HydrophobicContact CB-CG2 3.8Å; V194-D248 HydrophobicContact CG2-CB 4.09Å; V194-S251 VanDerWaalsContact O-CB 3.31Å; V194-S251 WeakPolarHBondContact O-CB 3.26Å; V194-M252 HydrophobicContact CG1-CB 4.23Å
195	K	95.4	Very high	93.9	Very high	25 Å²	25	40.1 Å²	40.1	11%	0.109	19%	0.194	C	C	.	.	S	Bend	trans	-164.5	164.2	176.4	60.2	-173.2	177.4	-139	0	109.4	D193 S197 N198 I199 Y232 S255	D193-K195 PolarHBondContact O-N 3.45Å; D193-K195 IonicContact OD1-NZ 3.65Å; D193-K195 PolarHBondContact OD1-NZ 3.22Å; D193-K195 IonicContact OD2-NZ 3.95Å; D193-K195 PolarHBondContact OD2-NZ 2.87Å; K195-S197 WeakPolarHBondContact CE-OG 3.3Å; K195-S197 WeakPolarHBondContact CG-OG 3.44Å; K195-S197 PolarHBondContact O-N 3.43Å; K195-S197 VanDerWaalsContact O-N 3.11Å; K195-N198 HydrophobicContact CG-CB 4.23Å; K195-N198 PolarHBondContact O-N 3.5Å; K195-I199 PolarHBondContact O-N 3.27Å; K195-Y232 HydrophobicContact CB-CD1 4.1Å; K195-Y232 HydrophobicContact CB-CD2 3.75Å; K195-Y232 HydrophobicContact CB-CE1 4.27Å; K195-Y232 HydrophobicContact CB-CE2 3.94Å; K195-Y232 HydrophobicContact CB-CG 3.86Å; K195-Y232 HydrophobicContact CD-CD2 4.1Å; K195-Y232 HydrophobicContact CD-CE2 4.25Å; K195-S255 WeakPolarHBondContact CA-OG 3.32Å
196	P	97.1	Very high	94.2	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.013	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-54.9	-33.9	-178.2	-30.6	39.2	0	0	0	114.8	L154 D155 N198 I199 E258 L259	L154-P196 HydrophobicContact CB-CB 4.18Å; L154-P196 PolarHBondContact N-O 3.18Å; L154-P196 VanDerWaalsContact N-O 3.08Å; D155-P196 HydrophobicContact CB-CB 3.96Å; D155-P196 PolarHBondContact N-O 2.95Å; P196-N198 PolarHBondContact O-N 3.45Å; P196-I199 PolarHBondContact O-N 2.95Å; P196-E258 WeakPolarHBondContact CG-OE2 3.5Å; P196-L259 HydrophobicContact CB-CD2 4.03Å; P196-L259 HydrophobicContact CB-CG 4.49Å; P196-L259 HydrophobicContact CG-CD1 4.29Å; P196-L259 HydrophobicContact CG-CD2 4.1Å; P196-L259 HydrophobicContact CG-CG 4.07Å
197	S	94.1	Very high	94.6	Very high	44 Å²	44	30.4 Å²	30.4	31%	0.308	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-69.1	-16.2	177.9	74	0	0	0	0	114.6	S153 D155 K195	S153-S197 WeakPolarHBondContact CB-O 3.33Å; D155-S197 VanDerWaalsContact OD1-CA 3.26Å; D155-S197 WeakPolarHBondContact OD1-CA 3.35Å; D155-S197 WeakPolarHBondContact OD1-CB 3.35Å; K195-S197 WeakPolarHBondContact CE-OG 3.3Å; K195-S197 WeakPolarHBondContact CG-OG 3.44Å; K195-S197 PolarHBondContact O-N 3.43Å; K195-S197 VanDerWaalsContact O-N 3.11Å
198	N	96.1	Very high	95	Very high	7 Å²	7	29 Å²	29	4%	0.037	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-107.9	9.8	-179.1	-67.7	-0.7	0	0	0	112.4	D193 K195 P196 C210	D193-N198 VanDerWaalsContact CG-ND2 3.34Å; D193-N198 PolarHBondContact O-ND2 3.33Å; D193-N198 PolarHBondContact OD2-ND2 3.16Å; K195-N198 HydrophobicContact CG-CB 4.23Å; K195-N198 PolarHBondContact O-N 3.5Å; P196-N198 PolarHBondContact O-N 3.45Å; N198-C210 PolarHBondContact O-N 2.96Å
199	I	98.5	Very high	95.4	Very high	3 Å²	3	23.4 Å²	23.4	2%	0.015	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	108.5	172.2	-55.2	164.4	0	0	0	106.7	S153 L154 V176 K195 P196 I207 L209	S153-I199 CarbonylContact C-O 3.59Å; S153-I199 WeakPolarHBondContact CA-O 3.37Å; L154-I199 HydrophobicContact CB-CB 4.42Å; L154-I199 HydrophobicContact CD1-CB 3.81Å; L154-I199 HydrophobicContact CD1-CD1 4.14Å; L154-I199 HydrophobicContact CD1-CG2 3.46Å; L154-I199 VanDerWaalsContact CD1-CG2 3.46Å; L154-I199 HydrophobicContact CG-CB 4.01Å; L154-I199 HydrophobicContact CG-CG2 3.86Å; L154-I199 PolarHBondContact N-O 2.78Å; V176-I199 HydrophobicContact CG2-CD1 3.87Å; V176-I199 HydrophobicContact CG2-CG1 4.2Å; V176-I199 HydrophobicContact CG2-CG2 4.37Å; K195-I199 PolarHBondContact O-N 3.27Å; P196-I199 PolarHBondContact O-N 2.95Å; I199-I207 HydrophobicContact CG2-CG2 3.67Å; I199-L209 HydrophobicContact CG1-CD2 3.9Å
200	L	98.6	Very high	95.6	Very high	30 Å²	30	22.7 Å²	22.7	16%	0.157	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	149.1	-175.7	-55	-168.3	0	0	0	111.8	V130 M149 G152 I207 K208 C210	V130-L200 HydrophobicContact CG2-CB 4.32Å; V130-L200 HydrophobicContact CG2-CD1 3.99Å; V130-L200 HydrophobicContact CG2-CG 4.33Å; M149-L200 HydrophobicContact CB-CB 3.8Å; M149-L200 HydrophobicContact CB-CD1 4.1Å; M149-L200 HydrophobicContact CE-CB 4.34Å; M149-L200 HydrophobicContact CG-CB 3.72Å; M149-L200 HydrophobicContact CG-CD1 3.88Å; M149-L200 HydrophobicContact CG-CG 4.47Å; G152-L200 CarbonylContact O-C 3.6Å; G152-L200 WeakPolarHBondContact O-CA 3.14Å; L200-I207 WeakPolarHBondContact O-CA 3.46Å; L200-K208 PolarHBondContact N-O 3.03Å; L200-K208 PolarHBondContact O-N 3.4Å; L200-C210 HydrophobicContact CD1-CB 4.18Å; L200-C210 HydrophobicContact CG-CB 4.35Å
201	V	98.4	Very high	95.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	156.9	-178.3	-58.7	0	0	0	0	111.8	M149 G151 G152 L154 V157 E206 I207 F380 M384	M149-V201 WeakPolarHBondContact CB-O 2.96Å; G151-V201 CarbonylContact C-O 3.59Å; G151-V201 WeakPolarHBondContact CA-O 3.19Å; G151-V201 PolarHBondContact N-O 2.69Å; G152-V201 PolarHBondContact N-O 2.96Å; G152-V201 PolarHBondContact O-N 3.35Å; L154-V201 HydrophobicContact CD2-CG1 3.63Å; L154-V201 HydrophobicContact CD2-CG2 4.49Å; L154-V201 HydrophobicContact CG-CG1 4.23Å; V157-V201 HydrophobicContact CG2-CG2 3.86Å; V201-E206 VanDerWaalsContact CA-O 3.29Å; V201-E206 WeakPolarHBondContact CA-O 3.45Å; V201-I207 HydrophobicContact CG1-CG1 4.2Å; V201-I207 HydrophobicContact CG1-CG2 4.35Å; V201-F380 HydrophobicContact CB-CE1 4.24Å; V201-F380 HydrophobicContact CB-CZ 4.37Å; V201-F380 HydrophobicContact CG1-CE1 4.14Å; V201-F380 HydrophobicContact CG1-CZ 3.82Å; V201-M384 HydrophobicContact CB-CG 4.47Å; V201-M384 HydrophobicContact CG2-CG 3.86Å; V201-M384 HydrophobicContact CG2-SD 4.33Å
202	N	96.9	Very high	95.1	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.021	12%	0.124	C	C	.	.			trans	-139.3	164.8	178	74.3	18.3	0	0	0	113.1	M149 D150 R204 G205 E206 M384	M149-N202 HydrophobicContact CE-CB 3.91Å; M149-N202 HydrophobicContact SD-CB 4.23Å; D150-N202 WeakPolarHBondContact OD1-CA 3.49Å; D150-N202 WeakPolarHBondContact OD1-CB 3.46Å; N202-R204 PolarHBondContact O-N 3.04Å; N202-R204 WeakPolarHBondContact OD1-CA 3.39Å; N202-R204 WeakPolarHBondContact OD1-CB 3.4Å; N202-R204 PolarHBondContact OD1-N 3.16Å; N202-R204 VanDerWaalsContact OD1-N 3.1Å; N202-G205 PolarHBondContact O-N 3.37Å; N202-G205 PolarHBondContact OD1-N 3.07Å; N202-E206 PolarHBondContact N-O 2.94Å; N202-E206 PolarHBondContact ND2-OE2 3.47Å; N202-E206 WeakPolarHBondContact OD1-CB 3.43Å; N202-E206 PolarHBondContact OD1-N 3.35Å; N202-M384 VanDerWaalsContact O-CE 3.25Å; N202-M384 WeakPolarHBondContact O-CE 3.33Å
203	S	95.6	Very high	94.5	Very high	23 Å²	23	21.9 Å²	21.9	16%	0.161	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.4	-179.1	58.9	0	0	0	0	114.2	D150 G205 M384 P393	D150-S203 PolarHBondContact OD1-N 3.43Å; D150-S203 PolarHBondContact OD1-OG 3.46Å; D150-S203 VanDerWaalsContact OD2-CB 3.3Å; D150-S203 WeakPolarHBondContact OD2-CB 3.33Å; D150-S203 PolarHBondContact OD2-OG 2.86Å; S203-G205 VanDerWaalsContact C-N 3.3Å; S203-M384 VanDerWaalsContact N-CE 3.32Å; S203-P393 WeakPolarHBondContact O-CB 3.28Å; S203-P393 WeakPolarHBondContact O-CG 3.13Å
204	R	94.1	Very high	93.7	Very high	122 Å²	122	21.6 Å²	21.6	46%	0.46	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	1.7	173.9	-53	-172.8	-62.9	-144.7	-1.7	113.3	R52 N202 E206	R52-R204 PolarHBondContact NH1-O 2.89Å; R52-R204 PolarHBondContact NH2-O 3.33Å; N202-R204 PolarHBondContact O-N 3.04Å; N202-R204 WeakPolarHBondContact OD1-CA 3.39Å; N202-R204 WeakPolarHBondContact OD1-CB 3.4Å; N202-R204 PolarHBondContact OD1-N 3.16Å; N202-R204 VanDerWaalsContact OD1-N 3.1Å; R204-E206 IonicContact CZ-OE2 2.9Å; R204-E206 IonicContact NE-OE2 3.15Å; R204-E206 PolarHBondContact NE-OE2 3.2Å; R204-E206 IonicContact NH2-OE1 2.99Å; R204-E206 IonicContact NH2-OE2 2.78Å; R204-E206 PolarHBondContact NH2-OE2 3.13Å
205	G	95.3	Very high	92.8	Very high	24 Å²	24	21.7 Å²	21.7	25%	0.247	12%	0.12	C	C	.	.			trans	76.9	18.5	-179.4	0	0	0	0	0	114.9	N202 S203	N202-G205 PolarHBondContact O-N 3.37Å; N202-G205 PolarHBondContact OD1-N 3.07Å; S203-G205 VanDerWaalsContact C-N 3.3Å
206	E	97.4	Very high	91.8	Very high	18 Å²	18	21.9 Å²	21.9	8%	0.084	13%	0.129	C	C	.	.			trans	-80.8	143.3	174.1	-59.8	168.5	90.1	0	0	110.5	M149 V201 N202 R204 K208	M149-E206 HydrophobicContact CE-CB 4.39Å; V201-E206 VanDerWaalsContact CA-O 3.29Å; V201-E206 WeakPolarHBondContact CA-O 3.45Å; N202-E206 PolarHBondContact N-O 2.94Å; N202-E206 PolarHBondContact ND2-OE2 3.47Å; N202-E206 WeakPolarHBondContact OD1-CB 3.43Å; N202-E206 PolarHBondContact OD1-N 3.35Å; R204-E206 IonicContact CZ-OE2 2.9Å; R204-E206 IonicContact NE-OE2 3.15Å; R204-E206 PolarHBondContact NE-OE2 3.2Å; R204-E206 IonicContact NH2-OE1 2.99Å; R204-E206 IonicContact NH2-OE2 2.78Å; R204-E206 PolarHBondContact NH2-OE2 3.13Å; E206-K208 HydrophobicContact CB-CG 4.46Å; E206-K208 WeakPolarHBondContact OE1-CE 3.46Å; E206-K208 IonicContact OE1-NZ 2.91Å; E206-K208 PolarHBondContact OE1-NZ 2.88Å
207	I	98.6	Very high	90.5	Very high	14 Å²	14	24.7 Å²	24.7	7%	0.072	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	120.1	176.4	-52.7	169.8	0	0	0	106.8	K171 V172 A175 I199 L200 V201 F380	K171-I207 HydrophobicContact CB-CD1 4.28Å; V172-I207 HydrophobicContact CB-CD1 4.5Å; V172-I207 HydrophobicContact CG2-CD1 3.99Å; A175-I207 HydrophobicContact CB-CB 3.59Å; A175-I207 HydrophobicContact CB-CD1 4.28Å; A175-I207 HydrophobicContact CB-CG1 4.5Å; A175-I207 HydrophobicContact CB-CG2 3.71Å; I199-I207 HydrophobicContact CG2-CG2 3.67Å; L200-I207 WeakPolarHBondContact O-CA 3.46Å; V201-I207 HydrophobicContact CG1-CG1 4.2Å; V201-I207 HydrophobicContact CG1-CG2 4.35Å; I207-F380 HydrophobicContact CD1-CD1 4.45Å; I207-F380 HydrophobicContact CD1-CD2 3.96Å; I207-F380 HydrophobicContact CD1-CE1 4.06Å; I207-F380 HydrophobicContact CD1-CE2 3.51Å; I207-F380 HydrophobicContact CD1-CG 4.42Å; I207-F380 HydrophobicContact CD1-CZ 3.58Å; I207-F380 HydrophobicContact CG1-CD1 4.39Å; I207-F380 HydrophobicContact CG1-CE1 3.75Å; I207-F380 HydrophobicContact CG1-CE2 4.08Å; I207-F380 HydrophobicContact CG1-CZ 3.59Å
208	K	98.7	Very high	89.5	Confident	12 Å²	12	23.3 Å²	23.3	5%	0.052	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.6	-170.4	-58.2	-169.2	-175.8	-175.1	0	112.5	P127 Y128 V130 E147 M149 L200 E206	P127-K208 VanDerWaalsContact O-CE 3.25Å; P127-K208 WeakPolarHBondContact O-CE 3.44Å; P127-K208 WeakPolarHBondContact O-CG 3.17Å; Y128-K208 CarbonylContact O-C 3.46Å; Y128-K208 WeakPolarHBondContact O-CA 3.42Å; V130-K208 HydrophobicContact CG2-CB 3.54Å; E147-K208 WeakPolarHBondContact OE1-CD 3.45Å; E147-K208 WeakPolarHBondContact OE1-CE 3.01Å; E147-K208 IonicContact OE1-NZ 3.11Å; E147-K208 PolarHBondContact OE1-NZ 3.28Å; E147-K208 IonicContact OE2-NZ 3.84Å; E147-K208 PolarHBondContact OE2-NZ 2.87Å; E147-K208 VanDerWaalsContact OE2-NZ 3.17Å; M149-K208 HydrophobicContact CE-CB 4.13Å; M149-K208 HydrophobicContact CE-CD 4.01Å; M149-K208 HydrophobicContact CE-CG 3.92Å; M149-K208 HydrophobicContact SD-CD 4.23Å; L200-K208 PolarHBondContact N-O 3.03Å; L200-K208 PolarHBondContact O-N 3.4Å; E206-K208 HydrophobicContact CB-CG 4.46Å; E206-K208 WeakPolarHBondContact OE1-CE 3.46Å; E206-K208 IonicContact OE1-NZ 2.91Å; E206-K208 PolarHBondContact OE1-NZ 2.88Å
209	L	98.3	Very high	88.4	Confident	2 Å²	2	25.2 Å²	25.2	1%	0.01	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	140.9	173.3	-64.3	170.8	0	0	0	110.9	Y128 I129 V130 V176 L180 I199	Y128-L209 PolarHBondContact O-N 3Å; I129-L209 HydrophobicContact CD1-CB 4.12Å; V130-L209 WeakPolarHBondContact CG2-O 3.38Å; V130-L209 PolarHBondContact N-O 2.8Å; V176-L209 HydrophobicContact CG1-CD2 4.35Å; V176-L209 HydrophobicContact CG2-CD2 4.21Å; L180-L209 HydrophobicContact CD2-CD1 4.09Å; L180-L209 HydrophobicContact CG-CD1 4.14Å; I199-L209 HydrophobicContact CG1-CD2 3.9Å
210	C	94.7	Very high	87.1	Confident	6 Å²	6	29.5 Å²	29.5	4%	0.041	16%	0.164	C	C	.	.			trans	-129.4	174.8	171.1	68.9	0	0	0	0	111.3	V130 H191 N198 L200 F212	V130-C210 HydrophobicContact CB-CB 4.12Å; V130-C210 HydrophobicContact CG2-CB 3.85Å; H191-C210 PolarHBondContact CE1-O 3.03Å; H191-C210 PolarHBondContact NE2-O 2.89Å; N198-C210 PolarHBondContact O-N 2.96Å; L200-C210 HydrophobicContact CD1-CB 4.18Å; L200-C210 HydrophobicContact CG-CB 4.35Å; C210-F212 PolarHBondContact O-N 3.11Å
211	D	87.3	Confident	85.6	Confident	54 Å²	54	29.7 Å²	29.7	29%	0.289	17%	0.167	S	C	.	.	S	Bend	trans	55.6	35.8	172.6	-73.9	-23.3	0	0	0	114.6	K100	K100-D211 IonicContact NZ-OD1 2.71Å; K100-D211 PolarHBondContact NZ-OD1 3.32Å; K100-D211 IonicContact NZ-OD2 3.52Å; K100-D211 PolarHBondContact NZ-OD2 3.26Å
212	F	86	Confident	84.1	Confident	21 Å²	21	32 Å²	32	9%	0.092	18%	0.179	C	C	.	.			trans	-80.6	149.7	174.2	55.4	-86.1	0	0	0	112.2	L121 C124 I129 L183 I189 H191 C210 V214	L121-F212 HydrophobicContact CD2-CD2 4.38Å; L121-F212 HydrophobicContact CD2-CE1 4.03Å; L121-F212 HydrophobicContact CD2-CE2 3.44Å; L121-F212 VanDerWaalsContact CD2-CE2 3.44Å; L121-F212 HydrophobicContact CD2-CZ 3.21Å; C124-F212 HydrophobicContact CB-CZ 4.05Å; I129-F212 HydrophobicContact CG2-CD1 4.48Å; I129-F212 HydrophobicContact CG2-CE1 3.48Å; I129-F212 VanDerWaalsContact CG2-CE1 3.48Å; I129-F212 HydrophobicContact CG2-CZ 3.81Å; L183-F212 HydrophobicContact CD1-CB 3.98Å; L183-F212 HydrophobicContact CD1-CD1 4.36Å; L183-F212 HydrophobicContact CD1-CD2 4.11Å; L183-F212 HydrophobicContact CD1-CG 3.91Å; L183-F212 HydrophobicContact CD2-CD2 3.69Å; L183-F212 HydrophobicContact CD2-CE1 4.43Å; L183-F212 HydrophobicContact CD2-CE2 3.52Å; L183-F212 HydrophobicContact CD2-CG 4.19Å; L183-F212 HydrophobicContact CD2-CZ 3.93Å; I189-F212 HydrophobicContact CG2-CD2 4.04Å; H191-F212 HydrophobicContact CB-CB 4.21Å; C210-F212 PolarHBondContact O-N 3.11Å; F212-V214 HydrophobicContact CD2-CG2 3.31Å; F212-V214 HydrophobicContact CE2-CG2 3.23Å; F212-V214 HydrophobicContact CG-CG2 4.42Å; F212-V214 HydrophobicContact CZ-CG2 4.27Å; F212-V214 PolarHBondContact O-N 2.91Å
213	G	77.3	Confident	82.2	Confident	17 Å²	17	34 Å²	34	18%	0.175	20%	0.196	C	C	.	.			trans	-74	74.1	-168.8	0	0	0	0	0	115.9	H191	H191-G213 PolarHBondContact O-N 3.13Å
214	V	74.3	Confident	80.1	Confident	25 Å²	25	40.3 Å²	40.3	15%	0.152	23%	0.228	C	C	.	.			trans	-82.1	-36.5	178.5	-174.7	0	0	0	0	113.3	E117 V120 L121 I189 F212	E117-V214 WeakPolarHBondContact O-CG1 3.3Å; V120-V214 HydrophobicContact CB-CG1 3.78Å; V120-V214 HydrophobicContact CG1-CG1 4.16Å; L121-V214 HydrophobicContact CD2-CB 4.35Å; L121-V214 HydrophobicContact CD2-CG2 3.46Å; L121-V214 VanDerWaalsContact CD2-CG2 3.46Å; L121-V214 HydrophobicContact CG-CB 4.46Å; L121-V214 HydrophobicContact CG-CG1 4.45Å; L121-V214 HydrophobicContact CG-CG2 4.06Å; I189-V214 HydrophobicContact CD1-CG2 4.17Å; F212-V214 HydrophobicContact CD2-CG2 3.31Å; F212-V214 HydrophobicContact CE2-CG2 3.23Å; F212-V214 HydrophobicContact CG-CG2 4.42Å; F212-V214 HydrophobicContact CZ-CG2 4.27Å; F212-V214 PolarHBondContact O-N 2.91Å
215	S	76.4	Confident	77.9	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.021	23%	0.227	C	C	.	.			trans	-106.6	110.1	179.4	175.2	0	0	0	0	111.1	E117 Q217 L218 I219	E117-S215 WeakPolarHBondContact OE2-CA 3.17Å; E117-S215 VanDerWaalsContact OE2-CB 3.22Å; E117-S215 WeakPolarHBondContact OE2-CB 3.3Å; E117-S215 PolarHBondContact OE2-OG 2.84Å; S215-Q217 VanDerWaalsContact C-N 3.26Å; S215-Q217 PolarHBondContact O-N 2.77Å; S215-L218 PolarHBondContact O-N 3.35Å; S215-L218 WeakPolarHBondContact OG-CB 3.41Å; S215-L218 PolarHBondContact OG-N 2.82Å; S215-I219 WeakPolarHBondContact O-CD1 3.47Å; S215-I219 VanDerWaalsContact O-CG1 3.23Å; S215-I219 WeakPolarHBondContact O-CG1 3.41Å; S215-I219 PolarHBondContact O-N 2.52Å
216	G	73.4	Confident	76	Confident	29 Å²	29	40.1 Å²	40.1	30%	0.299	23%	0.232	S	C	.	.	H	α-helix	trans	-59.6	-39.7	173.3	0	0	0	0	0	111.5	E117 I219 D220	E117-G216 PolarHBondContact OE2-N 2.69Å; G216-I219 WeakPolarHBondContact O-CB 3.28Å; G216-I219 PolarHBondContact O-N 3.37Å; G216-D220 WeakPolarHBondContact O-CB 3.5Å; G216-D220 VanDerWaalsContact O-CG 3.22Å; G216-D220 PolarHBondContact O-N 3.36Å
217	Q	70.8	Confident	73.7	Confident	61 Å²	61	42.8 Å²	42.8	29%	0.285	25%	0.249	S	C	.	.	H	α-helix	trans	-65	-40.3	177	-69.3	-63.3	-23.4	0	0	112.8	Q113 I114 S215 D220 S221	Q113-Q217 HydrophobicContact CG-CG 4.15Å; I114-Q217 HydrophobicContact CD1-CB 4.4Å; I114-Q217 HydrophobicContact CG1-CB 3.77Å; S215-Q217 VanDerWaalsContact C-N 3.26Å; S215-Q217 PolarHBondContact O-N 2.77Å; Q217-D220 PolarHBondContact O-N 3.04Å; Q217-S221 VanDerWaalsContact O-CB 3.25Å; Q217-S221 WeakPolarHBondContact O-CB 3.33Å; Q217-S221 PolarHBondContact O-N 3.33Å; Q217-S221 PolarHBondContact O-OG 2.95Å
218	L	73.3	Confident	71.4	Confident	15 Å²	15	44.3 Å²	44.3	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-65.8	-42.8	174.8	-174.7	62.2	0	0	0	110.6	I102 L104 I114 L118 S215 S221 M222	I102-L218 HydrophobicContact CD1-CD1 4.4Å; I102-L218 HydrophobicContact CD1-CD2 4.26Å; L104-L218 HydrophobicContact CD1-CD1 3.47Å; L104-L218 VanDerWaalsContact CD1-CD1 3.47Å; I114-L218 HydrophobicContact CD1-CB 4.31Å; I114-L218 HydrophobicContact CD1-CD1 4.26Å; I114-L218 HydrophobicContact CG1-CB 4.37Å; I114-L218 HydrophobicContact CG2-CB 4.1Å; I114-L218 HydrophobicContact CG2-CD1 4.28Å; I114-L218 HydrophobicContact CG2-CD2 4.46Å; L118-L218 HydrophobicContact CD2-CD2 4.43Å; S215-L218 PolarHBondContact O-N 3.35Å; S215-L218 WeakPolarHBondContact OG-CB 3.41Å; S215-L218 PolarHBondContact OG-N 2.82Å; L218-S221 PolarHBondContact O-N 3.22Å; L218-M222 HydrophobicContact CD1-CG 4.44Å; L218-M222 HydrophobicContact CD1-SD 4.43Å; L218-M222 HydrophobicContact CG-CE 4.1Å; L218-M222 HydrophobicContact CG-SD 4.4Å; L218-M222 WeakPolarHBondContact O-CB 3.29Å; L218-M222 VanDerWaalsContact O-CG 3.3Å; L218-M222 WeakPolarHBondContact O-CG 3.41Å; L218-M222 PolarHBondContact O-N 3.35Å
219	I	72.9	Confident	69.6	Low	46 Å²	46	45.6 Å²	45.6	24%	0.236	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-50.2	175.2	-66.7	162.6	0	0	0	110.2	S215 G216 S221 M222 A223	S215-I219 WeakPolarHBondContact O-CD1 3.47Å; S215-I219 VanDerWaalsContact O-CG1 3.23Å; S215-I219 WeakPolarHBondContact O-CG1 3.41Å; S215-I219 PolarHBondContact O-N 2.52Å; G216-I219 WeakPolarHBondContact O-CB 3.28Å; G216-I219 PolarHBondContact O-N 3.37Å; I219-S221 VanDerWaalsContact C-N 3.33Å; I219-S221 PolarHBondContact O-N 2.76Å; I219-M222 CarbonylContact O-C 3.32Å; I219-M222 PolarHBondContact O-N 2.99Å; I219-A223 WeakPolarHBondContact O-CA 3.38Å; I219-A223 WeakPolarHBondContact O-CB 3.3Å; I219-A223 PolarHBondContact O-N 2.88Å
220	D	70	Confident	68.2	Low	94 Å²	94	49.9 Å²	49.9	50%	0.503	29%	0.293	S	S	.	.	H	α-helix	trans	-64.4	-38.9	-178.4	-67.9	-20.2	0	0	0	111.6	G216 Q217 M222 A223 N224	G216-D220 WeakPolarHBondContact O-CB 3.5Å; G216-D220 VanDerWaalsContact O-CG 3.22Å; G216-D220 PolarHBondContact O-N 3.36Å; Q217-D220 PolarHBondContact O-N 3.04Å; D220-M222 VanDerWaalsContact C-N 3.31Å; D220-M222 PolarHBondContact O-N 2.97Å; D220-A223 PolarHBondContact O-N 3.36Å; D220-N224 PolarHBondContact O-N 2.84Å
221	S	67.7	Low	67.6	Low	34 Å²	34	50.4 Å²	50.4	24%	0.238	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-34	176.1	-59.2	0	0	0	0	112.2	Q217 L218 I219	Q217-S221 VanDerWaalsContact O-CB 3.25Å; Q217-S221 WeakPolarHBondContact O-CB 3.33Å; Q217-S221 PolarHBondContact O-N 3.33Å; Q217-S221 PolarHBondContact O-OG 2.95Å; L218-S221 PolarHBondContact O-N 3.22Å; I219-S221 VanDerWaalsContact C-N 3.33Å; I219-S221 PolarHBondContact O-N 2.76Å
222	M	67.6	Low	67.9	Low	48 Å²	48	49.3 Å²	49.3	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-86.7	-27.9	175.5	-66	-168.6	-52.4	0	0	113.3	I102 L218 I219 D220 N224 S225 F226	I102-M222 HydrophobicContact CG2-SD 4.41Å; L218-M222 HydrophobicContact CD1-CG 4.44Å; L218-M222 HydrophobicContact CD1-SD 4.43Å; L218-M222 HydrophobicContact CG-CE 4.1Å; L218-M222 HydrophobicContact CG-SD 4.4Å; L218-M222 WeakPolarHBondContact O-CB 3.29Å; L218-M222 VanDerWaalsContact O-CG 3.3Å; L218-M222 WeakPolarHBondContact O-CG 3.41Å; L218-M222 PolarHBondContact O-N 3.35Å; I219-M222 CarbonylContact O-C 3.32Å; I219-M222 PolarHBondContact O-N 2.99Å; D220-M222 VanDerWaalsContact C-N 3.31Å; D220-M222 PolarHBondContact O-N 2.97Å; M222-N224 VanDerWaalsContact C-N 3.32Å; M222-N224 PolarHBondContact O-N 3.4Å; M222-S225 PolarHBondContact O-N 3.28Å; M222-S225 PolarHBondContact O-OG 3.45Å; M222-F226 WeakPolarHBondContact O-CD2 3.32Å
223	A	57.7	Low	68.2	Low	46 Å²	46	50 Å²	50	38%	0.38	29%	0.293	S	S	.	.	H	α-helix	trans	-71.9	-27.9	-173.4	0	0	0	0	0	112.5	I219 D220 S225	I219-A223 WeakPolarHBondContact O-CA 3.38Å; I219-A223 WeakPolarHBondContact O-CB 3.3Å; I219-A223 PolarHBondContact O-N 2.88Å; D220-A223 PolarHBondContact O-N 3.36Å; A223-S225 PolarHBondContact O-N 3.13Å
224	N	49.8	Very low	69	Low	156 Å²	156	49.2 Å²	49.2	83%	0.834	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-10.1	176.8	-77.3	-26	0	0	0	113.9	D220 M222	D220-N224 PolarHBondContact O-N 2.84Å; M222-N224 VanDerWaalsContact C-N 3.32Å; M222-N224 PolarHBondContact O-N 3.4Å
225	S	49.6	Very low	70	Confident	64 Å²	64	48.2 Å²	48.2	45%	0.448	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-10.8	-173.2	38.7	0	0	0	0	115.8	M222 A223	M222-S225 PolarHBondContact O-N 3.28Å; M222-S225 PolarHBondContact O-OG 3.45Å; A223-S225 PolarHBondContact O-N 3.13Å
226	F	54.7	Low	70.9	Confident	77 Å²	77	48.3 Å²	48.3	34%	0.338	28%	0.279	S	S	.	.			trans	-137.5	138.7	-163.7	-51.6	-61.5	0	0	0	118.1	N81 M222 R230	N81-F226 HydrophobicContact CB-CB 4.34Å; N81-F226 HydrophobicContact CB-CD1 4.44Å; N81-F226 HydrophobicContact CB-CD2 4.19Å; N81-F226 HydrophobicContact CB-CG 4.06Å; N81-F226 VanDerWaalsContact O-CE2 3.3Å; N81-F226 WeakPolarHBondContact O-CE2 3.36Å; M222-F226 WeakPolarHBondContact O-CD2 3.32Å; F226-R230 PolarHBondContact O-NE 3.05Å
227	V	48.7	Very low	71.7	Confident	75 Å²	75	48.9 Å²	48.9	46%	0.455	27%	0.272	S	S	.	.	S	Bend	trans	-104.4	-35.4	-169.9	175.1	0	0	0	0	111.9	T229 R230 I319	V227-T229 PolarHBondContact O-N 2.87Å; V227-R230 WeakPolarHBondContact O-CB 3.5Å; V227-R230 PolarHBondContact O-N 3.43Å; V227-I319 HydrophobicContact CG1-CB 3.71Å; V227-I319 HydrophobicContact CG1-CD1 4Å; V227-I319 HydrophobicContact CG1-CG1 3.4Å; V227-I319 HydrophobicContact CG1-CG2 3.62Å
228	G	51.2	Low	72.6	Confident	45 Å²	45	48.2 Å²	48.2	46%	0.464	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-74	-19.2	-172.9	0	0	0	0	0	116.4	R230	G228-R230 PolarHBondContact O-N 2.99Å
229	T	59.6	Low	73.3	Confident	40 Å²	40	53.1 Å²	53.1	25%	0.245	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-75.9	-12.9	176.2	-54.1	0	0	0	0	112.4	N81 D193 V227	N81-T229 PolarHBondContact ND2-OG1 2.95Å; D193-T229 WeakPolarHBondContact OD1-CG2 3.41Å; V227-T229 PolarHBondContact O-N 2.87Å
230	R	69.4	Low	73.8	Confident	91 Å²	91	54.2 Å²	54.2	34%	0.343	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-81.7	-14.5	-172.7	-57.8	-179.4	-172.9	-178.7	-2.3	113.8	F226 V227 G228 Y232 M233 L323	F226-R230 PolarHBondContact O-NE 3.05Å; V227-R230 WeakPolarHBondContact O-CB 3.5Å; V227-R230 PolarHBondContact O-N 3.43Å; G228-R230 PolarHBondContact O-N 2.99Å; R230-Y232 VanDerWaalsContact C-N 3.29Å; R230-Y232 PolarHBondContact O-N 2.57Å; R230-M233 HydrophobicContact CB-CE 4.47Å; R230-M233 HydrophobicContact CG-CE 4.16Å; R230-M233 WeakPolarHBondContact O-CB 3.49Å; R230-M233 PolarHBondContact O-N 3.28Å; R230-L323 HydrophobicContact CB-CD2 3.82Å
231	S	83.3	Confident	74.5	Confident	18 Å²	18	52.9 Å²	52.9	13%	0.126	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-60.4	-34.7	-176.4	-53	0	0	0	0	113.3	M233 L254 Y264 L322 I326	S231-M233 VanDerWaalsContact C-N 3.34Å; S231-L254 WeakPolarHBondContact O-CD2 3.18Å; S231-Y264 WeakPolarHBondContact CB-OH 3.25Å; S231-Y264 PolarHBondContact O-OH 3.48Å; S231-L322 WeakPolarHBondContact OG-CD2 3.46Å; S231-I326 VanDerWaalsContact O-CD1 3.24Å; S231-I326 WeakPolarHBondContact O-CD1 3.23Å
232	Y	92.9	Very high	75.2	Confident	31 Å²	31	59.7 Å²	59.7	12%	0.122	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-91.2	1.7	178.1	-56.6	-91.6	0	0	0	113.4	K195 R230 S251 L254 E258 Y264	K195-Y232 HydrophobicContact CB-CD1 4.1Å; K195-Y232 HydrophobicContact CB-CD2 3.75Å; K195-Y232 HydrophobicContact CB-CE1 4.27Å; K195-Y232 HydrophobicContact CB-CE2 3.94Å; K195-Y232 HydrophobicContact CB-CG 3.86Å; K195-Y232 HydrophobicContact CD-CD2 4.1Å; K195-Y232 HydrophobicContact CD-CE2 4.25Å; R230-Y232 VanDerWaalsContact C-N 3.29Å; R230-Y232 PolarHBondContact O-N 2.57Å; Y232-S251 WeakPolarHBondContact O-CB 3.49Å; Y232-S251 PolarHBondContact O-OG 2.79Å; Y232-L254 HydrophobicContact CD1-CB 4.38Å; Y232-L254 HydrophobicContact CD1-CD2 3.88Å; Y232-L254 HydrophobicContact CD1-CG 4.35Å; Y232-L254 HydrophobicContact CE1-CD2 4.49Å; Y232-L254 HydrophobicContact CG-CD2 4.43Å; Y232-E258 VanDerWaalsContact CE1-OE2 3.28Å; Y232-E258 WeakPolarHBondContact CE1-OE2 3.49Å; Y232-E258 PolarHBondContact OH-OE1 2.96Å; Y232-E258 PolarHBondContact OH-OE2 3.34Å; Y232-Y264 HydrophobicContact CD1-CE2 4.39Å; Y232-Y264 HydrophobicContact CE1-CD2 4.12Å; Y232-Y264 AromaticContact CE1-CE2 3.83Å; Y232-Y264 HydrophobicContact CE1-CE2 3.83Å; Y232-Y264 HydrophobicContact CE2-CE2 4.34Å; Y232-Y264 AromaticContact CZ-CD2 3.92Å; Y232-Y264 AromaticContact CZ-CE2 3.79Å
233	M	92.3	Very high	76.1	Confident	36 Å²	36	61 Å²	61	18%	0.177	34%	0.341	C	S	.	.			trans	-70.4	139.5	-177.3	-165.8	172.5	-61.2	0	0	110	R230 S231 R237 L238 W250	R230-M233 HydrophobicContact CB-CE 4.47Å; R230-M233 HydrophobicContact CG-CE 4.16Å; R230-M233 WeakPolarHBondContact O-CB 3.49Å; R230-M233 PolarHBondContact O-N 3.28Å; S231-M233 VanDerWaalsContact C-N 3.34Å; M233-R237 HydrophobicContact CG-CB 3.45Å; M233-R237 VanDerWaalsContact CG-CB 3.45Å; M233-R237 HydrophobicContact CG-CG 4.38Å; M233-R237 HydrophobicContact SD-CB 3.75Å; M233-L238 HydrophobicContact CB-CD2 3.95Å; M233-L238 HydrophobicContact CB-CG 4.09Å; M233-L238 HydrophobicContact CG-CD2 4.03Å; M233-L238 HydrophobicContact CG-CG 4.05Å; M233-L238 HydrophobicContact SD-CD2 3.64Å; M233-L238 HydrophobicContact SD-CG 4.16Å; M233-W250 PolarHBondContact O-NE1 2.7Å
234	S	94.8	Very high	77.7	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.339	C	S	.	.			trans	-71.3	155.4	178.8	63.3	0	0	0	0	112.4	E236 R237 L238 S247 W250	S234-E236 VanDerWaalsContact C-N 3.28Å; S234-E236 VanDerWaalsContact CB-CD 3.42Å; S234-E236 WeakPolarHBondContact CB-OE1 3.22Å; S234-E236 VanDerWaalsContact CB-OE2 3.29Å; S234-E236 WeakPolarHBondContact CB-OE2 3.41Å; S234-E236 PolarHBondContact O-N 2.98Å; S234-E236 PolarHBondContact OG-OE1 3.09Å; S234-E236 PolarHBondContact OG-OE2 3.12Å; S234-R237 PolarHBondContact O-N 2.93Å; S234-R237 VanDerWaalsContact O-N 3.15Å; S234-R237 WeakPolarHBondContact OG-CG 3.49Å; S234-L238 PolarHBondContact O-N 3.42Å; S234-L238 VanDerWaalsContact O-N 3.1Å; S234-S247 VanDerWaalsContact OG-CB 3.24Å; S234-S247 WeakPolarHBondContact OG-CB 3.18Å; S234-S247 PolarHBondContact OG-OG 2.88Å; S234-S247 VanDerWaalsContact OG-OG 3.09Å; S234-W250 VanDerWaalsContact CA-CD1 3.44Å
235	P	95.1	Very high	79.7	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-56	-42.8	-178	-24.8	33.3	0	0	0	112.6	R237 L238 Q239 W250 I326 K353	P235-R237 VanDerWaalsContact C-N 3.3Å; P235-R237 PolarHBondContact O-N 3.02Å; P235-L238 PolarHBondContact O-N 3.41Å; P235-Q239 WeakPolarHBondContact O-CG 3.19Å; P235-Q239 PolarHBondContact O-N 2.81Å; P235-W250 HydrophobicContact CG-CD2 4.5Å; P235-W250 HydrophobicContact CG-CE3 4.29Å; P235-W250 HydrophobicContact CG-CH2 3.7Å; P235-W250 HydrophobicContact CG-CZ2 3.93Å; P235-W250 HydrophobicContact CG-CZ3 3.88Å; P235-I326 HydrophobicContact CB-CG2 4.49Å; P235-I326 HydrophobicContact CG-CG2 3.93Å; P235-K353 HydrophobicContact CG-CB 4.39Å; P235-K353 HydrophobicContact CG-CG 4.35Å
236	E	94.2	Very high	81.9	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.023	29%	0.288	C	S	.	.	H	α-helix	trans	-65	-33.4	-177.6	72.4	-83.1	178.6	0	0	112.6	S234 G240 T241 S247 P355 R358	S234-E236 VanDerWaalsContact C-N 3.28Å; S234-E236 VanDerWaalsContact CB-CD 3.42Å; S234-E236 WeakPolarHBondContact CB-OE1 3.22Å; S234-E236 VanDerWaalsContact CB-OE2 3.29Å; S234-E236 WeakPolarHBondContact CB-OE2 3.41Å; S234-E236 PolarHBondContact O-N 2.98Å; S234-E236 PolarHBondContact OG-OE1 3.09Å; S234-E236 PolarHBondContact OG-OE2 3.12Å; E236-G240 PolarHBondContact O-N 3.02Å; E236-T241 WeakPolarHBondContact CA-OG1 3.46Å; E236-T241 VanDerWaalsContact CB-OG1 3.32Å; E236-T241 WeakPolarHBondContact CB-OG1 3.37Å; E236-T241 PolarHBondContact O-N 2.86Å; E236-T241 PolarHBondContact O-OG1 3.26Å; E236-S247 WeakPolarHBondContact OE1-CA 3.36Å; E236-S247 WeakPolarHBondContact OE1-CB 3.27Å; E236-S247 PolarHBondContact OE1-OG 2.94Å; E236-P355 HydrophobicContact CB-CG 4.06Å; E236-P355 HydrophobicContact CG-CB 4.19Å; E236-P355 HydrophobicContact CG-CG 4.01Å; E236-R358 IonicContact OE1-CZ 3.88Å; E236-R358 IonicContact OE1-NH1 2.77Å; E236-R358 PolarHBondContact OE1-NH1 3.28Å; E236-R358 IonicContact OE1-NH2 2.78Å; E236-R358 IonicContact OE2-CZ 3.86Å; E236-R358 IonicContact OE2-NH1 2.87Å; E236-R358 PolarHBondContact OE2-NH1 2.88Å; E236-R358 IonicContact OE2-NH2 2.84Å; E236-R358 PolarHBondContact OE2-NH2 2.98Å
237	R	90.9	Very high	83.8	Confident	41 Å²	41	48.9 Å²	48.9	16%	0.155	27%	0.272	C	S	.	.	H	α-helix	trans	-72.2	-40.3	174.3	-78.8	179	66.7	-168.1	4	112.1	R192 M233 S234 P235 Q239 G240 Y243 S247	R192-R237 PolarHBondContact O-NH1 2.93Å; R192-R237 PolarHBondContact O-NH2 3.49Å; M233-R237 HydrophobicContact CG-CB 3.45Å; M233-R237 VanDerWaalsContact CG-CB 3.45Å; M233-R237 HydrophobicContact CG-CG 4.38Å; M233-R237 HydrophobicContact SD-CB 3.75Å; S234-R237 PolarHBondContact O-N 2.93Å; S234-R237 VanDerWaalsContact O-N 3.15Å; S234-R237 WeakPolarHBondContact OG-CG 3.49Å; P235-R237 VanDerWaalsContact C-N 3.3Å; P235-R237 PolarHBondContact O-N 3.02Å; R237-Q239 PolarHBondContact O-N 3.17Å; R237-G240 PolarHBondContact O-N 2.88Å; R237-G240 VanDerWaalsContact O-N 3.07Å; R237-Y243 HydrophobicContact CG-CD1 3.82Å; R237-Y243 HydrophobicContact CG-CD2 3.9Å; R237-Y243 HydrophobicContact CG-CE1 4.48Å; R237-Y243 HydrophobicContact CG-CG 3.5Å; R237-Y243 VanDerWaalsContact CG-CG 3.5Å; R237-S247 WeakPolarHBondContact CD-OG 3.25Å
238	L	89.3	Confident	86.1	Confident	47 Å²	47	45.4 Å²	45.4	25%	0.246	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-32.7	176.7	-69.4	174.5	0	0	0	112.1	M233 S234 P235 G240 L323 I326 V327	M233-L238 HydrophobicContact CB-CD2 3.95Å; M233-L238 HydrophobicContact CB-CG 4.09Å; M233-L238 HydrophobicContact CG-CD2 4.03Å; M233-L238 HydrophobicContact CG-CG 4.05Å; M233-L238 HydrophobicContact SD-CD2 3.64Å; M233-L238 HydrophobicContact SD-CG 4.16Å; S234-L238 PolarHBondContact O-N 3.42Å; S234-L238 VanDerWaalsContact O-N 3.1Å; P235-L238 PolarHBondContact O-N 3.41Å; L238-G240 VanDerWaalsContact C-N 3.26Å; L238-G240 PolarHBondContact O-N 2.99Å; L238-L323 HydrophobicContact CD1-CB 4.41Å; L238-L323 HydrophobicContact CD1-CD2 4.09Å; L238-L323 HydrophobicContact CD2-CD1 4.35Å; L238-L323 HydrophobicContact CD2-CD2 3.8Å; L238-L323 HydrophobicContact CD2-CG 4.47Å; L238-I326 HydrophobicContact CD1-CB 3.92Å; L238-I326 HydrophobicContact CD1-CD1 4.19Å; L238-I326 HydrophobicContact CD1-CG2 3.6Å; L238-V327 HydrophobicContact CB-CG2 3.86Å; L238-V327 HydrophobicContact CD1-CG2 4Å
239	Q	87.1	Confident	88.4	Confident	117 Å²	117	43.3 Å²	43.3	55%	0.547	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-4.7	175	-68	174.4	-31.2	0	0	113.6	P235 R237 T241 V327	P235-Q239 WeakPolarHBondContact O-CG 3.19Å; P235-Q239 PolarHBondContact O-N 2.81Å; R237-Q239 PolarHBondContact O-N 3.17Å; Q239-T241 VanDerWaalsContact C-N 3.28Å; Q239-T241 HydrophobicContact CB-CG2 4.04Å; Q239-T241 PolarHBondContact O-N 3.37Å; Q239-V327 HydrophobicContact CG-CG1 3.92Å; Q239-V327 HydrophobicContact CG-CG2 4.34Å
240	G	84.8	Confident	90.2	Very high	69 Å²	69	41.5 Å²	41.5	71%	0.711	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	71	19.7	-178.7	0	0	0	0	0	114.5	E236 R237 L238	E236-G240 PolarHBondContact O-N 3.02Å; R237-G240 PolarHBondContact O-N 2.88Å; R237-G240 VanDerWaalsContact O-N 3.07Å; L238-G240 VanDerWaalsContact C-N 3.26Å; L238-G240 PolarHBondContact O-N 2.99Å
241	T	84.3	Confident	91.6	Very high	66 Å²	66	37.2 Å²	37.2	41%	0.405	20%	0.202	S	C	.	.			trans	-80.2	171.6	177.5	66.5	0	0	0	0	111.3	E236 Q239 Y243	E236-T241 WeakPolarHBondContact CA-OG1 3.46Å; E236-T241 VanDerWaalsContact CB-OG1 3.32Å; E236-T241 WeakPolarHBondContact CB-OG1 3.37Å; E236-T241 PolarHBondContact O-N 2.86Å; E236-T241 PolarHBondContact O-OG1 3.26Å; Q239-T241 VanDerWaalsContact C-N 3.28Å; Q239-T241 HydrophobicContact CB-CG2 4.04Å; Q239-T241 PolarHBondContact O-N 3.37Å; T241-Y243 PolarHBondContact O-N 2.85Å
242	H	82.6	Confident	92.3	Very high	178 Å²	178	36.5 Å²	36.5	82%	0.824	20%	0.196	S	C	*	.			trans	-64.1	128.9	175.7	-173.6	57.2	0	0	0	110.2
243	Y	85.9	Confident	92.5	Very high	75 Å²	75	35 Å²	35	29%	0.294	19%	0.191	S	C	.	.			trans	-126.6	155.8	-176.5	65.6	-93.5	0	0	0	111.4	M190 R237 T241 S247	M190-Y243 HydrophobicContact CE-CE2 4.24Å; M190-Y243 HydrophobicContact SD-CD2 4.32Å; M190-Y243 HydrophobicContact SD-CE2 4.45Å; R237-Y243 HydrophobicContact CG-CD1 3.82Å; R237-Y243 HydrophobicContact CG-CD2 3.9Å; R237-Y243 HydrophobicContact CG-CE1 4.48Å; R237-Y243 HydrophobicContact CG-CG 3.5Å; R237-Y243 VanDerWaalsContact CG-CG 3.5Å; T241-Y243 PolarHBondContact O-N 2.85Å; Y243-S247 WeakPolarHBondContact CB-OG 3.34Å
244	S	90.5	Very high	92.8	Very high	47 Å²	47	33.3 Å²	33.3	33%	0.329	18%	0.182	S	C	.	.			trans	-138.7	-167.1	-175.9	71.8	0	0	0	0	110.3	M190 Q246 S247	M190-S244 VanDerWaalsContact SD-CA 3.52Å; S244-Q246 PolarHBondContact O-N 3.26Å; S244-Q246 VanDerWaalsContact OG-CG 3.31Å; S244-Q246 WeakPolarHBondContact OG-CG 3.28Å; S244-Q246 PolarHBondContact OG-N 3.38Å; S244-S247 WeakPolarHBondContact O-CB 3.23Å; S244-S247 PolarHBondContact O-N 3.28Å; S244-S247 PolarHBondContact O-OG 3.49Å
245	V	92.1	Very high	93	Very high	19 Å²	19	33.4 Å²	33.4	12%	0.115	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-19.6	173.4	71.3	0	0	0	0	113	S247 D248 V249 L361	V245-S247 PolarHBondContact O-N 2.84Å; V245-D248 WeakPolarHBondContact O-CB 3.34Å; V245-D248 PolarHBondContact O-N 2.96Å; V245-V249 PolarHBondContact O-N 3.11Å; V245-L361 HydrophobicContact CG2-CD1 3.79Å; V245-L361 HydrophobicContact CG2-CG 4.25Å
246	Q	96	Very high	93.2	Very high	22 Å²	22	33.4 Å²	33.4	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-55.9	-31.4	172	-61.5	-59.1	94.5	0	0	112.3	S244 D248 V249 W250 P355 R358 A359	S244-Q246 PolarHBondContact O-N 3.26Å; S244-Q246 VanDerWaalsContact OG-CG 3.31Å; S244-Q246 WeakPolarHBondContact OG-CG 3.28Å; S244-Q246 PolarHBondContact OG-N 3.38Å; Q246-D248 VanDerWaalsContact C-N 3.34Å; Q246-V249 WeakPolarHBondContact O-CB 3.23Å; Q246-V249 PolarHBondContact O-N 3.02Å; Q246-W250 PolarHBondContact O-N 3.33Å; Q246-P355 HydrophobicContact CB-CB 4.15Å; Q246-P355 PolarHBondContact NE2-O 2.83Å; Q246-P355 VanDerWaalsContact NE2-O 3.12Å; Q246-R358 VanDerWaalsContact C-NH1 3.33Å; Q246-R358 PolarHBondContact NE2-O 3.41Å; Q246-R358 VanDerWaalsContact O-CD 3.28Å; Q246-R358 WeakPolarHBondContact O-CD 3.35Å; Q246-R358 PolarHBondContact O-NH1 3.47Å; Q246-A359 PolarHBondContact NE2-O 3.09Å
247	S	95.4	Very high	93.4	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	18%	0.181	C	C	.	.	H	α-helix	trans	-68.4	-34	175.8	-56.5	0	0	0	0	112.9	S234 E236 R237 Y243 S244 V245 V249 W250 S251	S234-S247 VanDerWaalsContact OG-CB 3.24Å; S234-S247 WeakPolarHBondContact OG-CB 3.18Å; S234-S247 PolarHBondContact OG-OG 2.88Å; S234-S247 VanDerWaalsContact OG-OG 3.09Å; E236-S247 WeakPolarHBondContact OE1-CA 3.36Å; E236-S247 WeakPolarHBondContact OE1-CB 3.27Å; E236-S247 PolarHBondContact OE1-OG 2.94Å; R237-S247 WeakPolarHBondContact CD-OG 3.25Å; Y243-S247 WeakPolarHBondContact CB-OG 3.34Å; S244-S247 WeakPolarHBondContact O-CB 3.23Å; S244-S247 PolarHBondContact O-N 3.28Å; S244-S247 PolarHBondContact O-OG 3.49Å; V245-S247 PolarHBondContact O-N 2.84Å; S247-V249 VanDerWaalsContact C-N 3.31Å; S247-W250 PolarHBondContact O-N 2.87Å; S247-S251 PolarHBondContact O-N 3.2Å; S247-S251 VanDerWaalsContact O-N 3.16Å; S247-S251 PolarHBondContact O-OG 3.47Å; S247-S251 VanDerWaalsContact O-OG 3.12Å
248	D	96.6	Very high	93.7	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.011	18%	0.179	C	C	.	.	H	α-helix	trans	-69.2	-34.1	175	-63.9	-31.6	0	0	0	110.8	L180 H191 R192 V194 V245 Q246 S251 M252	L180-D248 HydrophobicContact CD1-CB 3.99Å; L180-D248 HydrophobicContact CD2-CB 3.96Å; H191-D248 PolarHBondContact N-OD2 3.44Å; R192-D248 WeakPolarHBondContact CA-OD1 3.31Å; R192-D248 PolarHBondContact N-OD1 3.1Å; V194-D248 HydrophobicContact CG2-CB 4.09Å; V245-D248 WeakPolarHBondContact O-CB 3.34Å; V245-D248 PolarHBondContact O-N 2.96Å; Q246-D248 VanDerWaalsContact C-N 3.34Å; D248-S251 PolarHBondContact O-N 3.25Å; D248-M252 WeakPolarHBondContact O-CB 3.44Å; D248-M252 PolarHBondContact O-N 2.94Å
249	V	98.4	Very high	94.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-43.2	173.2	170.7	0	0	0	0	111.7	V245 Q246 S247 M252 G253 C350 R358 L361 L364	V245-V249 PolarHBondContact O-N 3.11Å; Q246-V249 WeakPolarHBondContact O-CB 3.23Å; Q246-V249 PolarHBondContact O-N 3.02Å; S247-V249 VanDerWaalsContact C-N 3.31Å; V249-M252 PolarHBondContact O-N 3.44Å; V249-G253 PolarHBondContact O-N 3.28Å; V249-C350 HydrophobicContact CG1-CB 3.98Å; V249-R358 HydrophobicContact CG1-CG 4.07Å; V249-L361 HydrophobicContact CG2-CD2 3.89Å; V249-L364 HydrophobicContact CB-CD1 4.42Å; V249-L364 HydrophobicContact CG1-CD1 3.53Å; V249-L364 HydrophobicContact CG2-CD1 4.04Å
250	W	98.3	Very high	94.7	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-59.8	-50.2	173.9	170.4	-80.7	0	0	0	111.5	M233 S234 P235 Q246 S247 M252 G253 L254 I326 P331 C350 L351 K353	M233-W250 PolarHBondContact O-NE1 2.7Å; S234-W250 VanDerWaalsContact CA-CD1 3.44Å; P235-W250 HydrophobicContact CG-CD2 4.5Å; P235-W250 HydrophobicContact CG-CE3 4.29Å; P235-W250 HydrophobicContact CG-CH2 3.7Å; P235-W250 HydrophobicContact CG-CZ2 3.93Å; P235-W250 HydrophobicContact CG-CZ3 3.88Å; Q246-W250 PolarHBondContact O-N 3.33Å; S247-W250 PolarHBondContact O-N 2.87Å; W250-M252 VanDerWaalsContact C-N 3.27Å; W250-M252 PolarHBondContact O-N 3.25Å; W250-G253 PolarHBondContact O-N 3.37Å; W250-L254 PolarHBondContact O-N 2.96Å; W250-I326 HydrophobicContact CZ2-CG2 3.95Å; W250-P331 HydrophobicContact CH2-CB 4.04Å; W250-P331 HydrophobicContact CZ3-CB 4.33Å; W250-C350 WeakPolarHBondContact CA-O 3.24Å; W250-L351 HydrophobicContact CD2-CD2 3.93Å; W250-L351 HydrophobicContact CE3-CD2 4.03Å; W250-L351 HydrophobicContact CG-CD2 4.39Å; W250-L351 HydrophobicContact CZ2-CD2 4.41Å; W250-L351 HydrophobicContact CZ3-CB 4.38Å; W250-L351 HydrophobicContact CZ3-CD2 4.35Å; W250-L351 WeakPolarHBondContact CZ3-O 3.49Å; W250-K353 HydrophobicContact CH2-CG 4.09Å; W250-K353 HydrophobicContact CZ3-CG 3.9Å
251	S	97.8	Very high	95.2	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.007	11%	0.109	C	C	.	.	H	α-helix	trans	-60.2	-38.2	-179.4	-58.8	0	0	0	0	111.8	V194 Y232 S247 D248 S255	V194-S251 VanDerWaalsContact O-CB 3.31Å; V194-S251 WeakPolarHBondContact O-CB 3.26Å; Y232-S251 WeakPolarHBondContact O-CB 3.49Å; Y232-S251 PolarHBondContact O-OG 2.79Å; S247-S251 PolarHBondContact O-N 3.2Å; S247-S251 VanDerWaalsContact O-N 3.16Å; S247-S251 PolarHBondContact O-OG 3.47Å; S247-S251 VanDerWaalsContact O-OG 3.12Å; D248-S251 PolarHBondContact O-N 3.25Å; S251-S255 WeakPolarHBondContact O-CB 3.39Å; S251-S255 PolarHBondContact O-N 3.17Å; S251-S255 PolarHBondContact O-OG 3.48Å
252	M	98.5	Very high	95.8	Very high	3 Å²	3	19.9 Å²	19.9	2%	0.015	11%	0.106	C	C	.	.	H	α-helix	trans	-61.4	-49.3	170.6	176	-178.6	167	0	0	111.8	V176 L177 V194 D248 V249 W250 L254 S255 L256 F346	V176-M252 HydrophobicContact CB-CE 4.4Å; V176-M252 HydrophobicContact CB-SD 4.08Å; V176-M252 HydrophobicContact CG1-CB 4.3Å; V176-M252 HydrophobicContact CG1-CG 3.89Å; V176-M252 HydrophobicContact CG1-SD 3.59Å; V176-M252 VanDerWaalsContact CG1-SD 3.59Å; L177-M252 HydrophobicContact CD1-CE 4.44Å; L177-M252 HydrophobicContact CD2-CE 4.28Å; L177-M252 HydrophobicContact CD2-SD 3.85Å; L177-M252 HydrophobicContact CG-CE 3.9Å; L177-M252 HydrophobicContact CG-SD 4Å; V194-M252 HydrophobicContact CG1-CB 4.23Å; D248-M252 WeakPolarHBondContact O-CB 3.44Å; D248-M252 PolarHBondContact O-N 2.94Å; V249-M252 PolarHBondContact O-N 3.44Å; W250-M252 VanDerWaalsContact C-N 3.27Å; W250-M252 PolarHBondContact O-N 3.25Å; M252-L254 VanDerWaalsContact C-N 3.3Å; M252-L254 PolarHBondContact O-N 3.34Å; M252-S255 WeakPolarHBondContact O-CB 3.42Å; M252-S255 PolarHBondContact O-N 3.33Å; M252-L256 HydrophobicContact CE-CD1 3.74Å; M252-L256 HydrophobicContact CG-CD1 4.15Å; M252-L256 HydrophobicContact CG-CG 4.5Å; M252-L256 WeakPolarHBondContact O-CG 3.4Å; M252-L256 PolarHBondContact O-N 2.97Å; M252-F346 HydrophobicContact CE-CE1 3.85Å; M252-F346 HydrophobicContact CE-CZ 3.75Å
253	G	98.6	Very high	96.3	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-56.1	-44.6	178.1	0	0	0	0	0	112.4	V249 W250 L256 V257	V249-G253 PolarHBondContact O-N 3.28Å; W250-G253 PolarHBondContact O-N 3.37Å; G253-L256 PolarHBondContact O-N 3.37Å; G253-V257 WeakPolarHBondContact O-CG2 3.09Å; G253-V257 PolarHBondContact O-N 3.44Å; G253-V257 VanDerWaalsContact O-N 3.17Å
254	L	98.1	Very high	96.7	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-66	-41.4	179.3	-160.7	71.2	0	0	0	111.7	S231 Y232 W250 M252 L256 V257 E258 Y264 P265 I266 P332 L351	S231-L254 WeakPolarHBondContact O-CD2 3.18Å; Y232-L254 HydrophobicContact CD1-CB 4.38Å; Y232-L254 HydrophobicContact CD1-CD2 3.88Å; Y232-L254 HydrophobicContact CD1-CG 4.35Å; Y232-L254 HydrophobicContact CE1-CD2 4.49Å; Y232-L254 HydrophobicContact CG-CD2 4.43Å; W250-L254 PolarHBondContact O-N 2.96Å; M252-L254 VanDerWaalsContact C-N 3.3Å; M252-L254 PolarHBondContact O-N 3.34Å; L254-L256 VanDerWaalsContact C-N 3.31Å; L254-L256 PolarHBondContact O-N 3.49Å; L254-V257 PolarHBondContact O-N 2.73Å; L254-E258 PolarHBondContact O-N 2.72Å; L254-E258 VanDerWaalsContact O-N 3.09Å; L254-Y264 HydrophobicContact CD2-CE2 4.05Å; L254-P265 HydrophobicContact CD1-CG 3.53Å; L254-P265 HydrophobicContact CG-CG 3.93Å; L254-I266 HydrophobicContact CD1-CD1 3.97Å; L254-I266 HydrophobicContact CD1-CG1 4.34Å; L254-P332 HydrophobicContact CD1-CG 3.5Å; L254-L351 HydrophobicContact CB-CD2 4.24Å; L254-L351 HydrophobicContact CD1-CD2 4.42Å
255	S	98.4	Very high	96.9	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.014	6%	0.061	C	C	.	.	H	α-helix	trans	-60.5	-40.5	175.3	-55.7	0	0	0	0	111.8	K195 S251 M252 E258 L259	K195-S255 WeakPolarHBondContact CA-OG 3.32Å; S251-S255 WeakPolarHBondContact O-CB 3.39Å; S251-S255 PolarHBondContact O-N 3.17Å; S251-S255 PolarHBondContact O-OG 3.48Å; M252-S255 WeakPolarHBondContact O-CB 3.42Å; M252-S255 PolarHBondContact O-N 3.33Å; S255-E258 PolarHBondContact O-N 3.28Å; S255-L259 WeakPolarHBondContact O-CB 3.44Å; S255-L259 WeakPolarHBondContact O-CD1 3.42Å; S255-L259 WeakPolarHBondContact O-CG 3.37Å; S255-L259 PolarHBondContact O-N 3.21Å
256	L	98.8	Very high	96.9	Very high	4 Å²	4	11.4 Å²	11.4	2%	0.021	6%	0.058	C	C	.	.	H	α-helix	trans	-67.2	-39.2	179.1	-70.7	172.1	0	0	0	112.4	L169 S173 M252 G253 L254 E258 L259 A260 F343 F346 V347	L169-L256 HydrophobicContact CB-CD2 4.36Å; L169-L256 HydrophobicContact CD2-CD2 4.12Å; S173-L256 WeakPolarHBondContact OG-CD1 3.18Å; S173-L256 WeakPolarHBondContact OG-CD2 3.28Å; M252-L256 HydrophobicContact CE-CD1 3.74Å; M252-L256 HydrophobicContact CG-CD1 4.15Å; M252-L256 HydrophobicContact CG-CG 4.5Å; M252-L256 WeakPolarHBondContact O-CG 3.4Å; M252-L256 PolarHBondContact O-N 2.97Å; G253-L256 PolarHBondContact O-N 3.37Å; L254-L256 VanDerWaalsContact C-N 3.31Å; L254-L256 PolarHBondContact O-N 3.49Å; L256-E258 VanDerWaalsContact C-N 3.35Å; L256-L259 PolarHBondContact O-N 3.09Å; L256-A260 WeakPolarHBondContact O-CB 3.44Å; L256-A260 PolarHBondContact O-N 3Å; L256-F343 HydrophobicContact CB-CE2 4.41Å; L256-F343 HydrophobicContact CB-CZ 4.39Å; L256-F343 HydrophobicContact CD1-CE2 4.49Å; L256-F346 HydrophobicContact CD1-CD1 4.22Å; L256-F346 HydrophobicContact CD1-CE1 3.64Å; L256-V347 HydrophobicContact CB-CG2 4.21Å; L256-V347 HydrophobicContact CD1-CG2 4.48Å
257	V	98.4	Very high	96.7	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.1	-45.9	174.1	-176.9	0	0	0	0	110.4	G253 L254 L259 A260 I261 P265 L334 V347 L351	G253-V257 WeakPolarHBondContact O-CG2 3.09Å; G253-V257 PolarHBondContact O-N 3.44Å; G253-V257 VanDerWaalsContact O-N 3.17Å; L254-V257 PolarHBondContact O-N 2.73Å; V257-L259 PolarHBondContact O-N 2.78Å; V257-A260 PolarHBondContact O-N 2.88Å; V257-I261 HydrophobicContact CG1-CD1 3.54Å; V257-I261 HydrophobicContact CG1-CG1 4.23Å; V257-I261 WeakPolarHBondContact O-CB 3.31Å; V257-I261 WeakPolarHBondContact O-CG1 3.43Å; V257-I261 PolarHBondContact O-N 3.36Å; V257-P265 HydrophobicContact CB-CB 4.09Å; V257-P265 HydrophobicContact CB-CG 4.15Å; V257-P265 HydrophobicContact CG1-CB 3.46Å; V257-P265 VanDerWaalsContact CG1-CB 3.46Å; V257-P265 HydrophobicContact CG1-CG 4.09Å; V257-L334 HydrophobicContact CB-CD2 4.49Å; V257-L334 HydrophobicContact CG1-CD2 4.24Å; V257-L334 HydrophobicContact CG2-CD2 4.42Å; V257-L334 HydrophobicContact CG2-CG 4.43Å; V257-V347 HydrophobicContact CG2-CG1 3.36Å; V257-L351 HydrophobicContact CG2-CD1 3.95Å
258	E	97.9	Very high	96.5	Very high	24 Å²	24	14.9 Å²	14.9	11%	0.112	8%	0.083	C	C	.	.	H	α-helix	trans	-58.4	-49.6	178	177.8	178.2	-166.4	0	0	112.2	L158 P196 Y232 L254 S255 L256 A260 I261 G262 R263	L158-E258 HydrophobicContact CD2-CG 3.95Å; P196-E258 WeakPolarHBondContact CG-OE2 3.5Å; Y232-E258 VanDerWaalsContact CE1-OE2 3.28Å; Y232-E258 WeakPolarHBondContact CE1-OE2 3.49Å; Y232-E258 PolarHBondContact OH-OE1 2.96Å; Y232-E258 PolarHBondContact OH-OE2 3.34Å; L254-E258 PolarHBondContact O-N 2.72Å; L254-E258 VanDerWaalsContact O-N 3.09Å; S255-E258 PolarHBondContact O-N 3.28Å; L256-E258 VanDerWaalsContact C-N 3.35Å; E258-A260 VanDerWaalsContact C-N 3.31Å; E258-A260 PolarHBondContact O-N 3.33Å; E258-I261 PolarHBondContact O-N 3.07Å; E258-G262 WeakPolarHBondContact O-CA 3.15Å; E258-G262 PolarHBondContact O-N 3.35Å; E258-R263 WeakPolarHBondContact CA-O 3.45Å; E258-R263 PolarHBondContact O-N 3.43Å
259	L	98.5	Very high	96.2	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-65.9	-35.8	-178	-66.7	164.8	0	0	0	111.9	L154 L158 I164 L169 P196 S255 L256 V257	L154-L259 HydrophobicContact CB-CD2 4.09Å; L154-L259 HydrophobicContact CD1-CD1 3.98Å; L158-L259 HydrophobicContact CB-CD2 4.02Å; L158-L259 HydrophobicContact CD1-CD2 4.21Å; L158-L259 HydrophobicContact CD2-CD2 3.99Å; L158-L259 HydrophobicContact CG-CD2 4.3Å; I164-L259 HydrophobicContact CB-CB 4.42Å; I164-L259 HydrophobicContact CD1-CB 4.16Å; I164-L259 HydrophobicContact CD1-CD2 3.53Å; I164-L259 HydrophobicContact CD1-CG 4.29Å; I164-L259 HydrophobicContact CG1-CB 4.4Å; I164-L259 HydrophobicContact CG1-CD2 4.36Å; I164-L259 PolarHBondContact N-O 3.41Å; L169-L259 HydrophobicContact CD2-CB 3.69Å; L169-L259 HydrophobicContact CD2-CD1 4.08Å; P196-L259 HydrophobicContact CB-CD2 4.03Å; P196-L259 HydrophobicContact CB-CG 4.49Å; P196-L259 HydrophobicContact CG-CD1 4.29Å; P196-L259 HydrophobicContact CG-CD2 4.1Å; P196-L259 HydrophobicContact CG-CG 4.07Å; S255-L259 WeakPolarHBondContact O-CB 3.44Å; S255-L259 WeakPolarHBondContact O-CD1 3.42Å; S255-L259 WeakPolarHBondContact O-CG 3.37Å; S255-L259 PolarHBondContact O-N 3.21Å; L256-L259 PolarHBondContact O-N 3.09Å; V257-L259 PolarHBondContact O-N 2.78Å
260	A	98.2	Very high	95.8	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-70.7	-44.9	178.2	0	0	0	0	0	112.4	L169 L256 V257 E258 L334 F339 F343	L169-A260 HydrophobicContact CD1-CB 3.6Å; L256-A260 WeakPolarHBondContact O-CB 3.44Å; L256-A260 PolarHBondContact O-N 3Å; V257-A260 PolarHBondContact O-N 2.88Å; E258-A260 VanDerWaalsContact C-N 3.31Å; E258-A260 PolarHBondContact O-N 3.33Å; A260-L334 HydrophobicContact CB-CD2 3.65Å; A260-F339 HydrophobicContact CB-CE1 3.87Å; A260-F339 HydrophobicContact CB-CE2 4.38Å; A260-F339 HydrophobicContact CB-CZ 3.69Å; A260-F343 HydrophobicContact CB-CE1 3.98Å; A260-F343 HydrophobicContact CB-CZ 4.27Å
261	I	96.5	Very high	95.3	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-82	-28	-176.8	-62.1	-179.4	0	0	0	111.6	R163 V257 E258 R263 I277 L334	R163-I261 WeakPolarHBondContact CD-O 3.37Å; R163-I261 WeakPolarHBondContact CG-O 3.38Å; V257-I261 HydrophobicContact CG1-CD1 3.54Å; V257-I261 HydrophobicContact CG1-CG1 4.23Å; V257-I261 WeakPolarHBondContact O-CB 3.31Å; V257-I261 WeakPolarHBondContact O-CG1 3.43Å; V257-I261 PolarHBondContact O-N 3.36Å; E258-I261 PolarHBondContact O-N 3.07Å; I261-R263 HydrophobicContact CG2-CB 4.25Å; I261-I277 HydrophobicContact CG2-CD1 3.98Å; I261-I277 WeakPolarHBondContact O-CG2 3.39Å; I261-L334 HydrophobicContact CG1-CD2 4.31Å
262	G	96.3	Very high	94.9	Very high	32 Å²	32	28.1 Å²	28.1	33%	0.33	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	13.7	-173.7	0	0	0	0	0	114.4	R162 E258	R162-G262 WeakPolarHBondContact O-CA 3.27Å; E258-G262 WeakPolarHBondContact O-CA 3.15Å; E258-G262 PolarHBondContact O-N 3.35Å
263	R	93.4	Very high	94.5	Very high	84 Å²	84	30.8 Å²	30.8	32%	0.317	17%	0.166	S	C	.	.	S	Bend	trans	-155.8	138.9	-171	-179.3	-160.1	167.3	134	-24.1	109.4	E258 I261 E273	E258-R263 WeakPolarHBondContact CA-O 3.45Å; E258-R263 PolarHBondContact O-N 3.43Å; I261-R263 HydrophobicContact CG2-CB 4.25Å; R263-E273 IonicContact CZ-OE1 3.78Å; R263-E273 IonicContact CZ-OE2 2.74Å; R263-E273 IonicContact NH1-OE1 3.11Å; R263-E273 PolarHBondContact NH1-OE1 3.36Å; R263-E273 IonicContact NH1-OE2 2.78Å; R263-E273 PolarHBondContact NH1-OE2 3.34Å; R263-E273 IonicContact NH2-OE1 2.85Å; R263-E273 PolarHBondContact NH2-OE1 3.34Å; R263-E273 IonicContact NH2-OE2 2.7Å; R263-E273 PolarHBondContact NH2-OE2 3.4Å
264	Y	93.9	Very high	94.1	Very high	45 Å²	45	31.1 Å²	31.1	18%	0.176	17%	0.168	C	C	.	.			trans	-54.2	128	171.2	-175.6	-101.5	0	0	0	110.9	S231 Y232 L254 I266 L322	S231-Y264 WeakPolarHBondContact CB-OH 3.25Å; S231-Y264 PolarHBondContact O-OH 3.48Å; Y232-Y264 HydrophobicContact CD1-CE2 4.39Å; Y232-Y264 HydrophobicContact CE1-CD2 4.12Å; Y232-Y264 AromaticContact CE1-CE2 3.83Å; Y232-Y264 HydrophobicContact CE1-CE2 3.83Å; Y232-Y264 HydrophobicContact CE2-CE2 4.34Å; Y232-Y264 AromaticContact CZ-CD2 3.92Å; Y232-Y264 AromaticContact CZ-CE2 3.79Å; L254-Y264 HydrophobicContact CD2-CE2 4.05Å; Y264-I266 VanDerWaalsContact C-N 3.32Å; Y264-I266 HydrophobicContact CD1-CB 4.47Å; Y264-I266 VanDerWaalsContact CD1-O 3.23Å; Y264-I266 WeakPolarHBondContact CD1-O 3.11Å; Y264-I266 HydrophobicContact CE1-CB 3.77Å; Y264-I266 VanDerWaalsContact CE1-O 3.3Å; Y264-I266 WeakPolarHBondContact CE1-O 3.47Å; Y264-I266 PolarHBondContact O-N 3.01Å; Y264-L322 HydrophobicContact CE1-CD1 3.77Å; Y264-L322 HydrophobicContact CE1-CD2 4.07Å
265	P	93.9	Very high	93.8	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.013	19%	0.189	C	C	.	.			trans	-86.9	4.1	-159.6	34.6	-39.8	0	0	0	114.9	L254 V257 P267 P268 P332	L254-P265 HydrophobicContact CD1-CG 3.53Å; L254-P265 HydrophobicContact CG-CG 3.93Å; V257-P265 HydrophobicContact CB-CB 4.09Å; V257-P265 HydrophobicContact CB-CG 4.15Å; V257-P265 HydrophobicContact CG1-CB 3.46Å; V257-P265 VanDerWaalsContact CG1-CB 3.46Å; V257-P265 HydrophobicContact CG1-CG 4.09Å; P265-P267 CarbonylContact O-C 3.6Å; P265-P267 VanDerWaalsContact O-C 3.32Å; P265-P268 WeakPolarHBondContact O-CA 3.26Å; P265-P332 HydrophobicContact CB-CB 3.88Å; P265-P332 HydrophobicContact CB-CG 4.15Å; P265-P332 HydrophobicContact CG-CB 4.43Å; P265-P332 HydrophobicContact CG-CG 4.14Å
266	I	92.6	Very high	93.5	Very high	10 Å²	10	39.5 Å²	39.5	5%	0.051	22%	0.221	C	C	.	.	S	Bend	trans	-124.9	123.1	179.7	-55.4	175.8	0	0	0	110.2	L254 Y264 L322 Y325 I326 P332	L254-I266 HydrophobicContact CD1-CD1 3.97Å; L254-I266 HydrophobicContact CD1-CG1 4.34Å; Y264-I266 VanDerWaalsContact C-N 3.32Å; Y264-I266 HydrophobicContact CD1-CB 4.47Å; Y264-I266 VanDerWaalsContact CD1-O 3.23Å; Y264-I266 WeakPolarHBondContact CD1-O 3.11Å; Y264-I266 HydrophobicContact CE1-CB 3.77Å; Y264-I266 VanDerWaalsContact CE1-O 3.3Å; Y264-I266 WeakPolarHBondContact CE1-O 3.47Å; Y264-I266 PolarHBondContact O-N 3.01Å; I266-L322 HydrophobicContact CB-CD1 3.62Å; I266-L322 HydrophobicContact CG2-CD1 3.32Å; I266-Y325 HydrophobicContact CB-CD1 4.47Å; I266-Y325 HydrophobicContact CD1-CD1 4.47Å; I266-Y325 HydrophobicContact CG1-CD1 4.47Å; I266-Y325 HydrophobicContact CG2-CD1 3.28Å; I266-Y325 HydrophobicContact CG2-CD2 4.34Å; I266-Y325 HydrophobicContact CG2-CE1 3.86Å; I266-Y325 HydrophobicContact CG2-CG 3.59Å; I266-I326 HydrophobicContact CD1-CD1 4.39Å; I266-I326 HydrophobicContact CD1-CG1 3.6Å; I266-P332 HydrophobicContact CD1-CG 4.41Å; I266-P332 HydrophobicContact CG1-CG 4.13Å
267	P	91.8	Very high	93.2	Very high	47 Å²	47	41.6 Å²	41.6	31%	0.305	23%	0.232	S	C	.	.	S	Bend	cis	-66	154.5	-6.4	29.1	-34	0	0	0	111.9	P265 M317 Y325	P265-P267 CarbonylContact O-C 3.6Å; P265-P267 VanDerWaalsContact O-C 3.32Å; P267-M317 HydrophobicContact CB-CE 3.75Å; P267-M317 HydrophobicContact CG-CE 3.79Å; P267-Y325 HydrophobicContact CB-CE2 4.48Å
268	P	91.6	Very high	92.9	Very high	50 Å²	50	43 Å²	43	33%	0.325	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-54.5	142.1	176.3	-26.3	34.7	0	0	0	111.9	P265 Y325	P265-P268 WeakPolarHBondContact O-CA 3.26Å; P268-Y325 VanDerWaalsContact CD-CZ 3.47Å; P268-Y325 WeakPolarHBondContact CD-OH 3.42Å; P268-Y325 HydrophobicContact CG-CE1 4.49Å; P268-Y325 VanDerWaalsContact CG-OH 3.31Å; P268-Y325 WeakPolarHBondContact CG-OH 3.44Å
269	P	90.6	Very high	92.5	Very high	14 Å²	14	45.2 Å²	45.2	9%	0.091	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-65	141.9	173.6	29.5	-34.9	0	0	0	110.1	E273 L274	P269-E273 WeakPolarHBondContact CA-OE2 3.47Å; P269-E273 HydrophobicContact CB-CB 3.92Å; P269-L274 HydrophobicContact CB-CD2 4.18Å; P269-L274 HydrophobicContact CB-CG 4.12Å; P269-L274 HydrophobicContact CG-CD2 3.56Å; P269-L274 HydrophobicContact CG-CG 3.89Å
270	D	89.6	Confident	91.8	Very high	44 Å²	44	51.2 Å²	51.2	24%	0.235	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-79.1	172	173.4	66.5	37.5	0	0	0	112.1	K272 E273 L274 R314	D270-K272 PolarHBondContact O-N 2.96Å; D270-K272 WeakPolarHBondContact OD1-CB 3.32Å; D270-K272 PolarHBondContact OD1-N 3.21Å; D270-E273 PolarHBondContact O-N 3.07Å; D270-E273 VanDerWaalsContact O-N 3.1Å; D270-E273 PolarHBondContact OD1-N 2.94Å; D270-L274 WeakPolarHBondContact O-CG 3.33Å; D270-L274 PolarHBondContact O-N 2.88Å; D270-R314 IonicContact OD2-CZ 2.72Å; D270-R314 IonicContact OD2-NH1 2.82Å; D270-R314 PolarHBondContact OD2-NH1 3.28Å; D270-R314 IonicContact OD2-NH2 3.8Å; D270-R314 PolarHBondContact OD2-NH2 3.18Å
271	A	87.8	Confident	91	Very high	55 Å²	55	56.1 Å²	56.1	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-56	-34.5	-177.7	0	0	0	0	0	113.7	E275	A271-E275 WeakPolarHBondContact O-CB 3.41Å; A271-E275 PolarHBondContact O-N 2.7Å
272	K	89.1	Confident	90.2	Very high	170 Å²	170	56.7 Å²	56.7	74%	0.739	33%	0.325	S	S	*	.	H	α-helix	trans	-72.6	-41.3	178.3	-67.7	-174.8	178.5	-176.3	0	111.2	D270 E275 A276	D270-K272 PolarHBondContact O-N 2.96Å; D270-K272 WeakPolarHBondContact OD1-CB 3.32Å; D270-K272 PolarHBondContact OD1-N 3.21Å; K272-E275 PolarHBondContact O-N 3.04Å; K272-A276 WeakPolarHBondContact O-CB 3.4Å; K272-A276 PolarHBondContact O-N 3.18Å
273	E	90.8	Very high	88.6	Confident	59 Å²	59	63.5 Å²	63.5	28%	0.276	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-43.1	173.3	-77.1	-174.7	146.1	0	0	111.5	R263 P269 D270 A276 I277	R263-E273 IonicContact CZ-OE1 3.78Å; R263-E273 IonicContact CZ-OE2 2.74Å; R263-E273 IonicContact NH1-OE1 3.11Å; R263-E273 PolarHBondContact NH1-OE1 3.36Å; R263-E273 IonicContact NH1-OE2 2.78Å; R263-E273 PolarHBondContact NH1-OE2 3.34Å; R263-E273 IonicContact NH2-OE1 2.85Å; R263-E273 PolarHBondContact NH2-OE1 3.34Å; R263-E273 IonicContact NH2-OE2 2.7Å; R263-E273 PolarHBondContact NH2-OE2 3.4Å; P269-E273 WeakPolarHBondContact CA-OE2 3.47Å; P269-E273 HydrophobicContact CB-CB 3.92Å; D270-E273 PolarHBondContact O-N 3.07Å; D270-E273 VanDerWaalsContact O-N 3.1Å; D270-E273 PolarHBondContact OD1-N 2.94Å; E273-A276 PolarHBondContact O-N 3.43Å; E273-I277 WeakPolarHBondContact O-CB 3.44Å; E273-I277 WeakPolarHBondContact O-CD1 3.48Å; E273-I277 WeakPolarHBondContact O-CG1 3.36Å; E273-I277 PolarHBondContact O-N 2.96Å
274	L	91	Very high	87	Confident	7 Å²	7	63.5 Å²	63.5	4%	0.037	36%	0.355	C	S	.	.	H	α-helix	trans	-61.2	-44.5	175.8	-74	173.8	0	0	0	111.8	P269 D270 A276 I277 F278 V282 P335	P269-L274 HydrophobicContact CB-CD2 4.18Å; P269-L274 HydrophobicContact CB-CG 4.12Å; P269-L274 HydrophobicContact CG-CD2 3.56Å; P269-L274 HydrophobicContact CG-CG 3.89Å; D270-L274 WeakPolarHBondContact O-CG 3.33Å; D270-L274 PolarHBondContact O-N 2.88Å; L274-A276 VanDerWaalsContact C-N 3.33Å; L274-A276 PolarHBondContact O-N 3.44Å; L274-I277 PolarHBondContact O-N 3.4Å; L274-F278 HydrophobicContact CD2-CD2 4.22Å; L274-F278 HydrophobicContact CD2-CE2 3.8Å; L274-F278 VanDerWaalsContact O-CD2 3.25Å; L274-F278 WeakPolarHBondContact O-CD2 3.45Å; L274-F278 PolarHBondContact O-N 3.49Å; L274-V282 HydrophobicContact CB-CB 4.27Å; L274-V282 HydrophobicContact CB-CG2 4.29Å; L274-V282 HydrophobicContact CD1-CG1 4.45Å; L274-P335 HydrophobicContact CD2-CB 4.25Å; L274-P335 HydrophobicContact CD2-CG 4.3Å
275	E	90.9	Very high	84.8	Confident	93 Å²	93	64 Å²	64	44%	0.435	37%	0.374	S	S	.	.	H	α-helix	trans	-60.9	-42.4	175.2	-178.2	173.4	-164.3	0	0	111.7	A271 K272 I277 G279 R280	A271-E275 WeakPolarHBondContact O-CB 3.41Å; A271-E275 PolarHBondContact O-N 2.7Å; K272-E275 PolarHBondContact O-N 3.04Å; E275-I277 PolarHBondContact O-N 2.7Å; E275-G279 VanDerWaalsContact O-CA 3.26Å; E275-G279 WeakPolarHBondContact O-CA 3.47Å; E275-G279 PolarHBondContact O-N 3.4Å; E275-R280 WeakPolarHBondContact CA-O 3.25Å
276	A	92.1	Very high	82.6	Confident	85 Å²	85	67.1 Å²	67.1	70%	0.702	40%	0.4	S	S	*	.	H	α-helix	trans	-64.6	-38.2	175.7	0	0	0	0	0	112.6	K272 E273 L274	K272-A276 WeakPolarHBondContact O-CB 3.4Å; K272-A276 PolarHBondContact O-N 3.18Å; E273-A276 PolarHBondContact O-N 3.43Å; L274-A276 VanDerWaalsContact C-N 3.33Å; L274-A276 PolarHBondContact O-N 3.44Å
277	I	92.3	Very high	80.1	Confident	48 Å²	48	76 Å²	76	25%	0.246	44%	0.441	C	S	.	.	H	α-helix	trans	-68.2	-48.7	178	-70.9	163	0	0	0	110.3	R163 I261 E273 L274 E275	R163-I277 VanDerWaalsContact NH1-C 3.34Å; R163-I277 PolarHBondContact NH1-O 2.91Å; I261-I277 HydrophobicContact CG2-CD1 3.98Å; I261-I277 WeakPolarHBondContact O-CG2 3.39Å; E273-I277 WeakPolarHBondContact O-CB 3.44Å; E273-I277 WeakPolarHBondContact O-CD1 3.48Å; E273-I277 WeakPolarHBondContact O-CG1 3.36Å; E273-I277 PolarHBondContact O-N 2.96Å; L274-I277 PolarHBondContact O-N 3.4Å; E275-I277 PolarHBondContact O-N 2.7Å
278	F	91.9	Very high	77.4	Confident	30 Å²	30	76.5 Å²	76.5	13%	0.132	46%	0.455	C	S	.	.	H	α-helix	trans	-94.5	-8.5	-171.6	-65.6	-73.7	0	0	0	114.5	L274 R280 V282 P335 V338 F339	L274-F278 HydrophobicContact CD2-CD2 4.22Å; L274-F278 HydrophobicContact CD2-CE2 3.8Å; L274-F278 VanDerWaalsContact O-CD2 3.25Å; L274-F278 WeakPolarHBondContact O-CD2 3.45Å; L274-F278 PolarHBondContact O-N 3.49Å; F278-R280 HydrophobicContact CB-CG 4.36Å; F278-R280 PolarHBondContact O-N 3.39Å; F278-V282 HydrophobicContact CB-CG2 4.15Å; F278-V282 HydrophobicContact CD2-CG2 4Å; F278-V282 HydrophobicContact CG-CG2 4.34Å; F278-P335 HydrophobicContact CD2-CG 4.48Å; F278-P335 HydrophobicContact CE2-CB 4.49Å; F278-P335 HydrophobicContact CE2-CG 3.66Å; F278-P335 HydrophobicContact CZ-CG 3.85Å; F278-V338 HydrophobicContact CD1-CG1 3.51Å; F278-V338 HydrophobicContact CD1-CG2 4.24Å; F278-V338 HydrophobicContact CD2-CG2 4.35Å; F278-V338 HydrophobicContact CE1-CG1 3.39Å; F278-V338 HydrophobicContact CG-CG1 4.24Å; F278-V338 HydrophobicContact CG-CG2 4.14Å; F278-V338 HydrophobicContact CZ-CG1 3.98Å; F278-F339 HydrophobicContact CE1-CE2 4.24Å; F278-F339 HydrophobicContact CE1-CZ 4.1Å; F278-F339 AromaticContact CZ-CE2 3.98Å; F278-F339 HydrophobicContact CZ-CE2 3.98Å; F278-F339 HydrophobicContact CZ-CZ 4.14Å
279	G	89.1	Confident	74.4	Confident	70 Å²	70	82.5 Å²	82.5	72%	0.722	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	17	-179.6	0	0	0	0	0	113.8	E275	E275-G279 VanDerWaalsContact O-CA 3.26Å; E275-G279 WeakPolarHBondContact O-CA 3.47Å; E275-G279 PolarHBondContact O-N 3.4Å
280	R	85.5	Confident	71.7	Confident	126 Å²	126	87.3 Å²	87.3	48%	0.475	51%	0.509	S	S	.	.	S	Bend	trans	-154.9	151.6	179.8	63.7	-175.7	-178.5	-179.2	2.7	110.7	E275 F278 V282 G337	E275-R280 WeakPolarHBondContact CA-O 3.25Å; F278-R280 HydrophobicContact CB-CG 4.36Å; F278-R280 PolarHBondContact O-N 3.39Å; R280-V282 PolarHBondContact O-N 2.94Å; R280-G337 PolarHBondContact NH2-O 3.21Å
281	P	80.5	Confident	69.4	Low	104 Å²	104	93 Å²	93	68%	0.675	53%	0.534	S	S	*	.			trans	-56.5	126.3	171.7	-23.9	33.5	0	0	0	110.5
282	V	80.1	Confident	66.7	Low	16 Å²	16	96.3 Å²	96.3	10%	0.097	55%	0.549	C	S	.	.			trans	-104.3	121.9	174.2	177.8	0	0	0	0	106.8	L274 F278 R280 D284 P335 V338	L274-V282 HydrophobicContact CB-CB 4.27Å; L274-V282 HydrophobicContact CB-CG2 4.29Å; L274-V282 HydrophobicContact CD1-CG1 4.45Å; F278-V282 HydrophobicContact CB-CG2 4.15Å; F278-V282 HydrophobicContact CD2-CG2 4Å; F278-V282 HydrophobicContact CG-CG2 4.34Å; R280-V282 PolarHBondContact O-N 2.94Å; V282-D284 PolarHBondContact O-N 3.33Å; V282-D284 VanDerWaalsContact O-N 3.09Å; V282-P335 HydrophobicContact CG1-CB 3.49Å; V282-P335 VanDerWaalsContact CG1-CB 3.49Å; V282-V338 HydrophobicContact CG1-CG2 4.2Å; V282-V338 HydrophobicContact CG2-CG2 3.83Å
283	Q	63.2	Low	64.3	Low	175 Å²	175	95.5 Å²	95.5	82%	0.818	55%	0.551	S	S	*	*			trans	-68.3	107.7	170.4	-81.3	179.2	-8.5	0	0	107.9	G285	Q283-G285 PolarHBondContact O-N 3.32Å
284	D	58.2	Low	61.8	Low	84 Å²	84	97.9 Å²	97.9	45%	0.449	57%	0.574	S	S	.	*			trans	-74.2	120.9	169.3	-152.8	-6.3	0	0	0	107.3	V282 A286	V282-D284 PolarHBondContact O-N 3.33Å; V282-D284 VanDerWaalsContact O-N 3.09Å; D284-A286 PolarHBondContact O-N 3.21Å
285	G	48.5	Very low	59.1	Low	56 Å²	56	105.1 Å²	105.1	58%	0.577	61%	0.613	S	S	*	*	S	Bend	trans	-67.5	5.9	177.5	0	0	0	0	0	113.5	Q283 E287	Q283-G285 PolarHBondContact O-N 3.32Å; G285-E287 PolarHBondContact O-N 2.97Å; G285-E287 VanDerWaalsContact O-N 3.12Å
286	A	47.9	Very low	56.6	Low	67 Å²	67	111.7 Å²	111.7	55%	0.554	63%	0.634	S	S	*	*			trans	-79.7	48.5	170.4	0	0	0	0	0	111.8	D284 G288	D284-A286 PolarHBondContact O-N 3.21Å; A286-G288 PolarHBondContact O-N 3.32Å; A286-G288 VanDerWaalsContact O-N 3.09Å
287	E	38.8	Very low	54	Low	197 Å²	197	115.4 Å²	115.4	92%	0.921	64%	0.641	S	S	*	*			trans	-78	81.4	157.8	-72.8	-166.7	167.3	0	0	107.8	G285	G285-E287 PolarHBondContact O-N 2.97Å; G285-E287 VanDerWaalsContact O-N 3.12Å
288	G	35.4	Very low	51.5	Low	57 Å²	57	119.1 Å²	119.1	59%	0.588	67%	0.668	S	S	*	*	S	Bend	trans	-177.8	84.9	-178.1	0	0	0	0	0	113.2	A286	A286-G288 PolarHBondContact O-N 3.32Å; A286-G288 VanDerWaalsContact O-N 3.09Å
289	E	29.6	Very low	49.2	Very low	176 Å²	176	128.9 Å²	128.9	82%	0.822	70%	0.704	S	S	*	*			trans	77.2	129.8	174.3	-56.6	-144	151.6	0	0	118	H291	E289-H291 PolarHBondContact O-N 2.74Å; E289-H291 VanDerWaalsContact O-N 3.08Å
290	P	33.6	Very low	46.7	Very low	114 Å²	114	131 Å²	131	74%	0.74	71%	0.706	S	S	*	*			trans	-62.8	116.7	170	26.2	-29.1	0	0	0	107.7	T292	P290-T292 PolarHBondContact O-N 2.8Å
291	H	40.4	Very low	44.8	Very low	165 Å²	165	131.7 Å²	131.7	76%	0.764	73%	0.726	S	S	*	*			trans	-59.5	87.7	165	-69.2	-67.3	0	0	0	108.6	E289 I293	E289-H291 PolarHBondContact O-N 2.74Å; E289-H291 VanDerWaalsContact O-N 3.08Å; H291-I293 VanDerWaalsContact C-N 3.34Å; H291-I293 PolarHBondContact O-N 2.82Å
292	T	32.1	Very low	42.7	Very low	123 Å²	123	130.3 Å²	130.3	76%	0.755	73%	0.731	S	S	*	*			trans	-59.4	106.9	156	40.7	0	0	0	0	105.4	P290 S294	P290-T292 PolarHBondContact O-N 2.8Å; T292-S294 VanDerWaalsContact C-N 3.28Å; T292-S294 PolarHBondContact O-N 3.03Å
293	I	39.1	Very low	40.4	Very low	153 Å²	153	133.1 Å²	133.1	79%	0.785	76%	0.763	S	S	*	*			trans	-46.8	103.9	157.4	-61.6	171.2	0	0	0	105	H291 N295	H291-I293 VanDerWaalsContact C-N 3.34Å; H291-I293 PolarHBondContact O-N 2.82Å; I293-N295 PolarHBondContact O-N 3.48Å; I293-N295 VanDerWaalsContact O-N 3.09Å
294	S	37.3	Very low	38.9	Very low	110 Å²	110	136.3 Å²	136.3	77%	0.769	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-53.7	123.2	177	-175.2	0	0	0	0	107.2	T292 R296	T292-S294 VanDerWaalsContact C-N 3.28Å; T292-S294 PolarHBondContact O-N 3.03Å; S294-R296 PolarHBondContact O-N 2.72Å
295	N	34.2	Very low	37.9	Very low	158 Å²	158	138.3 Å²	138.3	85%	0.845	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-47.8	128.1	-177.4	-88.6	-36.9	0	0	0	110.3	I293 L297	I293-N295 PolarHBondContact O-N 3.48Å; I293-N295 VanDerWaalsContact O-N 3.09Å; N295-L297 PolarHBondContact O-N 3.26Å
296	R	38.1	Very low	37.2	Very low	231 Å²	231	142.3 Å²	142.3	87%	0.872	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-48.9	136.1	173.6	-65.1	-179.7	-178.9	-161.3	-1.5	110.9	S294	S294-R296 PolarHBondContact O-N 2.72Å
297	L	38.3	Very low	36.5	Very low	164 Å²	164	144.4 Å²	144.4	86%	0.859	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-53.9	134.6	154.2	-81.9	144.5	0	0	0	109.4	N295 R299	N295-L297 PolarHBondContact O-N 3.26Å; L297-R299 PolarHBondContact O-N 3.1Å
298	P	39.7	Very low	36.3	Very low	126 Å²	126	138 Å²	138	82%	0.818	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.8	123.8	-177.6	24.5	-29.3	0	0	0	111.1
299	R	44.6	Very low	36.2	Very low	234 Å²	234	144.9 Å²	144.9	88%	0.883	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-69.4	147	166.6	-90.7	-176.6	177.7	179.8	0.1	110.2	L297	L297-R299 PolarHBondContact O-N 3.1Å
300	P	36.3	Very low	36.2	Very low	116 Å²	116	140.2 Å²	140.2	75%	0.753	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-67.8	149.2	174.9	28.3	-32.1	0	0	0	111.4	G302	P300-G302 PolarHBondContact O-N 3.37Å
301	P	44.6	Very low	36.5	Very low	139 Å²	139	143.6 Å²	143.6	90%	0.903	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.6	119.1	-175.8	29.4	-30.7	0	0	0	111
302	G	36	Very low	36.6	Very low	75 Å²	75	143 Å²	143	77%	0.773	82%	0.821	S	S	*	*			trans	-171.9	72.9	178.3	0	0	0	0	0	115.4	P300	P300-G302 PolarHBondContact O-N 3.37Å
303	G	32.7	Very low	37.1	Very low	75 Å²	75	142.6 Å²	142.6	77%	0.773	82%	0.823	S	S	*	*			trans	76	101	138.6	0	0	0	0	0	121.7
304	R	32.4	Very low	37.8	Very low	242 Å²	242	143.9 Å²	143.9	91%	0.913	82%	0.818	S	S	*	*				160.5	143.5	111.7	-90	-176	-178.4	-174.2	1.6	110.3
305	P	35.4	Very low	38.9	Very low	127 Å²	127	144.5 Å²	144.5	83%	0.825	82%	0.819	S	S	*	*			trans	-78.3	134.8	-172.1	30.9	-31.2	0	0	0	111.4
306	V	35	Very low	40.5	Very low	139 Å²	139	141.7 Å²	141.7	84%	0.842	82%	0.818	S	S	*	*			trans	-93.4	114.2	168.8	178.6	0	0	0	0	107.8
307	S	32.5	Very low	42.5	Very low	112 Å²	112	133.7 Å²	133.7	78%	0.783	79%	0.791	S	S	*	*			trans	-64.3	130.1	164.2	38	0	0	0	0	109.2
308	G	35.3	Very low	44.9	Very low	61 Å²	61	128.2 Å²	128.2	63%	0.629	77%	0.77	S	S	*	*			trans	-66.9	153.6	-172.7	0	0	0	0	0	114
309	H	33.1	Very low	47	Very low	203 Å²	203	124.3 Å²	124.3	94%	0.94	74%	0.742	S	S	*	*			trans	-162.3	133.1	153.2	-101.6	51.7	0	0	0	108.3
310	G	29.9	Very low	49	Very low	77 Å²	77	121 Å²	121	79%	0.794	73%	0.734	S	S	*	*			trans	82.8	111.2	154.7	0	0	0	0	0	118.8
311	M	40.5	Very low	51.6	Low	186 Å²	186	120.8 Å²	120.8	92%	0.916	72%	0.723	S	S	*	*	S	Bend	trans	-66.5	146.5	153.4	-94.3	159.3	135.2	0	0	109.4
312	D	41.2	Very low	53.8	Low	153 Å²	153	115 Å²	115	82%	0.818	68%	0.684	S	S	*	*			trans	83.4	54.4	168.3	-53.5	-23.8	0	0	0	119.1
313	S	43.5	Very low	56.4	Low	114 Å²	114	112.5 Å²	112.5	80%	0.797	65%	0.653	S	S	*	*			trans	-146.2	101.8	150.4	-63.8	0	0	0	0	109.1
314	R	54	Low	59.2	Low	180 Å²	180	113.1 Å²	113.1	68%	0.679	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-56.6	135.1	165.4	-77.1	-175.6	-178.8	150	11	107.5	D270 A316	D270-R314 IonicContact OD2-CZ 2.72Å; D270-R314 IonicContact OD2-NH1 2.82Å; D270-R314 PolarHBondContact OD2-NH1 3.28Å; D270-R314 IonicContact OD2-NH2 3.8Å; D270-R314 PolarHBondContact OD2-NH2 3.18Å; R314-A316 PolarHBondContact O-N 3.17Å
315	P	58.7	Low	62.1	Low	122 Å²	122	103.8 Å²	103.8	79%	0.792	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-57.3	139.3	176.7	-19.4	29.7	0	0	0	110.1	M317	P315-M317 PolarHBondContact O-N 2.96Å
316	A	68.8	Low	64.9	Low	99 Å²	99	97.9 Å²	97.9	82%	0.818	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-57	127.9	170.2	0	0	0	0	0	109.3	R314 A318	R314-A316 PolarHBondContact O-N 3.17Å; A316-A318 PolarHBondContact O-N 2.77Å
317	M	80.1	Confident	67.7	Low	63 Å²	63	92.6 Å²	92.6	31%	0.31	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-56.9	133.5	178.2	-179.3	179.8	-82.7	0	0	110.1	P267 P315 E321 L322 Y325	P267-M317 HydrophobicContact CB-CE 3.75Å; P267-M317 HydrophobicContact CG-CE 3.79Å; P315-M317 PolarHBondContact O-N 2.96Å; M317-E321 HydrophobicContact CG-CB 3.55Å; M317-E321 HydrophobicContact SD-CB 4.26Å; M317-L322 HydrophobicContact CG-CB 4.31Å; M317-L322 WeakPolarHBondContact SD-CA 3.49Å; M317-L322 HydrophobicContact SD-CB 3.88Å; M317-L322 HydrophobicContact SD-CD1 4.25Å; M317-Y325 HydrophobicContact CE-CD2 4.08Å
318	A	87.9	Confident	70.6	Confident	49 Å²	49	91.9 Å²	91.9	41%	0.405	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-70.8	156.1	176.6	0	0	0	0	0	110.7	A316 F320 E321 L322	A316-A318 PolarHBondContact O-N 2.77Å; A318-F320 VanDerWaalsContact C-N 3.32Å; A318-F320 PolarHBondContact O-N 2.96Å; A318-E321 HydrophobicContact CB-CG 4.22Å; A318-E321 PolarHBondContact N-OE2 3.25Å; A318-E321 WeakPolarHBondContact O-CB 3.43Å; A318-E321 PolarHBondContact O-N 3.21Å; A318-E321 VanDerWaalsContact O-N 3.1Å; A318-L322 PolarHBondContact O-N 2.77Å
319	I	84.9	Confident	73.5	Confident	45 Å²	45	93 Å²	93	23%	0.231	51%	0.51	C	S	.	.	H	α-helix	trans	-57.3	-43.2	-177.5	-173.4	72.4	0	0	0	112.9	V227 E321 L322 L323	V227-I319 HydrophobicContact CG1-CB 3.71Å; V227-I319 HydrophobicContact CG1-CD1 4Å; V227-I319 HydrophobicContact CG1-CG1 3.4Å; V227-I319 HydrophobicContact CG1-CG2 3.62Å; I319-E321 VanDerWaalsContact C-N 3.27Å; I319-E321 PolarHBondContact O-N 3.49Å; I319-L322 HydrophobicContact CD1-CD2 4.17Å; I319-L322 WeakPolarHBondContact O-CB 3.23Å; I319-L322 PolarHBondContact O-N 3.24Å; I319-L322 VanDerWaalsContact O-N 3.09Å; I319-L323 HydrophobicContact CD1-CD2 4.28Å; I319-L323 HydrophobicContact CD1-CG 4.34Å; I319-L323 HydrophobicContact CG1-CD1 4.21Å; I319-L323 HydrophobicContact CG1-CG 4.11Å; I319-L323 WeakPolarHBondContact O-CG 3.38Å; I319-L323 PolarHBondContact O-N 2.86Å
320	F	86.5	Confident	76.4	Confident	163 Å²	163	86.9 Å²	86.9	72%	0.715	49%	0.488	S	S	*	.	H	α-helix	trans	-64.8	-35.6	-178.8	-70.8	-70.6	0	0	0	111.8	A318 L322 L323 D324	A318-F320 VanDerWaalsContact C-N 3.32Å; A318-F320 PolarHBondContact O-N 2.96Å; F320-L322 VanDerWaalsContact C-N 3.33Å; F320-L323 PolarHBondContact O-N 3.25Å; F320-D324 VanDerWaalsContact O-CB 3.26Å; F320-D324 WeakPolarHBondContact O-CB 3.49Å; F320-D324 PolarHBondContact O-N 2.86Å
321	E	90.3	Very high	79.6	Confident	113 Å²	113	84.9 Å²	84.9	53%	0.528	46%	0.461	S	S	.	.	H	α-helix	trans	-66.1	-38.6	173.5	-61.6	172.7	163	0	0	110.8	M317 A318 I319 D324 Y325	M317-E321 HydrophobicContact CG-CB 3.55Å; M317-E321 HydrophobicContact SD-CB 4.26Å; A318-E321 HydrophobicContact CB-CG 4.22Å; A318-E321 PolarHBondContact N-OE2 3.25Å; A318-E321 WeakPolarHBondContact O-CB 3.43Å; A318-E321 PolarHBondContact O-N 3.21Å; A318-E321 VanDerWaalsContact O-N 3.1Å; I319-E321 VanDerWaalsContact C-N 3.27Å; I319-E321 PolarHBondContact O-N 3.49Å; E321-D324 PolarHBondContact O-N 2.98Å; E321-Y325 WeakPolarHBondContact O-CB 3.3Å; E321-Y325 PolarHBondContact O-N 3.46Å
322	L	90.4	Very high	82.2	Confident	16 Å²	16	76.3 Å²	76.3	8%	0.084	42%	0.419	C	S	.	.	H	α-helix	trans	-64.2	-47	175.2	174.2	60.8	0	0	0	112.2	S231 Y264 I266 M317 A318 I319 F320 D324 Y325 I326	S231-L322 WeakPolarHBondContact OG-CD2 3.46Å; Y264-L322 HydrophobicContact CE1-CD1 3.77Å; Y264-L322 HydrophobicContact CE1-CD2 4.07Å; I266-L322 HydrophobicContact CB-CD1 3.62Å; I266-L322 HydrophobicContact CG2-CD1 3.32Å; M317-L322 HydrophobicContact CG-CB 4.31Å; M317-L322 WeakPolarHBondContact SD-CA 3.49Å; M317-L322 HydrophobicContact SD-CB 3.88Å; M317-L322 HydrophobicContact SD-CD1 4.25Å; A318-L322 PolarHBondContact O-N 2.77Å; I319-L322 HydrophobicContact CD1-CD2 4.17Å; I319-L322 WeakPolarHBondContact O-CB 3.23Å; I319-L322 PolarHBondContact O-N 3.24Å; I319-L322 VanDerWaalsContact O-N 3.09Å; F320-L322 VanDerWaalsContact C-N 3.33Å; L322-D324 VanDerWaalsContact C-N 3.32Å; L322-Y325 WeakPolarHBondContact O-CB 3.22Å; L322-Y325 PolarHBondContact O-N 3.26Å; L322-I326 HydrophobicContact CD1-CD1 4.3Å; L322-I326 HydrophobicContact CG-CD1 4.3Å; L322-I326 WeakPolarHBondContact O-CG1 3.11Å; L322-I326 PolarHBondContact O-N 3.45Å
323	L	90.5	Very high	84.6	Confident	23 Å²	23	77.5 Å²	77.5	12%	0.12	41%	0.412	C	S	.	.	H	α-helix	trans	-65.3	-39.1	178.6	-59.9	-174.8	0	0	0	111.2	R230 L238 I319 F320 I326 V327	R230-L323 HydrophobicContact CB-CD2 3.82Å; L238-L323 HydrophobicContact CD1-CB 4.41Å; L238-L323 HydrophobicContact CD1-CD2 4.09Å; L238-L323 HydrophobicContact CD2-CD1 4.35Å; L238-L323 HydrophobicContact CD2-CD2 3.8Å; L238-L323 HydrophobicContact CD2-CG 4.47Å; I319-L323 HydrophobicContact CD1-CD2 4.28Å; I319-L323 HydrophobicContact CD1-CG 4.34Å; I319-L323 HydrophobicContact CG1-CD1 4.21Å; I319-L323 HydrophobicContact CG1-CG 4.11Å; I319-L323 WeakPolarHBondContact O-CG 3.38Å; I319-L323 PolarHBondContact O-N 2.86Å; F320-L323 PolarHBondContact O-N 3.25Å; L323-I326 HydrophobicContact CD2-CD1 4.43Å; L323-I326 PolarHBondContact O-N 3.29Å; L323-V327 WeakPolarHBondContact O-CG2 3.41Å; L323-V327 PolarHBondContact O-N 2.95Å
324	D	91.6	Very high	87	Confident	89 Å²	89	72.4 Å²	72.4	48%	0.476	38%	0.376	S	S	.	.	H	α-helix	trans	-63.5	-43.8	174.6	-165.5	82.7	0	0	0	111.4	F320 E321 L322 I326 V327 N328	F320-D324 VanDerWaalsContact O-CB 3.26Å; F320-D324 WeakPolarHBondContact O-CB 3.49Å; F320-D324 PolarHBondContact O-N 2.86Å; E321-D324 PolarHBondContact O-N 2.98Å; L322-D324 VanDerWaalsContact C-N 3.32Å; D324-I326 PolarHBondContact O-N 3.02Å; D324-V327 CarbonylContact O-C 3.59Å; D324-V327 PolarHBondContact O-N 3Å; D324-N328 WeakPolarHBondContact O-CB 3.24Å; D324-N328 PolarHBondContact O-N 3.16Å; D324-N328 PolarHBondContact O-ND2 3.29Å; D324-N328 PolarHBondContact OD1-ND2 3.48Å; D324-N328 PolarHBondContact OD2-ND2 3.47Å
325	Y	93.6	Very high	88.9	Confident	45 Å²	45	64.1 Å²	64.1	18%	0.176	35%	0.346	C	S	.	.	H	α-helix	trans	-56.4	-49.1	175.3	-165.9	-73.4	0	0	0	111.3	I266 P267 P268 M317 E321 L322 V327 N328 E329	I266-Y325 HydrophobicContact CB-CD1 4.47Å; I266-Y325 HydrophobicContact CD1-CD1 4.47Å; I266-Y325 HydrophobicContact CG1-CD1 4.47Å; I266-Y325 HydrophobicContact CG2-CD1 3.28Å; I266-Y325 HydrophobicContact CG2-CD2 4.34Å; I266-Y325 HydrophobicContact CG2-CE1 3.86Å; I266-Y325 HydrophobicContact CG2-CG 3.59Å; P267-Y325 HydrophobicContact CB-CE2 4.48Å; P268-Y325 VanDerWaalsContact CD-CZ 3.47Å; P268-Y325 WeakPolarHBondContact CD-OH 3.42Å; P268-Y325 HydrophobicContact CG-CE1 4.49Å; P268-Y325 VanDerWaalsContact CG-OH 3.31Å; P268-Y325 WeakPolarHBondContact CG-OH 3.44Å; M317-Y325 HydrophobicContact CE-CD2 4.08Å; E321-Y325 WeakPolarHBondContact O-CB 3.3Å; E321-Y325 PolarHBondContact O-N 3.46Å; L322-Y325 WeakPolarHBondContact O-CB 3.22Å; L322-Y325 PolarHBondContact O-N 3.26Å; Y325-V327 PolarHBondContact O-N 3.23Å; Y325-N328 PolarHBondContact O-N 2.83Å; Y325-E329 HydrophobicContact CD1-CB 3.66Å; Y325-E329 HydrophobicContact CD1-CG 4.26Å; Y325-E329 HydrophobicContact CD2-CB 3.86Å; Y325-E329 HydrophobicContact CD2-CG 3.58Å; Y325-E329 HydrophobicContact CE1-CB 3.56Å; Y325-E329 HydrophobicContact CE1-CG 4.37Å; Y325-E329 HydrophobicContact CE2-CB 3.75Å; Y325-E329 HydrophobicContact CE2-CG 3.69Å; Y325-E329 HydrophobicContact CG-CB 3.79Å; Y325-E329 HydrophobicContact CG-CG 3.86Å; Y325-E329 WeakPolarHBondContact O-CB 3.49Å; Y325-E329 PolarHBondContact O-N 3.41Å
326	I	93.9	Very high	90.2	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.015	33%	0.329	C	S	.	.	H	α-helix	trans	-55.5	-40.9	177.9	-68.7	164.2	0	0	0	110.7	S231 P235 L238 W250 I266 L322 L323 D324 K353	S231-I326 VanDerWaalsContact O-CD1 3.24Å; S231-I326 WeakPolarHBondContact O-CD1 3.23Å; P235-I326 HydrophobicContact CB-CG2 4.49Å; P235-I326 HydrophobicContact CG-CG2 3.93Å; L238-I326 HydrophobicContact CD1-CB 3.92Å; L238-I326 HydrophobicContact CD1-CD1 4.19Å; L238-I326 HydrophobicContact CD1-CG2 3.6Å; W250-I326 HydrophobicContact CZ2-CG2 3.95Å; I266-I326 HydrophobicContact CD1-CD1 4.39Å; I266-I326 HydrophobicContact CD1-CG1 3.6Å; L322-I326 HydrophobicContact CD1-CD1 4.3Å; L322-I326 HydrophobicContact CG-CD1 4.3Å; L322-I326 WeakPolarHBondContact O-CG1 3.11Å; L322-I326 PolarHBondContact O-N 3.45Å; L323-I326 HydrophobicContact CD2-CD1 4.43Å; L323-I326 PolarHBondContact O-N 3.29Å; D324-I326 PolarHBondContact O-N 3.02Å; I326-K353 WeakPolarHBondContact O-CE 3.31Å; I326-K353 PolarHBondContact O-NZ 2.95Å
327	V	93.9	Very high	91	Very high	29 Å²	29	60.9 Å²	60.9	18%	0.176	32%	0.324	C	S	.	.	H	α-helix	trans	-80.5	-36.2	-175.5	176.9	0	0	0	0	113.2	L238 Q239 L323 D324 Y325 K353	L238-V327 HydrophobicContact CB-CG2 3.86Å; L238-V327 HydrophobicContact CD1-CG2 4Å; Q239-V327 HydrophobicContact CG-CG1 3.92Å; Q239-V327 HydrophobicContact CG-CG2 4.34Å; L323-V327 WeakPolarHBondContact O-CG2 3.41Å; L323-V327 PolarHBondContact O-N 2.95Å; D324-V327 CarbonylContact O-C 3.59Å; D324-V327 PolarHBondContact O-N 3Å; Y325-V327 PolarHBondContact O-N 3.23Å; V327-K353 VanDerWaalsContact O-CE 3.28Å; V327-K353 WeakPolarHBondContact O-CE 3.43Å; V327-K353 PolarHBondContact O-NZ 3.34Å
328	N	94.3	Very high	91.7	Very high	96 Å²	96	59.5 Å²	59.5	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-112.2	-28.2	-168.1	-62.4	-42.3	0	0	0	114.5	D324 Y325	D324-N328 WeakPolarHBondContact O-CB 3.24Å; D324-N328 PolarHBondContact O-N 3.16Å; D324-N328 PolarHBondContact O-ND2 3.29Å; D324-N328 PolarHBondContact OD1-ND2 3.48Å; D324-N328 PolarHBondContact OD2-ND2 3.47Å; Y325-N328 PolarHBondContact O-N 2.83Å
329	E	95.4	Very high	92	Very high	86 Å²	86	58.3 Å²	58.3	40%	0.402	30%	0.304	S	S	.	.	S	Bend	trans	-93.3	163	-175.9	-64.2	-66.1	161.4	0	0	112.4	Y325 K353	Y325-E329 HydrophobicContact CD1-CB 3.66Å; Y325-E329 HydrophobicContact CD1-CG 4.26Å; Y325-E329 HydrophobicContact CD2-CB 3.86Å; Y325-E329 HydrophobicContact CD2-CG 3.58Å; Y325-E329 HydrophobicContact CE1-CB 3.56Å; Y325-E329 HydrophobicContact CE1-CG 4.37Å; Y325-E329 HydrophobicContact CE2-CB 3.75Å; Y325-E329 HydrophobicContact CE2-CG 3.69Å; Y325-E329 HydrophobicContact CG-CB 3.79Å; Y325-E329 HydrophobicContact CG-CG 3.86Å; Y325-E329 WeakPolarHBondContact O-CB 3.49Å; Y325-E329 PolarHBondContact O-N 3.41Å; E329-K353 PolarHBondContact O-NZ 3.02Å
330	P	95.2	Very high	92.6	Very high	74 Å²	74	58.6 Å²	58.6	48%	0.481	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-56.5	144.4	174.4	-24.9	35.1	0	0	0	112.2
331	P	95.7	Very high	93.1	Very high	35 Å²	35	56.8 Å²	56.8	23%	0.227	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-64.7	149.8	175.5	28.4	-33.7	0	0	0	110.9	W250 L351 K353	W250-P331 HydrophobicContact CH2-CB 4.04Å; W250-P331 HydrophobicContact CZ3-CB 4.33Å; P331-L351 HydrophobicContact CB-CB 3.97Å; P331-L351 VanDerWaalsContact CB-O 3.28Å; P331-L351 WeakPolarHBondContact CB-O 3.31Å; P331-L351 WeakPolarHBondContact CG-O 3.29Å; P331-K353 HydrophobicContact CG-CG 4.5Å
332	P	94.8	Very high	93.5	Very high	6 Å²	6	53.4 Å²	53.4	4%	0.039	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-64.4	154.4	177	27.1	-32.3	0	0	0	111	L254 P265 I266 L351	L254-P332 HydrophobicContact CD1-CG 3.5Å; P265-P332 HydrophobicContact CB-CB 3.88Å; P265-P332 HydrophobicContact CB-CG 4.15Å; P265-P332 HydrophobicContact CG-CB 4.43Å; P265-P332 HydrophobicContact CG-CG 4.14Å; I266-P332 HydrophobicContact CD1-CG 4.41Å; I266-P332 HydrophobicContact CG1-CG 4.13Å; P332-L351 HydrophobicContact CG-CD1 4.04Å; P332-L351 VanDerWaalsContact O-CD1 3.29Å; P332-L351 WeakPolarHBondContact O-CD1 3.21Å
333	R	92.9	Very high	93.9	Very high	178 Å²	178	52.6 Å²	52.6	67%	0.672	29%	0.287	S	S	*	.			trans	-129.9	156.8	179	-61.3	-177.7	-176.3	-174.1	0.1	109.9
334	L	94.5	Very high	94.2	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.037	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-73.4	148.2	168.4	-72.6	171.4	0	0	0	109.8	V257 A260 I261 L336 F339 F343 N344 V347	V257-L334 HydrophobicContact CB-CD2 4.49Å; V257-L334 HydrophobicContact CG1-CD2 4.24Å; V257-L334 HydrophobicContact CG2-CD2 4.42Å; V257-L334 HydrophobicContact CG2-CG 4.43Å; A260-L334 HydrophobicContact CB-CD2 3.65Å; I261-L334 HydrophobicContact CG1-CD2 4.31Å; L334-L336 PolarHBondContact O-N 3.35Å; L334-F339 HydrophobicContact CB-CD2 3.96Å; L334-F339 HydrophobicContact CD1-CB 4.47Å; L334-F339 HydrophobicContact CD1-CD2 4.42Å; L334-F339 HydrophobicContact CD1-CG 4.38Å; L334-F339 HydrophobicContact CD2-CD2 3.97Å; L334-F339 HydrophobicContact CD2-CE2 3.88Å; L334-F339 HydrophobicContact CD2-CZ 4.41Å; L334-F339 HydrophobicContact CG-CD2 4.34Å; L334-F343 HydrophobicContact CD1-CD1 3.46Å; L334-F343 VanDerWaalsContact CD1-CD1 3.46Å; L334-F343 HydrophobicContact CD1-CD2 4.23Å; L334-F343 HydrophobicContact CD1-CE1 3.44Å; L334-F343 VanDerWaalsContact CD1-CE1 3.44Å; L334-F343 HydrophobicContact CD1-CE2 4.21Å; L334-F343 HydrophobicContact CD1-CG 3.87Å; L334-F343 HydrophobicContact CD1-CZ 3.81Å; L334-F343 HydrophobicContact CD2-CE1 4.38Å; L334-N344 VanDerWaalsContact CB-OD1 3.22Å; L334-N344 WeakPolarHBondContact CB-OD1 3.49Å; L334-N344 PolarHBondContact O-OD1 3.25Å; L334-V347 HydrophobicContact CD1-CB 4.2Å; L334-V347 HydrophobicContact CD1-CG2 3.83Å; L334-V347 HydrophobicContact CG-CG1 4.5Å
335	P	92	Very high	94.5	Very high	6 Å²	6	51.9 Å²	51.9	4%	0.039	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-66.2	129.6	176.4	21.9	-30.3	0	0	0	112	L274 F278 V282 V338 F339	L274-P335 HydrophobicContact CD2-CB 4.25Å; L274-P335 HydrophobicContact CD2-CG 4.3Å; F278-P335 HydrophobicContact CD2-CG 4.48Å; F278-P335 HydrophobicContact CE2-CB 4.49Å; F278-P335 HydrophobicContact CE2-CG 3.66Å; F278-P335 HydrophobicContact CZ-CG 3.85Å; V282-P335 HydrophobicContact CG1-CB 3.49Å; V282-P335 VanDerWaalsContact CG1-CB 3.49Å; P335-V338 HydrophobicContact CB-CB 4.35Å; P335-V338 HydrophobicContact CB-CG2 4.09Å; P335-V338 HydrophobicContact CG-CB 4.06Å; P335-V338 HydrophobicContact CG-CG1 4.42Å; P335-V338 HydrophobicContact CG-CG2 4.15Å; P335-V338 PolarHBondContact O-N 2.7Å; P335-F339 HydrophobicContact CG-CD2 3.88Å; P335-F339 HydrophobicContact CG-CE2 3.6Å
336	L	87.1	Confident	94.8	Very high	84 Å²	84	49.8 Å²	49.8	44%	0.44	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	145.4	178	-62.3	177.9	0	0	0	111.1	L334 V338	L334-L336 PolarHBondContact O-N 3.35Å; L336-V338 PolarHBondContact O-N 3.42Å; L336-V338 VanDerWaalsContact O-N 3.16Å
337	G	85.9	Confident	95	Very high	69 Å²	69	49.7 Å²	49.7	71%	0.711	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	-2.9	-179.5	0	0	0	0	0	115.2	R280	R280-G337 PolarHBondContact NH2-O 3.21Å
338	V	93.4	Very high	95.2	Very high	33 Å²	33	51.2 Å²	51.2	20%	0.2	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-45.5	172	176.2	0	0	0	0	111.6	F278 V282 P335 L336	F278-V338 HydrophobicContact CD1-CG1 3.51Å; F278-V338 HydrophobicContact CD1-CG2 4.24Å; F278-V338 HydrophobicContact CD2-CG2 4.35Å; F278-V338 HydrophobicContact CE1-CG1 3.39Å; F278-V338 HydrophobicContact CG-CG1 4.24Å; F278-V338 HydrophobicContact CG-CG2 4.14Å; F278-V338 HydrophobicContact CZ-CG1 3.98Å; V282-V338 HydrophobicContact CG1-CG2 4.2Å; V282-V338 HydrophobicContact CG2-CG2 3.83Å; P335-V338 HydrophobicContact CB-CB 4.35Å; P335-V338 HydrophobicContact CB-CG2 4.09Å; P335-V338 HydrophobicContact CG-CB 4.06Å; P335-V338 HydrophobicContact CG-CG1 4.42Å; P335-V338 HydrophobicContact CG-CG2 4.15Å; P335-V338 PolarHBondContact O-N 2.7Å; L336-V338 PolarHBondContact O-N 3.42Å; L336-V338 VanDerWaalsContact O-N 3.16Å
339	F	96	Very high	95.4	Very high	24 Å²	24	49.8 Å²	49.8	11%	0.105	27%	0.271	C	S	.	.	S	Bend	trans	-109.1	159.5	-178	-62.2	-75.6	0	0	0	110.8	E166 A260 F278 L334 P335 F343 N344	E166-F339 HydrophobicContact CB-CD1 4.36Å; E166-F339 WeakPolarHBondContact OE2-CA 3.39Å; A260-F339 HydrophobicContact CB-CE1 3.87Å; A260-F339 HydrophobicContact CB-CE2 4.38Å; A260-F339 HydrophobicContact CB-CZ 3.69Å; F278-F339 HydrophobicContact CE1-CE2 4.24Å; F278-F339 HydrophobicContact CE1-CZ 4.1Å; F278-F339 AromaticContact CZ-CE2 3.98Å; F278-F339 HydrophobicContact CZ-CE2 3.98Å; F278-F339 HydrophobicContact CZ-CZ 4.14Å; L334-F339 HydrophobicContact CB-CD2 3.96Å; L334-F339 HydrophobicContact CD1-CB 4.47Å; L334-F339 HydrophobicContact CD1-CD2 4.42Å; L334-F339 HydrophobicContact CD1-CG 4.38Å; L334-F339 HydrophobicContact CD2-CD2 3.97Å; L334-F339 HydrophobicContact CD2-CE2 3.88Å; L334-F339 HydrophobicContact CD2-CZ 4.41Å; L334-F339 HydrophobicContact CG-CD2 4.34Å; P335-F339 HydrophobicContact CG-CD2 3.88Å; P335-F339 HydrophobicContact CG-CE2 3.6Å; F339-F343 HydrophobicContact CB-CD1 3.99Å; F339-F343 AromaticContact CD1-CD1 3.81Å; F339-F343 HydrophobicContact CD1-CD1 3.81Å; F339-F343 AromaticContact CD1-CE1 3.93Å; F339-F343 HydrophobicContact CD1-CE1 3.93Å; F339-F343 HydrophobicContact CE1-CE1 4.33Å; F339-F343 HydrophobicContact CG-CD1 4.06Å; F339-F343 HydrophobicContact CG-CE1 4.38Å; F339-N344 PolarHBondContact O-ND2 2.95Å
340	T	97.1	Very high	95.6	Very high	51 Å²	51	45.7 Å²	45.7	31%	0.313	25%	0.252	S	S	.	.			trans	-65.1	154.4	177.5	73.9	0	0	0	0	111.4	E166 D342 F343 N344 R372	E166-T340 VanDerWaalsContact OE1-CB 3.3Å; E166-T340 WeakPolarHBondContact OE1-CB 3.42Å; E166-T340 WeakPolarHBondContact OE1-CG2 3.37Å; E166-T340 PolarHBondContact OE1-OG1 3.28Å; E166-T340 PolarHBondContact OE2-N 3Å; T340-D342 PolarHBondContact O-N 2.94Å; T340-F343 PolarHBondContact O-N 3.24Å; T340-F343 PolarHBondContact OG1-N 3.49Å; T340-N344 PolarHBondContact O-N 2.64Å; T340-N344 PolarHBondContact O-ND2 3.12Å; T340-R372 PolarHBondContact OG1-NH1 3.47Å; T340-R372 PolarHBondContact OG1-NH2 3.15Å
341	N	97.1	Very high	95.7	Very high	126 Å²	126	42.3 Å²	42.3	67%	0.674	23%	0.23	S	C	*	.	H	α-helix	trans	-60.9	-36.6	176.9	-70.3	-19.8	0	0	0	111.6	F343 N344 E345	N341-F343 VanDerWaalsContact C-N 3.32Å; N341-F343 PolarHBondContact O-N 3Å; N341-N344 PolarHBondContact O-N 3.44Å; N341-E345 WeakPolarHBondContact O-CB 3.48Å; N341-E345 PolarHBondContact O-N 2.86Å
342	D	97.9	Very high	95.8	Very high	41 Å²	41	42.9 Å²	42.9	22%	0.219	23%	0.23	C	C	.	.	H	α-helix	trans	-61	-41.1	177.5	-60.2	-31.9	0	0	0	111.6	T340 F346 H367 F369 R372	T340-D342 PolarHBondContact O-N 2.94Å; D342-F346 VanDerWaalsContact O-CB 3.26Å; D342-F346 WeakPolarHBondContact O-CB 3.41Å; D342-F346 PolarHBondContact O-N 2.93Å; D342-H367 PolarHBondContact O-CE1 2.85Å; D342-F369 HydrophobicContact CB-CB 4Å; D342-R372 IonicContact OD2-CZ 3.99Å; D342-R372 IonicContact OD2-NH1 2.92Å; D342-R372 PolarHBondContact OD2-NH1 3.04Å
343	F	98.6	Very high	95.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-71.9	-41.6	179.2	-175	-146.4	0	0	0	111.8	E166 L169 L256 A260 L334 F339 T340 N341 E345 F346 V347 F369	E166-F343 HydrophobicContact CB-CD1 4.35Å; E166-F343 HydrophobicContact CG-CB 4.11Å; E166-F343 HydrophobicContact CG-CD1 3.57Å; E166-F343 HydrophobicContact CG-CE1 4.19Å; E166-F343 HydrophobicContact CG-CG 3.95Å; E166-F343 WeakPolarHBondContact OE1-CB 3.48Å; L169-F343 HydrophobicContact CB-CZ 4.27Å; L169-F343 HydrophobicContact CD1-CE1 3.98Å; L169-F343 HydrophobicContact CD1-CZ 3.73Å; L256-F343 HydrophobicContact CB-CE2 4.41Å; L256-F343 HydrophobicContact CB-CZ 4.39Å; L256-F343 HydrophobicContact CD1-CE2 4.49Å; A260-F343 HydrophobicContact CB-CE1 3.98Å; A260-F343 HydrophobicContact CB-CZ 4.27Å; L334-F343 HydrophobicContact CD1-CD1 3.46Å; L334-F343 VanDerWaalsContact CD1-CD1 3.46Å; L334-F343 HydrophobicContact CD1-CD2 4.23Å; L334-F343 HydrophobicContact CD1-CE1 3.44Å; L334-F343 VanDerWaalsContact CD1-CE1 3.44Å; L334-F343 HydrophobicContact CD1-CE2 4.21Å; L334-F343 HydrophobicContact CD1-CG 3.87Å; L334-F343 HydrophobicContact CD1-CZ 3.81Å; L334-F343 HydrophobicContact CD2-CE1 4.38Å; F339-F343 HydrophobicContact CB-CD1 3.99Å; F339-F343 AromaticContact CD1-CD1 3.81Å; F339-F343 HydrophobicContact CD1-CD1 3.81Å; F339-F343 AromaticContact CD1-CE1 3.93Å; F339-F343 HydrophobicContact CD1-CE1 3.93Å; F339-F343 HydrophobicContact CE1-CE1 4.33Å; F339-F343 HydrophobicContact CG-CD1 4.06Å; F339-F343 HydrophobicContact CG-CE1 4.38Å; T340-F343 PolarHBondContact O-N 3.24Å; T340-F343 PolarHBondContact OG1-N 3.49Å; N341-F343 VanDerWaalsContact C-N 3.32Å; N341-F343 PolarHBondContact O-N 3Å; F343-E345 PolarHBondContact O-N 3.19Å; F343-F346 PolarHBondContact O-N 3.12Å; F343-V347 HydrophobicContact CD2-CG2 3.92Å; F343-V347 HydrophobicContact CE2-CG2 3.53Å; F343-V347 HydrophobicContact CZ-CG2 4.12Å; F343-V347 WeakPolarHBondContact O-CG2 3.5Å; F343-V347 PolarHBondContact O-N 3.15Å; F343-F369 HydrophobicContact CB-CD2 3.72Å; F343-F369 HydrophobicContact CB-CE2 3.64Å; F343-F369 HydrophobicContact CB-CG 4.46Å; F343-F369 HydrophobicContact CB-CZ 4.3Å; F343-F369 HydrophobicContact CD2-CD1 4.17Å; F343-F369 HydrophobicContact CD2-CD2 4.14Å; F343-F369 AromaticContact CD2-CE1 3.65Å; F343-F369 HydrophobicContact CD2-CE1 3.65Å; F343-F369 AromaticContact CD2-CE2 3.63Å; F343-F369 HydrophobicContact CD2-CE2 3.63Å; F343-F369 HydrophobicContact CD2-CG 4.39Å; F343-F369 AromaticContact CD2-CZ 3.35Å; F343-F369 HydrophobicContact CD2-CZ 3.35Å; F343-F369 HydrophobicContact CE2-CE1 4.04Å; F343-F369 HydrophobicContact CE2-CE2 4.48Å; F343-F369 AromaticContact CE2-CZ 3.82Å; F343-F369 HydrophobicContact CE2-CZ 3.82Å; F343-F369 HydrophobicContact CG-CD2 4.25Å; F343-F369 AromaticContact CG-CE2 3.74Å; F343-F369 HydrophobicContact CG-CE2 3.74Å; F343-F369 AromaticContact CG-CZ 3.92Å; F343-F369 HydrophobicContact CG-CZ 3.92Å
344	N	97.8	Very high	96.1	Very high	14 Å²	14	39.9 Å²	39.9	8%	0.075	23%	0.225	C	C	.	.	H	α-helix	trans	-57.3	-47.6	172.5	-81.9	-83.7	0	0	0	111.8	L334 F339 T340 N341 T348	L334-N344 VanDerWaalsContact CB-OD1 3.22Å; L334-N344 WeakPolarHBondContact CB-OD1 3.49Å; L334-N344 PolarHBondContact O-OD1 3.25Å; F339-N344 PolarHBondContact O-ND2 2.95Å; T340-N344 PolarHBondContact O-N 2.64Å; T340-N344 PolarHBondContact O-ND2 3.12Å; N341-N344 PolarHBondContact O-N 3.44Å; N344-T348 VanDerWaalsContact O-CB 3.31Å; N344-T348 WeakPolarHBondContact O-CB 3.42Å; N344-T348 PolarHBondContact O-N 3.41Å; N344-T348 PolarHBondContact O-OG1 2.82Å
345	E	98.1	Very high	96.2	Very high	83 Å²	83	41.3 Å²	41.3	39%	0.388	23%	0.234	S	C	.	.	H	α-helix	trans	-64.1	-44.2	178.3	-171.8	-170	177.7	0	0	111.4	N341 F343 V347 T348 K349 H367	N341-E345 WeakPolarHBondContact O-CB 3.48Å; N341-E345 PolarHBondContact O-N 2.86Å; F343-E345 PolarHBondContact O-N 3.19Å; E345-V347 PolarHBondContact O-N 3.3Å; E345-T348 WeakPolarHBondContact O-CB 3.19Å; E345-T348 PolarHBondContact O-N 3.46Å; E345-K349 HydrophobicContact CG-CD 4.47Å; E345-K349 PolarHBondContact O-N 3.46Å; E345-K349 WeakPolarHBondContact OE1-CE 3.39Å; E345-K349 IonicContact OE1-NZ 3.75Å; E345-K349 PolarHBondContact OE1-NZ 3.19Å; E345-H367 IonicContact OE1-NE2 2.7Å; E345-H367 IonicContact OE2-CE1 3.9Å; E345-H367 IonicContact OE2-NE2 2.93Å
346	F	98.8	Very high	96.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.1	-51.8	178.3	178.9	-98.7	0	0	0	111.6	L177 M252 L256 D342 F343 T348 K349 C350 L364 H367 F369 I370	L177-F346 HydrophobicContact CD1-CE2 4.22Å; L177-F346 HydrophobicContact CD1-CZ 4.03Å; M252-F346 HydrophobicContact CE-CE1 3.85Å; M252-F346 HydrophobicContact CE-CZ 3.75Å; L256-F346 HydrophobicContact CD1-CD1 4.22Å; L256-F346 HydrophobicContact CD1-CE1 3.64Å; D342-F346 VanDerWaalsContact O-CB 3.26Å; D342-F346 WeakPolarHBondContact O-CB 3.41Å; D342-F346 PolarHBondContact O-N 2.93Å; F343-F346 PolarHBondContact O-N 3.12Å; F346-T348 VanDerWaalsContact C-N 3.34Å; F346-T348 PolarHBondContact O-N 3.39Å; F346-K349 PolarHBondContact O-N 2.75Å; F346-C350 PolarHBondContact O-N 3.09Å; F346-C350 VanDerWaalsContact O-N 3.15Å; F346-C350 PolarHBondContact O-SG 3.27Å; F346-C350 VanDerWaalsContact O-SG 3.32Å; F346-L364 HydrophobicContact CD2-CD2 3.87Å; F346-L364 HydrophobicContact CE2-CB 3.99Å; F346-L364 HydrophobicContact CE2-CD2 3.59Å; F346-L364 HydrophobicContact CE2-CG 4.31Å; F346-L364 HydrophobicContact CZ-CD2 4.23Å; F346-H367 HydrophobicContact CD2-CB 3.85Å; F346-H367 AromaticContact CD2-CG 3.74Å; F346-H367 AromaticContact CD2-ND1 3.77Å; F346-H367 HydrophobicContact CE2-CB 4.32Å; F346-F369 HydrophobicContact CB-CB 3.9Å; F346-F369 HydrophobicContact CB-CD1 3.97Å; F346-F369 HydrophobicContact CB-CG 4.12Å; F346-F369 AromaticContact CD1-CD1 3.67Å; F346-F369 HydrophobicContact CD1-CD1 3.67Å; F346-F369 HydrophobicContact CD1-CE1 4.01Å; F346-F369 HydrophobicContact CD2-CB 4.36Å; F346-F369 HydrophobicContact CD2-CD1 4.02Å; F346-F369 HydrophobicContact CE1-CD1 4.13Å; F346-F369 HydrophobicContact CE1-CE1 4.28Å; F346-F369 HydrophobicContact CE2-CD1 4.44Å; F346-F369 HydrophobicContact CG-CB 4.22Å; F346-F369 AromaticContact CG-CD1 3.61Å; F346-F369 HydrophobicContact CG-CD1 3.61Å; F346-F369 HydrophobicContact CG-CE1 4.4Å; F346-F369 HydrophobicContact CG-CG 4.23Å; F346-F369 HydrophobicContact CZ-CD1 4.5Å; F346-I370 HydrophobicContact CD2-CG1 4.13Å; F346-I370 HydrophobicContact CE2-CD1 3.79Å; F346-I370 HydrophobicContact CE2-CG1 3.5Å; F346-I370 HydrophobicContact CZ-CD1 3.82Å; F346-I370 HydrophobicContact CZ-CG1 4.07Å
347	V	98.5	Very high	96.9	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-39.7	178	169.1	0	0	0	0	111.4	L256 V257 L334 F343 E345 K349 C350 L351	L256-V347 HydrophobicContact CB-CG2 4.21Å; L256-V347 HydrophobicContact CD1-CG2 4.48Å; V257-V347 HydrophobicContact CG2-CG1 3.36Å; L334-V347 HydrophobicContact CD1-CB 4.2Å; L334-V347 HydrophobicContact CD1-CG2 3.83Å; L334-V347 HydrophobicContact CG-CG1 4.5Å; F343-V347 HydrophobicContact CD2-CG2 3.92Å; F343-V347 HydrophobicContact CE2-CG2 3.53Å; F343-V347 HydrophobicContact CZ-CG2 4.12Å; F343-V347 WeakPolarHBondContact O-CG2 3.5Å; F343-V347 PolarHBondContact O-N 3.15Å; E345-V347 PolarHBondContact O-N 3.3Å; V347-K349 VanDerWaalsContact C-N 3.32Å; V347-K349 PolarHBondContact O-N 3.16Å; V347-C350 WeakPolarHBondContact O-CB 3.12Å; V347-C350 PolarHBondContact O-N 3.33Å; V347-C350 VanDerWaalsContact O-N 3.12Å; V347-L351 HydrophobicContact CG1-CD1 3.74Å; V347-L351 HydrophobicContact CG1-CG 4.36Å; V347-L351 WeakPolarHBondContact O-CG 3.46Å; V347-L351 PolarHBondContact O-N 3.48Å
348	T	98.3	Very high	97.4	Very high	62 Å²	62	44.7 Å²	44.7	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-43.9	177	-61	0	0	0	0	111.1	N344 E345 F346 C350 L351 I352	N344-T348 VanDerWaalsContact O-CB 3.31Å; N344-T348 WeakPolarHBondContact O-CB 3.42Å; N344-T348 PolarHBondContact O-N 3.41Å; N344-T348 PolarHBondContact O-OG1 2.82Å; E345-T348 WeakPolarHBondContact O-CB 3.19Å; E345-T348 PolarHBondContact O-N 3.46Å; F346-T348 VanDerWaalsContact C-N 3.34Å; F346-T348 PolarHBondContact O-N 3.39Å; T348-C350 VanDerWaalsContact C-N 3.31Å; T348-C350 PolarHBondContact O-N 2.62Å; T348-L351 PolarHBondContact O-N 2.78Å; T348-I352 WeakPolarHBondContact O-CG1 3.44Å; T348-I352 PolarHBondContact O-N 3.36Å
349	K	98.6	Very high	97.7	Very high	66 Å²	66	43.3 Å²	43.3	29%	0.287	24%	0.237	S	C	.	.	H	α-helix	trans	-65	-32.2	176.3	-76.8	178.7	-177	160.5	0	113.3	E345 F346 V347 R358 A359 L364 H367	E345-K349 HydrophobicContact CG-CD 4.47Å; E345-K349 PolarHBondContact O-N 3.46Å; E345-K349 WeakPolarHBondContact OE1-CE 3.39Å; E345-K349 IonicContact OE1-NZ 3.75Å; E345-K349 PolarHBondContact OE1-NZ 3.19Å; F346-K349 PolarHBondContact O-N 2.75Å; V347-K349 VanDerWaalsContact C-N 3.32Å; V347-K349 PolarHBondContact O-N 3.16Å; K349-R358 WeakPolarHBondContact O-CG 3.29Å; K349-A359 HydrophobicContact CB-CB 3.91Å; K349-A359 PolarHBondContact O-N 3.42Å; K349-L364 HydrophobicContact CB-CD2 4.49Å; K349-H367 PolarHBondContact NZ-CD2 3.12Å; K349-H367 PolarHBondContact NZ-NE2 2.65Å; K349-H367 VanDerWaalsContact NZ-NE2 3.1Å
350	C	98.7	Very high	97.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-70.1	-34.1	173.4	-65.4	0	0	0	0	112.6	V249 W250 F346 V347 T348 R358	V249-C350 HydrophobicContact CG1-CB 3.98Å; W250-C350 WeakPolarHBondContact CA-O 3.24Å; F346-C350 PolarHBondContact O-N 3.09Å; F346-C350 VanDerWaalsContact O-N 3.15Å; F346-C350 PolarHBondContact O-SG 3.27Å; F346-C350 VanDerWaalsContact O-SG 3.32Å; V347-C350 WeakPolarHBondContact O-CB 3.12Å; V347-C350 PolarHBondContact O-N 3.33Å; V347-C350 VanDerWaalsContact O-N 3.12Å; T348-C350 VanDerWaalsContact C-N 3.31Å; T348-C350 PolarHBondContact O-N 2.62Å; C350-R358 WeakPolarHBondContact O-CD 3.46Å; C350-R358 WeakPolarHBondContact O-CG 3.42Å; C350-R358 PolarHBondContact O-NE 2.63Å
351	L	98.5	Very high	97.7	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.01	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	18.4	-173.1	-65.9	178.2	0	0	0	114.2	W250 L254 V257 P331 P332 V347 T348 K353	W250-L351 HydrophobicContact CD2-CD2 3.93Å; W250-L351 HydrophobicContact CE3-CD2 4.03Å; W250-L351 HydrophobicContact CG-CD2 4.39Å; W250-L351 HydrophobicContact CZ2-CD2 4.41Å; W250-L351 HydrophobicContact CZ3-CB 4.38Å; W250-L351 HydrophobicContact CZ3-CD2 4.35Å; W250-L351 WeakPolarHBondContact CZ3-O 3.49Å; L254-L351 HydrophobicContact CB-CD2 4.24Å; L254-L351 HydrophobicContact CD1-CD2 4.42Å; V257-L351 HydrophobicContact CG2-CD1 3.95Å; P331-L351 HydrophobicContact CB-CB 3.97Å; P331-L351 VanDerWaalsContact CB-O 3.28Å; P331-L351 WeakPolarHBondContact CB-O 3.31Å; P331-L351 WeakPolarHBondContact CG-O 3.29Å; P332-L351 HydrophobicContact CG-CD1 4.04Å; P332-L351 VanDerWaalsContact O-CD1 3.29Å; P332-L351 WeakPolarHBondContact O-CD1 3.21Å; V347-L351 HydrophobicContact CG1-CD1 3.74Å; V347-L351 HydrophobicContact CG1-CG 4.36Å; V347-L351 WeakPolarHBondContact O-CG 3.46Å; V347-L351 PolarHBondContact O-N 3.48Å; T348-L351 PolarHBondContact O-N 2.78Å; L351-K353 PolarHBondContact O-N 3.12Å
352	I	98.4	Very high	97.7	Very high	47 Å²	47	45.3 Å²	45.3	24%	0.241	24%	0.239	C	C	.	.			trans	-64.6	125	169.1	-63.2	174.9	0	0	0	108.6	T348 N354 E357 R358	T348-I352 WeakPolarHBondContact O-CG1 3.44Å; T348-I352 PolarHBondContact O-N 3.36Å; I352-N354 HydrophobicContact CG2-CB 4.43Å; I352-E357 WeakPolarHBondContact CD1-O 3.47Å; I352-E357 HydrophobicContact CG2-CB 3.79Å; I352-R358 HydrophobicContact CB-CB 4.12Å; I352-R358 HydrophobicContact CB-CG 4.45Å; I352-R358 VanDerWaalsContact O-CZ 3.3Å; I352-R358 PolarHBondContact O-NE 3.43Å; I352-R358 PolarHBondContact O-NH2 3.44Å
353	K	96.3	Very high	97.7	Very high	53 Å²	53	49.3 Å²	49.3	23%	0.23	26%	0.257	C	S	.	.	S	Bend	trans	-66.8	-40.9	-175.8	-63	-173.6	72	156.2	0	112.2	P235 W250 I326 V327 E329 P331 L351 P355 R358	P235-K353 HydrophobicContact CG-CB 4.39Å; P235-K353 HydrophobicContact CG-CG 4.35Å; W250-K353 HydrophobicContact CH2-CG 4.09Å; W250-K353 HydrophobicContact CZ3-CG 3.9Å; I326-K353 WeakPolarHBondContact O-CE 3.31Å; I326-K353 PolarHBondContact O-NZ 2.95Å; V327-K353 VanDerWaalsContact O-CE 3.28Å; V327-K353 WeakPolarHBondContact O-CE 3.43Å; V327-K353 PolarHBondContact O-NZ 3.34Å; E329-K353 PolarHBondContact O-NZ 3.02Å; P331-K353 HydrophobicContact CG-CG 4.5Å; L351-K353 PolarHBondContact O-N 3.12Å; K353-P355 VanDerWaalsContact O-CD 3.25Å; K353-P355 WeakPolarHBondContact O-CD 3.28Å; K353-R358 PolarHBondContact O-NH2 3.09Å; K353-R358 VanDerWaalsContact O-NH2 3.12Å
354	N	96.5	Very high	97.7	Very high	68 Å²	68	49.3 Å²	49.3	36%	0.364	26%	0.257	S	S	.	.	S	Bend	trans	-70.1	111.5	174.1	-176.9	-4	0	0	0	109.9	I352 A356 E357 R358	I352-N354 HydrophobicContact CG2-CB 4.43Å; N354-A356 PolarHBondContact O-N 3.39Å; N354-A356 VanDerWaalsContact O-N 3.15Å; N354-A356 PolarHBondContact OD1-N 2.93Å; N354-A356 VanDerWaalsContact OD1-N 3.14Å; N354-E357 HydrophobicContact CB-CB 4.28Å; N354-E357 HydrophobicContact CB-CG 4.39Å; N354-E357 VanDerWaalsContact ND2-CD 3.35Å; N354-E357 PolarHBondContact ND2-OE1 3.17Å; N354-E357 PolarHBondContact O-N 3.1Å; N354-E357 VanDerWaalsContact O-N 3.11Å; N354-R358 PolarHBondContact O-N 3.07Å
355	P	96.5	Very high	97.7	Very high	37 Å²	37	50.4 Å²	50.4	24%	0.24	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-21.4	-176	27.5	-36.3	0	0	0	113.6	E236 Q246 K353	E236-P355 HydrophobicContact CB-CG 4.06Å; E236-P355 HydrophobicContact CG-CB 4.19Å; E236-P355 HydrophobicContact CG-CG 4.01Å; Q246-P355 HydrophobicContact CB-CB 4.15Å; Q246-P355 PolarHBondContact NE2-O 2.83Å; Q246-P355 VanDerWaalsContact NE2-O 3.12Å; K353-P355 VanDerWaalsContact O-CD 3.25Å; K353-P355 WeakPolarHBondContact O-CD 3.28Å
356	A	95.9	Very high	97.7	Very high	90 Å²	90	51 Å²	51	74%	0.744	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-25.5	177.1	0	0	0	0	0	113.3	N354	N354-A356 PolarHBondContact O-N 3.39Å; N354-A356 VanDerWaalsContact O-N 3.15Å; N354-A356 PolarHBondContact OD1-N 2.93Å; N354-A356 VanDerWaalsContact OD1-N 3.14Å
357	E	97.4	Very high	97.7	Very high	134 Å²	134	51.5 Å²	51.5	63%	0.626	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-20	176.9	-70.1	168.1	-153.7	0	0	112.3	I352 N354	I352-E357 WeakPolarHBondContact CD1-O 3.47Å; I352-E357 HydrophobicContact CG2-CB 3.79Å; N354-E357 HydrophobicContact CB-CB 4.28Å; N354-E357 HydrophobicContact CB-CG 4.39Å; N354-E357 VanDerWaalsContact ND2-CD 3.35Å; N354-E357 PolarHBondContact ND2-OE1 3.17Å; N354-E357 PolarHBondContact O-N 3.1Å; N354-E357 VanDerWaalsContact O-N 3.11Å
358	R	98.3	Very high	97.7	Very high	6 Å²	6	55.2 Å²	55.2	2%	0.023	29%	0.293	C	S	.	.	S	Bend	trans	-57.8	137	174	-167.8	-177.2	-61.5	151.3	8.7	109.8	E236 Q246 V249 K349 C350 I352 K353 N354 D360	E236-R358 IonicContact OE1-CZ 3.88Å; E236-R358 IonicContact OE1-NH1 2.77Å; E236-R358 PolarHBondContact OE1-NH1 3.28Å; E236-R358 IonicContact OE1-NH2 2.78Å; E236-R358 IonicContact OE2-CZ 3.86Å; E236-R358 IonicContact OE2-NH1 2.87Å; E236-R358 PolarHBondContact OE2-NH1 2.88Å; E236-R358 IonicContact OE2-NH2 2.84Å; E236-R358 PolarHBondContact OE2-NH2 2.98Å; Q246-R358 VanDerWaalsContact C-NH1 3.33Å; Q246-R358 PolarHBondContact NE2-O 3.41Å; Q246-R358 VanDerWaalsContact O-CD 3.28Å; Q246-R358 WeakPolarHBondContact O-CD 3.35Å; Q246-R358 PolarHBondContact O-NH1 3.47Å; V249-R358 HydrophobicContact CG1-CG 4.07Å; K349-R358 WeakPolarHBondContact O-CG 3.29Å; C350-R358 WeakPolarHBondContact O-CD 3.46Å; C350-R358 WeakPolarHBondContact O-CG 3.42Å; C350-R358 PolarHBondContact O-NE 2.63Å; I352-R358 HydrophobicContact CB-CB 4.12Å; I352-R358 HydrophobicContact CB-CG 4.45Å; I352-R358 VanDerWaalsContact O-CZ 3.3Å; I352-R358 PolarHBondContact O-NE 3.43Å; I352-R358 PolarHBondContact O-NH2 3.44Å; K353-R358 PolarHBondContact O-NH2 3.09Å; K353-R358 VanDerWaalsContact O-NH2 3.12Å; N354-R358 PolarHBondContact O-N 3.07Å; R358-D360 PolarHBondContact O-N 2.71Å
359	A	97.9	Very high	97.7	Very high	5 Å²	5	52.3 Å²	52.3	4%	0.041	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-61.6	137.5	179.3	0	0	0	0	0	110.7	Q246 K349 M363 L364	Q246-A359 PolarHBondContact NE2-O 3.09Å; K349-A359 HydrophobicContact CB-CB 3.91Å; K349-A359 PolarHBondContact O-N 3.42Å; A359-M363 HydrophobicContact CB-CB 4.12Å; A359-M363 HydrophobicContact CB-SD 4.43Å; A359-L364 HydrophobicContact CB-CD1 4.46Å; A359-L364 HydrophobicContact CB-CD2 3.75Å; A359-L364 HydrophobicContact CB-CG 3.82Å
360	D	97.3	Very high	97.7	Very high	66 Å²	66	49.1 Å²	49.1	35%	0.353	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-82.6	172.1	173.4	71.5	24.8	0	0	0	111.7	R358 K362 M363 L364	R358-D360 PolarHBondContact O-N 2.71Å; D360-K362 PolarHBondContact O-N 3.37Å; D360-K362 WeakPolarHBondContact OD1-CA 3.36Å; D360-K362 WeakPolarHBondContact OD1-CB 3.04Å; D360-K362 PolarHBondContact OD1-N 2.88Å; D360-M363 PolarHBondContact O-N 2.97Å; D360-M363 WeakPolarHBondContact OD1-CG 3.31Å; D360-M363 PolarHBondContact OD1-N 3.1Å; D360-L364 WeakPolarHBondContact O-CG 3.41Å; D360-L364 PolarHBondContact O-N 3.25Å
361	L	97.2	Very high	97.6	Very high	18 Å²	18	53.1 Å²	53.1	9%	0.094	28%	0.279	C	S	.	.	H	α-helix	trans	-57.1	-34.8	-179.7	-64.5	-179.8	0	0	0	112.8	L177 L180 A181 V245 V249 M365	L177-L361 HydrophobicContact CD2-CD2 3.77Å; L180-L361 HydrophobicContact CB-CD1 4.09Å; L180-L361 HydrophobicContact CB-CD2 4.01Å; L180-L361 HydrophobicContact CD1-CD2 4.24Å; A181-L361 HydrophobicContact CB-CD1 4.19Å; V245-L361 HydrophobicContact CG2-CD1 3.79Å; V245-L361 HydrophobicContact CG2-CG 4.25Å; V249-L361 HydrophobicContact CG2-CD2 3.89Å; L361-M365 WeakPolarHBondContact O-CB 3.38Å; L361-M365 PolarHBondContact O-N 3.47Å
362	K	96.6	Very high	97.6	Very high	159 Å²	159	56 Å²	56	69%	0.691	29%	0.29	S	S	*	.	H	α-helix	trans	-72.7	-42	-178.5	-176.6	-179.3	179	-179	0	111.2	D360 N366	D360-K362 PolarHBondContact O-N 3.37Å; D360-K362 WeakPolarHBondContact OD1-CA 3.36Å; D360-K362 WeakPolarHBondContact OD1-CB 3.04Å; D360-K362 PolarHBondContact OD1-N 2.88Å; K362-N366 PolarHBondContact O-N 3.32Å; K362-N366 PolarHBondContact O-ND2 3.3Å
363	M	97.9	Very high	97.5	Very high	124 Å²	124	53.8 Å²	53.8	61%	0.611	28%	0.279	S	S	*	.	H	α-helix	trans	-61.9	-45	173.6	-70.1	180	124	0	0	110.8	A359 D360 N366 H367	A359-M363 HydrophobicContact CB-CB 4.12Å; A359-M363 HydrophobicContact CB-SD 4.43Å; D360-M363 PolarHBondContact O-N 2.97Å; D360-M363 WeakPolarHBondContact OD1-CG 3.31Å; D360-M363 PolarHBondContact OD1-N 3.1Å; M363-N366 CarbonylContact O-C 3.46Å; M363-N366 PolarHBondContact O-N 2.79Å; M363-H367 PolarHBondContact O-N 2.98Å
364	L	98.4	Very high	97.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.9	-41.3	-179.7	-68.8	172.9	0	0	0	112.4	L177 V249 F346 K349 A359 D360 N366 H367 I370	L177-L364 HydrophobicContact CD1-CB 3.93Å; L177-L364 HydrophobicContact CD2-CB 3.8Å; L177-L364 HydrophobicContact CD2-CD1 3.9Å; V249-L364 HydrophobicContact CB-CD1 4.42Å; V249-L364 HydrophobicContact CG1-CD1 3.53Å; V249-L364 HydrophobicContact CG2-CD1 4.04Å; F346-L364 HydrophobicContact CD2-CD2 3.87Å; F346-L364 HydrophobicContact CE2-CB 3.99Å; F346-L364 HydrophobicContact CE2-CD2 3.59Å; F346-L364 HydrophobicContact CE2-CG 4.31Å; F346-L364 HydrophobicContact CZ-CD2 4.23Å; K349-L364 HydrophobicContact CB-CD2 4.49Å; A359-L364 HydrophobicContact CB-CD1 4.46Å; A359-L364 HydrophobicContact CB-CD2 3.75Å; A359-L364 HydrophobicContact CB-CG 3.82Å; D360-L364 WeakPolarHBondContact O-CG 3.41Å; D360-L364 PolarHBondContact O-N 3.25Å; L364-N366 PolarHBondContact O-N 3.04Å; L364-N366 VanDerWaalsContact O-N 3.17Å; L364-H367 WeakPolarHBondContact O-CB 3.48Å; L364-H367 PolarHBondContact O-N 3.32Å; L364-I370 VanDerWaalsContact O-CG1 3.25Å; L364-I370 WeakPolarHBondContact O-CG1 3.35Å
365	M	97.5	Very high	97.4	Very high	37 Å²	37	56.5 Å²	56.5	18%	0.182	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-24.1	176.5	-161.9	62.3	70.4	0	0	113.1	L177 R178 L361 I370 K371	L177-M365 HydrophobicContact CB-CE 3.42Å; L177-M365 VanDerWaalsContact CB-CE 3.42Å; L177-M365 HydrophobicContact CB-SD 4.43Å; L177-M365 HydrophobicContact CD1-CE 4.44Å; R178-M365 HydrophobicContact CG-CE 3.69Å; R178-M365 HydrophobicContact CG-SD 4.29Å; L361-M365 WeakPolarHBondContact O-CB 3.38Å; L361-M365 PolarHBondContact O-N 3.47Å; M365-I370 HydrophobicContact SD-CG2 4.26Å; M365-K371 VanDerWaalsContact O-CE 3.23Å; M365-K371 WeakPolarHBondContact O-CE 3.42Å
366	N	97.8	Very high	97.3	Very high	97 Å²	97	57.3 Å²	57.3	52%	0.519	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	5.6	177.3	-67.6	-61.4	0	0	0	113.5	K362 M363 L364	K362-N366 PolarHBondContact O-N 3.32Å; K362-N366 PolarHBondContact O-ND2 3.3Å; M363-N366 CarbonylContact O-C 3.46Å; M363-N366 PolarHBondContact O-N 2.79Å; L364-N366 PolarHBondContact O-N 3.04Å; L364-N366 VanDerWaalsContact O-N 3.17Å
367	H	98.6	Very high	97.2	Very high	10 Å²	10	62.5 Å²	62.5	5%	0.046	31%	0.307	C	S	.	.	S	Bend	trans	-67.9	145.7	179.1	-162.6	-90.6	0	0	0	111.6	D342 E345 F346 K349 M363 L364 F369 I370 K371	D342-H367 PolarHBondContact O-CE1 2.85Å; E345-H367 IonicContact OE1-NE2 2.7Å; E345-H367 IonicContact OE2-CE1 3.9Å; E345-H367 IonicContact OE2-NE2 2.93Å; F346-H367 HydrophobicContact CD2-CB 3.85Å; F346-H367 AromaticContact CD2-CG 3.74Å; F346-H367 AromaticContact CD2-ND1 3.77Å; F346-H367 HydrophobicContact CE2-CB 4.32Å; K349-H367 PolarHBondContact NZ-CD2 3.12Å; K349-H367 PolarHBondContact NZ-NE2 2.65Å; K349-H367 VanDerWaalsContact NZ-NE2 3.1Å; M363-H367 PolarHBondContact O-N 2.98Å; L364-H367 WeakPolarHBondContact O-CB 3.48Å; L364-H367 PolarHBondContact O-N 3.32Å; H367-F369 VanDerWaalsContact C-N 3.28Å; H367-F369 PolarHBondContact ND1-N 3.15Å; H367-F369 PolarHBondContact O-N 3.2Å; H367-I370 HydrophobicContact CB-CG1 4.47Å; H367-I370 PolarHBondContact O-N 3.35Å; H367-K371 PolarHBondContact O-N 3Å
368	T	98.3	Very high	97	Very high	78 Å²	78	57.5 Å²	57.5	48%	0.479	29%	0.286	S	S	.	.	H	α-helix	trans	-52	-44.8	-179.8	-47.8	0	0	0	0	112.4	I370 K371 R372	T368-I370 VanDerWaalsContact C-N 3.33Å; T368-I370 PolarHBondContact O-N 2.72Å; T368-K371 PolarHBondContact O-N 3.1Å; T368-R372 WeakPolarHBondContact O-CB 3.35Å; T368-R372 PolarHBondContact O-N 3.28Å
369	F	98.6	Very high	96.9	Very high	1 Å²	1	60.8 Å²	60.8	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-53.3	-46.2	174.7	178.6	-114.2	0	0	0	113.1	E166 D342 F343 F346 H367 A373	E166-F369 HydrophobicContact CG-CE2 3.9Å; E166-F369 HydrophobicContact CG-CZ 4.47Å; D342-F369 HydrophobicContact CB-CB 4Å; F343-F369 HydrophobicContact CB-CD2 3.72Å; F343-F369 HydrophobicContact CB-CE2 3.64Å; F343-F369 HydrophobicContact CB-CG 4.46Å; F343-F369 HydrophobicContact CB-CZ 4.3Å; F343-F369 HydrophobicContact CD2-CD1 4.17Å; F343-F369 HydrophobicContact CD2-CD2 4.14Å; F343-F369 AromaticContact CD2-CE1 3.65Å; F343-F369 HydrophobicContact CD2-CE1 3.65Å; F343-F369 AromaticContact CD2-CE2 3.63Å; F343-F369 HydrophobicContact CD2-CE2 3.63Å; F343-F369 HydrophobicContact CD2-CG 4.39Å; F343-F369 AromaticContact CD2-CZ 3.35Å; F343-F369 HydrophobicContact CD2-CZ 3.35Å; F343-F369 HydrophobicContact CE2-CE1 4.04Å; F343-F369 HydrophobicContact CE2-CE2 4.48Å; F343-F369 AromaticContact CE2-CZ 3.82Å; F343-F369 HydrophobicContact CE2-CZ 3.82Å; F343-F369 HydrophobicContact CG-CD2 4.25Å; F343-F369 AromaticContact CG-CE2 3.74Å; F343-F369 HydrophobicContact CG-CE2 3.74Å; F343-F369 AromaticContact CG-CZ 3.92Å; F343-F369 HydrophobicContact CG-CZ 3.92Å; F346-F369 HydrophobicContact CB-CB 3.9Å; F346-F369 HydrophobicContact CB-CD1 3.97Å; F346-F369 HydrophobicContact CB-CG 4.12Å; F346-F369 AromaticContact CD1-CD1 3.67Å; F346-F369 HydrophobicContact CD1-CD1 3.67Å; F346-F369 HydrophobicContact CD1-CE1 4.01Å; F346-F369 HydrophobicContact CD2-CB 4.36Å; F346-F369 HydrophobicContact CD2-CD1 4.02Å; F346-F369 HydrophobicContact CE1-CD1 4.13Å; F346-F369 HydrophobicContact CE1-CE1 4.28Å; F346-F369 HydrophobicContact CE2-CD1 4.44Å; F346-F369 HydrophobicContact CG-CB 4.22Å; F346-F369 AromaticContact CG-CD1 3.61Å; F346-F369 HydrophobicContact CG-CD1 3.61Å; F346-F369 HydrophobicContact CG-CE1 4.4Å; F346-F369 HydrophobicContact CG-CG 4.23Å; F346-F369 HydrophobicContact CZ-CD1 4.5Å; H367-F369 VanDerWaalsContact C-N 3.28Å; H367-F369 PolarHBondContact ND1-N 3.15Å; H367-F369 PolarHBondContact O-N 3.2Å; F369-A373 WeakPolarHBondContact O-CB 3.39Å; F369-A373 PolarHBondContact O-N 3.32Å
370	I	98.5	Very high	96.8	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-70.7	-44.2	179.7	-64.3	-57.6	0	0	0	110.6	I174 L177 F346 L364 M365 H367 T368 R372 A373 E374	I174-I370 HydrophobicContact CG1-CD1 4.25Å; I174-I370 HydrophobicContact CG1-CG2 3.98Å; L177-I370 HydrophobicContact CD1-CD1 3.86Å; L177-I370 HydrophobicContact CD1-CG1 3.92Å; F346-I370 HydrophobicContact CD2-CG1 4.13Å; F346-I370 HydrophobicContact CE2-CD1 3.79Å; F346-I370 HydrophobicContact CE2-CG1 3.5Å; F346-I370 HydrophobicContact CZ-CD1 3.82Å; F346-I370 HydrophobicContact CZ-CG1 4.07Å; L364-I370 VanDerWaalsContact O-CG1 3.25Å; L364-I370 WeakPolarHBondContact O-CG1 3.35Å; M365-I370 HydrophobicContact SD-CG2 4.26Å; H367-I370 HydrophobicContact CB-CG1 4.47Å; H367-I370 PolarHBondContact O-N 3.35Å; T368-I370 VanDerWaalsContact C-N 3.33Å; T368-I370 PolarHBondContact O-N 2.72Å; I370-R372 VanDerWaalsContact C-N 3.28Å; I370-R372 PolarHBondContact O-N 3.39Å; I370-A373 CarbonylContact O-C 3.57Å; I370-A373 PolarHBondContact O-N 2.7Å; I370-E374 HydrophobicContact CG2-CG 4.45Å; I370-E374 WeakPolarHBondContact O-CG 3.28Å; I370-E374 PolarHBondContact O-N 2.82Å
371	K	98.1	Very high	96.7	Very high	84 Å²	84	58.1 Å²	58.1	37%	0.365	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-37.8	178.3	-67.6	-70.5	151.4	-150.8	0	112.2	M365 H367 T368 E374	M365-K371 VanDerWaalsContact O-CE 3.23Å; M365-K371 WeakPolarHBondContact O-CE 3.42Å; H367-K371 PolarHBondContact O-N 3Å; T368-K371 PolarHBondContact O-N 3.1Å; K371-E374 IonicContact NZ-OE2 2.88Å; K371-E374 PolarHBondContact NZ-OE2 2.96Å
372	R	97.4	Very high	96.7	Very high	61 Å²	61	57.7 Å²	57.7	23%	0.23	29%	0.288	C	S	.	.	H	α-helix	trans	-66.1	-49.4	173.4	-161.2	-176.2	73.7	-153.1	1	111	E166 T340 D342 T368 I370 E374 V375 E376	E166-R372 IonicContact OE1-CZ 3.57Å; E166-R372 IonicContact OE1-NH2 2.74Å; E166-R372 PolarHBondContact OE1-NH2 3.11Å; T340-R372 PolarHBondContact OG1-NH1 3.47Å; T340-R372 PolarHBondContact OG1-NH2 3.15Å; D342-R372 IonicContact OD2-CZ 3.99Å; D342-R372 IonicContact OD2-NH1 2.92Å; D342-R372 PolarHBondContact OD2-NH1 3.04Å; T368-R372 WeakPolarHBondContact O-CB 3.35Å; T368-R372 PolarHBondContact O-N 3.28Å; I370-R372 VanDerWaalsContact C-N 3.28Å; I370-R372 PolarHBondContact O-N 3.39Å; R372-E374 PolarHBondContact O-N 3.07Å; R372-V375 WeakPolarHBondContact O-CG2 3.47Å; R372-V375 PolarHBondContact O-N 3.41Å; R372-V375 VanDerWaalsContact O-N 3.16Å; R372-E376 WeakPolarHBondContact CD-OE1 3.43Å; R372-E376 HydrophobicContact CG-CG 4.47Å; R372-E376 WeakPolarHBondContact CG-OE1 3.25Å; R372-E376 IonicContact CZ-OE1 2.63Å; R372-E376 IonicContact NE-OE1 3.41Å; R372-E376 PolarHBondContact NE-OE1 3.12Å; R372-E376 WeakPolarHBondContact O-CG 3.15Å; R372-E376 PolarHBondContact O-N 2.86Å
373	A	97.3	Very high	96.7	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-63.6	-25.4	178.1	0	0	0	0	0	113.5	K171 I174 F369 I370	K171-A373 WeakPolarHBondContact CE-O 3.01Å; K171-A373 PolarHBondContact NZ-O 2.84Å; I174-A373 HydrophobicContact CD1-CB 3.81Å; F369-A373 WeakPolarHBondContact O-CB 3.39Å; F369-A373 PolarHBondContact O-N 3.32Å; I370-A373 CarbonylContact O-C 3.57Å; I370-A373 PolarHBondContact O-N 2.7Å
374	E	94.7	Very high	96.6	Very high	61 Å²	61	46.5 Å²	46.5	29%	0.285	24%	0.235	S	C	.	.	H	α-helix	trans	-67.2	-36.6	175.2	-79.2	-177.8	145.6	0	0	112	I174 R178 I370 K371 R372	I174-E374 HydrophobicContact CD1-CB 4.47Å; I174-E374 HydrophobicContact CD1-CG 3.74Å; I174-E374 HydrophobicContact CG1-CG 4.27Å; R178-E374 IonicContact CZ-OE1 2.62Å; R178-E374 IonicContact NH2-OE1 2.72Å; R178-E374 PolarHBondContact NH2-OE1 2.98Å; I370-E374 HydrophobicContact CG2-CG 4.45Å; I370-E374 WeakPolarHBondContact O-CG 3.28Å; I370-E374 PolarHBondContact O-N 2.82Å; K371-E374 IonicContact NZ-OE2 2.88Å; K371-E374 PolarHBondContact NZ-OE2 2.96Å; R372-E374 PolarHBondContact O-N 3.07Å
375	V	95.4	Very high	96.5	Very high	117 Å²	117	46.5 Å²	46.5	71%	0.709	24%	0.235	S	C	*	.	H	α-helix	trans	-93.2	-20.8	-178.1	-59.6	0	0	0	0	113.8	R372 E377	R372-V375 WeakPolarHBondContact O-CG2 3.47Å; R372-V375 PolarHBondContact O-N 3.41Å; R372-V375 VanDerWaalsContact O-N 3.16Å; V375-E377 PolarHBondContact O-N 2.89Å
376	E	94.1	Very high	96.4	Very high	54 Å²	54	53.2 Å²	53.2	25%	0.252	26%	0.263	S	S	.	.	S	Bend	trans	-63.9	124.6	175.8	-79	170.9	-174.7	0	0	110.9	K171 R372 V378	K171-E376 VanDerWaalsContact CE-O 3.25Å; K171-E376 WeakPolarHBondContact CE-O 3.46Å; K171-E376 PolarHBondContact NZ-O 3.47Å; R372-E376 WeakPolarHBondContact CD-OE1 3.43Å; R372-E376 HydrophobicContact CG-CG 4.47Å; R372-E376 WeakPolarHBondContact CG-OE1 3.25Å; R372-E376 IonicContact CZ-OE1 2.63Å; R372-E376 IonicContact NE-OE1 3.41Å; R372-E376 PolarHBondContact NE-OE1 3.12Å; R372-E376 WeakPolarHBondContact O-CG 3.15Å; R372-E376 PolarHBondContact O-N 2.86Å; E376-V378 HydrophobicContact CB-CG2 4.08Å; E376-V378 PolarHBondContact O-N 3.4Å
377	E	93.8	Very high	96.3	Very high	200 Å²	200	50.1 Å²	50.1	94%	0.935	25%	0.248	S	C	*	.			trans	-81.8	101.6	173	-66.7	-165.8	158	0	0	110.1	V375	V375-E377 PolarHBondContact O-N 2.89Å
378	V	94.3	Very high	96.2	Very high	29 Å²	29	52.2 Å²	52.2	18%	0.176	26%	0.258	C	S	.	.			trans	-117.5	120.2	-178.6	-176.1	0	0	0	0	109.1	E167 I168 K171 E376 F380	E167-V378 HydrophobicContact CB-CG1 4.49Å; E167-V378 HydrophobicContact CB-CG2 3.99Å; E167-V378 HydrophobicContact CG-CG1 4.15Å; E167-V378 HydrophobicContact CG-CG2 4.47Å; I168-V378 HydrophobicContact CD1-CG1 3.51Å; I168-V378 HydrophobicContact CG1-CG1 4.44Å; K171-V378 HydrophobicContact CG-CB 4.18Å; E376-V378 HydrophobicContact CB-CG2 4.08Å; E376-V378 PolarHBondContact O-N 3.4Å; V378-F380 PolarHBondContact O-N 2.8Å
379	D	95.4	Very high	96	Very high	74 Å²	74	51.7 Å²	51.7	40%	0.396	27%	0.269	S	S	.	.			trans	-76.4	71.2	173.9	-176.3	21.6	0	0	0	110.9	A381 G382 W383 T397	D379-A381 VanDerWaalsContact C-N 3.27Å; D379-A381 PolarHBondContact O-N 3.43Å; D379-G382 PolarHBondContact O-N 3.38Å; D379-G382 PolarHBondContact OD1-N 3.22Å; D379-G382 WeakPolarHBondContact OD2-CA 3.32Å; D379-W383 WeakPolarHBondContact O-CB 3.43Å; D379-W383 PolarHBondContact O-N 2.92Å; D379-T397 PolarHBondContact OD1-OG1 3.44Å
380	F	96.2	Very high	95.7	Very high	13 Å²	13	54.5 Å²	54.5	6%	0.057	28%	0.283	C	S	.	.	H	α-helix	trans	-58.3	-41.2	-179.5	-177.2	-83.5	0	0	0	111.7	I168 K171 V172 V201 I207 V378 W383 M384	I168-F380 HydrophobicContact CD1-CD2 4.08Å; I168-F380 HydrophobicContact CG2-CD2 3.74Å; I168-F380 HydrophobicContact CG2-CE2 3.53Å; K171-F380 HydrophobicContact CB-CD2 4.25Å; V172-F380 HydrophobicContact CG2-CE2 4.03Å; V201-F380 HydrophobicContact CB-CE1 4.24Å; V201-F380 HydrophobicContact CB-CZ 4.37Å; V201-F380 HydrophobicContact CG1-CE1 4.14Å; V201-F380 HydrophobicContact CG1-CZ 3.82Å; I207-F380 HydrophobicContact CD1-CD1 4.45Å; I207-F380 HydrophobicContact CD1-CD2 3.96Å; I207-F380 HydrophobicContact CD1-CE1 4.06Å; I207-F380 HydrophobicContact CD1-CE2 3.51Å; I207-F380 HydrophobicContact CD1-CG 4.42Å; I207-F380 HydrophobicContact CD1-CZ 3.58Å; I207-F380 HydrophobicContact CG1-CD1 4.39Å; I207-F380 HydrophobicContact CG1-CE1 3.75Å; I207-F380 HydrophobicContact CG1-CE2 4.08Å; I207-F380 HydrophobicContact CG1-CZ 3.59Å; V378-F380 PolarHBondContact O-N 2.8Å; F380-W383 HydrophobicContact CE2-CZ3 4.37Å; F380-W383 PolarHBondContact O-N 3.2Å; F380-M384 HydrophobicContact CE1-CB 4.25Å; F380-M384 HydrophobicContact CE1-CG 4.49Å; F380-M384 VanDerWaalsContact O-CB 3.26Å; F380-M384 WeakPolarHBondContact O-CB 3.34Å; F380-M384 PolarHBondContact O-N 2.71Å
381	A	95.3	Very high	95.1	Very high	3 Å²	3	61.8 Å²	61.8	3%	0.025	32%	0.323	C	S	.	.	H	α-helix	trans	-65.6	-46.5	-178.9	0	0	0	0	0	111.4	D379 M384 C385 P393 T397	D379-A381 VanDerWaalsContact C-N 3.27Å; D379-A381 PolarHBondContact O-N 3.43Å; A381-M384 PolarHBondContact O-N 3.06Å; A381-C385 WeakPolarHBondContact O-CB 3.44Å; A381-C385 PolarHBondContact O-N 2.86Å; A381-C385 PolarHBondContact O-SG 3.04Å; A381-P393 HydrophobicContact CB-CG 4.02Å; A381-T397 HydrophobicContact CB-CG2 4.13Å
382	G	95.9	Very high	93.8	Very high	8 Å²	8	64.9 Å²	64.9	8%	0.082	34%	0.338	C	S	.	.	H	α-helix	trans	-62.4	-43.6	175.7	0	0	0	0	0	112.8	D379 K386	D379-G382 PolarHBondContact O-N 3.38Å; D379-G382 PolarHBondContact OD1-N 3.22Å; D379-G382 WeakPolarHBondContact OD2-CA 3.32Å; G382-K386 VanDerWaalsContact O-CB 3.3Å; G382-K386 WeakPolarHBondContact O-CB 3.26Å; G382-K386 PolarHBondContact O-N 3.42Å
383	W	96.9	Very high	92.2	Very high	48 Å²	48	63.5 Å²	63.5	18%	0.182	34%	0.337	C	S	.	.	H	α-helix	trans	-59.9	-47.8	174.9	172.1	84.6	0	0	0	112	V157 A161 I164 I168 D379 F380 K386 T387	V157-W383 HydrophobicContact CG1-CH2 3.55Å; V157-W383 HydrophobicContact CG1-CZ2 4.48Å; V157-W383 HydrophobicContact CG1-CZ3 3.98Å; A161-W383 HydrophobicContact CB-CZ2 4.24Å; I164-W383 HydrophobicContact CB-CH2 4.49Å; I164-W383 HydrophobicContact CD1-CH2 4.16Å; I164-W383 HydrophobicContact CG1-CH2 4.08Å; I164-W383 HydrophobicContact CG1-CZ2 4.34Å; I164-W383 HydrophobicContact CG2-CH2 3.86Å; I164-W383 HydrophobicContact CG2-CZ2 4.04Å; I168-W383 HydrophobicContact CD1-CB 3.84Å; I168-W383 HydrophobicContact CD1-CD2 3.72Å; I168-W383 HydrophobicContact CD1-CE3 3.89Å; I168-W383 HydrophobicContact CD1-CG 3.69Å; I168-W383 HydrophobicContact CG1-CD2 3.82Å; I168-W383 HydrophobicContact CG1-CE3 4.15Å; I168-W383 HydrophobicContact CG1-CG 4.04Å; I168-W383 HydrophobicContact CG2-CD2 4.22Å; I168-W383 HydrophobicContact CG2-CE3 3.74Å; I168-W383 HydrophobicContact CG2-CH2 3.87Å; I168-W383 HydrophobicContact CG2-CZ2 4.31Å; I168-W383 HydrophobicContact CG2-CZ3 3.56Å; D379-W383 WeakPolarHBondContact O-CB 3.43Å; D379-W383 PolarHBondContact O-N 2.92Å; F380-W383 HydrophobicContact CE2-CZ3 4.37Å; F380-W383 PolarHBondContact O-N 3.2Å; W383-K386 PolarHBondContact O-N 2.9Å; W383-T387 WeakPolarHBondContact O-CB 3.35Å; W383-T387 PolarHBondContact O-N 3.09Å; W383-T387 PolarHBondContact O-OG1 3.04Å
384	M	95.9	Very high	89.8	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-65.5	-48.4	-178.4	-172.3	-71.7	-56.9	0	0	110.8	V201 N202 S203 F380 A381 K386 T387 M388 L390	V201-M384 HydrophobicContact CB-CG 4.47Å; V201-M384 HydrophobicContact CG2-CG 3.86Å; V201-M384 HydrophobicContact CG2-SD 4.33Å; N202-M384 VanDerWaalsContact O-CE 3.25Å; N202-M384 WeakPolarHBondContact O-CE 3.33Å; S203-M384 VanDerWaalsContact N-CE 3.32Å; F380-M384 HydrophobicContact CE1-CB 4.25Å; F380-M384 HydrophobicContact CE1-CG 4.49Å; F380-M384 VanDerWaalsContact O-CB 3.26Å; F380-M384 WeakPolarHBondContact O-CB 3.34Å; F380-M384 PolarHBondContact O-N 2.71Å; A381-M384 PolarHBondContact O-N 3.06Å; M384-K386 VanDerWaalsContact C-N 3.31Å; M384-K386 PolarHBondContact O-N 3.14Å; M384-T387 PolarHBondContact O-N 3.08Å; M384-T387 VanDerWaalsContact O-N 3.12Å; M384-M388 PolarHBondContact O-N 2.69Å; M384-M388 HydrophobicContact SD-CB 4.13Å; M384-M388 HydrophobicContact SD-CG 3.72Å; M384-L390 HydrophobicContact CE-CD1 4.04Å; M384-L390 HydrophobicContact SD-CD1 4.05Å
385	C	96.3	Very high	87.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-59.2	-42.2	177.9	-76	0	0	0	0	111.9	A381 T387 G389 L390 N391	A381-C385 WeakPolarHBondContact O-CB 3.44Å; A381-C385 PolarHBondContact O-N 2.86Å; A381-C385 PolarHBondContact O-SG 3.04Å; C385-T387 PolarHBondContact O-N 3.47Å; C385-G389 CarbonylContact O-C 3.56Å; C385-G389 PolarHBondContact O-N 2.85Å; C385-L390 HydrophobicContact CB-CB 4.17Å; C385-L390 PolarHBondContact O-N 2.99Å; C385-N391 PolarHBondContact SG-O 3.25Å; C385-N391 VanDerWaalsContact SG-O 3.37Å
386	K	96.1	Very high	84.9	Confident	178 Å²	178	69.9 Å²	69.9	77%	0.774	39%	0.388	S	S	*	.	H	α-helix	trans	-61.6	-43.8	175.4	-178.9	-177.6	177.2	-175.8	0	112	G382 W383 M384	G382-K386 VanDerWaalsContact O-CB 3.3Å; G382-K386 WeakPolarHBondContact O-CB 3.26Å; G382-K386 PolarHBondContact O-N 3.42Å; W383-K386 PolarHBondContact O-N 2.9Å; M384-K386 VanDerWaalsContact C-N 3.31Å; M384-K386 PolarHBondContact O-N 3.14Å
387	T	96.1	Very high	82.8	Confident	33 Å²	33	71.2 Å²	71.2	20%	0.202	40%	0.4	C	S	.	.	H	α-helix	trans	-66.1	-42.5	-178.3	-59.4	0	0	0	0	111.5	V157 E160 A161 W383 M384 C385	V157-T387 HydrophobicContact CG1-CG2 4.15Å; E160-T387 HydrophobicContact CB-CG2 4.1Å; A161-T387 HydrophobicContact CB-CG2 3.78Å; W383-T387 WeakPolarHBondContact O-CB 3.35Å; W383-T387 PolarHBondContact O-N 3.09Å; W383-T387 PolarHBondContact O-OG1 3.04Å; M384-T387 PolarHBondContact O-N 3.08Å; M384-T387 VanDerWaalsContact O-N 3.12Å; C385-T387 PolarHBondContact O-N 3.47Å
388	M	95.3	Very high	80.4	Confident	53 Å²	53	71.4 Å²	71.4	26%	0.261	39%	0.392	S	S	.	.	H	α-helix	trans	-90.9	2.5	-176.5	-62.9	-57.8	-69.9	0	0	113.9	V157 E160 M384 L390	V157-M388 HydrophobicContact CB-SD 4.25Å; V157-M388 HydrophobicContact CG2-CG 4.21Å; V157-M388 HydrophobicContact CG2-SD 3.83Å; E160-M388 HydrophobicContact CB-SD 4.35Å; E160-M388 HydrophobicContact CG-SD 4.03Å; M384-M388 PolarHBondContact O-N 2.69Å; M384-M388 HydrophobicContact SD-CB 4.13Å; M384-M388 HydrophobicContact SD-CG 3.72Å; M388-L390 VanDerWaalsContact C-N 3.27Å; M388-L390 HydrophobicContact CB-CD1 4.14Å; M388-L390 HydrophobicContact CB-CG 3.97Å; M388-L390 PolarHBondContact O-N 3.09Å
389	G	93.8	Very high	77.6	Confident	68 Å²	68	73.7 Å²	73.7	70%	0.701	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	27.3	-177.7	0	0	0	0	0	114.2	C385	C385-G389 CarbonylContact O-C 3.56Å; C385-G389 PolarHBondContact O-N 2.85Å
390	L	92.3	Very high	74.6	Confident	59 Å²	59	76.5 Å²	76.5	31%	0.309	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-89.1	153	177.4	-57.6	176.1	0	0	0	110.8	M384 C385 M388	M384-L390 HydrophobicContact CE-CD1 4.04Å; M384-L390 HydrophobicContact SD-CD1 4.05Å; C385-L390 HydrophobicContact CB-CB 4.17Å; C385-L390 PolarHBondContact O-N 2.99Å; M388-L390 VanDerWaalsContact C-N 3.27Å; M388-L390 HydrophobicContact CB-CD1 4.14Å; M388-L390 HydrophobicContact CB-CG 3.97Å; M388-L390 PolarHBondContact O-N 3.09Å
391	N	87.2	Confident	71.5	Confident	154 Å²	154	88.6 Å²	88.6	82%	0.824	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-60.6	141.3	171.2	-67.4	-36.2	0	0	0	109.9	C385	C385-N391 PolarHBondContact SG-O 3.25Å; C385-N391 VanDerWaalsContact SG-O 3.37Å
392	Q	70.9	Confident	70.4	Confident	149 Å²	149	92.9 Å²	92.9	70%	0.696	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-60.2	144.1	176.4	-71.5	-163.2	-5.5	0	0	110.5	S394	Q392-S394 PolarHBondContact O-N 2.7Å
393	P	62.3	Low	69	Low	32 Å²	32	97.3 Å²	97.3	21%	0.208	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-57.6	135.2	176.9	22.1	-31.2	0	0	0	110.2	S203 A381 T395	S203-P393 WeakPolarHBondContact O-CB 3.28Å; S203-P393 WeakPolarHBondContact O-CG 3.13Å; A381-P393 HydrophobicContact CB-CG 4.02Å; P393-T395 PolarHBondContact O-N 2.82Å
394	S	48.6	Very low	67.5	Low	129 Å²	129	100.1 Å²	100.1	90%	0.902	57%	0.565	S	S	*	*	S	Bend	trans	-65.8	-6.4	176	-30.3	0	0	0	0	113.3	Q392	Q392-S394 PolarHBondContact O-N 2.7Å
395	T	46.9	Very low	65.8	Low	82 Å²	82	105.9 Å²	105.9	50%	0.503	60%	0.598	S	S	.	*	S	Bend	trans	-101.4	126.2	-177.5	-37	0	0	0	0	108.7	P393 T397	P393-T395 PolarHBondContact O-N 2.82Å; T395-T397 PolarHBondContact O-N 3.42Å; T395-T397 VanDerWaalsContact O-N 3.09Å
396	P	40.1	Very low	63.9	Low	102 Å²	102	112.6 Å²	112.6	66%	0.662	64%	0.635	S	S	*	*			trans	-62.9	117	178.4	-11.4	25	0	0	0	109	R398	P396-R398 WeakPolarHBondContact CB-O 3.37Å
397	T	48.4	Very low	61.7	Low	82 Å²	82	108.2 Å²	108.2	50%	0.503	63%	0.626	S	S	.	*	S	Bend	trans	-75.1	-6.8	160.1	40	0	0	0	0	111.5	D379 A381 T395	D379-T397 PolarHBondContact OD1-OG1 3.44Å; A381-T397 HydrophobicContact CB-CG2 4.13Å; T395-T397 PolarHBondContact O-N 3.42Å; T395-T397 VanDerWaalsContact O-N 3.09Å
398	R	43.9	Very low	59.3	Low	204 Å²	204	113.6 Å²	113.6	77%	0.77	66%	0.656	S	S	*	*	S	Bend	trans	-92.7	116.1	168.7	-72.8	-177.4	173.6	-173.7	-4	109.7	P396 T400	P396-R398 WeakPolarHBondContact CB-O 3.37Å; R398-T400 PolarHBondContact O-N 3.31Å; R398-T400 VanDerWaalsContact O-N 3.09Å
399	G	36.8	Very low	56.5	Low	76 Å²	76	118.2 Å²	118.2	78%	0.784	69%	0.687	S	S	*	*			trans	-56.3	112.8	148.3	0	0	0	0	0	106.8	E401	G399-E401 PolarHBondContact O-N 3.47Å; G399-E401 VanDerWaalsContact O-N 3.16Å
400	T	30.6	Very low	53.4	Low	133 Å²	133	122.4 Å²	122.4	82%	0.816	69%	0.685	S	S	*	*			trans	-66.5	106.8	164.6	43.7	0	0	0	0	106.7	R398	R398-T400 PolarHBondContact O-N 3.31Å; R398-T400 VanDerWaalsContact O-N 3.09Å
401	E	32.9	Very low	49.9	Very low	267 Å²	267	128.2 Å²	128.2	100%	1.248	72%	0.72	S	S	*	*			trans	-68.2	0	151.3	-73.4	-169	149	0	0	110.2	G399	G399-E401 PolarHBondContact O-N 3.47Å; G399-E401 VanDerWaalsContact O-N 3.16Å

Retrieved 401 of 401 residues in 3027.8 ms (Link to these results)

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