A0A087X7K5_POEFO Loading...

Dual specificity mitogen-activated protein kinase kinase 2

AlphaFold DB (A0A3B5QDC0), UniProt , Accession A0A087X7K5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 399 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	42.1	Very low	36.1	Very low	250 Å²	250	169.5 Å²	169.5	100%	1.232	88%	0.88	S	S	*	*				0	112.9	0	-81.9	177.6	159.4	0	0	108.1
2	A	36.3	Very low	36	Very low	97 Å²	97	168.2 Å²	168.2	80%	0.802	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-78.6	148.5	-178.6	0	0	0	0	0	111.6
3	P	36.1	Very low	35.5	Very low	126 Å²	126	163.9 Å²	163.9	82%	0.818	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-77.6	135.7	-179.1	30.2	-31.4	0	0	0	111.8	R5	P3-R5 PolarHBondContact O-N 2.91Å
4	K	37.8	Very low	35	Very low	211 Å²	211	161.1 Å²	161.1	92%	0.917	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-65.7	124.6	177.9	-72.8	179	174.9	179.4	0	111
5	R	40.7	Very low	35.1	Very low	244 Å²	244	161.7 Å²	161.7	92%	0.921	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-71.3	132.4	168	-74.9	-178.1	174.5	-178.1	-1.9	110	P3	P3-R5 PolarHBondContact O-N 2.91Å
6	R	39.2	Very low	34.7	Very low	232 Å²	232	155.4 Å²	155.4	88%	0.875	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-75.4	144.3	169.2	-72.7	-178.7	177.8	-175.6	-1.1	109.9
7	P	35.8	Very low	34.8	Very low	127 Å²	127	158.7 Å²	158.7	83%	0.825	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-71.6	144.2	175.9	27.8	-31.1	0	0	0	111.7
8	V	38.8	Very low	34.6	Very low	132 Å²	132	153.6 Å²	153.6	80%	0.8	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-82.4	137.8	176.6	-174.2	0	0	0	0	108.8
9	P	29.6	Very low	34.5	Very low	116 Å²	116	155.5 Å²	155.5	75%	0.753	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-70.9	133.2	179.1	26.2	-30.4	0	0	0	111.6	N11	P9-N11 PolarHBondContact O-N 3.35Å
10	L	32.3	Very low	34.4	Very low	167 Å²	167	151.8 Å²	151.8	87%	0.874	84%	0.835	S	S	*	*			trans	-71.8	114.9	169.2	-85.9	152.4	0	0	0	108.9	I12	L10-I12 PolarHBondContact O-N 3.31Å
11	N	28.1	Very low	34.3	Very low	162 Å²	162	149 Å²	149	87%	0.866	82%	0.823	S	S	*	*			trans	-81.6	106.9	175	-142.2	16.5	0	0	0	108.1	P9	P9-N11 PolarHBondContact O-N 3.35Å
12	I	34.7	Very low	34	Very low	154 Å²	154	141 Å²	141	79%	0.79	79%	0.791	S	S	*	*			trans	-92.3	109	174.3	-58.2	173.6	0	0	0	107.1	L10	L10-I12 PolarHBondContact O-N 3.31Å
13	T	29.9	Very low	33.8	Very low	113 Å²	113	142.4 Å²	142.4	69%	0.693	79%	0.785	S	S	*	*			trans	-72	141	165.8	33.4	0	0	0	0	109.9	I15	T13-I15 PolarHBondContact O-N 3.36Å
14	P	28.9	Very low	33.7	Very low	124 Å²	124	140.7 Å²	140.7	81%	0.805	77%	0.773	S	S	*	*			trans	-70.4	124	178.8	13.9	-5.2	0	0	0	109.5	G16	P14-G16 PolarHBondContact O-N 3.01Å
15	I	35.8	Very low	33.8	Very low	170 Å²	170	135.9 Å²	135.9	87%	0.872	76%	0.756	S	S	*	*			trans	-72.6	112.3	168.2	-64.2	174.6	0	0	0	106.4	T13	T13-I15 PolarHBondContact O-N 3.36Å
16	G	28.7	Very low	33.6	Very low	61 Å²	61	128.1 Å²	128.1	63%	0.629	73%	0.733	S	S	*	*			trans	-65.2	149	173.9	0	0	0	0	0	111.6	P14 G18	P14-G16 PolarHBondContact O-N 3.01Å; G16-G18 PolarHBondContact O-N 3.2Å
17	E	37.7	Very low	33.3	Very low	212 Å²	212	119.8 Å²	119.8	99%	0.991	71%	0.713	S	S	*	*			trans	-50.4	106.5	172.9	-65.2	176.4	155.4	0	0	110.4
18	G	30.9	Very low	33.6	Very low	67 Å²	67	116.7 Å²	116.7	69%	0.691	70%	0.699	S	S	*	*			trans	-125.8	119.8	176	0	0	0	0	0	109.3	G16 A20	G16-G18 PolarHBondContact O-N 3.2Å; G18-A20 PolarHBondContact O-N 3.15Å
19	Q	32.1	Very low	34	Very low	189 Å²	189	113.4 Å²	113.4	88%	0.883	68%	0.682	S	S	*	*			trans	-49.7	118.5	173.1	-73.8	165	-23.6	0	0	110.4	T21	Q19-T21 PolarHBondContact O-N 3.38Å; Q19-T21 VanDerWaalsContact O-N 3.15Å
20	A	33	Very low	34.7	Very low	81 Å²	81	114.4 Å²	114.4	67%	0.669	68%	0.676	S	S	*	*			trans	-63.4	114.1	168.7	0	0	0	0	0	108.4	G18	G18-A20 PolarHBondContact O-N 3.15Å
21	T	32.2	Very low	35.6	Very low	95 Å²	95	109.2 Å²	109.2	58%	0.583	66%	0.658	S	S	*	*			trans	-78.5	142.7	173.7	51.1	0	0	0	0	109.5	Q19 N23 T24	Q19-T21 PolarHBondContact O-N 3.38Å; Q19-T21 VanDerWaalsContact O-N 3.15Å; T21-N23 PolarHBondContact O-N 3.41Å; T21-T24 PolarHBondContact O-N 2.73Å; T21-T24 PolarHBondContact O-OG1 2.96Å
22	S	34.9	Very low	37.1	Very low	80 Å²	80	107 Å²	107	56%	0.559	65%	0.646	S	S	*	*	H	α-helix	trans	-42.6	-34.3	-177.4	-164.5	0	0	0	0	114.7	T24 I25 D26	S22-T24 PolarHBondContact O-N 3.17Å; S22-I25 PolarHBondContact O-N 3.42Å; S22-D26 PolarHBondContact O-N 3.4Å
23	N	32.6	Very low	38.3	Very low	127 Å²	127	103.6 Å²	103.6	68%	0.679	63%	0.629	S	S	*	*	H	α-helix	trans	-70	-21.3	-172.5	-67	-0.8	0	0	0	115.1	T21 A27	T21-N23 PolarHBondContact O-N 3.41Å; N23-A27 PolarHBondContact O-N 3.01Å
24	T	34.8	Very low	39.9	Very low	90 Å²	90	104.9 Å²	104.9	55%	0.552	63%	0.627	S	S	*	*	H	α-helix	trans	-84.8	-24	177.5	36.9	0	0	0	0	113.3	T21 S22 A28	T21-T24 PolarHBondContact O-N 2.73Å; T21-T24 PolarHBondContact O-OG1 2.96Å; S22-T24 PolarHBondContact O-N 3.17Å; T24-A28 WeakPolarHBondContact O-CB 3.39Å; T24-A28 PolarHBondContact O-N 3.48Å
25	I	38.9	Very low	41.7	Very low	111 Å²	111	101.4 Å²	101.4	57%	0.569	61%	0.608	S	S	*	*	H	α-helix	trans	-75.8	-41.3	174.4	-62.2	170.9	0	0	0	109.6	S22 A28 S29	S22-I25 PolarHBondContact O-N 3.42Å; I25-A28 PolarHBondContact O-N 3.41Å; I25-S29 WeakPolarHBondContact O-CB 3.44Å; I25-S29 PolarHBondContact O-N 3.47Å
26	D	36.7	Very low	43	Very low	80 Å²	80	95.4 Å²	95.4	43%	0.428	58%	0.578	S	S	.	*	H	α-helix	trans	-64.1	-46.4	179.8	-68	-29.6	0	0	0	111.9	S22 A28 S29 E30	S22-D26 PolarHBondContact O-N 3.4Å; D26-A28 PolarHBondContact O-N 2.97Å; D26-S29 PolarHBondContact O-N 3.2Å; D26-S29 PolarHBondContact O-OG 2.86Å; D26-E30 PolarHBondContact O-N 3.11Å
27	A	32.5	Very low	44.8	Very low	57 Å²	57	97.6 Å²	97.6	47%	0.471	57%	0.572	S	S	.	*	H	α-helix	trans	-66.5	-34.1	178.3	0	0	0	0	0	113.6	N23 A31	N23-A27 PolarHBondContact O-N 3.01Å; A27-A31 WeakPolarHBondContact O-CB 3.42Å; A27-A31 PolarHBondContact O-N 3.41Å; A27-A31 VanDerWaalsContact O-N 3.12Å
28	A	42.8	Very low	46.4	Very low	63 Å²	63	94.8 Å²	94.8	52%	0.521	56%	0.556	S	S	.	*	H	α-helix	trans	-70.7	-34.5	174.2	0	0	0	0	0	111.5	T24 I25 D26 N32	T24-A28 WeakPolarHBondContact O-CB 3.39Å; T24-A28 PolarHBondContact O-N 3.48Å; I25-A28 PolarHBondContact O-N 3.41Å; D26-A28 PolarHBondContact O-N 2.97Å; A28-N32 VanDerWaalsContact O-CB 3.26Å; A28-N32 WeakPolarHBondContact O-CB 3.29Å; A28-N32 PolarHBondContact O-N 2.77Å; A28-N32 VanDerWaalsContact O-N 3.15Å
29	S	47	Very low	48.2	Very low	63 Å²	63	97.3 Å²	97.3	44%	0.441	55%	0.548	S	S	.	.	H	α-helix	trans	-70.9	-40.4	176.8	78.7	0	0	0	0	112.7	I25 D26 N32 L33	I25-S29 WeakPolarHBondContact O-CB 3.44Å; I25-S29 PolarHBondContact O-N 3.47Å; D26-S29 PolarHBondContact O-N 3.2Å; D26-S29 PolarHBondContact O-OG 2.86Å; S29-N32 PolarHBondContact O-N 3.07Å; S29-L33 PolarHBondContact O-N 3.06Å
30	E	44.9	Very low	50	Low	136 Å²	136	88.7 Å²	88.7	64%	0.636	51%	0.508	S	S	*	.	H	α-helix	trans	-67.8	-45.8	176.7	-77	-176.7	159.8	0	0	112.1	D26 N32 L33 E34	D26-E30 PolarHBondContact O-N 3.11Å; E30-N32 PolarHBondContact O-N 3.04Å; E30-L33 WeakPolarHBondContact O-CB 2.79Å; E30-L33 PolarHBondContact O-N 3.28Å; E30-L33 VanDerWaalsContact O-N 3.08Å; E30-E34 PolarHBondContact O-N 3.44Å
31	A	50.1	Low	51.7	Low	59 Å²	59	87.6 Å²	87.6	49%	0.488	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-32.9	175.4	0	0	0	0	0	112.3	A27 A35	A27-A31 WeakPolarHBondContact O-CB 3.42Å; A27-A31 PolarHBondContact O-N 3.41Å; A27-A31 VanDerWaalsContact O-N 3.12Å; A31-A35 WeakPolarHBondContact O-CB 3.23Å; A31-A35 PolarHBondContact O-N 2.77Å
32	N	59.4	Low	53.8	Low	114 Å²	114	88.8 Å²	88.8	61%	0.61	50%	0.504	S	S	*	.	H	α-helix	trans	-71.3	-37	175.4	-149.7	17.4	0	0	0	111	A28 S29 E30 L36	A28-N32 VanDerWaalsContact O-CB 3.26Å; A28-N32 WeakPolarHBondContact O-CB 3.29Å; A28-N32 PolarHBondContact O-N 2.77Å; A28-N32 VanDerWaalsContact O-N 3.15Å; S29-N32 PolarHBondContact O-N 3.07Å; E30-N32 PolarHBondContact O-N 3.04Å; N32-L36 VanDerWaalsContact O-CB 3.29Å; N32-L36 WeakPolarHBondContact O-CB 3.2Å; N32-L36 PolarHBondContact O-N 3.04Å
33	L	59.7	Low	55.8	Low	83 Å²	83	86.4 Å²	86.4	44%	0.435	49%	0.485	S	S	.	.	H	α-helix	trans	-67.8	-42.5	177	-152.8	89	0	0	0	112.5	S29 E30 L36 Q37	S29-L33 PolarHBondContact O-N 3.06Å; E30-L33 WeakPolarHBondContact O-CB 2.79Å; E30-L33 PolarHBondContact O-N 3.28Å; E30-L33 VanDerWaalsContact O-N 3.08Å; L33-L36 WeakPolarHBondContact O-CB 3.36Å; L33-L36 PolarHBondContact O-N 2.78Å; L33-Q37 WeakPolarHBondContact O-CG 3.44Å; L33-Q37 PolarHBondContact O-N 2.8Å
34	E	63.6	Low	58.2	Low	141 Å²	141	88.3 Å²	88.3	66%	0.659	50%	0.495	S	S	*	.	H	α-helix	trans	-65.6	-43.4	175.9	-77.3	-171.2	160.1	0	0	112.2	E30 L36 Q37 K38	E30-E34 PolarHBondContact O-N 3.44Å; E34-L36 PolarHBondContact O-N 3.29Å; E34-Q37 PolarHBondContact O-N 3.1Å; E34-K38 PolarHBondContact O-N 3Å
35	A	66.8	Low	60.6	Low	50 Å²	50	84.8 Å²	84.8	41%	0.413	47%	0.473	S	S	.	.	H	α-helix	trans	-61.4	-34.6	174.5	0	0	0	0	0	111.6	A31 K39	A31-A35 WeakPolarHBondContact O-CB 3.23Å; A31-A35 PolarHBondContact O-N 2.77Å; A35-K39 PolarHBondContact O-N 3.17Å
36	L	63	Low	63	Low	44 Å²	44	83.2 Å²	83.2	23%	0.23	47%	0.465	C	S	.	.	H	α-helix	trans	-66.4	-48.5	175	-147.4	90.9	0	0	0	112	N32 L33 E34 K38 K39 L40 L57	N32-L36 VanDerWaalsContact O-CB 3.29Å; N32-L36 WeakPolarHBondContact O-CB 3.2Å; N32-L36 PolarHBondContact O-N 3.04Å; L33-L36 WeakPolarHBondContact O-CB 3.36Å; L33-L36 PolarHBondContact O-N 2.78Å; E34-L36 PolarHBondContact O-N 3.29Å; L36-K38 VanDerWaalsContact C-N 3.26Å; L36-K38 PolarHBondContact O-N 3.46Å; L36-K39 WeakPolarHBondContact O-CB 3.48Å; L36-K39 PolarHBondContact O-N 3.48Å; L36-K39 VanDerWaalsContact O-N 3.14Å; L36-L40 WeakPolarHBondContact O-CB 3.43Å; L36-L40 PolarHBondContact O-N 3.48Å; L36-L57 HydrophobicContact CD1-CD1 4.12Å; L36-L57 HydrophobicContact CD1-CD2 4.39Å; L36-L57 HydrophobicContact CD2-CB 3.56Å; L36-L57 HydrophobicContact CD2-CD1 3.34Å; L36-L57 HydrophobicContact CD2-CG 3.93Å; L36-L57 HydrophobicContact CG-CD1 3.75Å
37	Q	67.2	Low	65.4	Low	107 Å²	107	84 Å²	84	50%	0.5	47%	0.467	S	S	.	.	H	α-helix	trans	-59.4	-40.5	177.4	-76.7	178.3	-14.2	0	0	111	L33 E34 L40 G41	L33-Q37 WeakPolarHBondContact O-CG 3.44Å; L33-Q37 PolarHBondContact O-N 2.8Å; E34-Q37 PolarHBondContact O-N 3.1Å; Q37-L40 WeakPolarHBondContact O-CB 3.44Å; Q37-L40 PolarHBondContact O-N 3.4Å; Q37-G41 PolarHBondContact O-N 3.43Å
38	K	70.9	Confident	68.1	Low	153 Å²	153	85.6 Å²	85.6	67%	0.665	46%	0.464	S	S	*	.	H	α-helix	trans	-62.2	-46.2	174.2	-170.8	179.9	178.1	-177.6	0	112.1	E34 L36 L40 G41 E42	E34-K38 PolarHBondContact O-N 3Å; L36-K38 VanDerWaalsContact C-N 3.26Å; L36-K38 PolarHBondContact O-N 3.46Å; K38-L40 VanDerWaalsContact C-N 3.28Å; K38-L40 PolarHBondContact O-N 2.95Å; K38-G41 PolarHBondContact O-N 3.1Å; K38-E42 PolarHBondContact O-N 2.86Å
39	K	69.7	Low	70.4	Confident	121 Å²	121	84.1 Å²	84.1	53%	0.526	45%	0.447	S	S	.	.	H	α-helix	trans	-61.4	-36.9	174.8	-80.7	-174.8	176.6	-175	0	112.2	A35 L36 G41 E42	A35-K39 PolarHBondContact O-N 3.17Å; L36-K39 WeakPolarHBondContact O-CB 3.48Å; L36-K39 PolarHBondContact O-N 3.48Å; L36-K39 VanDerWaalsContact O-N 3.14Å; K39-G41 VanDerWaalsContact C-N 3.34Å; K39-E42 PolarHBondContact O-N 3.09Å
40	L	70.4	Confident	72.4	Confident	8 Å²	8	85 Å²	85	4%	0.042	44%	0.44	C	S	.	.	H	α-helix	trans	-67.9	-35.4	178.4	-141.3	69.5	0	0	0	112.2	L36 Q37 K38 E42 L43 L45 R50 L53 E54	L36-L40 WeakPolarHBondContact O-CB 3.43Å; L36-L40 PolarHBondContact O-N 3.48Å; Q37-L40 WeakPolarHBondContact O-CB 3.44Å; Q37-L40 PolarHBondContact O-N 3.4Å; K38-L40 VanDerWaalsContact C-N 3.28Å; K38-L40 PolarHBondContact O-N 2.95Å; L40-E42 VanDerWaalsContact C-N 3.26Å; L40-E42 PolarHBondContact O-N 3.27Å; L40-L43 PolarHBondContact O-N 3.36Å; L40-L45 HydrophobicContact CD1-CD1 4.21Å; L40-L45 HydrophobicContact CG-CD1 4.02Å; L40-R50 HydrophobicContact CD2-CG 3.56Å; L40-R50 HydrophobicContact CG-CG 4.33Å; L40-L53 HydrophobicContact CD1-CB 4.25Å; L40-L53 HydrophobicContact CD1-CD2 3.36Å; L40-L53 HydrophobicContact CD1-CG 3.69Å; L40-E54 HydrophobicContact CD2-CG 3.42Å; L40-E54 VanDerWaalsContact CD2-CG 3.42Å
41	G	68.1	Low	74.6	Confident	58 Å²	58	84.3 Å²	84.3	60%	0.598	44%	0.435	S	S	*	.	H	α-helix	trans	-68.8	-18.8	175.8	0	0	0	0	0	114.6	Q37 K38 K39 L43	Q37-G41 PolarHBondContact O-N 3.43Å; K38-G41 PolarHBondContact O-N 3.1Å; K39-G41 VanDerWaalsContact C-N 3.34Å; G41-L43 VanDerWaalsContact C-N 3.3Å
42	E	76.6	Confident	76.6	Confident	120 Å²	120	84.4 Å²	84.4	56%	0.561	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-6.5	174.7	-66.4	-179.6	-171.8	0	0	113.7	K38 K39 L40 K186	K38-E42 PolarHBondContact O-N 2.86Å; K39-E42 PolarHBondContact O-N 3.09Å; L40-E42 VanDerWaalsContact C-N 3.26Å; L40-E42 PolarHBondContact O-N 3.27Å; E42-K186 IonicContact OE2-NZ 3.07Å
43	L	76.4	Confident	78	Confident	30 Å²	30	79.6 Å²	79.6	16%	0.157	40%	0.397	C	S	.	.	S	Bend	trans	-98.4	136.2	177.1	-61.4	175.9	0	0	0	109.3	L40 G41 L45 Y182	L40-L43 PolarHBondContact O-N 3.36Å; G41-L43 VanDerWaalsContact C-N 3.3Å; L43-L45 VanDerWaalsContact C-N 3.25Å; L43-L45 HydrophobicContact CB-CD1 3.79Å; L43-L45 HydrophobicContact CB-CD2 4.02Å; L43-L45 HydrophobicContact CB-CG 3.54Å; L43-L45 HydrophobicContact CD1-CD1 4.08Å; L43-L45 PolarHBondContact O-N 2.91Å; L43-Y182 HydrophobicContact CD1-CE2 4.49Å; L43-Y182 HydrophobicContact CD2-CD2 4Å; L43-Y182 HydrophobicContact CD2-CE2 3.9Å
44	D	83.2	Confident	79.5	Confident	167 Å²	167	78.7 Å²	78.7	89%	0.893	39%	0.391	S	S	*	.			trans	-75.2	80.9	172.9	-170.4	23.6	0	0	0	109.4
45	L	85.3	Confident	80.8	Confident	16 Å²	16	74.4 Å²	74.4	8%	0.084	38%	0.379	C	S	.	.			trans	-113.4	137.4	-175.6	-57.9	178.3	0	0	0	110.7	L40 L43 Q49 L53 P127	L40-L45 HydrophobicContact CD1-CD1 4.21Å; L40-L45 HydrophobicContact CG-CD1 4.02Å; L43-L45 VanDerWaalsContact C-N 3.25Å; L43-L45 HydrophobicContact CB-CD1 3.79Å; L43-L45 HydrophobicContact CB-CD2 4.02Å; L43-L45 HydrophobicContact CB-CG 3.54Å; L43-L45 HydrophobicContact CD1-CD1 4.08Å; L43-L45 PolarHBondContact O-N 2.91Å; L45-Q49 HydrophobicContact CB-CB 4.26Å; L45-Q49 HydrophobicContact CD2-CB 4.34Å; L45-L53 HydrophobicContact CD1-CD2 4.25Å; L45-P127 HydrophobicContact CD2-CG 3.51Å
46	D	88.6	Confident	82.1	Confident	78 Å²	78	72.8 Å²	72.8	42%	0.417	36%	0.363	S	S	.	.			trans	-69.6	165.4	163	70.7	59.2	0	0	0	111.3	Q48 Q49 R50	D46-Q48 VanDerWaalsContact C-N 3.27Å; D46-Q48 PolarHBondContact O-N 3.08Å; D46-Q48 WeakPolarHBondContact OD1-CA 3.4Å; D46-Q48 WeakPolarHBondContact OD1-CB 3.1Å; D46-Q48 PolarHBondContact OD1-N 2.99Å; D46-Q49 PolarHBondContact O-N 2.72Å; D46-Q49 WeakPolarHBondContact OD1-CG 3.34Å; D46-Q49 PolarHBondContact OD1-N 3.3Å; D46-Q49 VanDerWaalsContact OD2-CG 3.27Å; D46-Q49 WeakPolarHBondContact OD2-CG 3.47Å; D46-Q49 PolarHBondContact OD2-NE2 3.15Å; D46-Q49 PolarHBondContact OD2-OE1 3.12Å; D46-R50 WeakPolarHBondContact O-CB 3.34Å; D46-R50 PolarHBondContact O-N 2.98Å
47	E	87.6	Confident	83.3	Confident	97 Å²	97	71.3 Å²	71.3	45%	0.453	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-32.5	-176.1	-177.2	58.7	-161.8	0	0	112.8	R50 K51	E47-R50 IonicContact OE2-CZ 2.67Å; E47-R50 IonicContact OE2-NH1 3.81Å; E47-R50 PolarHBondContact OE2-NH1 2.92Å; E47-K51 WeakPolarHBondContact O-CG 3.45Å; E47-K51 PolarHBondContact O-N 3.26Å; E47-K51 VanDerWaalsContact O-N 3.1Å; E47-K51 WeakPolarHBondContact OE1-CE 3.26Å; E47-K51 IonicContact OE1-NZ 3.41Å; E47-K51 PolarHBondContact OE1-NZ 2.85Å
48	Q	88.4	Confident	84.5	Confident	89 Å²	89	69.5 Å²	69.5	42%	0.416	35%	0.351	S	S	.	.	H	α-helix	trans	-73.7	-41.4	179.3	-168	179.3	27.2	0	0	111	D46 K51 R52	D46-Q48 VanDerWaalsContact C-N 3.27Å; D46-Q48 PolarHBondContact O-N 3.08Å; D46-Q48 WeakPolarHBondContact OD1-CA 3.4Å; D46-Q48 WeakPolarHBondContact OD1-CB 3.1Å; D46-Q48 PolarHBondContact OD1-N 2.99Å; Q48-K51 PolarHBondContact O-N 3.44Å; Q48-R52 VanDerWaalsContact O-CG 3.29Å; Q48-R52 WeakPolarHBondContact O-CG 3.39Å; Q48-R52 PolarHBondContact O-N 2.86Å
49	Q	91.5	Very high	85.4	Confident	33 Å²	33	66 Å²	66	15%	0.154	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-45.2	173.7	-72.8	178.9	-10.7	0	0	111.2	L45 D46 R52 L53 P127 Y128	L45-Q49 HydrophobicContact CB-CB 4.26Å; L45-Q49 HydrophobicContact CD2-CB 4.34Å; D46-Q49 PolarHBondContact O-N 2.72Å; D46-Q49 WeakPolarHBondContact OD1-CG 3.34Å; D46-Q49 PolarHBondContact OD1-N 3.3Å; D46-Q49 VanDerWaalsContact OD2-CG 3.27Å; D46-Q49 WeakPolarHBondContact OD2-CG 3.47Å; D46-Q49 PolarHBondContact OD2-NE2 3.15Å; D46-Q49 PolarHBondContact OD2-OE1 3.12Å; Q49-R52 PolarHBondContact O-N 3.41Å; Q49-L53 WeakPolarHBondContact O-CB 3.38Å; Q49-L53 PolarHBondContact O-N 3.38Å; Q49-P127 HydrophobicContact CB-CB 4.25Å; Q49-P127 HydrophobicContact CB-CG 4.5Å; Q49-P127 HydrophobicContact CG-CB 4.09Å; Q49-P127 HydrophobicContact CG-CG 4.45Å; Q49-Y128 PolarHBondContact NE2-OH 3.19Å
50	R	89.2	Confident	86.5	Confident	80 Å²	80	61.6 Å²	61.6	30%	0.302	32%	0.318	S	S	.	.	H	α-helix	trans	-56.2	-53.6	175.9	-172	-178.4	-64.7	130.9	3.5	111.2	L40 D46 E47 R52 L53 E54	L40-R50 HydrophobicContact CD2-CG 3.56Å; L40-R50 HydrophobicContact CG-CG 4.33Å; D46-R50 WeakPolarHBondContact O-CB 3.34Å; D46-R50 PolarHBondContact O-N 2.98Å; E47-R50 IonicContact OE2-CZ 2.67Å; E47-R50 IonicContact OE2-NH1 3.81Å; E47-R50 PolarHBondContact OE2-NH1 2.92Å; R50-R52 VanDerWaalsContact C-N 3.34Å; R50-R52 PolarHBondContact O-N 2.62Å; R50-L53 PolarHBondContact O-N 3.27Å; R50-E54 WeakPolarHBondContact O-CG 3.45Å; R50-E54 PolarHBondContact O-N 3.33Å
51	K	90.9	Very high	87.4	Confident	123 Å²	123	65.2 Å²	65.2	54%	0.535	35%	0.349	S	S	.	.	H	α-helix	trans	-58.3	-42.4	178.9	-77.7	175.9	174.8	161.2	0	113.3	E47 Q48 A55	E47-K51 WeakPolarHBondContact O-CG 3.45Å; E47-K51 PolarHBondContact O-N 3.26Å; E47-K51 VanDerWaalsContact O-N 3.1Å; E47-K51 WeakPolarHBondContact OE1-CE 3.26Å; E47-K51 IonicContact OE1-NZ 3.41Å; E47-K51 PolarHBondContact OE1-NZ 2.85Å; Q48-K51 PolarHBondContact O-N 3.44Å; K51-A55 WeakPolarHBondContact O-CB 3.37Å; K51-A55 PolarHBondContact O-N 3.3Å
52	R	91.6	Very high	88.3	Confident	60 Å²	60	68.6 Å²	68.6	23%	0.226	35%	0.349	C	S	.	.	H	α-helix	trans	-64.6	-42.6	178.2	-73.4	173.7	-175.9	-169.9	1.2	111.4	Q48 Q49 R50 A55 F56 R204	Q48-R52 VanDerWaalsContact O-CG 3.29Å; Q48-R52 WeakPolarHBondContact O-CG 3.39Å; Q48-R52 PolarHBondContact O-N 2.86Å; Q49-R52 PolarHBondContact O-N 3.41Å; R50-R52 VanDerWaalsContact C-N 3.34Å; R50-R52 PolarHBondContact O-N 2.62Å; R52-A55 PolarHBondContact O-N 2.86Å; R52-F56 PolarHBondContact O-N 3.36Å; R52-R204 PolarHBondContact NH1-O 3.43Å; R52-R204 PolarHBondContact NH2-O 2.87Å
53	L	90.4	Very high	89.1	Confident	13 Å²	13	63.7 Å²	63.7	7%	0.068	33%	0.328	C	S	.	.	H	α-helix	trans	-70	-40.4	-179.8	-169.2	51.6	0	0	0	111.5	L40 L45 Q49 R50 F56 L57 N125	L40-L53 HydrophobicContact CD1-CB 4.25Å; L40-L53 HydrophobicContact CD1-CD2 3.36Å; L40-L53 HydrophobicContact CD1-CG 3.69Å; L45-L53 HydrophobicContact CD1-CD2 4.25Å; Q49-L53 WeakPolarHBondContact O-CB 3.38Å; Q49-L53 PolarHBondContact O-N 3.38Å; R50-L53 PolarHBondContact O-N 3.27Å; L53-F56 PolarHBondContact O-N 3.27Å; L53-L57 HydrophobicContact CD1-CD1 4.3Å; L53-L57 HydrophobicContact CG-CD1 4.09Å; L53-L57 WeakPolarHBondContact O-CD1 3.48Å; L53-L57 WeakPolarHBondContact O-CG 3.34Å; L53-L57 PolarHBondContact O-N 2.91Å; L53-N125 HydrophobicContact CD1-CB 4.29Å
54	E	89.8	Confident	89.7	Confident	65 Å²	65	64.9 Å²	64.9	30%	0.304	35%	0.347	S	S	.	.	H	α-helix	trans	-58.1	-49.1	170.7	-73	174.3	178.6	0	0	111.4	L40 R50 F56 L57 T58	L40-E54 HydrophobicContact CD2-CG 3.42Å; L40-E54 VanDerWaalsContact CD2-CG 3.42Å; R50-E54 WeakPolarHBondContact O-CG 3.45Å; R50-E54 PolarHBondContact O-N 3.33Å; E54-F56 VanDerWaalsContact C-N 3.33Å; E54-F56 PolarHBondContact O-N 2.82Å; E54-L57 PolarHBondContact O-N 3.38Å; E54-L57 VanDerWaalsContact O-N 3.09Å; E54-T58 PolarHBondContact O-N 2.78Å; E54-T58 PolarHBondContact O-OG1 3.41Å; E54-T58 VanDerWaalsContact O-OG1 3.1Å
55	A	91.3	Very high	90.2	Very high	50 Å²	50	64.7 Å²	64.7	41%	0.413	34%	0.341	S	S	.	.	H	α-helix	trans	-59	-43.1	178.7	0	0	0	0	0	112.3	K51 R52 L57 T58 Q59	K51-A55 WeakPolarHBondContact O-CB 3.37Å; K51-A55 PolarHBondContact O-N 3.3Å; R52-A55 PolarHBondContact O-N 2.86Å; A55-L57 VanDerWaalsContact C-N 3.34Å; A55-L57 PolarHBondContact O-N 3.13Å; A55-T58 PolarHBondContact O-N 3.2Å; A55-Q59 WeakPolarHBondContact O-CG 3.38Å; A55-Q59 PolarHBondContact O-N 2.99Å
56	F	93.2	Very high	90.6	Very high	16 Å²	16	64.8 Å²	64.8	7%	0.07	34%	0.341	C	S	.	.	H	α-helix	trans	-60.2	-44.2	174.7	172.5	-100.2	0	0	0	111.5	R52 L53 E54 Q59 K60 G131 Y133 E147	R52-F56 PolarHBondContact O-N 3.36Å; L53-F56 PolarHBondContact O-N 3.27Å; E54-F56 VanDerWaalsContact C-N 3.33Å; E54-F56 PolarHBondContact O-N 2.82Å; F56-Q59 WeakPolarHBondContact O-CB 3.31Å; F56-Q59 PolarHBondContact O-N 3.38Å; F56-K60 HydrophobicContact CE1-CD 4.01Å; F56-K60 HydrophobicContact CZ-CD 4.32Å; F56-K60 WeakPolarHBondContact O-CB 3.38Å; F56-K60 PolarHBondContact O-N 3.27Å; F56-G131 VanDerWaalsContact CZ-C 3.46Å; F56-Y133 HydrophobicContact CE2-CD1 4.43Å; F56-Y133 AromaticContact CE2-CE1 3.78Å; F56-Y133 HydrophobicContact CE2-CE1 3.78Å; F56-Y133 AromaticContact CE2-CE2 3.95Å; F56-Y133 HydrophobicContact CE2-CE2 3.95Å; F56-Y133 AromaticContact CE2-CZ 3.51Å; F56-Y133 HydrophobicContact CZ-CD1 4.44Å; F56-Y133 HydrophobicContact CZ-CE1 4.18Å; F56-E147 HydrophobicContact CD2-CB 4.38Å; F56-E147 HydrophobicContact CE2-CB 3.92Å
57	L	90.2	Very high	90.9	Very high	13 Å²	13	65.7 Å²	65.7	7%	0.068	34%	0.342	C	S	.	.	H	α-helix	trans	-71.2	-35.3	-177.7	-65.5	164.7	0	0	0	112.6	L36 L53 E54 A55 K60 A61 N125	L36-L57 HydrophobicContact CD1-CD1 4.12Å; L36-L57 HydrophobicContact CD1-CD2 4.39Å; L36-L57 HydrophobicContact CD2-CB 3.56Å; L36-L57 HydrophobicContact CD2-CD1 3.34Å; L36-L57 HydrophobicContact CD2-CG 3.93Å; L36-L57 HydrophobicContact CG-CD1 3.75Å; L53-L57 HydrophobicContact CD1-CD1 4.3Å; L53-L57 HydrophobicContact CG-CD1 4.09Å; L53-L57 WeakPolarHBondContact O-CD1 3.48Å; L53-L57 WeakPolarHBondContact O-CG 3.34Å; L53-L57 PolarHBondContact O-N 2.91Å; E54-L57 PolarHBondContact O-N 3.38Å; E54-L57 VanDerWaalsContact O-N 3.09Å; A55-L57 VanDerWaalsContact C-N 3.34Å; A55-L57 PolarHBondContact O-N 3.13Å; L57-K60 HydrophobicContact CD2-CD 4.32Å; L57-K60 PolarHBondContact O-N 2.86Å; L57-A61 PolarHBondContact O-N 3.43Å; L57-N125 HydrophobicContact CD2-CB 4.45Å; L57-N125 WeakPolarHBondContact CD2-OD1 3.3Å
58	T	90.4	Very high	91.3	Very high	69 Å²	69	64.2 Å²	64.2	42%	0.423	34%	0.337	S	S	.	.	H	α-helix	trans	-61.3	-44.1	170.4	-57.9	0	0	0	0	111.2	E54 A55 A61	E54-T58 PolarHBondContact O-N 2.78Å; E54-T58 PolarHBondContact O-OG1 3.41Å; E54-T58 VanDerWaalsContact O-OG1 3.1Å; A55-T58 PolarHBondContact O-N 3.2Å; T58-A61 PolarHBondContact O-N 3.32Å
59	Q	91	Very high	91.7	Very high	81 Å²	81	66.2 Å²	66.2	38%	0.379	35%	0.346	S	S	.	.	H	α-helix	trans	-62.6	-43.7	174.4	-72.1	174.2	0.7	0	0	111.5	A55 F56 A61 Q62 L95	A55-Q59 WeakPolarHBondContact O-CG 3.38Å; A55-Q59 PolarHBondContact O-N 2.99Å; F56-Q59 WeakPolarHBondContact O-CB 3.31Å; F56-Q59 PolarHBondContact O-N 3.38Å; Q59-A61 VanDerWaalsContact C-N 3.3Å; Q59-A61 PolarHBondContact O-N 3.37Å; Q59-Q62 WeakPolarHBondContact O-CB 3.5Å; Q59-Q62 PolarHBondContact O-N 3.43Å; Q59-Q62 VanDerWaalsContact O-N 3.1Å; Q59-L95 HydrophobicContact CB-CD1 4.07Å; Q59-L95 HydrophobicContact CB-CD2 4.16Å; Q59-L95 HydrophobicContact CG-CD2 4.09Å
60	K	92.1	Very high	91.9	Very high	28 Å²	28	66.3 Å²	66.3	12%	0.122	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-37	177.5	179.7	176.1	173.4	172.2	0	112.4	F56 L57 Q62 V63 H122 F132 Y133	F56-K60 HydrophobicContact CE1-CD 4.01Å; F56-K60 HydrophobicContact CZ-CD 4.32Å; F56-K60 WeakPolarHBondContact O-CB 3.38Å; F56-K60 PolarHBondContact O-N 3.27Å; L57-K60 HydrophobicContact CD2-CD 4.32Å; L57-K60 PolarHBondContact O-N 2.86Å; K60-Q62 PolarHBondContact O-N 2.89Å; K60-V63 WeakPolarHBondContact O-CB 3.47Å; K60-V63 PolarHBondContact O-N 3.1Å; K60-H122 WeakPolarHBondContact CE-ND1 3.49Å; K60-H122 PolarHBondContact NZ-O 3.3Å; K60-F132 WeakPolarHBondContact CD-O 3.41Å; K60-F132 WeakPolarHBondContact CE-O 3.3Å; K60-F132 PolarHBondContact NZ-O 3.23Å; K60-Y133 HydrophobicContact CB-CD1 4.06Å; K60-Y133 HydrophobicContact CB-CE1 4.06Å; K60-Y133 HydrophobicContact CG-CD1 4.14Å
61	A	89.4	Confident	92.3	Very high	83 Å²	83	63.1 Å²	63.1	69%	0.686	34%	0.336	S	S	*	.	H	α-helix	trans	-64.6	-23.2	176.6	0	0	0	0	0	113.3	L57 T58 Q59 V63	L57-A61 PolarHBondContact O-N 3.43Å; T58-A61 PolarHBondContact O-N 3.32Å; Q59-A61 VanDerWaalsContact C-N 3.3Å; Q59-A61 PolarHBondContact O-N 3.37Å; A61-V63 VanDerWaalsContact C-N 3.31Å
62	Q	87.5	Confident	92.7	Very high	130 Å²	130	60.3 Å²	60.3	61%	0.607	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-12	174.1	-59.6	171.5	6.7	0	0	112.6	Q59 K60 G64	Q59-Q62 WeakPolarHBondContact O-CB 3.5Å; Q59-Q62 PolarHBondContact O-N 3.43Å; Q59-Q62 VanDerWaalsContact O-N 3.1Å; K60-Q62 PolarHBondContact O-N 2.89Å; Q62-G64 PolarHBondContact O-N 2.95Å
63	V	92.3	Very high	92.9	Very high	17 Å²	17	62.6 Å²	62.6	10%	0.103	35%	0.349	C	S	.	.			trans	-85	108.7	176.1	-177.2	0	0	0	0	108	K60 A61 L66 L95 M97 Y133	K60-V63 WeakPolarHBondContact O-CB 3.47Å; K60-V63 PolarHBondContact O-N 3.1Å; A61-V63 VanDerWaalsContact C-N 3.31Å; V63-L66 HydrophobicContact CG1-CD2 3.4Å; V63-L66 HydrophobicContact CG1-CG 4.14Å; V63-L95 HydrophobicContact CG2-CD1 3.53Å; V63-M97 HydrophobicContact CG1-CE 4.21Å; V63-M97 HydrophobicContact CG2-CE 3.81Å; V63-Y133 HydrophobicContact CB-CD1 4.45Å; V63-Y133 HydrophobicContact CG2-CD1 3.82Å; V63-Y133 HydrophobicContact CG2-CE1 4.09Å
64	G	90	Very high	93.2	Very high	55 Å²	55	66.1 Å²	66.1	57%	0.567	37%	0.368	S	S	*	.			trans	-73.4	-155.8	172.1	0	0	0	0	0	112.7	Q62 L66	Q62-G64 PolarHBondContact O-N 2.95Å; G64-L66 PolarHBondContact O-N 3.31Å
65	E	92.8	Very high	93.6	Very high	162 Å²	162	66 Å²	66	76%	0.757	37%	0.373	S	S	*	.	S	Bend	trans	-61.8	132.3	171.7	-172.4	178.3	-159.1	0	0	110.4
66	L	95.3	Very high	93.8	Very high	18 Å²	18	69.5 Å²	69.5	9%	0.094	38%	0.381	C	S	.	.			trans	-89.8	130.5	-179.5	-63.5	179.2	0	0	0	110.8	V63 G64 F71 F136 C145	V63-L66 HydrophobicContact CG1-CD2 3.4Å; V63-L66 HydrophobicContact CG1-CG 4.14Å; G64-L66 PolarHBondContact O-N 3.31Å; L66-F71 HydrophobicContact CB-CE2 4.42Å; L66-F71 HydrophobicContact CB-CZ 4.35Å; L66-F71 HydrophobicContact CD1-CZ 4.36Å; L66-F71 HydrophobicContact CD2-CZ 3.82Å; L66-F71 HydrophobicContact CG-CZ 4.4Å; L66-F136 HydrophobicContact CB-CD1 3.69Å; L66-F136 HydrophobicContact CB-CE1 3.87Å; L66-C145 HydrophobicContact CD1-CB 3.76Å
67	K	94.9	Very high	93.9	Very high	98 Å²	98	71.5 Å²	71.5	43%	0.426	39%	0.392	S	S	.	.			trans	-126.9	156.8	173.3	-55.6	177.4	-176.2	175.4	0	110.8	E69 D70 F71	K67-E69 VanDerWaalsContact C-N 3.31Å; K67-E69 HydrophobicContact CB-CG 4.14Å; K67-E69 PolarHBondContact O-N 3.36Å; K67-D70 WeakPolarHBondContact CB-OD2 3.48Å; K67-D70 PolarHBondContact N-OD2 3.47Å; K67-D70 WeakPolarHBondContact O-CB 3.42Å; K67-D70 PolarHBondContact O-N 3.35Å; K67-F71 WeakPolarHBondContact O-CD2 3.4Å; K67-F71 WeakPolarHBondContact O-CE2 3.49Å
68	D	96	Very high	93.8	Very high	66 Å²	66	72.1 Å²	72.1	35%	0.353	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-59	-42.7	-177.7	-175.6	58.7	0	0	0	112.7	D70 F71 R99 F136	D68-D70 PolarHBondContact O-N 3.03Å; D68-D70 VanDerWaalsContact O-N 3.13Å; D68-F71 PolarHBondContact O-N 2.87Å; D68-R99 IonicContact OD1-CZ 2.82Å; D68-R99 IonicContact OD1-NH1 2.78Å; D68-R99 PolarHBondContact OD1-NH1 3.14Å; D68-R99 IonicContact OD1-NH2 3.23Å; D68-R99 PolarHBondContact OD1-NH2 2.75Å; D68-F136 HydrophobicContact CB-CE2 4.08Å
69	E	96.4	Very high	93.6	Very high	131 Å²	131	72.2 Å²	72.2	61%	0.612	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-63.6	-17.2	-179.2	61.6	-172.8	175.5	0	0	114.4	K67 F71 K91	K67-E69 VanDerWaalsContact C-N 3.31Å; K67-E69 HydrophobicContact CB-CG 4.14Å; K67-E69 PolarHBondContact O-N 3.36Å; E69-F71 VanDerWaalsContact C-N 3.26Å; E69-F71 PolarHBondContact O-N 3.18Å; E69-K91 PolarHBondContact O-NZ 3.45Å
70	D	95.9	Very high	92.8	Very high	35 Å²	35	70.8 Å²	70.8	19%	0.187	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-81.4	-1.4	-178.1	-66.8	-41.3	0	0	0	113.4	K67 D68 H90 K91 P92	K67-D70 WeakPolarHBondContact CB-OD2 3.48Å; K67-D70 PolarHBondContact N-OD2 3.47Å; K67-D70 WeakPolarHBondContact O-CB 3.42Å; K67-D70 PolarHBondContact O-N 3.35Å; D68-D70 PolarHBondContact O-N 3.03Å; D68-D70 VanDerWaalsContact O-N 3.13Å; D70-H90 CarbonylContact O-C 3.56Å; D70-H90 WeakPolarHBondContact O-CA 3.44Å; D70-K91 WeakPolarHBondContact O-CB 3.29Å; D70-K91 WeakPolarHBondContact O-CG 3.19Å; D70-K91 PolarHBondContact O-N 3.39Å; D70-P92 HydrophobicContact CB-CG 4.37Å
71	F	97.8	Very high	91.6	Very high	13 Å²	13	73.4 Å²	73.4	6%	0.057	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.6	-175.3	-64.6	-76.6	0	0	0	112.9	L66 K67 D68 E69 V88 Q89 H90 M97 F136 C145	L66-F71 HydrophobicContact CB-CE2 4.42Å; L66-F71 HydrophobicContact CB-CZ 4.35Å; L66-F71 HydrophobicContact CD1-CZ 4.36Å; L66-F71 HydrophobicContact CD2-CZ 3.82Å; L66-F71 HydrophobicContact CG-CZ 4.4Å; K67-F71 WeakPolarHBondContact O-CD2 3.4Å; K67-F71 WeakPolarHBondContact O-CE2 3.49Å; D68-F71 PolarHBondContact O-N 2.87Å; E69-F71 VanDerWaalsContact C-N 3.26Å; E69-F71 PolarHBondContact O-N 3.18Å; F71-V88 HydrophobicContact CB-CB 4.31Å; F71-V88 HydrophobicContact CD1-CB 4.1Å; F71-V88 HydrophobicContact CD1-CG2 3.52Å; F71-V88 HydrophobicContact CE1-CG2 4.05Å; F71-V88 HydrophobicContact CG-CG2 4.32Å; F71-Q89 WeakPolarHBondContact CA-O 3.46Å; F71-H90 HydrophobicContact CD1-CB 4.18Å; F71-H90 HydrophobicContact CE1-CB 3.89Å; F71-H90 AromaticContact CE1-CD2 3.81Å; F71-H90 AromaticContact CZ-CD2 3.97Å; F71-M97 HydrophobicContact CE1-SD 3.98Å; F71-F136 HydrophobicContact CD2-CZ 4.26Å; F71-F136 AromaticContact CE2-CE1 3.69Å; F71-F136 HydrophobicContact CE2-CE1 3.69Å; F71-F136 AromaticContact CE2-CZ 3.75Å; F71-F136 HydrophobicContact CE2-CZ 3.75Å; F71-F136 HydrophobicContact CZ-CE1 4.3Å; F71-C145 VanDerWaalsContact CZ-SG 3.58Å
72	D	97.6	Very high	90.7	Very high	63 Å²	63	70.2 Å²	70.2	34%	0.337	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120	165	-71	-41.1	0	0	0	109.4	V88 Q89 K91	D72-V88 CarbonylContact O-C 3.56Å; D72-V88 VanDerWaalsContact O-CA 3.3Å; D72-V88 WeakPolarHBondContact O-CA 3.19Å; D72-Q89 PolarHBondContact N-O 2.99Å; D72-Q89 PolarHBondContact O-N 2.97Å; D72-K91 WeakPolarHBondContact OD1-CE 3.16Å; D72-K91 IonicContact OD1-NZ 3.36Å; D72-K91 PolarHBondContact OD1-NZ 2.76Å; D72-K91 VanDerWaalsContact OD2-CE 3.23Å; D72-K91 WeakPolarHBondContact OD2-CE 3.29Å; D72-K91 VanDerWaalsContact OD2-CG 3.29Å; D72-K91 WeakPolarHBondContact OD2-CG 3.37Å
73	P	96.6	Very high	90.5	Very high	108 Å²	108	65.1 Å²	65.1	70%	0.701	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	138.7	176.3	29.1	-33.5	0	0	0	110.9
74	I	97.8	Very high	90.5	Very high	88 Å²	88	66.8 Å²	66.8	45%	0.451	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-61.6	177	-61.2	166.9	0	0	0	110	K87 Q89 V96	I74-K87 HydrophobicContact CB-CB 4.28Å; I74-K87 HydrophobicContact CB-CD 4.44Å; I74-K87 HydrophobicContact CB-CG 4.22Å; I74-K87 WeakPolarHBondContact CB-O 3.39Å; I74-K87 HydrophobicContact CD1-CD 4.41Å; I74-K87 HydrophobicContact CD1-CG 4.04Å; I74-K87 HydrophobicContact CG2-CD 4.19Å; I74-K87 PolarHBondContact N-O 3.01Å; I74-Q89 HydrophobicContact CD1-CB 4.12Å; I74-V96 HydrophobicContact CD1-CG1 4.33Å; I74-V96 HydrophobicContact CD1-CG2 4.44Å
75	C	96.5	Very high	90.8	Very high	63 Å²	63	65.7 Å²	65.7	43%	0.426	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	160.3	178.7	65.5	0	0	0	0	111.1	K87	C75-K87 PolarHBondContact N-O 3.05Å; C75-K87 PolarHBondContact O-N 3.03Å
76	E	96.7	Very high	91	Very high	122 Å²	122	59.9 Å²	59.9	57%	0.57	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	135.5	169.6	-170	178.9	129.7	0	0	109.8	V84 N86	E76-V84 HydrophobicContact CG-CG1 3.99Å; E76-N86 WeakPolarHBondContact CA-OD1 3.35Å
77	L	94.2	Very high	91.2	Very high	58 Å²	58	61.6 Å²	61.6	30%	0.304	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-29.4	175.1	-65.6	174.4	0	0	0	111.7	V85 K87 A98 Q156	L77-V85 HydrophobicContact CB-CB 4.45Å; L77-V85 HydrophobicContact CB-CG1 4.31Å; L77-V85 HydrophobicContact CD1-CG1 4.18Å; L77-V85 PolarHBondContact N-O 2.85Å; L77-K87 HydrophobicContact CD1-CB 4Å; L77-K87 HydrophobicContact CD2-CB 3.97Å; L77-K87 HydrophobicContact CG-CB 3.88Å; L77-A98 HydrophobicContact CD1-CB 3.95Å; L77-Q156 PolarHBondContact O-NE2 3.38Å
78	G	89.2	Confident	91.3	Very high	26 Å²	26	57.1 Å²	57.1	27%	0.268	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	167.8	163.5	172.6	0	0	0	0	0	112.6	V85	G78-V85 PolarHBondContact N-O 3.14Å; G78-V85 PolarHBondContact O-N 2.99Å
79	A	86.3	Confident	91.4	Very high	72 Å²	72	56.9 Å²	56.9	60%	0.595	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.8	142.6	175.4	0	0	0	0	0	110.1	V84	A79-V84 HydrophobicContact CB-CG2 4.07Å
80	G	74.1	Confident	91.5	Very high	50 Å²	50	50.8 Å²	50.8	52%	0.515	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	-168.7	178.4	0	0	0	0	0	113.1	G82 G83	G80-G82 PolarHBondContact O-N 2.97Å; G80-G83 PolarHBondContact N-O 3.27Å; G80-G83 PolarHBondContact O-N 3.28Å
81	N	66.1	Low	91.5	Very high	84 Å²	84	53 Å²	53	45%	0.449	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.3	-175	-60.2	-16.5	0	0	0	113.7	T229	N81-T229 PolarHBondContact ND2-OG1 3.21Å
82	G	70.2	Confident	91.5	Very high	16 Å²	16	56.5 Å²	56.5	17%	0.165	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	13.1	-179.6	0	0	0	0	0	114.4	G80 K100 I102	G80-G82 PolarHBondContact O-N 2.97Å; G82-K100 WeakPolarHBondContact O-CE 3.39Å; G82-I102 VanDerWaalsContact O-CG1 3.28Å; G82-I102 WeakPolarHBondContact O-CG1 3.49Å
83	G	84.8	Confident	91.4	Very high	22 Å²	22	54.6 Å²	54.6	23%	0.227	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	110.5	-167.8	-178.6	0	0	0	0	0	114.3	G80 L101	G80-G83 PolarHBondContact N-O 3.27Å; G80-G83 PolarHBondContact O-N 3.28Å; G83-L101 VanDerWaalsContact CA-O 3.22Å; G83-L101 WeakPolarHBondContact CA-O 3.48Å
84	V	92.2	Very high	91.4	Very high	53 Å²	53	57.1 Å²	57.1	32%	0.321	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	138.7	-179.1	-177.5	0	0	0	0	109.5	E76 A79 K100 L101	E76-V84 HydrophobicContact CG-CG1 3.99Å; A79-V84 HydrophobicContact CB-CG2 4.07Å; V84-K100 CarbonylContact O-C 3.55Å; V84-K100 WeakPolarHBondContact O-CA 3.09Å; V84-L101 PolarHBondContact N-O 2.8Å; V84-L101 VanDerWaalsContact N-O 3.09Å; V84-L101 PolarHBondContact O-N 3.26Å
85	V	95.9	Very high	91.3	Very high	31 Å²	31	54.1 Å²	54.1	19%	0.188	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.4	176.7	-169.9	0	0	0	0	109.1	L77 G78 A98 R99 K100	L77-V85 HydrophobicContact CB-CB 4.45Å; L77-V85 HydrophobicContact CB-CG1 4.31Å; L77-V85 HydrophobicContact CD1-CG1 4.18Å; L77-V85 PolarHBondContact N-O 2.85Å; G78-V85 PolarHBondContact N-O 3.14Å; G78-V85 PolarHBondContact O-N 2.99Å; V85-A98 HydrophobicContact CG1-CB 4.17Å; V85-R99 WeakPolarHBondContact CA-O 3.4Å; V85-K100 HydrophobicContact CG2-CB 4.04Å; V85-K100 HydrophobicContact CG2-CD 4.18Å; V85-K100 HydrophobicContact CG2-CG 3.95Å
86	N	97.1	Very high	91.3	Very high	40 Å²	40	53.8 Å²	53.8	21%	0.214	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	141.3	178.3	-68	-43.4	0	0	0	110.8	E76 V88 R99 L101	E76-N86 WeakPolarHBondContact CA-OD1 3.35Å; N86-V88 HydrophobicContact CB-CG1 4.08Å; N86-R99 PolarHBondContact N-O 3.33Å; N86-R99 PolarHBondContact O-N 3.4Å; N86-L101 WeakPolarHBondContact ND2-CD1 3.39Å
87	K	98.3	Very high	91.4	Very high	54 Å²	54	48 Å²	48	24%	0.235	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	125.4	162.3	-169.9	177.6	-175.2	167.9	0	107.9	I74 C75 L77 V96 M97 H148	I74-K87 HydrophobicContact CB-CB 4.28Å; I74-K87 HydrophobicContact CB-CD 4.44Å; I74-K87 HydrophobicContact CB-CG 4.22Å; I74-K87 WeakPolarHBondContact CB-O 3.39Å; I74-K87 HydrophobicContact CD1-CD 4.41Å; I74-K87 HydrophobicContact CD1-CG 4.04Å; I74-K87 HydrophobicContact CG2-CD 4.19Å; I74-K87 PolarHBondContact N-O 3.01Å; C75-K87 PolarHBondContact N-O 3.05Å; C75-K87 PolarHBondContact O-N 3.03Å; L77-K87 HydrophobicContact CD1-CB 4Å; L77-K87 HydrophobicContact CD2-CB 3.97Å; L77-K87 HydrophobicContact CG-CB 3.88Å; K87-V96 HydrophobicContact CD-CG1 4.28Å; K87-V96 VanDerWaalsContact CE-CG1 3.42Å; K87-V96 HydrophobicContact CG-CG1 3.85Å; K87-M97 WeakPolarHBondContact CA-O 3.44Å; K87-H148 WeakPolarHBondContact CD-NE2 3.2Å; K87-H148 WeakPolarHBondContact CE-NE2 3.37Å; K87-H148 PolarHBondContact NZ-NE2 2.86Å
88	V	98.3	Very high	91.6	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.03	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	154.3	-177.4	-59	0	0	0	0	110.5	F71 D72 N86 V96 M97 R99	F71-V88 HydrophobicContact CB-CB 4.31Å; F71-V88 HydrophobicContact CD1-CB 4.1Å; F71-V88 HydrophobicContact CD1-CG2 3.52Å; F71-V88 HydrophobicContact CE1-CG2 4.05Å; F71-V88 HydrophobicContact CG-CG2 4.32Å; D72-V88 CarbonylContact O-C 3.56Å; D72-V88 VanDerWaalsContact O-CA 3.3Å; D72-V88 WeakPolarHBondContact O-CA 3.19Å; N86-V88 HydrophobicContact CB-CG1 4.08Å; V88-V96 CarbonylContact O-C 3.57Å; V88-V96 WeakPolarHBondContact O-CA 3.5Å; V88-M97 HydrophobicContact CG2-CB 4.04Å; V88-M97 PolarHBondContact N-O 2.86Å; V88-M97 PolarHBondContact O-N 2.76Å; V88-R99 HydrophobicContact CG1-CB 3.99Å; V88-R99 HydrophobicContact CG2-CB 3.7Å
89	Q	98.2	Very high	92	Very high	61 Å²	61	45.1 Å²	45.1	29%	0.285	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.7	166.2	-175.3	169.4	50.1	0	0	109.6	F71 D72 I74 K91 R94 L95	F71-Q89 WeakPolarHBondContact CA-O 3.46Å; D72-Q89 PolarHBondContact N-O 2.99Å; D72-Q89 PolarHBondContact O-N 2.97Å; I74-Q89 HydrophobicContact CD1-CB 4.12Å; Q89-K91 PolarHBondContact O-N 2.98Å; Q89-R94 PolarHBondContact NE2-O 3.14Å; Q89-R94 VanDerWaalsContact NE2-O 3.11Å; Q89-L95 WeakPolarHBondContact CA-O 3.34Å
90	H	97.9	Very high	92.4	Very high	3 Å²	3	42.5 Å²	42.5	1%	0.014	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	111.1	172.9	-177.9	-129.9	0	0	0	109.5	D70 F71 P92 S93 R94 L95 M97	D70-H90 CarbonylContact O-C 3.56Å; D70-H90 WeakPolarHBondContact O-CA 3.44Å; F71-H90 HydrophobicContact CD1-CB 4.18Å; F71-H90 HydrophobicContact CE1-CB 3.89Å; F71-H90 AromaticContact CE1-CD2 3.81Å; F71-H90 AromaticContact CZ-CD2 3.97Å; H90-P92 WeakPolarHBondContact NE2-CD 3.49Å; H90-S93 PolarHBondContact ND1-OG 3.36Å; H90-S93 PolarHBondContact O-N 2.98Å; H90-R94 WeakPolarHBondContact O-CA 3.32Å; H90-R94 PolarHBondContact O-N 3.45Å; H90-L95 PolarHBondContact N-O 3.41Å; H90-M97 HydrophobicContact CB-CE 3.79Å; H90-M97 HydrophobicContact CB-SD 4.26Å
91	K	96.9	Very high	93.3	Very high	80 Å²	80	41.4 Å²	41.4	35%	0.348	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-47.8	-172.3	-66.1	166.4	-175.2	166.7	0	113.8	E69 D70 D72 Q89 R94	E69-K91 PolarHBondContact O-NZ 3.45Å; D70-K91 WeakPolarHBondContact O-CB 3.29Å; D70-K91 WeakPolarHBondContact O-CG 3.19Å; D70-K91 PolarHBondContact O-N 3.39Å; D72-K91 WeakPolarHBondContact OD1-CE 3.16Å; D72-K91 IonicContact OD1-NZ 3.36Å; D72-K91 PolarHBondContact OD1-NZ 2.76Å; D72-K91 VanDerWaalsContact OD2-CE 3.23Å; D72-K91 WeakPolarHBondContact OD2-CE 3.29Å; D72-K91 VanDerWaalsContact OD2-CG 3.29Å; D72-K91 WeakPolarHBondContact OD2-CG 3.37Å; Q89-K91 PolarHBondContact O-N 2.98Å; K91-R94 WeakPolarHBondContact O-CD 3.49Å; K91-R94 PolarHBondContact O-NE 3.48Å
92	P	96.6	Very high	94.4	Very high	87 Å²	87	37.8 Å²	37.8	57%	0.565	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-46.8	-176.5	-21.6	34.8	0	0	0	112.8	D70 H90	D70-P92 HydrophobicContact CB-CG 4.37Å; H90-P92 WeakPolarHBondContact NE2-CD 3.49Å
93	S	95.8	Very high	95.2	Very high	24 Å²	24	42.4 Å²	42.4	17%	0.168	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-13.5	-175.9	69.2	0	0	0	0	114.5	H90 L95	H90-S93 PolarHBondContact ND1-OG 3.36Å; H90-S93 PolarHBondContact O-N 2.98Å; S93-L95 PolarHBondContact O-N 2.91Å; S93-L95 WeakPolarHBondContact OG-CB 3.3Å; S93-L95 WeakPolarHBondContact OG-CG 3.49Å; S93-L95 PolarHBondContact OG-N 3.47Å
94	R	95.7	Very high	95	Very high	161 Å²	161	42.5 Å²	42.5	61%	0.608	21%	0.213	S	C	*	.			trans	59.8	4.2	-169	-55.6	-61.1	-175.3	173.7	-2.7	116	Q89 H90 K91	Q89-R94 PolarHBondContact NE2-O 3.14Å; Q89-R94 VanDerWaalsContact NE2-O 3.11Å; H90-R94 WeakPolarHBondContact O-CA 3.32Å; H90-R94 PolarHBondContact O-N 3.45Å; K91-R94 WeakPolarHBondContact O-CD 3.49Å; K91-R94 PolarHBondContact O-NE 3.48Å
95	L	96.3	Very high	94.3	Very high	25 Å²	25	48.3 Å²	48.3	13%	0.131	24%	0.237	C	C	.	.			trans	-64.8	141.2	177	-64.7	173.4	0	0	0	111.5	Q59 V63 Q89 H90 S93 M97 Y133	Q59-L95 HydrophobicContact CB-CD1 4.07Å; Q59-L95 HydrophobicContact CB-CD2 4.16Å; Q59-L95 HydrophobicContact CG-CD2 4.09Å; V63-L95 HydrophobicContact CG2-CD1 3.53Å; Q89-L95 WeakPolarHBondContact CA-O 3.34Å; H90-L95 PolarHBondContact N-O 3.41Å; S93-L95 PolarHBondContact O-N 2.91Å; S93-L95 WeakPolarHBondContact OG-CB 3.3Å; S93-L95 WeakPolarHBondContact OG-CG 3.49Å; S93-L95 PolarHBondContact OG-N 3.47Å; L95-M97 HydrophobicContact CB-CE 3.97Å; L95-M97 HydrophobicContact CD1-CE 4.17Å; L95-Y133 HydrophobicContact CD1-CE1 3.97Å
96	V	97.4	Very high	93.5	Very high	56 Å²	56	48.6 Å²	48.6	34%	0.339	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	128.5	171	176.3	0	0	0	0	108.5	I74 K87 V88 H148	I74-V96 HydrophobicContact CD1-CG1 4.33Å; I74-V96 HydrophobicContact CD1-CG2 4.44Å; K87-V96 HydrophobicContact CD-CG1 4.28Å; K87-V96 VanDerWaalsContact CE-CG1 3.42Å; K87-V96 HydrophobicContact CG-CG1 3.85Å; V88-V96 CarbonylContact O-C 3.57Å; V88-V96 WeakPolarHBondContact O-CA 3.5Å; V96-H148 HydrophobicContact CG1-CB 4.23Å
97	M	98.1	Very high	93	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	158.5	-175.8	-57.6	-177	-176.2	0	0	110.8	V63 F71 K87 V88 H90 L95 Y133 C145 M146	V63-M97 HydrophobicContact CG1-CE 4.21Å; V63-M97 HydrophobicContact CG2-CE 3.81Å; F71-M97 HydrophobicContact CE1-SD 3.98Å; K87-M97 WeakPolarHBondContact CA-O 3.44Å; V88-M97 HydrophobicContact CG2-CB 4.04Å; V88-M97 PolarHBondContact N-O 2.86Å; V88-M97 PolarHBondContact O-N 2.76Å; H90-M97 HydrophobicContact CB-CE 3.79Å; H90-M97 HydrophobicContact CB-SD 4.26Å; L95-M97 HydrophobicContact CB-CE 3.97Å; L95-M97 HydrophobicContact CD1-CE 4.17Å; M97-Y133 HydrophobicContact CE-CD1 4.1Å; M97-Y133 HydrophobicContact CE-CD2 3.83Å; M97-Y133 HydrophobicContact CE-CE1 4.39Å; M97-Y133 HydrophobicContact CE-CE2 4.11Å; M97-Y133 HydrophobicContact CE-CG 3.82Å; M97-Y133 HydrophobicContact CG-CD2 3.75Å; M97-Y133 HydrophobicContact CG-CE2 3.79Å; M97-Y133 HydrophobicContact SD-CD2 3.65Å; M97-Y133 HydrophobicContact SD-CE2 4.22Å; M97-Y133 HydrophobicContact SD-CG 4.01Å; M97-C145 HydrophobicContact SD-CB 4.03Å; M97-M146 WeakPolarHBondContact CA-O 3.17Å
98	A	98	Very high	92.4	Very high	9 Å²	9	55.3 Å²	55.3	7%	0.074	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	118.2	160.5	0	0	0	0	0	108.3	L77 V85 M146	L77-A98 HydrophobicContact CD1-CB 3.95Å; V85-A98 HydrophobicContact CG1-CB 4.17Å; A98-M146 PolarHBondContact N-O 3.39Å; A98-M146 PolarHBondContact O-N 2.86Å
99	R	97.3	Very high	91.9	Very high	15 Å²	15	58.5 Å²	58.5	6%	0.057	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	112.7	178.5	-179.1	178	176.8	-167.6	-4	109.4	D68 V85 N86 V88 L101 S143 I144	D68-R99 IonicContact OD1-CZ 2.82Å; D68-R99 IonicContact OD1-NH1 2.78Å; D68-R99 PolarHBondContact OD1-NH1 3.14Å; D68-R99 IonicContact OD1-NH2 3.23Å; D68-R99 PolarHBondContact OD1-NH2 2.75Å; V85-R99 WeakPolarHBondContact CA-O 3.4Å; N86-R99 PolarHBondContact N-O 3.33Å; N86-R99 PolarHBondContact O-N 3.4Å; V88-R99 HydrophobicContact CG1-CB 3.99Å; V88-R99 HydrophobicContact CG2-CB 3.7Å; R99-L101 HydrophobicContact CG-CD1 4.24Å; R99-L101 HydrophobicContact CG-CG 4.46Å; R99-S143 PolarHBondContact NE-OG 3.04Å; R99-S143 VanDerWaalsContact NE-OG 3.12Å; R99-S143 PolarHBondContact NH2-OG 2.87Å; R99-I144 WeakPolarHBondContact CA-O 3.48Å
100	K	94.7	Very high	91.3	Very high	17 Å²	17	58.3 Å²	58.3	7%	0.074	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	124.3	174.1	-177.9	169.2	-178.8	176.6	0	109.8	G82 V84 V85 I102 S143 I144 M146 D211	G82-K100 WeakPolarHBondContact O-CE 3.39Å; V84-K100 CarbonylContact O-C 3.55Å; V84-K100 WeakPolarHBondContact O-CA 3.09Å; V85-K100 HydrophobicContact CG2-CB 4.04Å; V85-K100 HydrophobicContact CG2-CD 4.18Å; V85-K100 HydrophobicContact CG2-CG 3.95Å; K100-I102 HydrophobicContact CG-CG1 4.16Å; K100-S143 CarbonylContact O-C 3.59Å; K100-S143 WeakPolarHBondContact O-CA 3.12Å; K100-I144 HydrophobicContact CB-CB 4.37Å; K100-I144 PolarHBondContact N-O 2.96Å; K100-I144 PolarHBondContact O-N 2.87Å; K100-M146 HydrophobicContact CB-CE 4.32Å; K100-D211 IonicContact NZ-OD1 3.75Å; K100-D211 PolarHBondContact NZ-OD1 2.87Å; K100-D211 IonicContact NZ-OD2 2.84Å; K100-D211 PolarHBondContact NZ-OD2 2.5Å
101	L	93.1	Very high	90.7	Very high	27 Å²	27	61 Å²	61	14%	0.141	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.8	178.2	-58.2	95.7	0	0	0	109	G83 V84 N86 R99 E141	G83-L101 VanDerWaalsContact CA-O 3.22Å; G83-L101 WeakPolarHBondContact CA-O 3.48Å; V84-L101 PolarHBondContact N-O 2.8Å; V84-L101 VanDerWaalsContact N-O 3.09Å; V84-L101 PolarHBondContact O-N 3.26Å; N86-L101 WeakPolarHBondContact ND2-CD1 3.39Å; R99-L101 HydrophobicContact CG-CD1 4.24Å; R99-L101 HydrophobicContact CG-CG 4.46Å; L101-E141 WeakPolarHBondContact CD2-OE2 3.44Å
102	I	89.7	Confident	90.2	Very high	8 Å²	8	60.7 Å²	60.7	4%	0.041	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	108.2	-179.9	-40.9	-170	0	0	0	108.1	G82 K100 L104 E141 I142 I144 L218	G82-I102 VanDerWaalsContact O-CG1 3.28Å; G82-I102 WeakPolarHBondContact O-CG1 3.49Å; K100-I102 HydrophobicContact CG-CG1 4.16Å; I102-L104 HydrophobicContact CB-CD1 4.49Å; I102-L104 HydrophobicContact CG2-CD1 3.77Å; I102-L104 HydrophobicContact CG2-CG 3.95Å; I102-L104 PolarHBondContact O-N 2.95Å; I102-E141 WeakPolarHBondContact O-CA 3.43Å; I102-I142 HydrophobicContact CB-CB 4.42Å; I102-I142 PolarHBondContact N-O 2.92Å; I102-I142 PolarHBondContact O-N 3.38Å; I102-I144 HydrophobicContact CD1-CD1 3.99Å; I102-L218 HydrophobicContact CD1-CD1 4.39Å; I102-L218 HydrophobicContact CD1-CD2 4.21Å
103	H	87.2	Confident	89.8	Confident	112 Å²	112	59.6 Å²	59.6	52%	0.519	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	116	176	-171.9	80.4	0	0	0	110.2	E141	H103-E141 IonicContact ND1-OE1 3.38Å
104	L	79.6	Confident	89.4	Confident	24 Å²	24	58.4 Å²	58.4	13%	0.126	29%	0.291	C	S	.	.			trans	-142.3	108.3	-177.6	-77.8	167.7	0	0	0	110.6	I102 I106 G140 I142 L218	I102-L104 HydrophobicContact CB-CD1 4.49Å; I102-L104 HydrophobicContact CG2-CD1 3.77Å; I102-L104 HydrophobicContact CG2-CG 3.95Å; I102-L104 PolarHBondContact O-N 2.95Å; L104-I106 HydrophobicContact CB-CD1 4.37Å; L104-I106 HydrophobicContact CB-CG1 4.25Å; L104-I106 HydrophobicContact CB-CG2 4.33Å; L104-I106 PolarHBondContact O-N 2.62Å; L104-G140 PolarHBondContact N-O 2.85Å; L104-I142 HydrophobicContact CD1-CD1 4.01Å; L104-L218 HydrophobicContact CD1-CD1 3.39Å
105	E	78.5	Confident	88.9	Confident	176 Å²	176	52.4 Å²	52.4	82%	0.822	27%	0.27	S	S	*	.			trans	-78.1	85.6	169	-67.3	-168.8	167.5	0	0	110.3
106	I	78.6	Confident	88.5	Confident	36 Å²	36	58.1 Å²	58.1	19%	0.185	29%	0.29	C	S	.	.			trans	-126.5	152.5	-178.6	55.9	172.1	0	0	0	112	L104 I110 R111 I114	L104-I106 HydrophobicContact CB-CD1 4.37Å; L104-I106 HydrophobicContact CB-CG1 4.25Å; L104-I106 HydrophobicContact CB-CG2 4.33Å; L104-I106 PolarHBondContact O-N 2.62Å; I106-I110 HydrophobicContact CB-CB 4.47Å; I106-I110 HydrophobicContact CB-CG2 4.5Å; I106-I110 HydrophobicContact CD1-CB 4.46Å; I106-I110 HydrophobicContact CD1-CG2 4.11Å; I106-R111 HydrophobicContact CD1-CB 3.89Å; I106-R111 HydrophobicContact CG1-CB 4.1Å; I106-I114 HydrophobicContact CD1-CD1 3.52Å
107	K	86.2	Confident	88	Confident	159 Å²	159	57.8 Å²	57.8	69%	0.691	29%	0.285	S	S	*	.			trans	-59.2	143.7	177.7	-66.2	178.6	-178.3	174.8	0	110.3	A109 I110 R111	K107-A109 PolarHBondContact O-N 2.8Å; K107-I110 PolarHBondContact O-N 2.75Å; K107-R111 PolarHBondContact O-N 3.12Å; K107-R111 VanDerWaalsContact O-N 3.08Å
108	P	86.7	Confident	87.5	Confident	77 Å²	77	58.1 Å²	58.1	50%	0.5	29%	0.287	S	S	.	.	H	α-helix	trans	-51	-34.6	-179.3	-30.9	35.8	0	0	0	114.8	N112	P108-N112 WeakPolarHBondContact O-CB 3.45Å; P108-N112 PolarHBondContact O-N 3.22Å; P108-N112 PolarHBondContact O-OD1 2.97Å
109	A	87.4	Confident	86.8	Confident	72 Å²	72	63.1 Å²	63.1	60%	0.595	31%	0.309	S	S	*	.	H	α-helix	trans	-63.9	-43.9	177.4	0	0	0	0	0	113	K107 Q113	K107-A109 PolarHBondContact O-N 2.8Å; A109-Q113 PolarHBondContact O-N 3.28Å; A109-Q113 VanDerWaalsContact O-N 3.1Å
110	I	85.3	Confident	86.3	Confident	56 Å²	56	65 Å²	65	29%	0.287	32%	0.322	S	S	.	.	H	α-helix	trans	-69.7	-43.3	178.5	-58.8	175.2	0	0	0	109.4	I106 K107 N112 Q113 I114	I106-I110 HydrophobicContact CB-CB 4.47Å; I106-I110 HydrophobicContact CB-CG2 4.5Å; I106-I110 HydrophobicContact CD1-CB 4.46Å; I106-I110 HydrophobicContact CD1-CG2 4.11Å; K107-I110 PolarHBondContact O-N 2.75Å; I110-N112 PolarHBondContact O-N 2.79Å; I110-Q113 WeakPolarHBondContact O-CA 3.28Å; I110-Q113 WeakPolarHBondContact O-CB 3.05Å; I110-Q113 PolarHBondContact O-N 3.07Å; I110-Q113 VanDerWaalsContact O-N 3.12Å; I110-I114 HydrophobicContact CG2-CD1 4.15Å; I110-I114 WeakPolarHBondContact O-CG1 3.09Å; I110-I114 PolarHBondContact O-N 2.86Å
111	R	86.4	Confident	86	Confident	59 Å²	59	65.1 Å²	65.1	22%	0.223	32%	0.323	C	S	.	.	H	α-helix	trans	-54.2	-52.3	174.5	176.9	-170.7	64.3	-167.4	7	111.9	I106 K107 Q113 I114 I115 Y137	I106-R111 HydrophobicContact CD1-CB 3.89Å; I106-R111 HydrophobicContact CG1-CB 4.1Å; K107-R111 PolarHBondContact O-N 3.12Å; K107-R111 VanDerWaalsContact O-N 3.08Å; R111-Q113 PolarHBondContact O-N 2.82Å; R111-I114 PolarHBondContact O-N 2.97Å; R111-I114 VanDerWaalsContact O-N 3.14Å; R111-I115 WeakPolarHBondContact O-CG1 3.38Å; R111-I115 PolarHBondContact O-N 2.75Å; R111-Y137 VanDerWaalsContact CD-CD1 3.44Å; R111-Y137 VanDerWaalsContact CD-CD2 3.4Å; R111-Y137 HydrophobicContact CG-CD2 3.88Å; R111-Y137 HydrophobicContact CG-CE2 4.23Å; R111-Y137 HydrophobicContact CG-CG 4.05Å
112	N	86.1	Confident	85.7	Confident	74 Å²	74	67.6 Å²	67.6	40%	0.396	33%	0.334	S	S	.	.	H	α-helix	trans	-64.8	-30.4	-179	-66.3	-1.2	0	0	0	111.4	P108 I110 R116	P108-N112 WeakPolarHBondContact O-CB 3.45Å; P108-N112 PolarHBondContact O-N 3.22Å; P108-N112 PolarHBondContact O-OD1 2.97Å; I110-N112 PolarHBondContact O-N 2.79Å; N112-R116 VanDerWaalsContact O-CG 3.31Å; N112-R116 WeakPolarHBondContact O-CG 3.44Å; N112-R116 PolarHBondContact O-N 2.9Å; N112-R116 VanDerWaalsContact O-N 3.14Å
113	Q	87.9	Confident	85.7	Confident	64 Å²	64	72.5 Å²	72.5	30%	0.299	36%	0.356	S	S	.	.	H	α-helix	trans	-66.5	-47.2	171.3	177.6	173.9	-7	0	0	111.9	A109 I110 R111 I115 R116 E117 Q217	A109-Q113 PolarHBondContact O-N 3.28Å; A109-Q113 VanDerWaalsContact O-N 3.1Å; I110-Q113 WeakPolarHBondContact O-CA 3.28Å; I110-Q113 WeakPolarHBondContact O-CB 3.05Å; I110-Q113 PolarHBondContact O-N 3.07Å; I110-Q113 VanDerWaalsContact O-N 3.12Å; R111-Q113 PolarHBondContact O-N 2.82Å; Q113-I115 PolarHBondContact O-N 2.76Å; Q113-R116 PolarHBondContact O-N 3.37Å; Q113-E117 HydrophobicContact CG-CG 4.44Å; Q113-E117 VanDerWaalsContact CG-OE1 3.27Å; Q113-E117 WeakPolarHBondContact CG-OE1 3.3Å; Q113-E117 PolarHBondContact NE2-OE1 2.96Å; Q113-E117 WeakPolarHBondContact O-CG 3.45Å; Q113-E117 PolarHBondContact O-N 3.13Å; Q113-Q217 HydrophobicContact CG-CG 4.32Å
114	I	87	Confident	85.9	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.7	-48.3	177	-68.3	170.4	0	0	0	110.7	I106 I110 R111 R116 E117 L118 I142 Q217 L218	I106-I114 HydrophobicContact CD1-CD1 3.52Å; I110-I114 HydrophobicContact CG2-CD1 4.15Å; I110-I114 WeakPolarHBondContact O-CG1 3.09Å; I110-I114 PolarHBondContact O-N 2.86Å; R111-I114 PolarHBondContact O-N 2.97Å; R111-I114 VanDerWaalsContact O-N 3.14Å; I114-R116 VanDerWaalsContact C-N 3.29Å; I114-R116 PolarHBondContact O-N 2.83Å; I114-E117 PolarHBondContact O-N 3.45Å; I114-E117 VanDerWaalsContact O-N 3.13Å; I114-L118 HydrophobicContact CG2-CD1 3.88Å; I114-L118 HydrophobicContact CG2-CG 4.22Å; I114-L118 WeakPolarHBondContact O-CG 3.43Å; I114-L118 PolarHBondContact O-N 3.24Å; I114-I142 HydrophobicContact CB-CD1 4.32Å; I114-I142 HydrophobicContact CD1-CD1 4.27Å; I114-I142 HydrophobicContact CG2-CD1 3.71Å; I114-Q217 HydrophobicContact CD1-CB 4.33Å; I114-Q217 HydrophobicContact CG1-CB 3.8Å; I114-L218 HydrophobicContact CD1-CB 4.41Å; I114-L218 HydrophobicContact CD1-CD1 4.24Å; I114-L218 HydrophobicContact CG1-CB 4.47Å; I114-L218 HydrophobicContact CG2-CB 4.22Å; I114-L218 HydrophobicContact CG2-CD1 4.2Å
115	I	86.5	Confident	86.5	Confident	35 Å²	35	67.3 Å²	67.3	18%	0.179	33%	0.333	C	S	.	.	H	α-helix	trans	-59.1	-41.2	178.9	-64.7	-64.4	0	0	0	111.1	R111 Q113 L118 Q119 I142	R111-I115 WeakPolarHBondContact O-CG1 3.38Å; R111-I115 PolarHBondContact O-N 2.75Å; Q113-I115 PolarHBondContact O-N 2.76Å; I115-L118 PolarHBondContact O-N 3.25Å; I115-Q119 PolarHBondContact O-N 2.92Å; I115-I142 HydrophobicContact CD1-CG2 4.11Å
116	R	85.9	Confident	87.2	Confident	145 Å²	145	59.2 Å²	59.2	55%	0.547	30%	0.295	S	S	.	.	H	α-helix	trans	-64.3	-43.4	174.1	-75.9	-173.8	-57.5	-117.3	0.5	112.7	N112 Q113 I114 L118 Q119	N112-R116 VanDerWaalsContact O-CG 3.31Å; N112-R116 WeakPolarHBondContact O-CG 3.44Å; N112-R116 PolarHBondContact O-N 2.9Å; N112-R116 VanDerWaalsContact O-N 3.14Å; Q113-R116 PolarHBondContact O-N 3.37Å; I114-R116 VanDerWaalsContact C-N 3.29Å; I114-R116 PolarHBondContact O-N 2.83Å; R116-L118 VanDerWaalsContact C-N 3.3Å; R116-L118 PolarHBondContact O-N 2.91Å; R116-Q119 VanDerWaalsContact O-CB 3.29Å; R116-Q119 WeakPolarHBondContact O-CB 3.36Å; R116-Q119 PolarHBondContact O-N 3.27Å; R116-Q119 VanDerWaalsContact O-N 3.12Å
117	E	87.4	Confident	88.1	Confident	49 Å²	49	58 Å²	58	23%	0.229	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-38.5	177.5	-72.5	173.2	-168	0	0	111.1	Q113 I114 Q119 V120 V214 S215 G216	Q113-E117 HydrophobicContact CG-CG 4.44Å; Q113-E117 VanDerWaalsContact CG-OE1 3.27Å; Q113-E117 WeakPolarHBondContact CG-OE1 3.3Å; Q113-E117 PolarHBondContact NE2-OE1 2.96Å; Q113-E117 WeakPolarHBondContact O-CG 3.45Å; Q113-E117 PolarHBondContact O-N 3.13Å; I114-E117 PolarHBondContact O-N 3.45Å; I114-E117 VanDerWaalsContact O-N 3.13Å; E117-Q119 PolarHBondContact O-N 3.4Å; E117-V120 WeakPolarHBondContact O-CB 3.06Å; E117-V120 WeakPolarHBondContact O-CG2 3.36Å; E117-V120 PolarHBondContact O-N 3.45Å; E117-V214 VanDerWaalsContact O-CG1 3.25Å; E117-V214 WeakPolarHBondContact O-CG1 3.17Å; E117-S215 WeakPolarHBondContact OE2-CA 3.41Å; E117-S215 WeakPolarHBondContact OE2-CB 3.49Å; E117-S215 PolarHBondContact OE2-OG 2.97Å; E117-G216 PolarHBondContact OE2-N 3.31Å
118	L	88	Confident	88.6	Confident	7 Å²	7	51.6 Å²	51.6	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-64.4	-19.4	174.8	-69.8	173	0	0	0	113.4	I114 I115 R116 V120 L121 A135 I142 I144	I114-L118 HydrophobicContact CG2-CD1 3.88Å; I114-L118 HydrophobicContact CG2-CG 4.22Å; I114-L118 WeakPolarHBondContact O-CG 3.43Å; I114-L118 PolarHBondContact O-N 3.24Å; I115-L118 PolarHBondContact O-N 3.25Å; R116-L118 VanDerWaalsContact C-N 3.3Å; R116-L118 PolarHBondContact O-N 2.91Å; L118-V120 PolarHBondContact O-N 3.23Å; L118-L121 HydrophobicContact CB-CD1 4.42Å; L118-L121 HydrophobicContact CD2-CD1 3.69Å; L118-L121 WeakPolarHBondContact O-CB 3.44Å; L118-L121 WeakPolarHBondContact O-CG 3.27Å; L118-L121 PolarHBondContact O-N 3.35Å; L118-A135 HydrophobicContact CB-CB 4.29Å; L118-A135 HydrophobicContact CD1-CB 3.98Å; L118-I142 HydrophobicContact CD1-CG2 4.09Å; L118-I144 HydrophobicContact CD1-CD1 4.14Å; L118-I144 HydrophobicContact CD1-CG1 4.18Å; L118-I144 HydrophobicContact CD2-CD1 4.2Å
119	Q	83.2	Confident	89.2	Confident	114 Å²	114	48 Å²	48	53%	0.533	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-62.1	-26	176.4	-68.6	175.3	-30.7	0	0	112.7	I115 R116 E117 L121 H122	I115-Q119 PolarHBondContact O-N 2.92Å; R116-Q119 VanDerWaalsContact O-CB 3.29Å; R116-Q119 WeakPolarHBondContact O-CB 3.36Å; R116-Q119 PolarHBondContact O-N 3.27Å; R116-Q119 VanDerWaalsContact O-N 3.12Å; E117-Q119 PolarHBondContact O-N 3.4Å; Q119-L121 PolarHBondContact O-N 3.44Å; Q119-L121 VanDerWaalsContact O-N 3.14Å; Q119-H122 WeakPolarHBondContact O-CB 3.49Å; Q119-H122 PolarHBondContact O-N 3.39Å
120	V	86.4	Confident	89.7	Confident	55 Å²	55	45 Å²	45	33%	0.333	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-58	-26.9	174.4	176.9	0	0	0	0	111.6	E117 L118 H122 E123 I189 V214	E117-V120 WeakPolarHBondContact O-CB 3.06Å; E117-V120 WeakPolarHBondContact O-CG2 3.36Å; E117-V120 PolarHBondContact O-N 3.45Å; L118-V120 PolarHBondContact O-N 3.23Å; V120-H122 PolarHBondContact O-N 3.4Å; V120-E123 PolarHBondContact O-N 3.13Å; V120-I189 HydrophobicContact CG1-CD1 4Å; V120-V214 HydrophobicContact CB-CG1 3.81Å; V120-V214 HydrophobicContact CG1-CG1 4.21Å
121	L	88.8	Confident	90.2	Very high	19 Å²	19	42.6 Å²	42.6	10%	0.099	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-62.5	-24.8	174.6	-65.1	171.6	0	0	0	112.9	L118 Q119 E123 C124 F132 F212 V214	L118-L121 HydrophobicContact CB-CD1 4.42Å; L118-L121 HydrophobicContact CD2-CD1 3.69Å; L118-L121 WeakPolarHBondContact O-CB 3.44Å; L118-L121 WeakPolarHBondContact O-CG 3.27Å; L118-L121 PolarHBondContact O-N 3.35Å; Q119-L121 PolarHBondContact O-N 3.44Å; Q119-L121 VanDerWaalsContact O-N 3.14Å; L121-E123 PolarHBondContact O-N 3.26Å; L121-C124 PolarHBondContact O-N 3.41Å; L121-F132 HydrophobicContact CB-CB 4.01Å; L121-F132 HydrophobicContact CB-CD1 3.55Å; L121-F132 HydrophobicContact CB-CD2 3.73Å; L121-F132 HydrophobicContact CB-CE1 3.78Å; L121-F132 HydrophobicContact CB-CE2 3.95Å; L121-F132 HydrophobicContact CB-CG 3.5Å; L121-F132 VanDerWaalsContact CB-CG 3.5Å; L121-F132 HydrophobicContact CB-CZ 3.96Å; L121-F132 HydrophobicContact CD1-CD2 3.76Å; L121-F132 HydrophobicContact CD1-CE2 3.56Å; L121-F132 HydrophobicContact CD1-CG 4.42Å; L121-F132 HydrophobicContact CD1-CZ 4.08Å; L121-F132 HydrophobicContact CG-CD2 4.36Å; L121-F132 HydrophobicContact CG-CE2 4.41Å; L121-F212 HydrophobicContact CD2-CD2 4.38Å; L121-F212 HydrophobicContact CD2-CE1 4.02Å; L121-F212 HydrophobicContact CD2-CE2 3.43Å; L121-F212 VanDerWaalsContact CD2-CE2 3.43Å; L121-F212 HydrophobicContact CD2-CZ 3.21Å; L121-V214 HydrophobicContact CD2-CB 4.41Å; L121-V214 HydrophobicContact CD2-CG2 3.49Å; L121-V214 VanDerWaalsContact CD2-CG2 3.49Å; L121-V214 HydrophobicContact CG-CG2 4.08Å
122	H	87.7	Confident	90.7	Very high	79 Å²	79	40 Å²	40	37%	0.366	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-63.6	-27.9	174	-77.5	-77.7	0	0	0	112.6	K60 Q119 V120 N125 F132 Y133	K60-H122 WeakPolarHBondContact CE-ND1 3.49Å; K60-H122 PolarHBondContact NZ-O 3.3Å; Q119-H122 WeakPolarHBondContact O-CB 3.49Å; Q119-H122 PolarHBondContact O-N 3.39Å; V120-H122 PolarHBondContact O-N 3.4Å; H122-N125 PolarHBondContact O-ND2 2.89Å; H122-F132 AromaticContact CD2-CE1 3.54Å; H122-F132 AromaticContact CE1-CE1 3.78Å; H122-F132 AromaticContact CG-CD1 3.88Å; H122-F132 AromaticContact CG-CE1 3.84Å; H122-F132 AromaticContact ND1-CD1 3.88Å; H122-F132 AromaticContact ND1-CE1 3.99Å; H122-F132 AromaticContact NE2-CE1 3.49Å; H122-F132 WeakPolarHBondContact NE2-CE1 3.47Å; H122-Y133 PolarHBondContact CE1-O 3.47Å
123	E	88.1	Confident	91.1	Very high	110 Å²	110	37.2 Å²	37.2	51%	0.514	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-14.8	-178.9	-56.2	-173	-170.4	0	0	112.7	V120 L121 N125 Y182 H187	V120-E123 PolarHBondContact O-N 3.13Å; L121-E123 PolarHBondContact O-N 3.26Å; E123-N125 VanDerWaalsContact C-ND2 3.34Å; E123-N125 PolarHBondContact O-N 2.96Å; E123-N125 PolarHBondContact O-ND2 3.46Å; E123-Y182 PolarHBondContact O-OH 2.86Å; E123-H187 PolarHBondContact O-CE1 3.43Å; E123-H187 PolarHBondContact O-NE2 3.42Å
124	C	91.2	Very high	91.5	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.014	16%	0.164	C	C	.	.			trans	-79.6	84.5	178	-65.8	0	0	0	0	110.8	L121 I129 Y182 F212	L121-C124 PolarHBondContact O-N 3.41Å; C124-I129 HydrophobicContact CB-CG2 4.35Å; C124-Y182 HydrophobicContact CB-CE1 4.49Å; C124-F212 HydrophobicContact CB-CZ 4.05Å
125	N	92.4	Very high	91.8	Very high	25 Å²	25	35.6 Å²	35.6	13%	0.134	17%	0.174	C	C	.	.			trans	-121.3	105.5	179.7	-53.8	-74.4	0	0	0	109.3	L53 L57 H122 E123 Y182	L53-N125 HydrophobicContact CD1-CB 4.29Å; L57-N125 HydrophobicContact CD2-CB 4.45Å; L57-N125 WeakPolarHBondContact CD2-OD1 3.3Å; H122-N125 PolarHBondContact O-ND2 2.89Å; E123-N125 VanDerWaalsContact C-ND2 3.34Å; E123-N125 PolarHBondContact O-N 2.96Å; E123-N125 PolarHBondContact O-ND2 3.46Å; N125-Y182 PolarHBondContact N-OH 2.85Å; N125-Y182 PolarHBondContact O-OH 2.74Å; N125-Y182 VanDerWaalsContact O-OH 3.14Å
126	S	95	Very high	92.1	Very high	6 Å²	6	35.1 Å²	35.1	4%	0.042	17%	0.171	C	C	.	.			trans	-153	147.1	-177.4	167.1	0	0	0	0	109	Y128 I129	S126-Y128 PolarHBondContact O-N 3.24Å; S126-Y128 PolarHBondContact OG-N 2.86Å; S126-I129 PolarHBondContact O-N 2.81Å; S126-I129 VanDerWaalsContact O-O 3.1Å
127	P	96.3	Very high	92.4	Very high	11 Å²	11	31.7 Å²	31.7	7%	0.071	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-11.3	175.8	31	-40.5	0	0	0	113.6	L45 Q49 K208	L45-P127 HydrophobicContact CD2-CG 3.51Å; Q49-P127 HydrophobicContact CB-CB 4.25Å; Q49-P127 HydrophobicContact CB-CG 4.5Å; Q49-P127 HydrophobicContact CG-CB 4.09Å; Q49-P127 HydrophobicContact CG-CG 4.45Å; P127-K208 VanDerWaalsContact O-CE 3.3Å; P127-K208 WeakPolarHBondContact O-CE 3.28Å; P127-K208 WeakPolarHBondContact O-CG 3.35Å
128	Y	97.8	Very high	92.6	Very high	25 Å²	25	30.9 Å²	30.9	10%	0.098	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	5.2	179.9	-48.1	-69.7	0	0	0	113.5	Q49 S126 A175 R178 K208 L209	Q49-Y128 PolarHBondContact NE2-OH 3.19Å; S126-Y128 PolarHBondContact O-N 3.24Å; S126-Y128 PolarHBondContact OG-N 2.86Å; Y128-A175 HydrophobicContact CD1-CB 3.83Å; Y128-A175 HydrophobicContact CE1-CB 4.31Å; Y128-R178 HydrophobicContact CD1-CB 4.33Å; Y128-R178 HydrophobicContact CD2-CB 3.42Å; Y128-R178 VanDerWaalsContact CD2-CB 3.42Å; 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 3.28Å; Y128-R178 WeakPolarHBondContact OH-CD 3.47Å; Y128-R178 PolarHBondContact OH-NH1 3.48Å; Y128-K208 CarbonylContact O-C 3.54Å; Y128-K208 WeakPolarHBondContact O-CA 3.42Å; Y128-L209 PolarHBondContact O-N 3.41Å
129	I	97.7	Very high	92.6	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-122.9	131.7	177.9	-57.2	-61.3	0	0	0	108.5	C124 S126 G131 Y182 L183 L209 F212	C124-I129 HydrophobicContact CB-CG2 4.35Å; S126-I129 PolarHBondContact O-N 2.81Å; S126-I129 VanDerWaalsContact O-O 3.1Å; I129-G131 PolarHBondContact O-N 2.89Å; I129-Y182 HydrophobicContact CD1-CD1 4.48Å; I129-Y182 HydrophobicContact CG1-CD1 3.74Å; I129-Y182 HydrophobicContact CG1-CE1 4.12Å; I129-L183 HydrophobicContact CD1-CD1 3.94Å; I129-L183 HydrophobicContact CD1-CD2 4Å; I129-L183 HydrophobicContact CD1-CG 3.79Å; I129-L183 HydrophobicContact CG1-CD2 4.46Å; I129-L209 HydrophobicContact CD1-CB 4.11Å; I129-L209 HydrophobicContact CD1-CD1 4.49Å; I129-F212 HydrophobicContact CG2-CD1 4.46Å; I129-F212 HydrophobicContact CG2-CE1 3.47Å; I129-F212 VanDerWaalsContact CG2-CE1 3.47Å; I129-F212 HydrophobicContact CG2-CZ 3.81Å
130	V	97.8	Very high	92.7	Very high	8 Å²	8	32.5 Å²	32.5	5%	0.048	17%	0.174	C	C	.	.			trans	-60.7	124.5	179.1	173.5	0	0	0	0	109.5	M146 E147 M149 L200 K208 L209 C210	V130-M146 HydrophobicContact CG1-CB 3.95Å; V130-M146 HydrophobicContact CG1-SD 4.42Å; V130-E147 WeakPolarHBondContact CA-OE1 3.35Å; V130-E147 HydrophobicContact CG1-CG 3.68Å; V130-M149 HydrophobicContact CG2-CG 4.35Å; V130-L200 HydrophobicContact CG2-CB 4.31Å; 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 3.43Å; V130-L209 PolarHBondContact N-O 3.3Å; V130-C210 HydrophobicContact CB-CB 4.14Å; V130-C210 HydrophobicContact CG2-CB 3.87Å
131	G	96.4	Very high	92.9	Very high	5 Å²	5	32.9 Å²	32.9	5%	0.052	17%	0.173	C	C	.	.			trans	-59	133.1	-178.8	0	0	0	0	0	112.3	F56 I129 M146 E147	F56-G131 VanDerWaalsContact CZ-C 3.46Å; I129-G131 PolarHBondContact O-N 2.89Å; G131-M146 CarbonylContact O-C 3.54Å; G131-M146 VanDerWaalsContact O-CA 3.28Å; G131-M146 WeakPolarHBondContact O-CA 3.21Å; G131-E147 PolarHBondContact N-OE1 3.07Å; G131-E147 PolarHBondContact O-N 2.69Å
132	F	96.3	Very high	93	Very high	6 Å²	6	32 Å²	32	3%	0.026	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125	-178.7	178.7	-103.5	0	0	0	111.1	K60 L121 H122 G134 A135 I144	K60-F132 WeakPolarHBondContact CD-O 3.41Å; K60-F132 WeakPolarHBondContact CE-O 3.3Å; K60-F132 PolarHBondContact NZ-O 3.23Å; L121-F132 HydrophobicContact CB-CB 4.01Å; L121-F132 HydrophobicContact CB-CD1 3.55Å; L121-F132 HydrophobicContact CB-CD2 3.73Å; L121-F132 HydrophobicContact CB-CE1 3.78Å; L121-F132 HydrophobicContact CB-CE2 3.95Å; L121-F132 HydrophobicContact CB-CG 3.5Å; L121-F132 VanDerWaalsContact CB-CG 3.5Å; L121-F132 HydrophobicContact CB-CZ 3.96Å; L121-F132 HydrophobicContact CD1-CD2 3.76Å; L121-F132 HydrophobicContact CD1-CE2 3.56Å; L121-F132 HydrophobicContact CD1-CG 4.42Å; L121-F132 HydrophobicContact CD1-CZ 4.08Å; L121-F132 HydrophobicContact CG-CD2 4.36Å; L121-F132 HydrophobicContact CG-CE2 4.41Å; H122-F132 AromaticContact CD2-CE1 3.54Å; H122-F132 AromaticContact CE1-CE1 3.78Å; H122-F132 AromaticContact CG-CD1 3.88Å; H122-F132 AromaticContact CG-CE1 3.84Å; H122-F132 AromaticContact ND1-CD1 3.88Å; H122-F132 AromaticContact ND1-CE1 3.99Å; H122-F132 AromaticContact NE2-CE1 3.49Å; H122-F132 WeakPolarHBondContact NE2-CE1 3.47Å; F132-G134 VanDerWaalsContact CE1-CA 3.5Å; F132-G134 VanDerWaalsContact CZ-CA 3.49Å; F132-A135 HydrophobicContact CE2-CB 4.13Å; F132-A135 HydrophobicContact CZ-CB 3.76Å; F132-I144 HydrophobicContact CD2-CG2 4.22Å; F132-I144 HydrophobicContact CE2-CG2 3.86Å
133	Y	96.1	Very high	93.4	Very high	14 Å²	14	28.3 Å²	28.3	6%	0.055	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-45.7	174.5	-72.9	-67	0	0	0	111.9	F56 K60 V63 L95 M97 H122 C145	F56-Y133 HydrophobicContact CE2-CD1 4.43Å; F56-Y133 AromaticContact CE2-CE1 3.78Å; F56-Y133 HydrophobicContact CE2-CE1 3.78Å; F56-Y133 AromaticContact CE2-CE2 3.95Å; F56-Y133 HydrophobicContact CE2-CE2 3.95Å; F56-Y133 AromaticContact CE2-CZ 3.51Å; F56-Y133 HydrophobicContact CZ-CD1 4.44Å; F56-Y133 HydrophobicContact CZ-CE1 4.18Å; K60-Y133 HydrophobicContact CB-CD1 4.06Å; K60-Y133 HydrophobicContact CB-CE1 4.06Å; K60-Y133 HydrophobicContact CG-CD1 4.14Å; V63-Y133 HydrophobicContact CB-CD1 4.45Å; V63-Y133 HydrophobicContact CG2-CD1 3.82Å; V63-Y133 HydrophobicContact CG2-CE1 4.09Å; L95-Y133 HydrophobicContact CD1-CE1 3.97Å; M97-Y133 HydrophobicContact CE-CD1 4.1Å; M97-Y133 HydrophobicContact CE-CD2 3.83Å; M97-Y133 HydrophobicContact CE-CE1 4.39Å; M97-Y133 HydrophobicContact CE-CE2 4.11Å; M97-Y133 HydrophobicContact CE-CG 3.82Å; M97-Y133 HydrophobicContact CG-CD2 3.75Å; M97-Y133 HydrophobicContact CG-CE2 3.79Å; M97-Y133 HydrophobicContact SD-CD2 3.65Å; M97-Y133 HydrophobicContact SD-CE2 4.22Å; M97-Y133 HydrophobicContact SD-CG 4.01Å; H122-Y133 PolarHBondContact CE1-O 3.47Å; Y133-C145 PolarHBondContact N-O 2.81Å
134	G	94.7	Very high	93.7	Very high	6 Å²	6	23.5 Å²	23.5	6%	0.062	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.7	169.8	-178.8	0	0	0	0	0	113.2	F132 C145	F132-G134 VanDerWaalsContact CE1-CA 3.5Å; F132-G134 VanDerWaalsContact CZ-CA 3.49Å; G134-C145 PolarHBondContact N-O 3.03Å; G134-C145 PolarHBondContact O-N 2.98Å
135	A	94	Very high	93.9	Very high	25 Å²	25	23.4 Å²	23.4	21%	0.207	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	143.6	173.4	0	0	0	0	0	110.7	L118 F132 S143 I144	L118-A135 HydrophobicContact CB-CB 4.29Å; L118-A135 HydrophobicContact CD1-CB 3.98Å; F132-A135 HydrophobicContact CE2-CB 4.13Å; F132-A135 HydrophobicContact CZ-CB 3.76Å; A135-S143 CarbonylContact C-O 3.59Å; A135-S143 WeakPolarHBondContact CA-O 3.38Å; A135-S143 WeakPolarHBondContact CB-O 3.4Å; A135-I144 HydrophobicContact CB-CG1 4.17Å
136	F	93.2	Very high	94.1	Very high	25 Å²	25	23.3 Å²	23.3	11%	0.11	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	170.2	179	65.5	-85.5	0	0	0	110.4	L66 D68 F71 S143	L66-F136 HydrophobicContact CB-CD1 3.69Å; L66-F136 HydrophobicContact CB-CE1 3.87Å; D68-F136 HydrophobicContact CB-CE2 4.08Å; F71-F136 HydrophobicContact CD2-CZ 4.26Å; F71-F136 AromaticContact CE2-CE1 3.69Å; F71-F136 HydrophobicContact CE2-CE1 3.69Å; F71-F136 AromaticContact CE2-CZ 3.75Å; F71-F136 HydrophobicContact CE2-CZ 3.75Å; F71-F136 HydrophobicContact CZ-CE1 4.3Å; F136-S143 PolarHBondContact N-O 2.85Å; F136-S143 PolarHBondContact O-N 2.86Å
137	Y	91.8	Very high	94.2	Very high	73 Å²	73	23.5 Å²	23.5	29%	0.286	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.3	175.4	175.7	-89.6	0	0	0	110.1	R111 G140 E141 I142	R111-Y137 VanDerWaalsContact CD-CD1 3.44Å; R111-Y137 VanDerWaalsContact CD-CD2 3.4Å; R111-Y137 HydrophobicContact CG-CD2 3.88Å; R111-Y137 HydrophobicContact CG-CE2 4.23Å; R111-Y137 HydrophobicContact CG-CG 4.05Å; Y137-G140 VanDerWaalsContact OH-CA 3.25Å; Y137-G140 WeakPolarHBondContact OH-CA 3.29Å; Y137-G140 PolarHBondContact OH-N 3.06Å; Y137-E141 VanDerWaalsContact CA-O 3.31Å; Y137-E141 WeakPolarHBondContact CA-O 3.16Å; Y137-E141 WeakPolarHBondContact CD2-O 3.35Å; Y137-I142 HydrophobicContact CD2-CG1 3.91Å
138	S	91.4	Very high	94.3	Very high	32 Å²	32	24.8 Å²	24.8	22%	0.224	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	139.9	172.3	-157.7	0	0	0	0	109.1	G140 E141	S138-G140 VanDerWaalsContact C-N 3.31Å; S138-G140 PolarHBondContact O-N 2.8Å; S138-G140 VanDerWaalsContact O-N 3.07Å; S138-E141 PolarHBondContact N-O 3.28Å; S138-E141 PolarHBondContact O-N 2.9Å
139	D	88	Confident	94.3	Very high	137 Å²	137	24.1 Å²	24.1	73%	0.733	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	40.3	165.8	-52.4	-57.5	0	0	0	116.6
140	G	86.3	Confident	94.2	Very high	17 Å²	17	27 Å²	27	18%	0.175	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.3	-4.2	179.6	0	0	0	0	0	114.6	L104 Y137 S138	L104-G140 PolarHBondContact N-O 2.85Å; Y137-G140 VanDerWaalsContact OH-CA 3.25Å; Y137-G140 WeakPolarHBondContact OH-CA 3.29Å; Y137-G140 PolarHBondContact OH-N 3.06Å; S138-G140 VanDerWaalsContact C-N 3.31Å; S138-G140 PolarHBondContact O-N 2.8Å; S138-G140 VanDerWaalsContact O-N 3.07Å
141	E	90.4	Very high	94.2	Very high	64 Å²	64	26.7 Å²	26.7	30%	0.299	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.6	-170.9	-55.7	-168.9	148.8	0	0	112.2	L101 I102 H103 Y137 S138	L101-E141 WeakPolarHBondContact CD2-OE2 3.44Å; I102-E141 WeakPolarHBondContact O-CA 3.43Å; H103-E141 IonicContact ND1-OE1 3.38Å; Y137-E141 VanDerWaalsContact CA-O 3.31Å; Y137-E141 WeakPolarHBondContact CA-O 3.16Å; Y137-E141 WeakPolarHBondContact CD2-O 3.35Å; S138-E141 PolarHBondContact N-O 3.28Å; S138-E141 PolarHBondContact O-N 2.9Å
142	I	91.3	Very high	94.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	123.1	166.9	-61.5	180	0	0	0	107.7	I102 L104 I114 I115 L118 Y137 I144 L218	I102-I142 HydrophobicContact CB-CB 4.42Å; I102-I142 PolarHBondContact N-O 2.92Å; I102-I142 PolarHBondContact O-N 3.38Å; L104-I142 HydrophobicContact CD1-CD1 4.01Å; I114-I142 HydrophobicContact CB-CD1 4.32Å; I114-I142 HydrophobicContact CD1-CD1 4.27Å; I114-I142 HydrophobicContact CG2-CD1 3.71Å; I115-I142 HydrophobicContact CD1-CG2 4.11Å; L118-I142 HydrophobicContact CD1-CG2 4.09Å; Y137-I142 HydrophobicContact CD2-CG1 3.91Å; I142-I144 HydrophobicContact CG2-CG1 4.31Å; I142-L218 HydrophobicContact CD1-CD1 4.48Å
143	S	94.5	Very high	94.3	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.007	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.8	174.3	-71.6	0	0	0	0	110.7	R99 K100 A135 F136	R99-S143 PolarHBondContact NE-OG 3.04Å; R99-S143 VanDerWaalsContact NE-OG 3.12Å; R99-S143 PolarHBondContact NH2-OG 2.87Å; K100-S143 CarbonylContact O-C 3.59Å; K100-S143 WeakPolarHBondContact O-CA 3.12Å; A135-S143 CarbonylContact C-O 3.59Å; A135-S143 WeakPolarHBondContact CA-O 3.38Å; A135-S143 WeakPolarHBondContact CB-O 3.4Å; F136-S143 PolarHBondContact N-O 2.85Å; F136-S143 PolarHBondContact O-N 2.86Å
144	I	94.7	Very high	94.4	Very high	10 Å²	10	26.8 Å²	26.8	5%	0.051	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.2	175.1	-64.5	168.6	0	0	0	108.2	R99 K100 I102 L118 F132 A135 I142 M146	R99-I144 WeakPolarHBondContact CA-O 3.48Å; K100-I144 HydrophobicContact CB-CB 4.37Å; K100-I144 PolarHBondContact N-O 2.96Å; K100-I144 PolarHBondContact O-N 2.87Å; I102-I144 HydrophobicContact CD1-CD1 3.99Å; L118-I144 HydrophobicContact CD1-CD1 4.14Å; L118-I144 HydrophobicContact CD1-CG1 4.18Å; L118-I144 HydrophobicContact CD2-CD1 4.2Å; F132-I144 HydrophobicContact CD2-CG2 4.22Å; F132-I144 HydrophobicContact CE2-CG2 3.86Å; A135-I144 HydrophobicContact CB-CG1 4.17Å; I142-I144 HydrophobicContact CG2-CG1 4.31Å; I144-M146 HydrophobicContact CG2-CE 4.47Å; I144-M146 HydrophobicContact CG2-CG 3.84Å; I144-M146 HydrophobicContact CG2-SD 4.02Å
145	C	97	Very high	94.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.9	-177.7	-60.7	0	0	0	0	110.7	L66 F71 M97 Y133 G134	L66-C145 HydrophobicContact CD1-CB 3.76Å; F71-C145 VanDerWaalsContact CZ-SG 3.58Å; M97-C145 HydrophobicContact SD-CB 4.03Å; Y133-C145 PolarHBondContact N-O 2.81Å; G134-C145 PolarHBondContact N-O 3.03Å; G134-C145 PolarHBondContact O-N 2.98Å
146	M	96.7	Very high	94.6	Very high	22 Å²	22	30.1 Å²	30.1	11%	0.108	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	164.2	-172.1	-60.1	178.3	-67	0	0	111.1	M97 A98 K100 V130 G131 I144	M97-M146 WeakPolarHBondContact CA-O 3.17Å; A98-M146 PolarHBondContact N-O 3.39Å; A98-M146 PolarHBondContact O-N 2.86Å; K100-M146 HydrophobicContact CB-CE 4.32Å; V130-M146 HydrophobicContact CG1-CB 3.95Å; V130-M146 HydrophobicContact CG1-SD 4.42Å; G131-M146 CarbonylContact O-C 3.54Å; G131-M146 VanDerWaalsContact O-CA 3.28Å; G131-M146 WeakPolarHBondContact O-CA 3.21Å; I144-M146 HydrophobicContact CG2-CE 4.47Å; I144-M146 HydrophobicContact CG2-CG 3.84Å; I144-M146 HydrophobicContact CG2-SD 4.02Å
147	E	96.8	Very high	94.9	Very high	11 Å²	11	28.9 Å²	28.9	5%	0.051	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	141.2	169.6	73.4	176.7	140.6	0	0	110.7	F56 V130 G131 M149 K208	F56-E147 HydrophobicContact CD2-CB 4.38Å; F56-E147 HydrophobicContact CE2-CB 3.92Å; V130-E147 WeakPolarHBondContact CA-OE1 3.35Å; V130-E147 HydrophobicContact CG1-CG 3.68Å; G131-E147 PolarHBondContact N-OE1 3.07Å; G131-E147 PolarHBondContact O-N 2.69Å; E147-M149 HydrophobicContact CG-CG 4.48Å; E147-M149 HydrophobicContact CG-SD 4.12Å; E147-K208 VanDerWaalsContact CD-NZ 3.32Å; E147-K208 WeakPolarHBondContact OE1-CD 3.25Å; E147-K208 WeakPolarHBondContact OE1-CE 3.02Å; E147-K208 IonicContact OE1-NZ 3.13Å; E147-K208 PolarHBondContact OE1-NZ 2.82Å; E147-K208 IonicContact OE2-NZ 2.71Å; E147-K208 PolarHBondContact OE2-NZ 3.21Å; E147-K208 VanDerWaalsContact OE2-NZ 3.07Å
148	H	97.6	Very high	95.1	Very high	37 Å²	37	26.1 Å²	26.1	17%	0.171	15%	0.145	C	C	.	.			trans	-83.9	121.2	177	168.9	-89.6	0	0	0	110.6	K87 V96 D150	K87-H148 WeakPolarHBondContact CD-NE2 3.2Å; K87-H148 WeakPolarHBondContact CE-NE2 3.37Å; K87-H148 PolarHBondContact NZ-NE2 2.86Å; V96-H148 HydrophobicContact CG1-CB 4.23Å; H148-D150 VanDerWaalsContact CE1-CA 3.43Å; H148-D150 WeakPolarHBondContact CE1-CA 3.43Å; H148-D150 VanDerWaalsContact CE1-CB 3.48Å; H148-D150 WeakPolarHBondContact CE1-CB 3.43Å
149	M	97.8	Very high	95.4	Very high	11 Å²	11	31.5 Å²	31.5	5%	0.054	16%	0.164	C	C	.	.			trans	-99.3	101.3	176.4	-61.1	-64.7	-74.9	0	0	109.1	V130 E147 G151 G152 L200 N202 E206 K208	V130-M149 HydrophobicContact CG2-CG 4.35Å; E147-M149 HydrophobicContact CG-CG 4.48Å; E147-M149 HydrophobicContact CG-SD 4.12Å; M149-G151 VanDerWaalsContact C-N 3.25Å; M149-G151 PolarHBondContact O-N 2.7Å; M149-G152 PolarHBondContact O-N 2.96Å; M149-L200 HydrophobicContact CB-CB 3.8Å; M149-L200 HydrophobicContact CB-CD1 4.1Å; M149-L200 HydrophobicContact CE-CB 4.29Å; M149-L200 HydrophobicContact CG-CB 3.72Å; M149-L200 HydrophobicContact CG-CD1 3.88Å; M149-L200 HydrophobicContact CG-CG 4.47Å; M149-N202 HydrophobicContact CE-CB 3.93Å; M149-N202 HydrophobicContact SD-CB 4.22Å; M149-E206 HydrophobicContact CE-CB 4.42Å; M149-K208 HydrophobicContact CE-CB 4.12Å; M149-K208 HydrophobicContact CE-CD 4Å; M149-K208 HydrophobicContact CE-CG 3.92Å; M149-K208 HydrophobicContact SD-CD 4.2Å
150	D	96.6	Very high	95.8	Very high	63 Å²	63	31.1 Å²	31.1	34%	0.337	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-11.4	-169.3	65.4	-14.2	0	0	0	115.2	H148 N202 S203	H148-D150 VanDerWaalsContact CE1-CA 3.43Å; H148-D150 WeakPolarHBondContact CE1-CA 3.43Å; H148-D150 VanDerWaalsContact CE1-CB 3.48Å; H148-D150 WeakPolarHBondContact CE1-CB 3.43Å; D150-N202 WeakPolarHBondContact OD1-CA 3.47Å; D150-N202 WeakPolarHBondContact OD1-CB 3.45Å; D150-S203 PolarHBondContact OD1-N 3.14Å; D150-S203 PolarHBondContact OD1-OG 3.31Å; D150-S203 VanDerWaalsContact OD2-CB 3.31Å; D150-S203 WeakPolarHBondContact OD2-CB 3.34Å; D150-S203 PolarHBondContact OD2-OG 3.12Å
151	G	97	Very high	96.3	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.01	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-4.6	170.1	0	0	0	0	0	114	M149 V201	M149-G151 VanDerWaalsContact C-N 3.25Å; M149-G151 PolarHBondContact O-N 2.7Å; G151-V201 CarbonylContact C-O 3.57Å; G151-V201 WeakPolarHBondContact CA-O 3.47Å; G151-V201 PolarHBondContact N-O 3.18Å
152	G	96.9	Very high	96.5	Very high	17 Å²	17	38.5 Å²	38.5	18%	0.175	18%	0.184	C	C	.	.			trans	69.9	-156.4	-178.6	0	0	0	0	0	113	M149 L200 V201	M149-G152 PolarHBondContact O-N 2.96Å; G152-L200 WeakPolarHBondContact O-CA 3.45Å; G152-V201 PolarHBondContact N-O 3.47Å; G152-V201 PolarHBondContact O-N 3.14Å
153	S	97.7	Very high	96.8	Very high	10 Å²	10	42.8 Å²	42.8	7%	0.07	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-95.5	156	179.2	52.4	0	0	0	0	112.5	D155 Q156 V157 S197 I199	S153-D155 VanDerWaalsContact CB-OD1 3.25Å; S153-D155 WeakPolarHBondContact CB-OD1 3.22Å; S153-D155 PolarHBondContact O-N 2.87Å; S153-D155 PolarHBondContact OG-OD1 3.07Å; S153-Q156 WeakPolarHBondContact O-CB 3.28Å; S153-Q156 PolarHBondContact O-N 2.91Å; S153-Q156 WeakPolarHBondContact OG-CG 3.2Å; S153-Q156 PolarHBondContact OG-OE1 3.06Å; S153-V157 WeakPolarHBondContact O-CG2 3.42Å; S153-V157 PolarHBondContact O-N 3.24Å; S153-S197 WeakPolarHBondContact CB-O 3.14Å; S153-I199 CarbonylContact C-O 3.55Å; S153-I199 WeakPolarHBondContact CA-O 3.25Å
154	L	98.4	Very high	97	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.7	-22.5	-179.9	-73	-173	0	0	0	114	Q156 V157 L158 I164 V172 P196 I199 V201 L259	L154-Q156 VanDerWaalsContact C-N 3.35Å; L154-V157 HydrophobicContact CD2-CB 4.36Å; L154-V157 HydrophobicContact CD2-CG2 4.39Å; L154-L158 VanDerWaalsContact O-CB 3.25Å; L154-L158 WeakPolarHBondContact O-CB 3.29Å; L154-L158 PolarHBondContact O-N 2.93Å; L154-I164 HydrophobicContact CD2-CD1 4.28Å; 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 4.16Å; L154-P196 WeakPolarHBondContact CB-O 3.31Å; L154-P196 PolarHBondContact N-O 2.84Å; L154-P196 VanDerWaalsContact N-O 3.08Å; L154-I199 HydrophobicContact CB-CB 4.42Å; L154-I199 HydrophobicContact CD1-CB 3.83Å; L154-I199 HydrophobicContact CD1-CD1 4.16Å; L154-I199 HydrophobicContact CD1-CG2 3.47Å; L154-I199 VanDerWaalsContact CD1-CG2 3.47Å; L154-I199 HydrophobicContact CG-CB 4.03Å; L154-I199 HydrophobicContact CG-CG2 3.88Å; L154-I199 PolarHBondContact N-O 3.22Å; L154-V201 HydrophobicContact CD2-CG1 3.66Å; L154-V201 HydrophobicContact CD2-CG2 4.38Å; L154-V201 HydrophobicContact CG-CG1 4.2Å; L154-L259 HydrophobicContact CB-CD2 4.11Å; L154-L259 HydrophobicContact CD1-CD1 3.99Å
155	D	96.3	Very high	97.1	Very high	37 Å²	37	44.7 Å²	44.7	20%	0.198	21%	0.213	C	C	.	.	H	α-helix	trans	-69.7	-33	171.3	79.1	-69.5	0	0	0	112.3	S153 K159 P196 S197	S153-D155 VanDerWaalsContact CB-OD1 3.25Å; S153-D155 WeakPolarHBondContact CB-OD1 3.22Å; S153-D155 PolarHBondContact O-N 2.87Å; S153-D155 PolarHBondContact OG-OD1 3.07Å; D155-K159 WeakPolarHBondContact O-CG 3.28Å; D155-K159 PolarHBondContact O-N 3.26Å; D155-K159 IonicContact OD2-NZ 2.97Å; D155-K159 PolarHBondContact OD2-NZ 3.23Å; D155-K159 VanDerWaalsContact OD2-NZ 3.1Å; D155-P196 HydrophobicContact CB-CB 3.96Å; D155-P196 PolarHBondContact N-O 3.3Å; D155-S197 WeakPolarHBondContact OD1-CA 3.36Å; D155-S197 VanDerWaalsContact OD1-CB 3.28Å; D155-S197 WeakPolarHBondContact OD1-CB 3.36Å
156	Q	96.9	Very high	97.2	Very high	64 Å²	64	46.2 Å²	46.2	30%	0.299	22%	0.22	S	C	.	.	H	α-helix	trans	-71.1	-45.6	173.6	-65.3	170.9	-29.2	0	0	109.7	L77 S153 L154 L158 K159 E160	L77-Q156 PolarHBondContact O-NE2 3.38Å; S153-Q156 WeakPolarHBondContact O-CB 3.28Å; S153-Q156 PolarHBondContact O-N 2.91Å; S153-Q156 WeakPolarHBondContact OG-CG 3.2Å; S153-Q156 PolarHBondContact OG-OE1 3.06Å; L154-Q156 VanDerWaalsContact C-N 3.35Å; Q156-L158 VanDerWaalsContact C-N 3.28Å; Q156-L158 PolarHBondContact O-N 3.3Å; Q156-K159 WeakPolarHBondContact O-CB 3.44Å; Q156-K159 PolarHBondContact O-N 3.14Å; Q156-K159 VanDerWaalsContact O-N 3.14Å; Q156-E160 PolarHBondContact O-N 3.12Å
157	V	98.2	Very high	97.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.5	-39.5	175.1	-179.4	0	0	0	0	111.6	S153 L154 K159 E160 A161 V201 W381 L382 T385 M386	S153-V157 WeakPolarHBondContact O-CG2 3.42Å; S153-V157 PolarHBondContact O-N 3.24Å; L154-V157 HydrophobicContact CD2-CB 4.36Å; L154-V157 HydrophobicContact CD2-CG2 4.39Å; V157-K159 VanDerWaalsContact C-N 3.31Å; V157-K159 PolarHBondContact O-N 3.02Å; V157-E160 PolarHBondContact O-N 3.31Å; V157-A161 VanDerWaalsContact O-CB 3.28Å; V157-A161 WeakPolarHBondContact O-CB 3.48Å; V157-A161 PolarHBondContact O-N 3.14Å; V157-V201 HydrophobicContact CG2-CG2 3.87Å; V157-W381 HydrophobicContact CG1-CH2 3.53Å; V157-W381 HydrophobicContact CG1-CZ2 4.34Å; V157-W381 HydrophobicContact CG1-CZ3 4.08Å; V157-L382 HydrophobicContact CG1-CD1 4.21Å; V157-L382 HydrophobicContact CG2-CD1 3.8Å; V157-T385 HydrophobicContact CG1-CG2 4.19Å; V157-M386 HydrophobicContact CB-SD 4.22Å; V157-M386 HydrophobicContact CG1-SD 4.44Å; V157-M386 HydrophobicContact CG2-CE 4.41Å; V157-M386 HydrophobicContact CG2-CG 4.13Å; V157-M386 HydrophobicContact CG2-SD 3.87Å
158	L	97.9	Very high	97.3	Very high	15 Å²	15	49.8 Å²	49.8	8%	0.079	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-37.6	177.4	-174.5	61.4	0	0	0	112.4	L154 Q156 E160 R162 I164 E258 L259	L154-L158 VanDerWaalsContact O-CB 3.25Å; L154-L158 WeakPolarHBondContact O-CB 3.29Å; L154-L158 PolarHBondContact O-N 2.93Å; Q156-L158 VanDerWaalsContact C-N 3.28Å; Q156-L158 PolarHBondContact O-N 3.3Å; L158-E160 VanDerWaalsContact C-N 3.31Å; L158-E160 PolarHBondContact O-N 3.22Å; L158-R162 WeakPolarHBondContact O-CA 3.38Å; L158-R162 PolarHBondContact O-N 3.49Å; L158-I164 HydrophobicContact CD1-CG1 4.14Å; L158-E258 HydrophobicContact CD2-CG 3.91Å; L158-L259 HydrophobicContact CB-CD2 4.03Å; L158-L259 HydrophobicContact CD1-CD2 4.21Å; L158-L259 HydrophobicContact CD2-CD2 4Å; L158-L259 HydrophobicContact CG-CD2 4.31Å
159	K	96.4	Very high	97.4	Very high	145 Å²	145	48 Å²	48	63%	0.63	23%	0.229	S	C	*	.	H	α-helix	trans	-62.7	-39.9	178	-70.5	163.5	-171.4	156.8	0	111.5	D155 Q156 V157	D155-K159 WeakPolarHBondContact O-CG 3.28Å; D155-K159 PolarHBondContact O-N 3.26Å; D155-K159 IonicContact OD2-NZ 2.97Å; D155-K159 PolarHBondContact OD2-NZ 3.23Å; D155-K159 VanDerWaalsContact OD2-NZ 3.1Å; Q156-K159 WeakPolarHBondContact O-CB 3.44Å; Q156-K159 PolarHBondContact O-N 3.14Å; Q156-K159 VanDerWaalsContact O-N 3.14Å; V157-K159 VanDerWaalsContact C-N 3.31Å; V157-K159 PolarHBondContact O-N 3.02Å
160	E	97.1	Very high	97.5	Very high	129 Å²	129	47.5 Å²	47.5	60%	0.603	23%	0.226	S	C	*	.	H	α-helix	trans	-76.8	-46.3	177.9	-60.6	-53.6	142.4	0	0	112.1	Q156 V157 L158 R162 T385 M386	Q156-E160 PolarHBondContact O-N 3.12Å; V157-E160 PolarHBondContact O-N 3.31Å; L158-E160 VanDerWaalsContact C-N 3.31Å; L158-E160 PolarHBondContact O-N 3.22Å; E160-R162 VanDerWaalsContact C-N 3.29Å; E160-R162 PolarHBondContact O-N 3.41Å; E160-T385 HydrophobicContact CB-CG2 4.14Å; E160-M386 HydrophobicContact CB-SD 4.1Å; E160-M386 HydrophobicContact CG-CE 4.42Å; E160-M386 HydrophobicContact CG-SD 3.84Å
161	A	96.3	Very high	97.6	Very high	30 Å²	30	46.6 Å²	46.6	25%	0.248	22%	0.219	C	C	.	.	H	α-helix	trans	-72.7	-22.4	-178.1	0	0	0	0	0	113.5	V157 R163 W381 T385	V157-A161 VanDerWaalsContact O-CB 3.28Å; V157-A161 WeakPolarHBondContact O-CB 3.48Å; V157-A161 PolarHBondContact O-N 3.14Å; A161-R163 WeakPolarHBondContact CB-O 3.37Å; A161-R163 PolarHBondContact O-N 3.03Å; A161-W381 HydrophobicContact CB-CZ2 4.3Å; A161-T385 HydrophobicContact CB-CG2 3.78Å
162	R	95.1	Very high	97.6	Very high	205 Å²	205	46.6 Å²	46.6	77%	0.774	22%	0.219	S	C	*	.	S	Bend	trans	62.2	-37.8	-165.1	-53.9	-179.1	179	-173.1	-1.2	114.5	L158 E160 G262	L158-R162 WeakPolarHBondContact O-CA 3.38Å; L158-R162 PolarHBondContact O-N 3.49Å; E160-R162 VanDerWaalsContact C-N 3.29Å; E160-R162 PolarHBondContact O-N 3.41Å; R162-G262 WeakPolarHBondContact O-CA 3.44Å
163	R	96.6	Very high	97.7	Very high	91 Å²	91	45.8 Å²	45.8	34%	0.343	21%	0.211	S	C	.	.	S	Bend	trans	-147.3	148.9	172.2	-63.9	-172.8	-60.8	-149.2	-7.9	109.5	A161 A260 I261 I277	A161-R163 WeakPolarHBondContact CB-O 3.37Å; A161-R163 PolarHBondContact O-N 3.03Å; R163-A260 WeakPolarHBondContact CD-O 3.39Å; R163-I261 WeakPolarHBondContact CD-O 3.48Å; R163-I261 WeakPolarHBondContact CG-O 3.5Å; R163-I277 VanDerWaalsContact NH1-CG2 3.35Å; R163-I277 PolarHBondContact NH1-O 2.77Å
164	I	98.3	Very high	97.8	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	21%	0.21	C	C	.	.			trans	-99.9	127.4	175.3	-57	-171.7	0	0	0	109.4	L154 L158 I168 L169 L259 W381	L154-I164 HydrophobicContact CD2-CD1 4.28Å; L158-I164 HydrophobicContact CD1-CG1 4.14Å; I164-I168 HydrophobicContact CG2-CB 3.73Å; I164-I168 HydrophobicContact CG2-CG2 3.4Å; I164-I168 VanDerWaalsContact CG2-CG2 3.4Å; I164-L169 HydrophobicContact CB-CD2 3.89Å; I164-L169 HydrophobicContact CB-CG 4.11Å; I164-L169 HydrophobicContact CG2-CD2 3.66Å; I164-L169 HydrophobicContact CG2-CG 3.79Å; I164-L259 HydrophobicContact CB-CB 4.4Å; I164-L259 HydrophobicContact CD1-CB 4.15Å; I164-L259 HydrophobicContact CD1-CD2 3.53Å; I164-L259 HydrophobicContact CD1-CG 4.28Å; I164-L259 HydrophobicContact CG1-CB 4.39Å; I164-L259 HydrophobicContact CG1-CD2 4.34Å; I164-L259 PolarHBondContact N-O 3.01Å; I164-W381 HydrophobicContact CD1-CH2 4.16Å; I164-W381 HydrophobicContact CG1-CH2 4.16Å; I164-W381 HydrophobicContact CG1-CZ2 4.3Å; I164-W381 HydrophobicContact CG2-CH2 3.9Å; I164-W381 HydrophobicContact CG2-CZ2 4Å
165	P	98.3	Very high	97.8	Very high	49 Å²	49	46.2 Å²	46.2	32%	0.318	21%	0.213	S	C	.	.			trans	-58.2	149.3	177.4	-25.5	35.1	0	0	0	113.4	E167 I168 L169	P165-E167 VanDerWaalsContact C-N 3.32Å; P165-E167 HydrophobicContact CB-CG 4.07Å; P165-E167 PolarHBondContact O-N 3.04Å; P165-I168 HydrophobicContact CB-CG1 4.17Å; P165-I168 HydrophobicContact CG-CG1 4.26Å; P165-I168 WeakPolarHBondContact O-CB 3.25Å; P165-I168 PolarHBondContact O-N 2.85Å; P165-I168 VanDerWaalsContact O-N 3.11Å; P165-L169 WeakPolarHBondContact O-CG 3.22Å; P165-L169 PolarHBondContact O-N 3.42Å
166	E	98.5	Very high	97.9	Very high	32 Å²	32	44.6 Å²	44.6	15%	0.15	20%	0.204	C	C	.	.	H	α-helix	trans	-57.1	-42.2	-179.3	-179.7	176	146.2	0	0	112.8	I168 L169 G170 F337 S338 F341 F367 R370	E166-I168 VanDerWaalsContact C-N 3.28Å; E166-I168 PolarHBondContact O-N 3.4Å; E166-L169 CarbonylContact O-C 3.5Å; E166-L169 WeakPolarHBondContact O-CA 3.25Å; E166-L169 WeakPolarHBondContact O-CB 3.33Å; E166-L169 PolarHBondContact O-N 3.28Å; E166-L169 VanDerWaalsContact O-N 3.11Å; E166-G170 PolarHBondContact O-N 3.4Å; E166-F337 HydrophobicContact CB-CD1 4.39Å; E166-F337 WeakPolarHBondContact OE2-CA 3.19Å; E166-S338 WeakPolarHBondContact OE1-CB 3.45Å; E166-S338 PolarHBondContact OE1-OG 3.25Å; E166-S338 PolarHBondContact OE2-N 2.94Å; E166-F341 HydrophobicContact CB-CD1 4.28Å; E166-F341 HydrophobicContact CG-CB 4.08Å; E166-F341 HydrophobicContact CG-CD1 3.56Å; E166-F341 HydrophobicContact CG-CE1 4.21Å; E166-F341 HydrophobicContact CG-CG 3.95Å; E166-F341 WeakPolarHBondContact OE1-CB 3.36Å; E166-F367 HydrophobicContact CG-CE2 3.91Å; E166-F367 HydrophobicContact CG-CZ 4.47Å; E166-R370 IonicContact OE1-CZ 2.75Å; E166-R370 IonicContact OE1-NH2 3.92Å; E166-R370 PolarHBondContact OE1-NH2 2.77Å
167	E	98.1	Very high	98	Very high	105 Å²	105	41.5 Å²	41.5	49%	0.491	19%	0.19	S	C	.	.	H	α-helix	trans	-59.3	-38.1	177.6	65.8	-159.9	-171.8	0	0	112.5	P165 G170 K171 V376	P165-E167 VanDerWaalsContact C-N 3.32Å; P165-E167 HydrophobicContact CB-CG 4.07Å; P165-E167 PolarHBondContact O-N 3.04Å; E167-G170 PolarHBondContact O-N 2.82Å; E167-K171 PolarHBondContact O-N 2.85Å; E167-V376 HydrophobicContact CB-CG2 4.04Å; E167-V376 HydrophobicContact CG-CG1 4.26Å
168	I	98.7	Very high	98	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-71.3	-42.1	175.2	-61.5	-67	0	0	0	109.8	I164 P165 E166 G170 K171 V172 V376 F378 W381	I164-I168 HydrophobicContact CG2-CB 3.73Å; I164-I168 HydrophobicContact CG2-CG2 3.4Å; I164-I168 VanDerWaalsContact CG2-CG2 3.4Å; P165-I168 HydrophobicContact CB-CG1 4.17Å; P165-I168 HydrophobicContact CG-CG1 4.26Å; P165-I168 WeakPolarHBondContact O-CB 3.25Å; P165-I168 PolarHBondContact O-N 2.85Å; P165-I168 VanDerWaalsContact O-N 3.11Å; E166-I168 VanDerWaalsContact C-N 3.28Å; E166-I168 PolarHBondContact O-N 3.4Å; I168-G170 PolarHBondContact O-N 3.46Å; I168-K171 PolarHBondContact O-N 3.03Å; I168-K171 VanDerWaalsContact O-N 3.14Å; I168-V172 WeakPolarHBondContact O-CG2 3.34Å; I168-V172 PolarHBondContact O-N 2.98Å; I168-V376 HydrophobicContact CD1-CG1 3.53Å; I168-V376 HydrophobicContact CG1-CG1 4.46Å; I168-F378 HydrophobicContact CD1-CD2 4.07Å; I168-F378 HydrophobicContact CG2-CD2 3.75Å; I168-F378 HydrophobicContact CG2-CE2 3.54Å; I168-W381 HydrophobicContact CD1-CB 3.82Å; I168-W381 HydrophobicContact CD1-CD2 3.71Å; I168-W381 HydrophobicContact CD1-CE3 3.87Å; I168-W381 HydrophobicContact CD1-CG 3.67Å; I168-W381 HydrophobicContact CG1-CD2 3.83Å; I168-W381 HydrophobicContact CG1-CE3 4.18Å; I168-W381 HydrophobicContact CG1-CG 4.02Å; I168-W381 HydrophobicContact CG2-CD2 4.18Å; I168-W381 HydrophobicContact CG2-CE3 3.74Å; I168-W381 HydrophobicContact CG2-CH2 3.81Å; I168-W381 HydrophobicContact CG2-CZ2 4.23Å; I168-W381 HydrophobicContact CG2-CZ3 3.55Å
169	L	98.8	Very high	98	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-27.3	175.9	-67.3	178.4	0	0	0	113	I164 P165 E166 V172 S173 L256 L259 A260 F341	I164-L169 HydrophobicContact CB-CD2 3.89Å; I164-L169 HydrophobicContact CB-CG 4.11Å; I164-L169 HydrophobicContact CG2-CD2 3.66Å; I164-L169 HydrophobicContact CG2-CG 3.79Å; P165-L169 WeakPolarHBondContact O-CG 3.22Å; P165-L169 PolarHBondContact O-N 3.42Å; E166-L169 CarbonylContact O-C 3.5Å; E166-L169 WeakPolarHBondContact O-CA 3.25Å; E166-L169 WeakPolarHBondContact O-CB 3.33Å; E166-L169 PolarHBondContact O-N 3.28Å; E166-L169 VanDerWaalsContact O-N 3.11Å; L169-V172 PolarHBondContact O-N 3.19Å; L169-S173 VanDerWaalsContact O-CB 3.27Å; L169-S173 WeakPolarHBondContact O-CB 3.43Å; L169-S173 PolarHBondContact O-N 3.11Å; L169-S173 PolarHBondContact O-OG 3.08Å; L169-L256 HydrophobicContact CB-CD2 4.35Å; L169-L256 HydrophobicContact CD2-CD2 4.09Å; L169-L259 HydrophobicContact CD1-CB 4.45Å; L169-L259 HydrophobicContact CD2-CB 3.68Å; L169-L259 HydrophobicContact CD2-CD1 4.03Å; L169-L259 HydrophobicContact CD2-CG 4.49Å; L169-A260 HydrophobicContact CD1-CB 3.61Å; L169-F341 HydrophobicContact CB-CZ 4.21Å; L169-F341 HydrophobicContact CD1-CE1 3.99Å; L169-F341 HydrophobicContact CD1-CZ 3.75Å
170	G	98.8	Very high	98	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58.6	-50.6	168.9	0	0	0	0	0	111.7	E166 E167 I168 S173 I174 S371	E166-G170 PolarHBondContact O-N 3.4Å; E167-G170 PolarHBondContact O-N 2.82Å; I168-G170 PolarHBondContact O-N 3.46Å; G170-S173 PolarHBondContact O-N 3.36Å; G170-I174 WeakPolarHBondContact O-CG1 3.31Å; G170-I174 PolarHBondContact O-N 3.35Å; G170-S371 VanDerWaalsContact CA-OG 3.25Å; G170-S371 WeakPolarHBondContact CA-OG 3.45Å
171	K	98.6	Very high	98	Very high	45 Å²	45	32.4 Å²	32.4	20%	0.196	15%	0.148	C	C	.	.	H	α-helix	trans	-64.6	-41.1	176.6	-58.8	-55.9	-174.8	-179.1	0	112.6	E167 I168 S173 I174 A175 I207 S371 E374 V376 F378	E167-K171 PolarHBondContact O-N 2.85Å; I168-K171 PolarHBondContact O-N 3.03Å; I168-K171 VanDerWaalsContact O-N 3.14Å; K171-S173 VanDerWaalsContact C-N 3.32Å; K171-S173 PolarHBondContact O-N 3.32Å; K171-I174 HydrophobicContact CD-CD1 4.37Å; K171-I174 PolarHBondContact O-N 3.09Å; K171-A175 PolarHBondContact O-N 3.49Å; K171-A175 VanDerWaalsContact O-N 3.11Å; K171-I207 HydrophobicContact CB-CD1 4.28Å; K171-S371 WeakPolarHBondContact CE-O 3.18Å; K171-S371 PolarHBondContact NZ-O 3.31Å; K171-E374 VanDerWaalsContact CE-O 3.25Å; K171-E374 WeakPolarHBondContact CE-O 3.29Å; K171-E374 PolarHBondContact NZ-O 3.49Å; K171-V376 HydrophobicContact CG-CB 4.19Å; K171-F378 HydrophobicContact CB-CD2 4.32Å
172	V	98.8	Very high	98	Very high	1 Å²	1	32 Å²	32	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-59.2	-45.3	172.8	173.9	0	0	0	0	110.7	L154 I168 L169 I174 A175 V176 I207 F378	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 3.34Å; I168-V172 PolarHBondContact O-N 2.98Å; L169-V172 PolarHBondContact O-N 3.19Å; V172-I174 PolarHBondContact O-N 2.84Å; V172-A175 PolarHBondContact O-N 2.9Å; V172-V176 HydrophobicContact CG1-CG2 4.17Å; V172-V176 WeakPolarHBondContact O-CG2 3.39Å; V172-V176 PolarHBondContact O-N 2.8Å; V172-I207 HydrophobicContact CB-CD1 4.49Å; V172-I207 HydrophobicContact CG2-CD1 3.97Å; V172-F378 HydrophobicContact CG2-CE2 4.06Å
173	S	98.9	Very high	97.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.7	-42.1	-178.3	-61	0	0	0	0	112.1	L169 G170 K171 L177 L256	L169-S173 VanDerWaalsContact O-CB 3.27Å; L169-S173 WeakPolarHBondContact O-CB 3.43Å; L169-S173 PolarHBondContact O-N 3.11Å; L169-S173 PolarHBondContact O-OG 3.08Å; G170-S173 PolarHBondContact O-N 3.36Å; K171-S173 VanDerWaalsContact C-N 3.32Å; K171-S173 PolarHBondContact O-N 3.32Å; S173-L177 WeakPolarHBondContact O-CB 3.33Å; S173-L177 VanDerWaalsContact O-CG 3.3Å; S173-L177 WeakPolarHBondContact O-CG 3.45Å; S173-L177 PolarHBondContact O-N 2.89Å; S173-L256 WeakPolarHBondContact OG-CD1 3.23Å; S173-L256 WeakPolarHBondContact OG-CD2 3.31Å
174	I	98.6	Very high	97.8	Very high	12 Å²	12	22.9 Å²	22.9	6%	0.062	11%	0.106	C	C	.	.	H	α-helix	trans	-58.4	-50.5	174	-68.4	160.8	0	0	0	110.5	G170 K171 V172 V176 L177 R178 I368 E372	G170-I174 WeakPolarHBondContact O-CG1 3.31Å; G170-I174 PolarHBondContact O-N 3.35Å; K171-I174 HydrophobicContact CD-CD1 4.37Å; K171-I174 PolarHBondContact O-N 3.09Å; V172-I174 PolarHBondContact O-N 2.84Å; I174-V176 PolarHBondContact O-N 3.11Å; I174-L177 PolarHBondContact O-N 2.98Å; I174-R178 HydrophobicContact CG2-CG 4.39Å; I174-R178 WeakPolarHBondContact O-CB 3.39Å; I174-R178 VanDerWaalsContact O-CG 3.31Å; I174-R178 WeakPolarHBondContact O-CG 3.48Å; I174-R178 PolarHBondContact O-N 3.07Å; I174-I368 HydrophobicContact CG1-CD1 4.17Å; I174-I368 HydrophobicContact CG1-CG2 4.02Å; I174-E372 HydrophobicContact CD1-CB 4.42Å; I174-E372 HydrophobicContact CD1-CG 3.69Å; I174-E372 HydrophobicContact CG1-CG 4.19Å
175	A	98.5	Very high	97.5	Very high	7 Å²	7	29.4 Å²	29.4	6%	0.058	14%	0.136	C	C	.	.	H	α-helix	trans	-62.7	-44.6	-177.7	0	0	0	0	0	112.5	Y128 K171 V172 R178 G179 I207	Y128-A175 HydrophobicContact CD1-CB 3.83Å; Y128-A175 HydrophobicContact CE1-CB 4.31Å; K171-A175 PolarHBondContact O-N 3.49Å; K171-A175 VanDerWaalsContact O-N 3.11Å; V172-A175 PolarHBondContact O-N 2.9Å; A175-R178 PolarHBondContact O-N 3.48Å; A175-G179 PolarHBondContact O-N 3.14Å; A175-I207 HydrophobicContact CB-CB 3.6Å; A175-I207 HydrophobicContact CB-CD1 4.28Å; A175-I207 HydrophobicContact CB-CG2 3.71Å
176	V	98.8	Very high	97.1	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-46.3	177.7	176	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 3.39Å; V172-V176 PolarHBondContact O-N 2.8Å; I174-V176 PolarHBondContact O-N 3.11Å; V176-R178 PolarHBondContact O-N 3.35Å; V176-G179 PolarHBondContact O-N 2.69Å; V176-L180 HydrophobicContact CG1-CD1 3.98Å; V176-L180 HydrophobicContact CG1-CG 4.29Å; V176-L180 WeakPolarHBondContact O-CB 3.44Å; V176-L180 VanDerWaalsContact O-CG 3.32Å; V176-L180 WeakPolarHBondContact O-CG 3.33Å; V176-L180 PolarHBondContact O-N 3.44Å; V176-V194 HydrophobicContact CG1-CG1 4.31Å; V176-I199 HydrophobicContact CG2-CD1 3.87Å; V176-I199 HydrophobicContact CG2-CG1 4.2Å; V176-I199 HydrophobicContact CG2-CG2 4.4Å; V176-L209 HydrophobicContact CG1-CD2 4.35Å; V176-L209 HydrophobicContact CG2-CD2 4.2Å; V176-M252 HydrophobicContact CB-CE 4.36Å; V176-M252 HydrophobicContact CB-SD 4.09Å; V176-M252 HydrophobicContact CG1-CB 4.29Å; V176-M252 HydrophobicContact CG1-CE 4.48Å; V176-M252 HydrophobicContact CG1-CG 3.88Å; V176-M252 HydrophobicContact CG1-SD 3.6Å
177	L	98.6	Very high	96.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.6	-44.5	177.4	-74.8	172.4	0	0	0	112	S173 I174 L180 A181 M252 F344 L359 L362 M363 I368	S173-L177 WeakPolarHBondContact O-CB 3.33Å; S173-L177 VanDerWaalsContact O-CG 3.3Å; S173-L177 WeakPolarHBondContact O-CG 3.45Å; S173-L177 PolarHBondContact O-N 2.89Å; I174-L177 PolarHBondContact O-N 2.98Å; L177-L180 PolarHBondContact O-N 3.48Å; L177-A181 VanDerWaalsContact O-CB 3.28Å; L177-A181 WeakPolarHBondContact O-CB 3.41Å; L177-A181 PolarHBondContact O-N 3.36Å; L177-M252 HydrophobicContact CD1-CE 4.46Å; L177-M252 HydrophobicContact CD2-CE 4.36Å; L177-M252 HydrophobicContact CD2-SD 3.93Å; L177-M252 HydrophobicContact CG-CE 3.94Å; L177-M252 HydrophobicContact CG-SD 4.03Å; L177-F344 HydrophobicContact CD1-CE2 4.2Å; L177-F344 HydrophobicContact CD1-CZ 4.02Å; L177-L359 HydrophobicContact CD2-CD2 3.71Å; L177-L362 HydrophobicContact CD1-CB 3.92Å; L177-L362 HydrophobicContact CD2-CB 3.78Å; L177-L362 HydrophobicContact CD2-CD1 3.92Å; L177-M363 HydrophobicContact CB-CE 3.65Å; L177-M363 HydrophobicContact CB-SD 4.19Å; L177-I368 HydrophobicContact CD1-CD1 3.83Å; L177-I368 HydrophobicContact CD1-CG1 3.9Å
178	R	97.9	Very high	96.3	Very high	82 Å²	82	32.8 Å²	32.8	31%	0.309	15%	0.146	S	C	.	.	H	α-helix	trans	-67	-37.7	178.7	-69.8	179.6	-179.4	-177.2	-1.5	111.7	Y128 I174 A175 V176 Y182 M363 E372	Y128-R178 HydrophobicContact CD1-CB 4.33Å; Y128-R178 HydrophobicContact CD2-CB 3.42Å; Y128-R178 VanDerWaalsContact CD2-CB 3.42Å; 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 3.28Å; Y128-R178 WeakPolarHBondContact OH-CD 3.47Å; Y128-R178 PolarHBondContact OH-NH1 3.48Å; I174-R178 HydrophobicContact CG2-CG 4.39Å; I174-R178 WeakPolarHBondContact O-CB 3.39Å; I174-R178 VanDerWaalsContact O-CG 3.31Å; I174-R178 WeakPolarHBondContact O-CG 3.48Å; I174-R178 PolarHBondContact O-N 3.07Å; A175-R178 PolarHBondContact O-N 3.48Å; V176-R178 PolarHBondContact O-N 3.35Å; R178-Y182 WeakPolarHBondContact O-CB 3.25Å; R178-Y182 PolarHBondContact O-N 2.82Å; R178-M363 HydrophobicContact CG-CE 3.78Å; R178-M363 HydrophobicContact CG-SD 4.09Å; R178-E372 IonicContact CZ-OE1 2.62Å; R178-E372 IonicContact NH2-OE1 2.75Å; R178-E372 PolarHBondContact NH2-OE1 3.09Å
179	G	97.8	Very high	95.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.1	-47.6	172.9	0	0	0	0	0	112.8	A175 V176 Y182 L183	A175-G179 PolarHBondContact O-N 3.14Å; V176-G179 PolarHBondContact O-N 2.69Å; G179-Y182 PolarHBondContact O-N 2.74Å; G179-L183 WeakPolarHBondContact O-CG 3.49Å; G179-L183 PolarHBondContact O-N 2.9Å
180	L	97.6	Very high	95.5	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-64.5	-41.8	177	-68.5	177.9	0	0	0	112.2	V176 L177 L183 R184 H191 V194 L209 D248 L359	V176-L180 HydrophobicContact CG1-CD1 3.98Å; V176-L180 HydrophobicContact CG1-CG 4.29Å; V176-L180 WeakPolarHBondContact O-CB 3.44Å; V176-L180 VanDerWaalsContact O-CG 3.32Å; V176-L180 WeakPolarHBondContact O-CG 3.33Å; V176-L180 PolarHBondContact O-N 3.44Å; L177-L180 PolarHBondContact O-N 3.48Å; L180-L183 PolarHBondContact O-N 3.36Å; L180-R184 WeakPolarHBondContact O-CB 3.4Å; L180-R184 PolarHBondContact O-N 2.71Å; L180-H191 HydrophobicContact CD2-CB 3.66Å; L180-V194 HydrophobicContact CD2-CG2 3.96Å; L180-L209 HydrophobicContact CD2-CD1 4.11Å; L180-L209 HydrophobicContact CG-CD1 4.14Å; L180-D248 HydrophobicContact CD1-CB 3.98Å; L180-D248 HydrophobicContact CD2-CB 3.95Å; L180-L359 HydrophobicContact CB-CD1 4.12Å; L180-L359 HydrophobicContact CB-CD2 4.03Å; L180-L359 HydrophobicContact CD1-CD2 4.26Å
181	A	96.5	Very high	95.2	Very high	12 Å²	12	35.6 Å²	35.6	10%	0.099	16%	0.16	C	C	.	.	H	α-helix	trans	-60.9	-45.9	175.3	0	0	0	0	0	111.1	L177 L183 R184 E185 L359	L177-A181 VanDerWaalsContact O-CB 3.28Å; L177-A181 WeakPolarHBondContact O-CB 3.41Å; L177-A181 PolarHBondContact O-N 3.36Å; A181-L183 PolarHBondContact O-N 2.82Å; A181-R184 PolarHBondContact O-N 3.27Å; A181-E185 VanDerWaalsContact O-CB 3.31Å; A181-E185 WeakPolarHBondContact O-CB 3.42Å; A181-E185 WeakPolarHBondContact O-CG 3.49Å; A181-E185 PolarHBondContact O-N 2.96Å; A181-L359 HydrophobicContact CB-CD1 4.22Å
182	Y	95.6	Very high	94.9	Very high	22 Å²	22	36.7 Å²	36.7	9%	0.086	16%	0.163	C	C	.	.	H	α-helix	trans	-57.2	-50.8	176	173.6	-93.8	0	0	0	112.3	L43 E123 C124 N125 I129 R178 G179 R184 K186 H187	L43-Y182 HydrophobicContact CD1-CE2 4.49Å; L43-Y182 HydrophobicContact CD2-CD2 4Å; L43-Y182 HydrophobicContact CD2-CE2 3.9Å; E123-Y182 PolarHBondContact O-OH 2.86Å; C124-Y182 HydrophobicContact CB-CE1 4.49Å; N125-Y182 PolarHBondContact N-OH 2.85Å; N125-Y182 PolarHBondContact O-OH 2.74Å; N125-Y182 VanDerWaalsContact O-OH 3.14Å; I129-Y182 HydrophobicContact CD1-CD1 4.48Å; I129-Y182 HydrophobicContact CG1-CD1 3.74Å; I129-Y182 HydrophobicContact CG1-CE1 4.12Å; R178-Y182 WeakPolarHBondContact O-CB 3.25Å; R178-Y182 PolarHBondContact O-N 2.82Å; G179-Y182 PolarHBondContact O-N 2.74Å; Y182-R184 VanDerWaalsContact C-N 3.31Å; Y182-R184 PolarHBondContact O-N 3.15Å; Y182-K186 HydrophobicContact CD2-CB 4.42Å; Y182-K186 HydrophobicContact CD2-CG 3.95Å; Y182-K186 HydrophobicContact CE2-CB 4.26Å; Y182-K186 HydrophobicContact CE2-CG 3.99Å; Y182-K186 WeakPolarHBondContact O-CB 3.31Å; Y182-K186 PolarHBondContact O-N 3.27Å; Y182-H187 AromaticContact CE1-CD2 3.58Å; Y182-H187 AromaticContact CE1-NE2 3.56Å; Y182-H187 AromaticContact CZ-CD2 3.84Å; Y182-H187 AromaticContact CZ-NE2 3.42Å; Y182-H187 PolarHBondContact OH-NE2 2.93Å
183	L	94.3	Very high	94.5	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-59.5	-42.9	178.9	-70.4	174.9	0	0	0	111.6	I129 G179 L180 A181 H187 Q188 I189 F212	I129-L183 HydrophobicContact CD1-CD1 3.94Å; I129-L183 HydrophobicContact CD1-CD2 4Å; I129-L183 HydrophobicContact CD1-CG 3.79Å; I129-L183 HydrophobicContact CG1-CD2 4.46Å; G179-L183 WeakPolarHBondContact O-CG 3.49Å; G179-L183 PolarHBondContact O-N 2.9Å; L180-L183 PolarHBondContact O-N 3.36Å; A181-L183 PolarHBondContact O-N 2.82Å; L183-H187 CarbonylContact O-C 3.55Å; L183-H187 WeakPolarHBondContact O-CB 3.34Å; L183-H187 PolarHBondContact O-N 3.11Å; L183-Q188 PolarHBondContact O-N 3.49Å; L183-Q188 VanDerWaalsContact O-N 3.11Å; L183-I189 CarbonylContact C-O 3.47Å; L183-I189 HydrophobicContact CB-CB 4.33Å; L183-I189 PolarHBondContact O-N 3.49Å; L183-F212 HydrophobicContact CD1-CB 3.97Å; L183-F212 HydrophobicContact CD1-CD1 4.35Å; L183-F212 HydrophobicContact CD1-CD2 4.13Å; L183-F212 HydrophobicContact CD1-CG 3.91Å; L183-F212 HydrophobicContact CD2-CD2 3.71Å; L183-F212 HydrophobicContact CD2-CE1 4.42Å; L183-F212 HydrophobicContact CD2-CE2 3.54Å; L183-F212 HydrophobicContact CD2-CG 4.19Å; L183-F212 HydrophobicContact CD2-CZ 3.93Å
184	R	93.3	Very high	94.3	Very high	103 Å²	103	38.2 Å²	38.2	39%	0.389	17%	0.171	S	C	.	.	H	α-helix	trans	-69.6	-50.5	-178.5	177.2	57.4	-177.9	152.1	7.6	112.2	L180 A181 Y182 Q188	L180-R184 WeakPolarHBondContact O-CB 3.4Å; L180-R184 PolarHBondContact O-N 2.71Å; A181-R184 PolarHBondContact O-N 3.27Å; Y182-R184 VanDerWaalsContact C-N 3.31Å; Y182-R184 PolarHBondContact O-N 3.15Å; R184-Q188 VanDerWaalsContact O-CA 3.24Å; R184-Q188 WeakPolarHBondContact O-CA 3.37Å; R184-Q188 PolarHBondContact O-N 3.05Å; R184-Q188 VanDerWaalsContact O-N 3.11Å; R184-Q188 PolarHBondContact O-NE2 3.22Å
185	E	92.4	Very high	94.2	Very high	139 Å²	139	38.7 Å²	38.7	65%	0.65	17%	0.173	S	C	*	.	H	α-helix	trans	-77.3	-45.1	-170.3	-68	176.2	-174.4	0	0	112.1	A181	A181-E185 VanDerWaalsContact O-CB 3.31Å; A181-E185 WeakPolarHBondContact O-CB 3.42Å; A181-E185 WeakPolarHBondContact O-CG 3.49Å; A181-E185 PolarHBondContact O-N 2.96Å
186	K	90.9	Very high	94.1	Very high	99 Å²	99	38.5 Å²	38.5	43%	0.43	17%	0.171	S	C	.	.	H	α-helix	trans	-85.3	-31.5	-175.1	-61.7	-65.7	-173.3	170	0	113	E42 Y182	E42-K186 IonicContact OE2-NZ 3.07Å; Y182-K186 HydrophobicContact CD2-CB 4.42Å; Y182-K186 HydrophobicContact CD2-CG 3.95Å; Y182-K186 HydrophobicContact CE2-CB 4.26Å; Y182-K186 HydrophobicContact CE2-CG 3.99Å; Y182-K186 WeakPolarHBondContact O-CB 3.31Å; Y182-K186 PolarHBondContact O-N 3.27Å
187	H	89.2	Confident	93.9	Very high	39 Å²	39	40.6 Å²	40.6	18%	0.181	19%	0.185	C	C	.	.	H	α-helix	trans	-121.8	-7.2	-171.9	-61.9	-72.6	0	0	0	114.8	E123 Y182 L183 I189	E123-H187 PolarHBondContact O-CE1 3.43Å; E123-H187 PolarHBondContact O-NE2 3.42Å; Y182-H187 AromaticContact CE1-CD2 3.58Å; Y182-H187 AromaticContact CE1-NE2 3.56Å; Y182-H187 AromaticContact CZ-CD2 3.84Å; Y182-H187 AromaticContact CZ-NE2 3.42Å; Y182-H187 PolarHBondContact OH-NE2 2.93Å; L183-H187 CarbonylContact O-C 3.55Å; L183-H187 WeakPolarHBondContact O-CB 3.34Å; L183-H187 PolarHBondContact O-N 3.11Å; H187-I189 HydrophobicContact CB-CB 4.38Å; H187-I189 HydrophobicContact CB-CD1 3.62Å; H187-I189 HydrophobicContact CB-CG1 3.84Å; H187-I189 PolarHBondContact O-N 2.87Å
188	Q	90.6	Very high	93.8	Very high	120 Å²	120	41 Å²	41	56%	0.561	19%	0.187	S	C	*	.			trans	57.8	28	-173.4	-58.5	-62.7	-51.5	0	0	113.7	L183 R184	L183-Q188 PolarHBondContact O-N 3.49Å; L183-Q188 VanDerWaalsContact O-N 3.11Å; R184-Q188 VanDerWaalsContact O-CA 3.24Å; R184-Q188 WeakPolarHBondContact O-CA 3.37Å; R184-Q188 PolarHBondContact O-N 3.05Å; R184-Q188 VanDerWaalsContact O-N 3.11Å; R184-Q188 PolarHBondContact O-NE2 3.22Å
189	I	89.6	Confident	93.8	Very high	20 Å²	20	37.2 Å²	37.2	10%	0.103	17%	0.174	C	C	.	.			trans	-96.4	142.3	-179	-65.9	170.4	0	0	0	110.2	V120 L183 H187 F212 V214	V120-I189 HydrophobicContact CG1-CD1 4Å; L183-I189 CarbonylContact C-O 3.47Å; L183-I189 HydrophobicContact CB-CB 4.33Å; L183-I189 PolarHBondContact O-N 3.49Å; H187-I189 HydrophobicContact CB-CB 4.38Å; H187-I189 HydrophobicContact CB-CD1 3.62Å; H187-I189 HydrophobicContact CB-CG1 3.84Å; H187-I189 PolarHBondContact O-N 2.87Å; I189-F212 HydrophobicContact CG2-CD2 4.05Å; I189-V214 HydrophobicContact CD1-CG2 4.21Å
190	M	90.5	Very high	93.9	Very high	38 Å²	38	38.7 Å²	38.7	19%	0.187	18%	0.181	C	C	.	.			trans	-103.7	143.8	164.6	-66.9	176.4	-79	0	0	108.7	R192 Y243 S244	M190-R192 HydrophobicContact CB-CG 4.02Å; M190-Y243 HydrophobicContact CE-CE2 4.23Å; M190-Y243 HydrophobicContact SD-CD2 4.3Å; M190-Y243 HydrophobicContact SD-CE2 4.46Å; M190-S244 VanDerWaalsContact SD-CA 3.5Å
191	H	93.1	Very high	93.9	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.009	18%	0.18	C	C	.	.			trans	-71.8	-45.3	-177.4	-171	-47.7	0	0	0	112.1	L180 D193 V194 C210 F212 G213 D248	L180-H191 HydrophobicContact CD2-CB 3.66Å; H191-D193 PolarHBondContact CE1-O 2.94Å; H191-D193 PolarHBondContact ND1-N 3.05Å; H191-D193 PolarHBondContact O-N 2.87Å; H191-D193 VanDerWaalsContact O-N 3.14Å; H191-V194 HydrophobicContact CB-CG2 3.8Å; H191-C210 PolarHBondContact CE1-O 3.14Å; H191-C210 PolarHBondContact NE2-O 3.33Å; H191-F212 HydrophobicContact CB-CB 4.21Å; H191-G213 PolarHBondContact O-N 3.13Å; H191-D248 PolarHBondContact N-OD2 3.42Å
192	R	91.4	Very high	94	Very high	69 Å²	69	38 Å²	38	26%	0.26	18%	0.176	S	C	.	.	S	Bend	trans	67.4	-3.2	177.8	-56.4	174.8	173.8	179.1	-1.9	116.9	M190 R237 D248	M190-R192 HydrophobicContact CB-CG 4.02Å; R192-R237 PolarHBondContact O-NH1 3.18Å; R192-R237 PolarHBondContact O-NH2 2.9Å; R192-D248 WeakPolarHBondContact CA-OD1 3.31Å; R192-D248 PolarHBondContact N-OD1 3.27Å
193	D	90.3	Very high	94	Very high	32 Å²	32	37.4 Å²	37.4	17%	0.171	18%	0.175	C	C	.	.			trans	-150.9	42.7	-176.8	-163.4	25.6	0	0	0	111.6	H191 K195 N198 T229	H191-D193 PolarHBondContact CE1-O 2.94Å; H191-D193 PolarHBondContact ND1-N 3.05Å; H191-D193 PolarHBondContact O-N 2.87Å; H191-D193 VanDerWaalsContact O-N 3.14Å; D193-K195 PolarHBondContact O-N 3.3Å; D193-K195 WeakPolarHBondContact OD1-CE 2.95Å; D193-K195 IonicContact OD1-NZ 3.89Å; D193-K195 PolarHBondContact OD1-NZ 2.95Å; D193-K195 WeakPolarHBondContact OD2-CE 3.18Å; D193-K195 IonicContact OD2-NZ 3.74Å; D193-K195 PolarHBondContact OD2-NZ 3.45Å; D193-N198 PolarHBondContact O-ND2 3.13Å; D193-N198 PolarHBondContact OD2-ND2 2.89Å; D193-T229 VanDerWaalsContact OD1-CG2 3.24Å; D193-T229 WeakPolarHBondContact OD1-CG2 3.31Å
194	V	95.9	Very high	94.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.193	C	C	.	.			trans	-68.8	124	174.2	-179.6	0	0	0	0	108.9	V176 L180 H191 D248 S251 M252	V176-V194 HydrophobicContact CG1-CG1 4.31Å; L180-V194 HydrophobicContact CD2-CG2 3.96Å; H191-V194 HydrophobicContact CB-CG2 3.8Å; V194-D248 HydrophobicContact CG2-CB 4.07Å; V194-S251 VanDerWaalsContact O-CB 3.31Å; V194-S251 WeakPolarHBondContact O-CB 3.44Å; V194-M252 HydrophobicContact CG1-CB 4.22Å
195	K	95.6	Very high	94.2	Very high	23 Å²	23	38.6 Å²	38.6	10%	0.1	19%	0.187	C	C	.	.	S	Bend	trans	-164.8	164.2	176.9	60	-172.4	174.6	-144.5	0	109.3	D193 S197 N198 I199 Y232 S255	D193-K195 PolarHBondContact O-N 3.3Å; D193-K195 WeakPolarHBondContact OD1-CE 2.95Å; D193-K195 IonicContact OD1-NZ 3.89Å; D193-K195 PolarHBondContact OD1-NZ 2.95Å; D193-K195 WeakPolarHBondContact OD2-CE 3.18Å; D193-K195 IonicContact OD2-NZ 3.74Å; D193-K195 PolarHBondContact OD2-NZ 3.45Å; K195-S197 WeakPolarHBondContact CD-OG 3.25Å; K195-S197 WeakPolarHBondContact CE-OG 3.22Å; K195-S197 WeakPolarHBondContact CG-OG 3.42Å; K195-S197 PolarHBondContact O-N 3.36Å; K195-S197 VanDerWaalsContact O-N 3.11Å; K195-N198 WeakPolarHBondContact CE-ND2 3.36Å; K195-N198 HydrophobicContact CG-CB 4.22Å; K195-N198 PolarHBondContact O-N 3.45Å; K195-I199 PolarHBondContact O-N 3.34Å; K195-Y232 HydrophobicContact CB-CD1 4.12Å; K195-Y232 HydrophobicContact CB-CD2 3.77Å; K195-Y232 HydrophobicContact CB-CE1 4.28Å; K195-Y232 HydrophobicContact CB-CE2 3.94Å; K195-Y232 HydrophobicContact CB-CG 3.89Å; K195-Y232 HydrophobicContact CD-CD2 4.17Å; K195-Y232 HydrophobicContact CD-CE2 4.31Å; K195-S255 WeakPolarHBondContact CA-OG 3.42Å
196	P	97.2	Very high	94.5	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.013	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-55.1	-33.5	-178.6	-30.1	39	0	0	0	114.8	L154 D155 N198 I199 E258 L259	L154-P196 HydrophobicContact CB-CB 4.16Å; L154-P196 WeakPolarHBondContact CB-O 3.31Å; L154-P196 PolarHBondContact N-O 2.84Å; L154-P196 VanDerWaalsContact N-O 3.08Å; D155-P196 HydrophobicContact CB-CB 3.96Å; D155-P196 PolarHBondContact N-O 3.3Å; P196-N198 PolarHBondContact O-N 2.86Å; P196-I199 PolarHBondContact O-N 3.04Å; P196-E258 WeakPolarHBondContact CG-OE2 3.45Å; P196-L259 HydrophobicContact CB-CD2 4.01Å; P196-L259 HydrophobicContact CB-CG 4.47Å; P196-L259 HydrophobicContact CG-CD1 4.27Å; P196-L259 HydrophobicContact CG-CD2 4.09Å; P196-L259 HydrophobicContact CG-CG 4.06Å
197	S	94.2	Very high	94.8	Very high	46 Å²	46	28.7 Å²	28.7	32%	0.322	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-71.8	-13.5	177.6	54.9	0	0	0	0	115.2	S153 D155 K195	S153-S197 WeakPolarHBondContact CB-O 3.14Å; D155-S197 WeakPolarHBondContact OD1-CA 3.36Å; D155-S197 VanDerWaalsContact OD1-CB 3.28Å; D155-S197 WeakPolarHBondContact OD1-CB 3.36Å; K195-S197 WeakPolarHBondContact CD-OG 3.25Å; K195-S197 WeakPolarHBondContact CE-OG 3.22Å; K195-S197 WeakPolarHBondContact CG-OG 3.42Å; K195-S197 PolarHBondContact O-N 3.36Å; K195-S197 VanDerWaalsContact O-N 3.11Å
198	N	96.1	Very high	95.3	Very high	8 Å²	8	27.3 Å²	27.3	4%	0.043	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-107.1	10.9	176.5	-69.8	-6	0	0	0	112.8	D193 K195 P196 C210	D193-N198 PolarHBondContact O-ND2 3.13Å; D193-N198 PolarHBondContact OD2-ND2 2.89Å; K195-N198 WeakPolarHBondContact CE-ND2 3.36Å; K195-N198 HydrophobicContact CG-CB 4.22Å; K195-N198 PolarHBondContact O-N 3.45Å; P196-N198 PolarHBondContact O-N 2.86Å; N198-C210 PolarHBondContact O-N 3.27Å; N198-C210 VanDerWaalsContact O-N 3.09Å
199	I	98.5	Very high	95.6	Very high	4 Å²	4	21.7 Å²	21.7	2%	0.021	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	107.5	172.4	-55.3	164.5	0	0	0	107	S153 L154 V176 K195 P196 I207 L209	S153-I199 CarbonylContact C-O 3.55Å; S153-I199 WeakPolarHBondContact CA-O 3.25Å; L154-I199 HydrophobicContact CB-CB 4.42Å; L154-I199 HydrophobicContact CD1-CB 3.83Å; L154-I199 HydrophobicContact CD1-CD1 4.16Å; L154-I199 HydrophobicContact CD1-CG2 3.47Å; L154-I199 VanDerWaalsContact CD1-CG2 3.47Å; L154-I199 HydrophobicContact CG-CB 4.03Å; L154-I199 HydrophobicContact CG-CG2 3.88Å; L154-I199 PolarHBondContact N-O 3.22Å; V176-I199 HydrophobicContact CG2-CD1 3.87Å; V176-I199 HydrophobicContact CG2-CG1 4.2Å; V176-I199 HydrophobicContact CG2-CG2 4.4Å; K195-I199 PolarHBondContact O-N 3.34Å; P196-I199 PolarHBondContact O-N 3.04Å; I199-I207 HydrophobicContact CG2-CG2 3.66Å; I199-L209 HydrophobicContact CG1-CD2 3.91Å
200	L	98.6	Very high	95.9	Very high	30 Å²	30	21.1 Å²	21.1	16%	0.157	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	149.2	-176.2	-55.1	-168.2	0	0	0	111.6	V130 M149 G152 I207 K208 C210	V130-L200 HydrophobicContact CG2-CB 4.31Å; 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 4.29Å; M149-L200 HydrophobicContact CG-CB 3.72Å; M149-L200 HydrophobicContact CG-CD1 3.88Å; M149-L200 HydrophobicContact CG-CG 4.47Å; G152-L200 WeakPolarHBondContact O-CA 3.45Å; L200-I207 WeakPolarHBondContact O-CA 3.49Å; L200-K208 PolarHBondContact N-O 3.26Å; L200-K208 PolarHBondContact O-N 3.28Å; L200-C210 HydrophobicContact CD1-CB 4.14Å; L200-C210 HydrophobicContact CG-CB 4.31Å
201	V	98.6	Very high	95.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	156.3	-177.5	-61.2	0	0	0	0	111.6	G151 G152 L154 V157 E206 I207 F378 L382	G151-V201 CarbonylContact C-O 3.57Å; G151-V201 WeakPolarHBondContact CA-O 3.47Å; G151-V201 PolarHBondContact N-O 3.18Å; G152-V201 PolarHBondContact N-O 3.47Å; G152-V201 PolarHBondContact O-N 3.14Å; L154-V201 HydrophobicContact CD2-CG1 3.66Å; L154-V201 HydrophobicContact CD2-CG2 4.38Å; L154-V201 HydrophobicContact CG-CG1 4.2Å; V157-V201 HydrophobicContact CG2-CG2 3.87Å; V201-E206 VanDerWaalsContact CA-O 3.29Å; V201-E206 WeakPolarHBondContact CA-O 3.28Å; V201-I207 HydrophobicContact CG1-CB 4.49Å; V201-I207 HydrophobicContact CG1-CG1 4.17Å; V201-I207 HydrophobicContact CG1-CG2 4.28Å; V201-F378 HydrophobicContact CB-CE1 4.27Å; V201-F378 HydrophobicContact CB-CZ 4.36Å; V201-F378 HydrophobicContact CG1-CE1 4.18Å; V201-F378 HydrophobicContact CG1-CZ 3.83Å; V201-L382 HydrophobicContact CB-CD2 3.87Å; V201-L382 HydrophobicContact CG2-CD1 3.64Å; V201-L382 HydrophobicContact CG2-CD2 3.72Å; V201-L382 HydrophobicContact CG2-CG 4.34Å
202	N	97.8	Very high	95.4	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	12%	0.116	C	C	.	.			trans	-138	163.2	178.6	74.1	19.2	0	0	0	112.9	M149 D150 R204 G205 E206 L382	M149-N202 HydrophobicContact CE-CB 3.93Å; M149-N202 HydrophobicContact SD-CB 4.22Å; D150-N202 WeakPolarHBondContact OD1-CA 3.47Å; D150-N202 WeakPolarHBondContact OD1-CB 3.45Å; N202-R204 PolarHBondContact ND2-NH2 3.15Å; N202-R204 PolarHBondContact O-N 3.1Å; N202-R204 WeakPolarHBondContact OD1-CA 3.19Å; N202-R204 WeakPolarHBondContact OD1-CB 3.43Å; N202-R204 PolarHBondContact OD1-N 3.23Å; N202-R204 VanDerWaalsContact OD1-N 3.14Å; N202-G205 WeakPolarHBondContact O-CA 3.19Å; N202-G205 PolarHBondContact O-N 2.89Å; N202-G205 PolarHBondContact OD1-N 3.43Å; N202-E206 PolarHBondContact N-O 2.95Å; N202-E206 PolarHBondContact ND2-OE2 2.83Å; N202-E206 WeakPolarHBondContact OD1-CB 3.47Å; N202-E206 PolarHBondContact OD1-N 3.4Å; N202-L382 WeakPolarHBondContact O-CD2 3.44Å
203	S	96.6	Very high	94.7	Very high	9 Å²	9	20.2 Å²	20.2	6%	0.063	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.2	-178.6	61.3	0	0	0	0	114.2	D150 G205	D150-S203 PolarHBondContact OD1-N 3.14Å; D150-S203 PolarHBondContact OD1-OG 3.31Å; D150-S203 VanDerWaalsContact OD2-CB 3.31Å; D150-S203 WeakPolarHBondContact OD2-CB 3.34Å; D150-S203 PolarHBondContact OD2-OG 3.12Å; S203-G205 VanDerWaalsContact C-N 3.3Å
204	R	95.1	Very high	93.9	Very high	105 Å²	105	19.9 Å²	19.9	40%	0.396	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	0.5	172.9	-56.7	-174.4	-64.3	-109.6	3.4	113.6	R52 N202 E206 P391	R52-R204 PolarHBondContact NH1-O 3.43Å; R52-R204 PolarHBondContact NH2-O 2.87Å; N202-R204 PolarHBondContact ND2-NH2 3.15Å; N202-R204 PolarHBondContact O-N 3.1Å; N202-R204 WeakPolarHBondContact OD1-CA 3.19Å; N202-R204 WeakPolarHBondContact OD1-CB 3.43Å; N202-R204 PolarHBondContact OD1-N 3.23Å; N202-R204 VanDerWaalsContact OD1-N 3.14Å; R204-E206 IonicContact CZ-OE2 3.82Å; R204-E206 VanDerWaalsContact CZ-OE2 3.23Å; R204-E206 IonicContact NE-OE2 3.46Å; R204-E206 PolarHBondContact NE-OE2 2.95Å; R204-E206 IonicContact NH2-OE2 2.72Å; R204-E206 PolarHBondContact NH2-OE2 3.48Å; R204-P391 HydrophobicContact CG-CG 3.99Å
205	G	96	Very high	93	Very high	24 Å²	24	20 Å²	20	25%	0.247	11%	0.111	C	C	.	.			trans	78.3	18.6	179.8	0	0	0	0	0	115.2	N202 S203	N202-G205 WeakPolarHBondContact O-CA 3.19Å; N202-G205 PolarHBondContact O-N 2.89Å; N202-G205 PolarHBondContact OD1-N 3.43Å; S203-G205 VanDerWaalsContact C-N 3.3Å
206	E	97.9	Very high	91.9	Very high	17 Å²	17	20.3 Å²	20.3	8%	0.079	12%	0.121	C	C	.	.			trans	-79.5	143.4	173.5	-57.5	170.5	84.3	0	0	110.3	M149 V201 N202 R204 K208	M149-E206 HydrophobicContact CE-CB 4.42Å; V201-E206 VanDerWaalsContact CA-O 3.29Å; V201-E206 WeakPolarHBondContact CA-O 3.28Å; N202-E206 PolarHBondContact N-O 2.95Å; N202-E206 PolarHBondContact ND2-OE2 2.83Å; N202-E206 WeakPolarHBondContact OD1-CB 3.47Å; N202-E206 PolarHBondContact OD1-N 3.4Å; R204-E206 IonicContact CZ-OE2 3.82Å; R204-E206 VanDerWaalsContact CZ-OE2 3.23Å; R204-E206 IonicContact NE-OE2 3.46Å; R204-E206 PolarHBondContact NE-OE2 2.95Å; R204-E206 IonicContact NH2-OE2 2.72Å; R204-E206 PolarHBondContact NH2-OE2 3.48Å; E206-K208 HydrophobicContact CB-CG 4.49Å; E206-K208 WeakPolarHBondContact OE1-CE 3.47Å; E206-K208 IonicContact OE1-NZ 2.7Å; E206-K208 PolarHBondContact OE1-NZ 3.02Å
207	I	98.7	Very high	90.5	Very high	13 Å²	13	23.3 Å²	23.3	7%	0.067	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	119.8	176.8	-52.7	169.9	0	0	0	106.9	K171 V172 A175 I199 L200 V201 F378	K171-I207 HydrophobicContact CB-CD1 4.28Å; V172-I207 HydrophobicContact CB-CD1 4.49Å; V172-I207 HydrophobicContact CG2-CD1 3.97Å; A175-I207 HydrophobicContact CB-CB 3.6Å; A175-I207 HydrophobicContact CB-CD1 4.28Å; A175-I207 HydrophobicContact CB-CG2 3.71Å; I199-I207 HydrophobicContact CG2-CG2 3.66Å; L200-I207 WeakPolarHBondContact O-CA 3.49Å; V201-I207 HydrophobicContact CG1-CB 4.49Å; V201-I207 HydrophobicContact CG1-CG1 4.17Å; V201-I207 HydrophobicContact CG1-CG2 4.28Å; I207-F378 HydrophobicContact CD1-CD2 3.98Å; I207-F378 HydrophobicContact CD1-CE1 4.15Å; I207-F378 HydrophobicContact CD1-CE2 3.53Å; I207-F378 HydrophobicContact CD1-CG 4.47Å; I207-F378 HydrophobicContact CD1-CZ 3.64Å; I207-F378 HydrophobicContact CG1-CD1 4.46Å; I207-F378 HydrophobicContact CG1-CE1 3.83Å; I207-F378 HydrophobicContact CG1-CE2 4.08Å; I207-F378 HydrophobicContact CG1-CZ 3.63Å
208	K	98.7	Very high	89.4	Confident	11 Å²	11	21.8 Å²	21.8	5%	0.048	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.5	-170.1	-57.9	-170.2	-175.8	-176.2	0	112.4	P127 Y128 V130 E147 M149 L200 E206	P127-K208 VanDerWaalsContact O-CE 3.3Å; P127-K208 WeakPolarHBondContact O-CE 3.28Å; P127-K208 WeakPolarHBondContact O-CG 3.35Å; Y128-K208 CarbonylContact O-C 3.54Å; Y128-K208 WeakPolarHBondContact O-CA 3.42Å; V130-K208 HydrophobicContact CG2-CB 3.54Å; E147-K208 VanDerWaalsContact CD-NZ 3.32Å; E147-K208 WeakPolarHBondContact OE1-CD 3.25Å; E147-K208 WeakPolarHBondContact OE1-CE 3.02Å; E147-K208 IonicContact OE1-NZ 3.13Å; E147-K208 PolarHBondContact OE1-NZ 2.82Å; E147-K208 IonicContact OE2-NZ 2.71Å; E147-K208 PolarHBondContact OE2-NZ 3.21Å; E147-K208 VanDerWaalsContact OE2-NZ 3.07Å; M149-K208 HydrophobicContact CE-CB 4.12Å; M149-K208 HydrophobicContact CE-CD 4Å; M149-K208 HydrophobicContact CE-CG 3.92Å; M149-K208 HydrophobicContact SD-CD 4.2Å; L200-K208 PolarHBondContact N-O 3.26Å; L200-K208 PolarHBondContact O-N 3.28Å; E206-K208 HydrophobicContact CB-CG 4.49Å; E206-K208 WeakPolarHBondContact OE1-CE 3.47Å; E206-K208 IonicContact OE1-NZ 2.7Å; E206-K208 PolarHBondContact OE1-NZ 3.02Å
209	L	98.3	Very high	88.3	Confident	2 Å²	2	23.3 Å²	23.3	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	139.9	173.2	-63.7	170.9	0	0	0	110.8	Y128 I129 V130 V176 L180 I199	Y128-L209 PolarHBondContact O-N 3.41Å; I129-L209 HydrophobicContact CD1-CB 4.11Å; I129-L209 HydrophobicContact CD1-CD1 4.49Å; V130-L209 WeakPolarHBondContact CG2-O 3.43Å; V130-L209 PolarHBondContact N-O 3.3Å; V176-L209 HydrophobicContact CG1-CD2 4.35Å; V176-L209 HydrophobicContact CG2-CD2 4.2Å; L180-L209 HydrophobicContact CD2-CD1 4.11Å; L180-L209 HydrophobicContact CG-CD1 4.14Å; I199-L209 HydrophobicContact CG1-CD2 3.91Å
210	C	94.7	Very high	86.8	Confident	7 Å²	7	27.3 Å²	27.3	5%	0.047	15%	0.152	C	C	.	.			trans	-126.7	175.1	170.7	67.8	0	0	0	0	111.2	V130 H191 N198 L200 F212	V130-C210 HydrophobicContact CB-CB 4.14Å; V130-C210 HydrophobicContact CG2-CB 3.87Å; H191-C210 PolarHBondContact CE1-O 3.14Å; H191-C210 PolarHBondContact NE2-O 3.33Å; N198-C210 PolarHBondContact O-N 3.27Å; N198-C210 VanDerWaalsContact O-N 3.09Å; L200-C210 HydrophobicContact CD1-CB 4.14Å; L200-C210 HydrophobicContact CG-CB 4.31Å; C210-F212 PolarHBondContact O-N 3.1Å; C210-F212 VanDerWaalsContact O-N 3.13Å
211	D	87	Confident	85.3	Confident	54 Å²	54	27.6 Å²	27.6	29%	0.289	16%	0.156	S	C	.	.	S	Bend	trans	55.1	35.3	171.4	-73.8	-23.2	0	0	0	114.7	K100	K100-D211 IonicContact NZ-OD1 3.75Å; K100-D211 PolarHBondContact NZ-OD1 2.87Å; K100-D211 IonicContact NZ-OD2 2.84Å; K100-D211 PolarHBondContact NZ-OD2 2.5Å
212	F	85.6	Confident	83.8	Confident	20 Å²	20	30.3 Å²	30.3	9%	0.088	17%	0.17	C	C	.	.			trans	-79.4	149	174	55.1	-86.2	0	0	0	112.1	L121 C124 I129 L183 I189 H191 C210 V214	L121-F212 HydrophobicContact CD2-CD2 4.38Å; L121-F212 HydrophobicContact CD2-CE1 4.02Å; L121-F212 HydrophobicContact CD2-CE2 3.43Å; L121-F212 VanDerWaalsContact CD2-CE2 3.43Å; L121-F212 HydrophobicContact CD2-CZ 3.21Å; C124-F212 HydrophobicContact CB-CZ 4.05Å; I129-F212 HydrophobicContact CG2-CD1 4.46Å; I129-F212 HydrophobicContact CG2-CE1 3.47Å; I129-F212 VanDerWaalsContact CG2-CE1 3.47Å; I129-F212 HydrophobicContact CG2-CZ 3.81Å; L183-F212 HydrophobicContact CD1-CB 3.97Å; L183-F212 HydrophobicContact CD1-CD1 4.35Å; L183-F212 HydrophobicContact CD1-CD2 4.13Å; L183-F212 HydrophobicContact CD1-CG 3.91Å; L183-F212 HydrophobicContact CD2-CD2 3.71Å; L183-F212 HydrophobicContact CD2-CE1 4.42Å; L183-F212 HydrophobicContact CD2-CE2 3.54Å; L183-F212 HydrophobicContact CD2-CG 4.19Å; L183-F212 HydrophobicContact CD2-CZ 3.93Å; I189-F212 HydrophobicContact CG2-CD2 4.05Å; H191-F212 HydrophobicContact CB-CB 4.21Å; C210-F212 PolarHBondContact O-N 3.1Å; C210-F212 VanDerWaalsContact O-N 3.13Å; F212-V214 HydrophobicContact CD2-CG2 3.34Å; F212-V214 HydrophobicContact CE2-CG2 3.25Å; F212-V214 HydrophobicContact CG-CG2 4.44Å; F212-V214 HydrophobicContact CZ-CG2 4.3Å; F212-V214 PolarHBondContact O-N 3.39Å
213	G	77.5	Confident	81.8	Confident	16 Å²	16	32.5 Å²	32.5	17%	0.165	19%	0.188	C	C	.	.			trans	-73.3	75.9	-169.4	0	0	0	0	0	115.6	H191	H191-G213 PolarHBondContact O-N 3.13Å
214	V	74.3	Confident	79.6	Confident	26 Å²	26	39 Å²	39	16%	0.158	22%	0.222	C	C	.	.			trans	-82.4	-38.8	177.6	-175.1	0	0	0	0	113.1	E117 V120 L121 I189 F212	E117-V214 VanDerWaalsContact O-CG1 3.25Å; E117-V214 WeakPolarHBondContact O-CG1 3.17Å; V120-V214 HydrophobicContact CB-CG1 3.81Å; V120-V214 HydrophobicContact CG1-CG1 4.21Å; L121-V214 HydrophobicContact CD2-CB 4.41Å; L121-V214 HydrophobicContact CD2-CG2 3.49Å; L121-V214 VanDerWaalsContact CD2-CG2 3.49Å; L121-V214 HydrophobicContact CG-CG2 4.08Å; I189-V214 HydrophobicContact CD1-CG2 4.21Å; F212-V214 HydrophobicContact CD2-CG2 3.34Å; F212-V214 HydrophobicContact CE2-CG2 3.25Å; F212-V214 HydrophobicContact CG-CG2 4.44Å; F212-V214 HydrophobicContact CZ-CG2 4.3Å; F212-V214 PolarHBondContact O-N 3.39Å
215	S	75.6	Confident	77.4	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.021	22%	0.222	C	C	.	.			trans	-104.6	111.6	180	175.2	0	0	0	0	111.3	E117 Q217 L218 I219	E117-S215 WeakPolarHBondContact OE2-CA 3.41Å; E117-S215 WeakPolarHBondContact OE2-CB 3.49Å; E117-S215 PolarHBondContact OE2-OG 2.97Å; S215-Q217 VanDerWaalsContact C-N 3.26Å; S215-Q217 PolarHBondContact O-N 2.99Å; S215-L218 PolarHBondContact O-N 2.92Å; S215-L218 WeakPolarHBondContact OG-CB 3.49Å; S215-L218 PolarHBondContact OG-N 3.11Å; S215-L218 VanDerWaalsContact OG-N 3.09Å; S215-I219 WeakPolarHBondContact O-CD1 3.39Å; S215-I219 WeakPolarHBondContact O-CG1 3.41Å; S215-I219 PolarHBondContact O-N 3.01Å
216	G	72.9	Confident	75.4	Confident	29 Å²	29	41 Å²	41	30%	0.299	23%	0.234	S	C	.	.	H	α-helix	trans	-59.5	-39.5	174	0	0	0	0	0	111.8	E117 I219 D220	E117-G216 PolarHBondContact OE2-N 3.31Å; G216-I219 PolarHBondContact O-N 3.03Å; G216-D220 WeakPolarHBondContact O-CB 3.27Å; G216-D220 PolarHBondContact O-N 3.38Å
217	Q	67.9	Low	73.1	Confident	64 Å²	64	43.8 Å²	43.8	30%	0.299	25%	0.252	S	S	.	.	H	α-helix	trans	-65.9	-40.6	177.6	-68.3	-63.1	-21.1	0	0	112.7	Q113 I114 S215 D220 S221	Q113-Q217 HydrophobicContact CG-CG 4.32Å; I114-Q217 HydrophobicContact CD1-CB 4.33Å; I114-Q217 HydrophobicContact CG1-CB 3.8Å; S215-Q217 VanDerWaalsContact C-N 3.26Å; S215-Q217 PolarHBondContact O-N 2.99Å; Q217-D220 PolarHBondContact O-N 2.98Å; Q217-S221 VanDerWaalsContact O-CB 3.28Å; Q217-S221 WeakPolarHBondContact O-CB 3.33Å; Q217-S221 PolarHBondContact O-N 2.97Å; Q217-S221 PolarHBondContact O-OG 2.51Å
218	L	71.5	Confident	70.8	Confident	14 Å²	14	45.3 Å²	45.3	7%	0.073	27%	0.271	C	S	.	.	H	α-helix	trans	-65.8	-43	175.1	-170.2	67.7	0	0	0	110.5	I102 L104 I114 I142 S215 S221 M222	I102-L218 HydrophobicContact CD1-CD1 4.39Å; I102-L218 HydrophobicContact CD1-CD2 4.21Å; L104-L218 HydrophobicContact CD1-CD1 3.39Å; I114-L218 HydrophobicContact CD1-CB 4.41Å; I114-L218 HydrophobicContact CD1-CD1 4.24Å; I114-L218 HydrophobicContact CG1-CB 4.47Å; I114-L218 HydrophobicContact CG2-CB 4.22Å; I114-L218 HydrophobicContact CG2-CD1 4.2Å; I142-L218 HydrophobicContact CD1-CD1 4.48Å; S215-L218 PolarHBondContact O-N 2.92Å; S215-L218 WeakPolarHBondContact OG-CB 3.49Å; S215-L218 PolarHBondContact OG-N 3.11Å; S215-L218 VanDerWaalsContact OG-N 3.09Å; L218-S221 PolarHBondContact O-N 3.31Å; L218-M222 HydrophobicContact CD2-CE 4.35Å; L218-M222 HydrophobicContact CG-CE 3.94Å; L218-M222 HydrophobicContact CG-SD 4.28Å; L218-M222 WeakPolarHBondContact O-CB 3.46Å; L218-M222 VanDerWaalsContact O-CG 3.28Å; L218-M222 WeakPolarHBondContact O-CG 3.3Å; L218-M222 PolarHBondContact O-N 2.82Å
219	I	71.6	Confident	68.9	Low	40 Å²	40	46.8 Å²	46.8	21%	0.205	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-49.7	175.2	-66.1	162.6	0	0	0	110.3	S215 G216 S221 M222 A223	S215-I219 WeakPolarHBondContact O-CD1 3.39Å; S215-I219 WeakPolarHBondContact O-CG1 3.41Å; S215-I219 PolarHBondContact O-N 3.01Å; G216-I219 PolarHBondContact O-N 3.03Å; I219-S221 VanDerWaalsContact C-N 3.31Å; I219-S221 PolarHBondContact O-N 2.77Å; I219-M222 CarbonylContact O-C 3.59Å; I219-M222 PolarHBondContact O-N 2.68Å; I219-A223 WeakPolarHBondContact O-CA 3.4Å; I219-A223 WeakPolarHBondContact O-CB 3.45Å; I219-A223 PolarHBondContact O-N 3.23Å
220	D	68.5	Low	67.6	Low	88 Å²	88	51.3 Å²	51.3	47%	0.471	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-38.9	-178.8	-68.6	-20.1	0	0	0	111.5	G216 Q217 M222 A223 N224	G216-D220 WeakPolarHBondContact O-CB 3.27Å; G216-D220 PolarHBondContact O-N 3.38Å; Q217-D220 PolarHBondContact O-N 2.98Å; D220-M222 VanDerWaalsContact C-N 3.34Å; D220-M222 PolarHBondContact O-N 2.83Å; D220-A223 PolarHBondContact O-N 3.35Å; D220-N224 PolarHBondContact O-N 2.75Å; D220-N224 PolarHBondContact O-ND2 3.01Å
221	S	66.8	Low	67.1	Low	36 Å²	36	51.8 Å²	51.8	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-65.2	-36	176.1	-58.4	0	0	0	0	112.3	Q217 L218 I219	Q217-S221 VanDerWaalsContact O-CB 3.28Å; Q217-S221 WeakPolarHBondContact O-CB 3.33Å; Q217-S221 PolarHBondContact O-N 2.97Å; Q217-S221 PolarHBondContact O-OG 2.51Å; L218-S221 PolarHBondContact O-N 3.31Å; I219-S221 VanDerWaalsContact C-N 3.31Å; I219-S221 PolarHBondContact O-N 2.77Å
222	M	65.9	Low	67.3	Low	58 Å²	58	50.7 Å²	50.7	29%	0.286	29%	0.294	S	S	.	.	H	α-helix	trans	-85.2	-27.9	176.5	-66.4	-173.2	-53.7	0	0	113.6	L218 I219 D220 S225	L218-M222 HydrophobicContact CD2-CE 4.35Å; L218-M222 HydrophobicContact CG-CE 3.94Å; L218-M222 HydrophobicContact CG-SD 4.28Å; L218-M222 WeakPolarHBondContact O-CB 3.46Å; L218-M222 VanDerWaalsContact O-CG 3.28Å; L218-M222 WeakPolarHBondContact O-CG 3.3Å; L218-M222 PolarHBondContact O-N 2.82Å; I219-M222 CarbonylContact O-C 3.59Å; I219-M222 PolarHBondContact O-N 2.68Å; D220-M222 VanDerWaalsContact C-N 3.34Å; D220-M222 PolarHBondContact O-N 2.83Å; M222-S225 PolarHBondContact O-N 3.47Å; M222-S225 PolarHBondContact O-OG 3.03Å
223	A	57.2	Low	67.7	Low	46 Å²	46	51.3 Å²	51.3	38%	0.38	30%	0.297	S	S	.	.	H	α-helix	trans	-77.6	-27.9	-175.2	0	0	0	0	0	112.5	I219 D220 S225	I219-A223 WeakPolarHBondContact O-CA 3.4Å; I219-A223 WeakPolarHBondContact O-CB 3.45Å; I219-A223 PolarHBondContact O-N 3.23Å; D220-A223 PolarHBondContact O-N 3.35Å; A223-S225 PolarHBondContact O-N 3.41Å
224	N	50.5	Low	68.5	Low	147 Å²	147	50.6 Å²	50.6	79%	0.786	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-11.3	175	-78.6	-25.8	0	0	0	113.5	D220	D220-N224 PolarHBondContact O-N 2.75Å; D220-N224 PolarHBondContact O-ND2 3.01Å
225	S	48.9	Very low	69.5	Low	55 Å²	55	49.6 Å²	49.6	39%	0.385	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-25.3	-170.1	53.6	0	0	0	0	115.2	M222 A223	M222-S225 PolarHBondContact O-N 3.47Å; M222-S225 PolarHBondContact O-OG 3.03Å; A223-S225 PolarHBondContact O-N 3.41Å
226	F	53.6	Low	70.4	Confident	115 Å²	115	49.6 Å²	49.6	50%	0.504	28%	0.283	S	S	.	.			trans	-147.9	159.1	-170.2	-59.3	-71.9	0	0	0	119.5
227	V	48.8	Very low	71.3	Confident	75 Å²	75	50.4 Å²	50.4	46%	0.455	28%	0.277	S	S	.	.	S	Bend	trans	-100.2	-31.5	-162.4	173.9	0	0	0	0	112.8	T229 R230 I317	V227-T229 PolarHBondContact O-N 3.3Å; V227-R230 WeakPolarHBondContact O-CB 3.47Å; V227-R230 WeakPolarHBondContact O-CG 3.25Å; V227-R230 PolarHBondContact O-N 3.25Å; V227-I317 HydrophobicContact CG1-CB 3.51Å; V227-I317 HydrophobicContact CG1-CD1 3.81Å; V227-I317 HydrophobicContact CG1-CG1 3.29Å; V227-I317 HydrophobicContact CG1-CG2 3.5Å
228	G	51	Low	72.3	Confident	46 Å²	46	49.5 Å²	49.5	47%	0.474	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-75.2	-21.2	-172.6	0	0	0	0	0	116.1	R230	G228-R230 PolarHBondContact O-N 3.33Å
229	T	59.3	Low	73.1	Confident	42 Å²	42	54.3 Å²	54.3	26%	0.258	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-74.4	-10.5	175.9	-51.2	0	0	0	0	112.2	N81 D193 V227	N81-T229 PolarHBondContact ND2-OG1 3.21Å; D193-T229 VanDerWaalsContact OD1-CG2 3.24Å; D193-T229 WeakPolarHBondContact OD1-CG2 3.31Å; V227-T229 PolarHBondContact O-N 3.3Å
230	R	70.1	Confident	73.8	Confident	96 Å²	96	55.7 Å²	55.7	36%	0.362	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-84.6	-16.7	-172.5	-50.2	-159.5	177.5	173.5	-3.5	114.1	V227 G228 Y232 M233 L321	V227-R230 WeakPolarHBondContact O-CB 3.47Å; V227-R230 WeakPolarHBondContact O-CG 3.25Å; V227-R230 PolarHBondContact O-N 3.25Å; G228-R230 PolarHBondContact O-N 3.33Å; R230-Y232 VanDerWaalsContact C-N 3.28Å; R230-Y232 PolarHBondContact O-N 3Å; R230-M233 HydrophobicContact CB-CE 3.53Å; R230-M233 HydrophobicContact CG-CE 3.31Å; R230-M233 WeakPolarHBondContact O-CB 3.2Å; R230-M233 PolarHBondContact O-N 3.4Å; R230-L321 HydrophobicContact CB-CD1 4.48Å; R230-L321 HydrophobicContact CB-CD2 3.8Å
231	S	83.8	Confident	74.6	Confident	18 Å²	18	54.7 Å²	54.7	13%	0.126	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.1	-174.9	-53.9	0	0	0	0	113.3	L254 Y264 L320 I324	S231-L254 WeakPolarHBondContact O-CD2 3.19Å; S231-Y264 WeakPolarHBondContact CB-OH 3.34Å; S231-Y264 PolarHBondContact O-OH 3.4Å; S231-L320 WeakPolarHBondContact OG-CD2 3.32Å; S231-I324 VanDerWaalsContact O-CD1 3.22Å; S231-I324 WeakPolarHBondContact O-CD1 3.28Å
232	Y	93.1	Very high	75.4	Confident	31 Å²	31	61.4 Å²	61.4	12%	0.122	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	1.5	178.5	-56.2	-92	0	0	0	113.6	K195 R230 S251 L254 E258 Y264	K195-Y232 HydrophobicContact CB-CD1 4.12Å; K195-Y232 HydrophobicContact CB-CD2 3.77Å; K195-Y232 HydrophobicContact CB-CE1 4.28Å; K195-Y232 HydrophobicContact CB-CE2 3.94Å; K195-Y232 HydrophobicContact CB-CG 3.89Å; K195-Y232 HydrophobicContact CD-CD2 4.17Å; K195-Y232 HydrophobicContact CD-CE2 4.31Å; R230-Y232 VanDerWaalsContact C-N 3.28Å; R230-Y232 PolarHBondContact O-N 3Å; Y232-S251 WeakPolarHBondContact O-CB 3.49Å; Y232-S251 PolarHBondContact O-OG 2.98Å; Y232-L254 HydrophobicContact CD1-CB 4.38Å; Y232-L254 HydrophobicContact CD1-CD2 3.89Å; Y232-L254 HydrophobicContact CD1-CG 4.34Å; Y232-L254 HydrophobicContact CE1-CD2 4.49Å; Y232-L254 HydrophobicContact CG-CD2 4.44Å; Y232-E258 VanDerWaalsContact CE1-OE2 3.31Å; Y232-E258 WeakPolarHBondContact CE1-OE2 3.28Å; Y232-E258 PolarHBondContact OH-OE1 3.46Å; Y232-E258 PolarHBondContact OH-OE2 2.7Å; Y232-Y264 HydrophobicContact CD1-CE2 4.39Å; Y232-Y264 HydrophobicContact CE1-CD2 4.11Å; Y232-Y264 AromaticContact CE1-CE2 3.84Å; Y232-Y264 HydrophobicContact CE1-CE2 3.84Å; Y232-Y264 HydrophobicContact CE2-CE2 4.36Å; Y232-Y264 AromaticContact CZ-CD2 3.91Å; Y232-Y264 AromaticContact CZ-CE2 3.81Å
233	M	92.4	Very high	76.4	Confident	33 Å²	33	62.3 Å²	62.3	16%	0.163	35%	0.345	C	S	.	.			trans	-68.6	142.4	178.7	-77.7	-159.4	-107.2	0	0	110.9	R230 R237 L238 W250	R230-M233 HydrophobicContact CB-CE 3.53Å; R230-M233 HydrophobicContact CG-CE 3.31Å; R230-M233 WeakPolarHBondContact O-CB 3.2Å; R230-M233 PolarHBondContact O-N 3.4Å; M233-R237 HydrophobicContact SD-CB 4.4Å; M233-L238 HydrophobicContact CB-CD2 3.83Å; M233-L238 HydrophobicContact CB-CG 3.99Å; M233-L238 HydrophobicContact CE-CD2 4.4Å; M233-L238 HydrophobicContact SD-CD2 4.33Å; M233-W250 PolarHBondContact O-NE1 3.11Å
234	S	95	Very high	78	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.342	C	S	.	.			trans	-70.8	155.4	175.8	64.3	0	0	0	0	111.9	E236 R237 L238 S247 W250	S234-E236 VanDerWaalsContact C-N 3.26Å; S234-E236 VanDerWaalsContact CB-CD 3.4Å; S234-E236 WeakPolarHBondContact CB-OE1 3.16Å; S234-E236 VanDerWaalsContact CB-OE2 3.28Å; S234-E236 WeakPolarHBondContact CB-OE2 3.27Å; S234-E236 PolarHBondContact O-N 2.85Å; S234-E236 PolarHBondContact OG-OE1 3.35Å; S234-E236 PolarHBondContact OG-OE2 3.14Å; S234-R237 PolarHBondContact O-N 3.08Å; S234-R237 VanDerWaalsContact O-N 3.14Å; S234-R237 WeakPolarHBondContact OG-CG 3.38Å; S234-L238 PolarHBondContact O-N 3.03Å; S234-L238 VanDerWaalsContact O-N 3.13Å; S234-S247 VanDerWaalsContact OG-CB 3.25Å; S234-S247 WeakPolarHBondContact OG-CB 3.34Å; S234-S247 PolarHBondContact OG-OG 2.96Å; S234-S247 VanDerWaalsContact OG-OG 3.08Å; S234-W250 VanDerWaalsContact CA-CD1 3.42Å
235	P	95.3	Very high	80	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.032	31%	0.31	C	S	.	.	H	α-helix	trans	-56.6	-42	-178.3	-19.8	26.3	0	0	0	111.9	R237 L238 Q239 W250 I324 K351	P235-R237 VanDerWaalsContact C-N 3.28Å; P235-R237 PolarHBondContact O-N 3.01Å; P235-L238 PolarHBondContact O-N 3.15Å; P235-Q239 WeakPolarHBondContact O-CG 3.27Å; P235-Q239 PolarHBondContact O-N 3.13Å; P235-W250 HydrophobicContact CG-CE3 4.31Å; P235-W250 HydrophobicContact CG-CH2 3.75Å; P235-W250 HydrophobicContact CG-CZ2 4Å; P235-W250 HydrophobicContact CG-CZ3 3.9Å; P235-I324 HydrophobicContact CG-CG2 4.07Å; P235-K351 HydrophobicContact CG-CB 4.35Å; P235-K351 HydrophobicContact CG-CG 4.32Å
236	E	94.5	Very high	82.3	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.019	30%	0.297	C	S	.	.	H	α-helix	trans	-64.8	-32.7	-177.4	71.7	-82.8	178.6	0	0	112.7	S234 G240 T241 S247 P353 R356	S234-E236 VanDerWaalsContact C-N 3.26Å; S234-E236 VanDerWaalsContact CB-CD 3.4Å; S234-E236 WeakPolarHBondContact CB-OE1 3.16Å; S234-E236 VanDerWaalsContact CB-OE2 3.28Å; S234-E236 WeakPolarHBondContact CB-OE2 3.27Å; S234-E236 PolarHBondContact O-N 2.85Å; S234-E236 PolarHBondContact OG-OE1 3.35Å; S234-E236 PolarHBondContact OG-OE2 3.14Å; E236-G240 PolarHBondContact O-N 2.92Å; E236-T241 WeakPolarHBondContact CA-OG1 3.34Å; E236-T241 VanDerWaalsContact CB-OG1 3.32Å; E236-T241 WeakPolarHBondContact CB-OG1 3.24Å; E236-T241 PolarHBondContact O-N 3.09Å; E236-T241 PolarHBondContact O-OG1 3.29Å; E236-S247 WeakPolarHBondContact OE1-CA 3.38Å; E236-S247 WeakPolarHBondContact OE1-CB 3.39Å; E236-S247 PolarHBondContact OE1-OG 2.84Å; E236-P353 HydrophobicContact CB-CG 4.09Å; E236-P353 HydrophobicContact CG-CB 4.21Å; E236-P353 HydrophobicContact CG-CG 4.02Å; E236-R356 IonicContact OE1-CZ 2.7Å; E236-R356 IonicContact OE1-NH1 3.1Å; E236-R356 PolarHBondContact OE1-NH1 3.46Å; E236-R356 IonicContact OE1-NH2 2.77Å; E236-R356 IonicContact OE2-CZ 2.97Å; E236-R356 IonicContact OE2-NH1 2.9Å; E236-R356 PolarHBondContact OE2-NH1 2.86Å; E236-R356 IonicContact OE2-NH2 3.82Å; E236-R356 PolarHBondContact OE2-NH2 3.15Å
237	R	91.3	Very high	84.3	Confident	45 Å²	45	49.1 Å²	49.1	17%	0.17	27%	0.273	C	S	.	.	H	α-helix	trans	-72.2	-41.6	174.6	-78.4	178.3	64.4	-169.5	2.7	111.7	R192 M233 S234 P235 Q239 G240 Y243	R192-R237 PolarHBondContact O-NH1 3.18Å; R192-R237 PolarHBondContact O-NH2 2.9Å; M233-R237 HydrophobicContact SD-CB 4.4Å; S234-R237 PolarHBondContact O-N 3.08Å; S234-R237 VanDerWaalsContact O-N 3.14Å; S234-R237 WeakPolarHBondContact OG-CG 3.38Å; P235-R237 VanDerWaalsContact C-N 3.28Å; P235-R237 PolarHBondContact O-N 3.01Å; R237-Q239 PolarHBondContact O-N 2.95Å; R237-G240 PolarHBondContact O-N 2.94Å; R237-Y243 HydrophobicContact CG-CD1 3.86Å; R237-Y243 HydrophobicContact CG-CD2 3.96Å; R237-Y243 HydrophobicContact CG-CG 3.55Å
238	L	89.9	Confident	86.5	Confident	46 Å²	46	45.7 Å²	45.7	24%	0.241	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-31.9	178	-67.7	177.1	0	0	0	112.1	M233 S234 P235 G240 L321 I324 V325	M233-L238 HydrophobicContact CB-CD2 3.83Å; M233-L238 HydrophobicContact CB-CG 3.99Å; M233-L238 HydrophobicContact CE-CD2 4.4Å; M233-L238 HydrophobicContact SD-CD2 4.33Å; S234-L238 PolarHBondContact O-N 3.03Å; S234-L238 VanDerWaalsContact O-N 3.13Å; P235-L238 PolarHBondContact O-N 3.15Å; L238-G240 VanDerWaalsContact C-N 3.29Å; L238-L321 HydrophobicContact CD1-CB 4.38Å; L238-L321 HydrophobicContact CD1-CD2 4.02Å; L238-L321 HydrophobicContact CD2-CD2 3.88Å; L238-I324 HydrophobicContact CD1-CB 3.96Å; L238-I324 HydrophobicContact CD1-CD1 4.26Å; L238-I324 HydrophobicContact CD1-CG2 3.61Å; L238-V325 HydrophobicContact CB-CG2 3.88Å; L238-V325 HydrophobicContact CD1-CG2 4.02Å
239	Q	87.6	Confident	88.8	Confident	115 Å²	115	43.5 Å²	43.5	54%	0.537	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-4.7	175.1	-68.2	175.3	-27.1	0	0	113.7	P235 R237 T241 V325	P235-Q239 WeakPolarHBondContact O-CG 3.27Å; P235-Q239 PolarHBondContact O-N 3.13Å; R237-Q239 PolarHBondContact O-N 2.95Å; Q239-T241 VanDerWaalsContact C-N 3.28Å; Q239-T241 HydrophobicContact CB-CG2 4.05Å; Q239-T241 PolarHBondContact O-N 2.88Å; Q239-V325 HydrophobicContact CG-CG1 3.96Å; Q239-V325 HydrophobicContact CG-CG2 4.34Å
240	G	85.4	Confident	90.7	Very high	69 Å²	69	41.6 Å²	41.6	71%	0.711	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	71	19.4	-179.1	0	0	0	0	0	114.4	E236 R237 L238	E236-G240 PolarHBondContact O-N 2.92Å; R237-G240 PolarHBondContact O-N 2.94Å; L238-G240 VanDerWaalsContact C-N 3.29Å
241	T	85.8	Confident	92	Very high	66 Å²	66	37 Å²	37	41%	0.405	20%	0.201	S	C	.	.			trans	-80.1	171.1	176.9	67.3	0	0	0	0	111.2	E236 Q239 Y243	E236-T241 WeakPolarHBondContact CA-OG1 3.34Å; E236-T241 VanDerWaalsContact CB-OG1 3.32Å; E236-T241 WeakPolarHBondContact CB-OG1 3.24Å; E236-T241 PolarHBondContact O-N 3.09Å; E236-T241 PolarHBondContact O-OG1 3.29Å; Q239-T241 VanDerWaalsContact C-N 3.28Å; Q239-T241 HydrophobicContact CB-CG2 4.05Å; Q239-T241 PolarHBondContact O-N 2.88Å; T241-Y243 PolarHBondContact O-N 3.43Å
242	H	83.9	Confident	92.7	Very high	177 Å²	177	36.3 Å²	36.3	82%	0.819	20%	0.195	S	C	*	.			trans	-62.8	128.8	175.6	-173.4	72.5	0	0	0	110.4
243	Y	86.6	Confident	92.9	Very high	77 Å²	77	34.9 Å²	34.9	30%	0.302	19%	0.19	S	C	.	.			trans	-126.5	155.7	-177.4	64.9	-93.8	0	0	0	111.3	M190 R237 T241 S247	M190-Y243 HydrophobicContact CE-CE2 4.23Å; M190-Y243 HydrophobicContact SD-CD2 4.3Å; M190-Y243 HydrophobicContact SD-CE2 4.46Å; R237-Y243 HydrophobicContact CG-CD1 3.86Å; R237-Y243 HydrophobicContact CG-CD2 3.96Å; R237-Y243 HydrophobicContact CG-CG 3.55Å; T241-Y243 PolarHBondContact O-N 3.43Å; Y243-S247 WeakPolarHBondContact CB-OG 3.35Å
244	S	91	Very high	93.2	Very high	46 Å²	46	33.3 Å²	33.3	32%	0.322	18%	0.182	S	C	.	.			trans	-139	-167.1	-176.1	71.9	0	0	0	0	110.1	M190 Q246 S247	M190-S244 VanDerWaalsContact SD-CA 3.5Å; S244-Q246 PolarHBondContact O-N 2.81Å; S244-Q246 WeakPolarHBondContact OG-CG 3.49Å; S244-Q246 PolarHBondContact OG-N 3.39Å; S244-S247 WeakPolarHBondContact O-CB 3.41Å; S244-S247 PolarHBondContact O-N 3.41Å; S244-S247 PolarHBondContact O-OG 3.22Å
245	V	92.6	Very high	93.4	Very high	18 Å²	18	33.4 Å²	33.4	11%	0.109	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-19.3	172.8	71.7	0	0	0	0	113.1	S247 D248 V249 L359	V245-S247 PolarHBondContact O-N 2.88Å; V245-D248 WeakPolarHBondContact O-CB 3.17Å; V245-D248 PolarHBondContact O-N 3.45Å; V245-V249 PolarHBondContact O-N 2.97Å; V245-L359 HydrophobicContact CG2-CD1 3.78Å; V245-L359 HydrophobicContact CG2-CG 4.26Å
246	Q	96.5	Very high	93.5	Very high	22 Å²	22	33.3 Å²	33.3	10%	0.103	18%	0.182	C	C	.	.	H	α-helix	trans	-55.8	-31.8	171.8	-62.9	-60.8	91.3	0	0	112.3	S244 D248 V249 W250 P353 R356	S244-Q246 PolarHBondContact O-N 2.81Å; S244-Q246 WeakPolarHBondContact OG-CG 3.49Å; S244-Q246 PolarHBondContact OG-N 3.39Å; Q246-D248 VanDerWaalsContact C-N 3.34Å; Q246-V249 WeakPolarHBondContact O-CB 3.4Å; Q246-V249 PolarHBondContact O-N 3.11Å; Q246-W250 PolarHBondContact O-N 2.84Å; Q246-P353 HydrophobicContact CB-CB 4.13Å; Q246-P353 PolarHBondContact NE2-O 2.57Å; Q246-R356 VanDerWaalsContact C-NH1 3.32Å; Q246-R356 PolarHBondContact NE2-O 3.41Å; Q246-R356 VanDerWaalsContact O-CD 3.31Å; Q246-R356 WeakPolarHBondContact O-CD 3.33Å; Q246-R356 PolarHBondContact O-NH1 2.88Å
247	S	95.7	Very high	93.7	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	18%	0.181	C	C	.	.	H	α-helix	trans	-68.5	-34	176.3	-57	0	0	0	0	112.9	S234 E236 Y243 S244 V245 V249 W250 S251	S234-S247 VanDerWaalsContact OG-CB 3.25Å; S234-S247 WeakPolarHBondContact OG-CB 3.34Å; S234-S247 PolarHBondContact OG-OG 2.96Å; S234-S247 VanDerWaalsContact OG-OG 3.08Å; E236-S247 WeakPolarHBondContact OE1-CA 3.38Å; E236-S247 WeakPolarHBondContact OE1-CB 3.39Å; E236-S247 PolarHBondContact OE1-OG 2.84Å; Y243-S247 WeakPolarHBondContact CB-OG 3.35Å; S244-S247 WeakPolarHBondContact O-CB 3.41Å; S244-S247 PolarHBondContact O-N 3.41Å; S244-S247 PolarHBondContact O-OG 3.22Å; V245-S247 PolarHBondContact O-N 2.88Å; S247-V249 VanDerWaalsContact C-N 3.32Å; S247-W250 PolarHBondContact O-N 3.02Å; S247-S251 PolarHBondContact O-N 3.49Å; S247-S251 VanDerWaalsContact O-N 3.16Å; S247-S251 PolarHBondContact O-OG 3.34Å; S247-S251 VanDerWaalsContact O-OG 3.13Å
248	D	96.6	Very high	94.1	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.011	18%	0.178	C	C	.	.	H	α-helix	trans	-69	-34.4	174.7	-63.6	-31.5	0	0	0	110.9	L180 H191 R192 V194 V245 Q246 S251 M252	L180-D248 HydrophobicContact CD1-CB 3.98Å; L180-D248 HydrophobicContact CD2-CB 3.95Å; H191-D248 PolarHBondContact N-OD2 3.42Å; R192-D248 WeakPolarHBondContact CA-OD1 3.31Å; R192-D248 PolarHBondContact N-OD1 3.27Å; V194-D248 HydrophobicContact CG2-CB 4.07Å; V245-D248 WeakPolarHBondContact O-CB 3.17Å; V245-D248 PolarHBondContact O-N 3.45Å; Q246-D248 VanDerWaalsContact C-N 3.34Å; D248-S251 PolarHBondContact O-N 2.98Å; D248-M252 WeakPolarHBondContact O-CB 3.48Å; D248-M252 PolarHBondContact O-N 2.91Å
249	V	98.5	Very high	94.5	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-43.1	173.3	171.2	0	0	0	0	111.7	V245 Q246 S247 M252 G253 C348 R356 L359 L362	V245-V249 PolarHBondContact O-N 2.97Å; Q246-V249 WeakPolarHBondContact O-CB 3.4Å; Q246-V249 PolarHBondContact O-N 3.11Å; S247-V249 VanDerWaalsContact C-N 3.32Å; V249-M252 PolarHBondContact O-N 2.72Å; V249-G253 PolarHBondContact O-N 3.45Å; V249-C348 HydrophobicContact CG1-CB 3.99Å; V249-R356 HydrophobicContact CG1-CG 4.09Å; V249-L359 HydrophobicContact CG2-CD2 3.91Å; V249-L362 HydrophobicContact CB-CD1 4.44Å; V249-L362 HydrophobicContact CG1-CD1 3.53Å; V249-L362 HydrophobicContact CG2-CD1 4.06Å
250	W	98.4	Very high	95	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-50	173.8	170	-80.6	0	0	0	111.6	M233 S234 P235 Q246 S247 M252 G253 L254 I324 P329 C348 L349 K351	M233-W250 PolarHBondContact O-NE1 3.11Å; S234-W250 VanDerWaalsContact CA-CD1 3.42Å; P235-W250 HydrophobicContact CG-CE3 4.31Å; P235-W250 HydrophobicContact CG-CH2 3.75Å; P235-W250 HydrophobicContact CG-CZ2 4Å; P235-W250 HydrophobicContact CG-CZ3 3.9Å; Q246-W250 PolarHBondContact O-N 2.84Å; S247-W250 PolarHBondContact O-N 3.02Å; W250-M252 VanDerWaalsContact C-N 3.27Å; W250-M252 PolarHBondContact O-N 3.36Å; W250-G253 PolarHBondContact O-N 2.93Å; W250-G253 VanDerWaalsContact O-N 3.08Å; W250-L254 PolarHBondContact O-N 3.26Å; W250-I324 HydrophobicContact CZ2-CG2 3.98Å; W250-P329 HydrophobicContact CH2-CB 4.07Å; W250-P329 HydrophobicContact CZ3-CB 4.33Å; W250-C348 WeakPolarHBondContact CA-O 3.4Å; W250-L349 HydrophobicContact CD2-CD2 3.91Å; W250-L349 HydrophobicContact CE3-CD2 4.01Å; W250-L349 HydrophobicContact CG-CD2 4.37Å; W250-L349 HydrophobicContact CZ2-CD2 4.41Å; W250-L349 HydrophobicContact CZ3-CB 4.38Å; W250-L349 HydrophobicContact CZ3-CD2 4.33Å; W250-L349 WeakPolarHBondContact CZ3-O 3.43Å; W250-K351 HydrophobicContact CH2-CG 4.1Å; W250-K351 HydrophobicContact CZ3-CG 3.9Å
251	S	97.9	Very high	95.5	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.007	11%	0.109	C	C	.	.	H	α-helix	trans	-59.8	-38.9	-179.6	-59.3	0	0	0	0	111.7	V194 Y232 S247 D248 L254 S255	V194-S251 VanDerWaalsContact O-CB 3.31Å; V194-S251 WeakPolarHBondContact O-CB 3.44Å; Y232-S251 WeakPolarHBondContact O-CB 3.49Å; Y232-S251 PolarHBondContact O-OG 2.98Å; S247-S251 PolarHBondContact O-N 3.49Å; S247-S251 VanDerWaalsContact O-N 3.16Å; S247-S251 PolarHBondContact O-OG 3.34Å; S247-S251 VanDerWaalsContact O-OG 3.13Å; D248-S251 PolarHBondContact O-N 2.98Å; S251-L254 PolarHBondContact O-N 2.76Å; S251-S255 WeakPolarHBondContact O-CB 3.37Å; S251-S255 PolarHBondContact O-N 2.86Å; S251-S255 PolarHBondContact O-OG 3.37Å
252	M	98.5	Very high	96	Very high	3 Å²	3	19.9 Å²	19.9	2%	0.015	11%	0.105	C	C	.	.	H	α-helix	trans	-61	-49.7	171.1	176.4	-177.8	167.9	0	0	111.8	V176 L177 V194 D248 V249 W250 L254 S255 L256 F344	V176-M252 HydrophobicContact CB-CE 4.36Å; V176-M252 HydrophobicContact CB-SD 4.09Å; V176-M252 HydrophobicContact CG1-CB 4.29Å; V176-M252 HydrophobicContact CG1-CE 4.48Å; V176-M252 HydrophobicContact CG1-CG 3.88Å; V176-M252 HydrophobicContact CG1-SD 3.6Å; L177-M252 HydrophobicContact CD1-CE 4.46Å; L177-M252 HydrophobicContact CD2-CE 4.36Å; L177-M252 HydrophobicContact CD2-SD 3.93Å; L177-M252 HydrophobicContact CG-CE 3.94Å; L177-M252 HydrophobicContact CG-SD 4.03Å; V194-M252 HydrophobicContact CG1-CB 4.22Å; D248-M252 WeakPolarHBondContact O-CB 3.48Å; D248-M252 PolarHBondContact O-N 2.91Å; V249-M252 PolarHBondContact O-N 2.72Å; W250-M252 VanDerWaalsContact C-N 3.27Å; W250-M252 PolarHBondContact O-N 3.36Å; M252-L254 VanDerWaalsContact C-N 3.29Å; M252-L254 PolarHBondContact O-N 2.79Å; M252-S255 WeakPolarHBondContact O-CB 3.38Å; M252-S255 PolarHBondContact O-N 2.82Å; M252-L256 HydrophobicContact CE-CD1 3.75Å; M252-L256 HydrophobicContact CG-CD1 4.15Å; M252-L256 WeakPolarHBondContact O-CG 3.44Å; M252-L256 PolarHBondContact O-N 2.96Å; M252-F344 HydrophobicContact CE-CE1 3.86Å; M252-F344 HydrophobicContact CE-CZ 3.76Å
253	G	98.6	Very high	96.5	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-56.2	-44	178.1	0	0	0	0	0	112.4	V249 W250 L256 V257	V249-G253 PolarHBondContact O-N 3.45Å; W250-G253 PolarHBondContact O-N 2.93Å; W250-G253 VanDerWaalsContact O-N 3.08Å; G253-L256 PolarHBondContact O-N 3.44Å; G253-V257 WeakPolarHBondContact O-CG2 3.24Å; G253-V257 PolarHBondContact O-N 3.17Å
254	L	98.1	Very high	96.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-66.2	-41.5	179.4	-161.3	70.5	0	0	0	111.7	S231 Y232 W250 S251 M252 L256 V257 E258 Y264 P265 I266 P330 L349	S231-L254 WeakPolarHBondContact O-CD2 3.19Å; Y232-L254 HydrophobicContact CD1-CB 4.38Å; Y232-L254 HydrophobicContact CD1-CD2 3.89Å; Y232-L254 HydrophobicContact CD1-CG 4.34Å; Y232-L254 HydrophobicContact CE1-CD2 4.49Å; Y232-L254 HydrophobicContact CG-CD2 4.44Å; W250-L254 PolarHBondContact O-N 3.26Å; S251-L254 PolarHBondContact O-N 2.76Å; M252-L254 VanDerWaalsContact C-N 3.29Å; M252-L254 PolarHBondContact O-N 2.79Å; L254-L256 VanDerWaalsContact C-N 3.32Å; L254-L256 PolarHBondContact O-N 3.34Å; L254-V257 PolarHBondContact O-N 3.32Å; L254-E258 PolarHBondContact O-N 2.96Å; L254-E258 VanDerWaalsContact O-N 3.09Å; L254-Y264 HydrophobicContact CD2-CE2 4.03Å; L254-P265 HydrophobicContact CD1-CG 3.53Å; L254-P265 HydrophobicContact CG-CG 3.96Å; L254-I266 HydrophobicContact CD1-CD1 3.94Å; L254-I266 HydrophobicContact CD1-CG1 4.3Å; L254-I266 HydrophobicContact CD2-CD1 4.5Å; L254-P330 HydrophobicContact CD1-CG 3.5Å; L254-L349 HydrophobicContact CB-CD2 4.22Å; L254-L349 HydrophobicContact CD1-CD2 4.43Å
255	S	98.4	Very high	97	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.014	6%	0.064	C	C	.	.	H	α-helix	trans	-60.5	-41.2	175.5	-55.5	0	0	0	0	111.7	K195 S251 M252 E258 L259	K195-S255 WeakPolarHBondContact CA-OG 3.42Å; S251-S255 WeakPolarHBondContact O-CB 3.37Å; S251-S255 PolarHBondContact O-N 2.86Å; S251-S255 PolarHBondContact O-OG 3.37Å; M252-S255 WeakPolarHBondContact O-CB 3.38Å; M252-S255 PolarHBondContact O-N 2.82Å; S255-E258 PolarHBondContact O-N 2.72Å; S255-L259 WeakPolarHBondContact O-CB 3.44Å; S255-L259 WeakPolarHBondContact O-CD1 3.29Å; S255-L259 WeakPolarHBondContact O-CG 3.47Å; S255-L259 PolarHBondContact O-N 2.8Å
256	L	98.8	Very high	97	Very high	4 Å²	4	12.3 Å²	12.3	2%	0.021	6%	0.061	C	C	.	.	H	α-helix	trans	-66.6	-38.6	178.9	-70.3	172.3	0	0	0	112.3	L169 S173 M252 G253 L254 L259 A260 F341 F344 V345	L169-L256 HydrophobicContact CB-CD2 4.35Å; L169-L256 HydrophobicContact CD2-CD2 4.09Å; S173-L256 WeakPolarHBondContact OG-CD1 3.23Å; S173-L256 WeakPolarHBondContact OG-CD2 3.31Å; M252-L256 HydrophobicContact CE-CD1 3.75Å; M252-L256 HydrophobicContact CG-CD1 4.15Å; M252-L256 WeakPolarHBondContact O-CG 3.44Å; M252-L256 PolarHBondContact O-N 2.96Å; G253-L256 PolarHBondContact O-N 3.44Å; L254-L256 VanDerWaalsContact C-N 3.32Å; L254-L256 PolarHBondContact O-N 3.34Å; L256-L259 PolarHBondContact O-N 3.49Å; L256-A260 WeakPolarHBondContact O-CB 3.43Å; L256-A260 PolarHBondContact O-N 2.92Å; L256-F341 HydrophobicContact CB-CE2 4.4Å; L256-F341 HydrophobicContact CB-CZ 4.38Å; L256-F341 HydrophobicContact CD1-CE2 4.48Å; L256-F344 HydrophobicContact CD1-CD1 4.23Å; L256-F344 HydrophobicContact CD1-CE1 3.65Å; L256-V345 HydrophobicContact CB-CG2 4.23Å
257	V	98.5	Very high	96.8	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-63	-45.4	174.3	-177.4	0	0	0	0	110.6	G253 L254 L259 A260 I261 P265 L332 V345 L349	G253-V257 WeakPolarHBondContact O-CG2 3.24Å; G253-V257 PolarHBondContact O-N 3.17Å; L254-V257 PolarHBondContact O-N 3.32Å; V257-L259 PolarHBondContact O-N 3.5Å; V257-A260 PolarHBondContact O-N 3.21Å; V257-I261 HydrophobicContact CG1-CD1 3.54Å; V257-I261 HydrophobicContact CG1-CG1 4.22Å; V257-I261 WeakPolarHBondContact O-CB 3.33Å; V257-I261 WeakPolarHBondContact O-CG1 3.43Å; V257-I261 PolarHBondContact O-N 3.18Å; V257-P265 HydrophobicContact CB-CB 4.1Å; V257-P265 HydrophobicContact CB-CG 4.13Å; V257-P265 HydrophobicContact CG1-CB 3.46Å; V257-P265 VanDerWaalsContact CG1-CB 3.46Å; V257-P265 HydrophobicContact CG1-CG 4.05Å; V257-L332 HydrophobicContact CB-CD2 4.5Å; V257-L332 HydrophobicContact CG1-CD2 4.26Å; V257-L332 HydrophobicContact CG2-CD2 4.39Å; V257-L332 HydrophobicContact CG2-CG 4.43Å; V257-V345 HydrophobicContact CG2-CG1 3.35Å; V257-L349 HydrophobicContact CG2-CD1 3.96Å
258	E	98	Very high	96.6	Very high	24 Å²	24	15.8 Å²	15.8	11%	0.112	9%	0.086	C	C	.	.	H	α-helix	trans	-58.4	-49.7	177.7	177.1	177	-162.5	0	0	112	L158 P196 Y232 L254 S255 A260 I261 G262 R263	L158-E258 HydrophobicContact CD2-CG 3.91Å; P196-E258 WeakPolarHBondContact CG-OE2 3.45Å; Y232-E258 VanDerWaalsContact CE1-OE2 3.31Å; Y232-E258 WeakPolarHBondContact CE1-OE2 3.28Å; Y232-E258 PolarHBondContact OH-OE1 3.46Å; Y232-E258 PolarHBondContact OH-OE2 2.7Å; L254-E258 PolarHBondContact O-N 2.96Å; L254-E258 VanDerWaalsContact O-N 3.09Å; S255-E258 PolarHBondContact O-N 2.72Å; E258-A260 VanDerWaalsContact C-N 3.31Å; E258-A260 PolarHBondContact O-N 3.34Å; E258-I261 PolarHBondContact O-N 3.29Å; E258-G262 WeakPolarHBondContact O-CA 3.18Å; E258-G262 PolarHBondContact O-N 3.08Å; E258-R263 WeakPolarHBondContact CA-O 3.28Å; E258-R263 PolarHBondContact O-N 3.09Å
259	L	98.6	Very high	96.3	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.6	-36.1	-178.2	-66.2	165	0	0	0	111.9	L154 L158 I164 L169 P196 S255 L256 V257	L154-L259 HydrophobicContact CB-CD2 4.11Å; L154-L259 HydrophobicContact CD1-CD1 3.99Å; L158-L259 HydrophobicContact CB-CD2 4.03Å; L158-L259 HydrophobicContact CD1-CD2 4.21Å; L158-L259 HydrophobicContact CD2-CD2 4Å; L158-L259 HydrophobicContact CG-CD2 4.31Å; I164-L259 HydrophobicContact CB-CB 4.4Å; I164-L259 HydrophobicContact CD1-CB 4.15Å; I164-L259 HydrophobicContact CD1-CD2 3.53Å; I164-L259 HydrophobicContact CD1-CG 4.28Å; I164-L259 HydrophobicContact CG1-CB 4.39Å; I164-L259 HydrophobicContact CG1-CD2 4.34Å; I164-L259 PolarHBondContact N-O 3.01Å; L169-L259 HydrophobicContact CD1-CB 4.45Å; L169-L259 HydrophobicContact CD2-CB 3.68Å; L169-L259 HydrophobicContact CD2-CD1 4.03Å; L169-L259 HydrophobicContact CD2-CG 4.49Å; P196-L259 HydrophobicContact CB-CD2 4.01Å; P196-L259 HydrophobicContact CB-CG 4.47Å; P196-L259 HydrophobicContact CG-CD1 4.27Å; P196-L259 HydrophobicContact CG-CD2 4.09Å; P196-L259 HydrophobicContact CG-CG 4.06Å; S255-L259 WeakPolarHBondContact O-CB 3.44Å; S255-L259 WeakPolarHBondContact O-CD1 3.29Å; S255-L259 WeakPolarHBondContact O-CG 3.47Å; S255-L259 PolarHBondContact O-N 2.8Å; L256-L259 PolarHBondContact O-N 3.49Å; V257-L259 PolarHBondContact O-N 3.5Å
260	A	98.3	Very high	95.9	Very high	2 Å²	2	18.6 Å²	18.6	2%	0.017	10%	0.102	C	C	.	.	H	α-helix	trans	-70.8	-43.6	178.2	0	0	0	0	0	112.6	R163 L169 L256 V257 E258 L332 F337 F341	R163-A260 WeakPolarHBondContact CD-O 3.39Å; L169-A260 HydrophobicContact CD1-CB 3.61Å; L256-A260 WeakPolarHBondContact O-CB 3.43Å; L256-A260 PolarHBondContact O-N 2.92Å; V257-A260 PolarHBondContact O-N 3.21Å; E258-A260 VanDerWaalsContact C-N 3.31Å; E258-A260 PolarHBondContact O-N 3.34Å; A260-L332 HydrophobicContact CB-CD2 3.67Å; A260-F337 HydrophobicContact CB-CE1 3.85Å; A260-F337 HydrophobicContact CB-CE2 4.47Å; A260-F337 HydrophobicContact CB-CZ 3.72Å; A260-F341 HydrophobicContact CB-CE1 4.01Å; A260-F341 HydrophobicContact CB-CZ 4.3Å
261	I	96.6	Very high	95.4	Very high	5 Å²	5	21.1 Å²	21.1	3%	0.026	12%	0.123	C	C	.	.	H	α-helix	trans	-83.3	-27.9	-176.8	-62.5	-179.2	0	0	0	111.5	R163 V257 E258 R263 I277 L332	R163-I261 WeakPolarHBondContact CD-O 3.48Å; R163-I261 WeakPolarHBondContact CG-O 3.5Å; V257-I261 HydrophobicContact CG1-CD1 3.54Å; V257-I261 HydrophobicContact CG1-CG1 4.22Å; V257-I261 WeakPolarHBondContact O-CB 3.33Å; V257-I261 WeakPolarHBondContact O-CG1 3.43Å; V257-I261 PolarHBondContact O-N 3.18Å; E258-I261 PolarHBondContact O-N 3.29Å; I261-R263 HydrophobicContact CG2-CB 4.45Å; I261-I277 HydrophobicContact CG2-CD1 3.99Å; I261-L332 HydrophobicContact CG1-CD2 4.34Å
262	G	96.2	Very high	95	Very high	31 Å²	31	30.9 Å²	30.9	32%	0.32	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	89	12.7	-174.5	0	0	0	0	0	114.4	R162 E258	R162-G262 WeakPolarHBondContact O-CA 3.44Å; E258-G262 WeakPolarHBondContact O-CA 3.18Å; E258-G262 PolarHBondContact O-N 3.08Å
263	R	93.5	Very high	94.6	Very high	100 Å²	100	32.8 Å²	32.8	38%	0.377	17%	0.169	S	C	.	.	S	Bend	trans	-156.7	141.5	-173.5	177.8	-176.2	165	172.3	-11.1	109.9	E258 I261 E273	E258-R263 WeakPolarHBondContact CA-O 3.28Å; E258-R263 PolarHBondContact O-N 3.09Å; I261-R263 HydrophobicContact CG2-CB 4.45Å; R263-E273 IonicContact CZ-OE2 2.9Å; R263-E273 IonicContact NH1-OE1 2.74Å; R263-E273 IonicContact NH1-OE2 2.69Å; R263-E273 PolarHBondContact NH1-OE2 3.48Å; R263-E273 IonicContact NH2-OE2 2.68Å; R263-E273 PolarHBondContact NH2-OE2 3.08Å
264	Y	94.2	Very high	94.2	Very high	47 Å²	47	33 Å²	33	18%	0.184	17%	0.17	C	C	.	.			trans	-54.1	127.4	172.5	-176.2	-101.2	0	0	0	111.3	S231 Y232 L254 I266 L320	S231-Y264 WeakPolarHBondContact CB-OH 3.34Å; S231-Y264 PolarHBondContact O-OH 3.4Å; Y232-Y264 HydrophobicContact CD1-CE2 4.39Å; Y232-Y264 HydrophobicContact CE1-CD2 4.11Å; Y232-Y264 AromaticContact CE1-CE2 3.84Å; Y232-Y264 HydrophobicContact CE1-CE2 3.84Å; Y232-Y264 HydrophobicContact CE2-CE2 4.36Å; Y232-Y264 AromaticContact CZ-CD2 3.91Å; Y232-Y264 AromaticContact CZ-CE2 3.81Å; L254-Y264 HydrophobicContact CD2-CE2 4.03Å; Y264-I266 VanDerWaalsContact C-N 3.32Å; Y264-I266 HydrophobicContact CD1-CB 4.47Å; Y264-I266 VanDerWaalsContact CD1-O 3.27Å; Y264-I266 WeakPolarHBondContact CD1-O 3.45Å; Y264-I266 HydrophobicContact CE1-CB 3.75Å; Y264-I266 HydrophobicContact CE1-CG1 4.49Å; Y264-I266 VanDerWaalsContact CE1-O 3.32Å; Y264-I266 WeakPolarHBondContact CE1-O 3.41Å; Y264-I266 PolarHBondContact O-N 3.04Å; Y264-L320 HydrophobicContact CE1-CD1 3.73Å; Y264-L320 HydrophobicContact CE1-CD2 4.07Å
265	P	94.1	Very high	93.8	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.013	19%	0.191	C	C	.	.			trans	-87.4	6.2	-159.2	35.1	-40.2	0	0	0	115	L254 V257 P267 P268 P330	L254-P265 HydrophobicContact CD1-CG 3.53Å; L254-P265 HydrophobicContact CG-CG 3.96Å; V257-P265 HydrophobicContact CB-CB 4.1Å; V257-P265 HydrophobicContact CB-CG 4.13Å; V257-P265 HydrophobicContact CG1-CB 3.46Å; V257-P265 VanDerWaalsContact CG1-CB 3.46Å; V257-P265 HydrophobicContact CG1-CG 4.05Å; P265-P267 CarbonylContact C-O 3.47Å; P265-P267 CarbonylContact O-C 3.32Å; P265-P267 VanDerWaalsContact O-C 3.32Å; P265-P268 WeakPolarHBondContact O-CA 3.42Å; P265-P330 HydrophobicContact CB-CB 3.9Å; P265-P330 HydrophobicContact CB-CG 4.17Å; P265-P330 HydrophobicContact CG-CB 4.42Å; P265-P330 HydrophobicContact CG-CG 4.14Å
266	I	92.9	Very high	93.5	Very high	10 Å²	10	41.5 Å²	41.5	5%	0.051	22%	0.224	C	C	.	.	S	Bend	trans	-125.5	122.8	179.4	-54.6	176.8	0	0	0	110.2	L254 Y264 L320 Y323 I324 P330	L254-I266 HydrophobicContact CD1-CD1 3.94Å; L254-I266 HydrophobicContact CD1-CG1 4.3Å; L254-I266 HydrophobicContact CD2-CD1 4.5Å; Y264-I266 VanDerWaalsContact C-N 3.32Å; Y264-I266 HydrophobicContact CD1-CB 4.47Å; Y264-I266 VanDerWaalsContact CD1-O 3.27Å; Y264-I266 WeakPolarHBondContact CD1-O 3.45Å; Y264-I266 HydrophobicContact CE1-CB 3.75Å; Y264-I266 HydrophobicContact CE1-CG1 4.49Å; Y264-I266 VanDerWaalsContact CE1-O 3.32Å; Y264-I266 WeakPolarHBondContact CE1-O 3.41Å; Y264-I266 PolarHBondContact O-N 3.04Å; I266-L320 HydrophobicContact CB-CD1 3.61Å; I266-L320 HydrophobicContact CG2-CD1 3.33Å; I266-Y323 HydrophobicContact CG2-CD1 3.29Å; I266-Y323 HydrophobicContact CG2-CD2 4.37Å; I266-Y323 HydrophobicContact CG2-CE1 3.88Å; I266-Y323 HydrophobicContact CG2-CG 3.6Å; I266-I324 HydrophobicContact CD1-CD1 4.34Å; I266-I324 HydrophobicContact CD1-CG1 3.57Å; I266-P330 HydrophobicContact CD1-CG 4.41Å; I266-P330 HydrophobicContact CG1-CG 4.13Å
267	P	92	Very high	93.1	Very high	46 Å²	46	43.7 Å²	43.7	30%	0.299	24%	0.235	S	C	.	.	S	Bend	cis	-65.6	154.2	-6.3	29.2	-34.1	0	0	0	111.8	P265 M315 Y323	P265-P267 CarbonylContact C-O 3.47Å; P265-P267 CarbonylContact O-C 3.32Å; P265-P267 VanDerWaalsContact O-C 3.32Å; P267-M315 HydrophobicContact CB-CE 3.76Å; P267-M315 HydrophobicContact CG-CE 3.78Å; P267-Y323 HydrophobicContact CB-CE2 4.4Å
268	P	91.9	Very high	92.8	Very high	51 Å²	51	45.1 Å²	45.1	33%	0.331	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-55.6	142.8	176.6	-25.6	34.4	0	0	0	111.9	P265 Y323	P265-P268 WeakPolarHBondContact O-CA 3.42Å; P268-Y323 VanDerWaalsContact CD-CZ 3.47Å; P268-Y323 WeakPolarHBondContact CD-OH 3.37Å; P268-Y323 HydrophobicContact CG-CE1 4.46Å; P268-Y323 WeakPolarHBondContact CG-OH 3.38Å
269	P	90.7	Very high	92.2	Very high	18 Å²	18	47.3 Å²	47.3	12%	0.117	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-64	143.1	173.9	29.2	-35	0	0	0	110	E273 L274	P269-E273 WeakPolarHBondContact CA-OE2 3.41Å; P269-E273 HydrophobicContact CB-CB 3.97Å; P269-L274 HydrophobicContact CB-CD2 4.17Å; P269-L274 HydrophobicContact CB-CG 4.08Å; P269-L274 HydrophobicContact CG-CD2 3.56Å; P269-L274 HydrophobicContact CG-CG 3.85Å
270	D	89.9	Confident	91.4	Very high	42 Å²	42	53.4 Å²	53.4	23%	0.225	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-79.1	172.8	172.8	71.9	33	0	0	0	112	R272 E273 L274 R312	D270-R272 PolarHBondContact O-N 3.48Å; D270-R272 WeakPolarHBondContact OD1-CA 3.41Å; D270-R272 WeakPolarHBondContact OD1-CB 3.49Å; D270-R272 PolarHBondContact OD1-N 3.32Å; D270-E273 PolarHBondContact O-N 2.7Å; D270-E273 VanDerWaalsContact O-N 3.15Å; D270-E273 PolarHBondContact OD1-N 3.21Å; D270-L274 WeakPolarHBondContact O-CB 3.18Å; D270-L274 WeakPolarHBondContact O-CG 3.42Å; D270-L274 PolarHBondContact O-N 2.95Å; D270-R312 IonicContact OD2-CZ 2.8Å; D270-R312 IonicContact OD2-NH1 3.07Å; D270-R312 PolarHBondContact OD2-NH1 2.94Å; D270-R312 IonicContact OD2-NH2 3.71Å; D270-R312 PolarHBondContact OD2-NH2 3.07Å
271	A	87.6	Confident	90.2	Very high	56 Å²	56	57.8 Å²	57.8	46%	0.463	32%	0.324	S	S	.	.	H	α-helix	trans	-57.2	-33.9	-178	0	0	0	0	0	113.9	E275	A271-E275 WeakPolarHBondContact O-CB 3.49Å; A271-E275 PolarHBondContact O-N 3.35Å
272	R	88.9	Confident	89.1	Confident	205 Å²	205	58.2 Å²	58.2	77%	0.774	33%	0.327	S	S	*	.	H	α-helix	trans	-74.2	-41.1	179.1	-59.7	-176.5	-166.5	177.7	3.8	110.8	D270 L274 E275 A276	D270-R272 PolarHBondContact O-N 3.48Å; D270-R272 WeakPolarHBondContact OD1-CA 3.41Å; D270-R272 WeakPolarHBondContact OD1-CB 3.49Å; D270-R272 PolarHBondContact OD1-N 3.32Å; R272-L274 VanDerWaalsContact C-N 3.35Å; R272-E275 PolarHBondContact O-N 2.95Å; R272-A276 WeakPolarHBondContact O-CB 3.38Å; R272-A276 PolarHBondContact O-N 3.46Å
273	E	90.3	Very high	87.3	Confident	43 Å²	43	64.8 Å²	64.8	20%	0.201	35%	0.351	C	S	.	.	H	α-helix	trans	-63	-43.4	174.4	-68.4	177.4	-170.7	0	0	110.7	R263 P269 D270 A276 I277 R312	R263-E273 IonicContact CZ-OE2 2.9Å; R263-E273 IonicContact NH1-OE1 2.74Å; R263-E273 IonicContact NH1-OE2 2.69Å; R263-E273 PolarHBondContact NH1-OE2 3.48Å; R263-E273 IonicContact NH2-OE2 2.68Å; R263-E273 PolarHBondContact NH2-OE2 3.08Å; P269-E273 WeakPolarHBondContact CA-OE2 3.41Å; P269-E273 HydrophobicContact CB-CB 3.97Å; D270-E273 PolarHBondContact O-N 2.7Å; D270-E273 VanDerWaalsContact O-N 3.15Å; D270-E273 PolarHBondContact OD1-N 3.21Å; E273-A276 PolarHBondContact O-N 3.46Å; E273-I277 WeakPolarHBondContact O-CB 3.43Å; E273-I277 WeakPolarHBondContact O-CD1 3.46Å; E273-I277 WeakPolarHBondContact O-CG1 3.28Å; E273-I277 PolarHBondContact O-N 2.94Å; E273-R312 IonicContact OE1-NH1 2.72Å; E273-R312 PolarHBondContact OE1-NH1 3.03Å
274	L	90.8	Very high	85.4	Confident	6 Å²	6	64.3 Å²	64.3	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-61.4	-45.1	174.7	-78	177.7	0	0	0	112.3	P269 D270 R272 A276 I277 F278 I282 P333	P269-L274 HydrophobicContact CB-CD2 4.17Å; P269-L274 HydrophobicContact CB-CG 4.08Å; P269-L274 HydrophobicContact CG-CD2 3.56Å; P269-L274 HydrophobicContact CG-CG 3.85Å; D270-L274 WeakPolarHBondContact O-CB 3.18Å; D270-L274 WeakPolarHBondContact O-CG 3.42Å; D270-L274 PolarHBondContact O-N 2.95Å; R272-L274 VanDerWaalsContact C-N 3.35Å; L274-A276 VanDerWaalsContact C-N 3.33Å; L274-A276 PolarHBondContact O-N 3.2Å; L274-I277 PolarHBondContact O-N 3.48Å; L274-F278 HydrophobicContact CD2-CD2 4.22Å; L274-F278 HydrophobicContact CD2-CE2 3.84Å; L274-F278 VanDerWaalsContact O-CD2 3.28Å; L274-F278 WeakPolarHBondContact O-CD2 3.27Å; L274-F278 PolarHBondContact O-N 2.92Å; L274-I282 HydrophobicContact CB-CD1 4.21Å; L274-P333 HydrophobicContact CD1-CB 4.4Å; L274-P333 HydrophobicContact CD2-CB 4.22Å; L274-P333 HydrophobicContact CD2-CG 4.23Å
275	E	90	Very high	83.2	Confident	95 Å²	95	64.5 Å²	64.5	44%	0.444	37%	0.372	S	S	.	.	H	α-helix	trans	-61.7	-41.2	175.2	-179.1	169.7	-155.2	0	0	111.8	A271 R272 I277 F278 G279 R280	A271-E275 WeakPolarHBondContact O-CB 3.49Å; A271-E275 PolarHBondContact O-N 3.35Å; R272-E275 PolarHBondContact O-N 2.95Å; E275-I277 VanDerWaalsContact C-N 3.34Å; E275-I277 PolarHBondContact O-N 3.49Å; E275-F278 PolarHBondContact O-N 2.7Å; E275-G279 VanDerWaalsContact O-CA 3.27Å; E275-G279 WeakPolarHBondContact O-CA 3.45Å; E275-G279 PolarHBondContact O-N 3.37Å; E275-R280 WeakPolarHBondContact CA-O 3.44Å
276	A	90.9	Very high	81	Confident	85 Å²	85	68.3 Å²	68.3	70%	0.702	40%	0.404	S	S	*	.	H	α-helix	trans	-64.8	-37.5	175.3	0	0	0	0	0	112.5	R272 E273 L274	R272-A276 WeakPolarHBondContact O-CB 3.38Å; R272-A276 PolarHBondContact O-N 3.46Å; E273-A276 PolarHBondContact O-N 3.46Å; L274-A276 VanDerWaalsContact C-N 3.33Å; L274-A276 PolarHBondContact O-N 3.2Å
277	I	91.7	Very high	78.5	Confident	49 Å²	49	77.3 Å²	77.3	25%	0.251	45%	0.446	S	S	.	.	H	α-helix	trans	-69.3	-46.5	178.2	-70.8	162.7	0	0	0	110.6	R163 I261 E273 L274 E275	R163-I277 VanDerWaalsContact NH1-CG2 3.35Å; R163-I277 PolarHBondContact NH1-O 2.77Å; I261-I277 HydrophobicContact CG2-CD1 3.99Å; E273-I277 WeakPolarHBondContact O-CB 3.43Å; E273-I277 WeakPolarHBondContact O-CD1 3.46Å; E273-I277 WeakPolarHBondContact O-CG1 3.28Å; E273-I277 PolarHBondContact O-N 2.94Å; L274-I277 PolarHBondContact O-N 3.48Å; E275-I277 VanDerWaalsContact C-N 3.34Å; E275-I277 PolarHBondContact O-N 3.49Å
278	F	91.4	Very high	75.8	Confident	30 Å²	30	78 Å²	78	13%	0.132	46%	0.461	C	S	.	.	H	α-helix	trans	-99.8	-8.4	-170.5	-66	-76	0	0	0	114.7	L274 E275 R280 I282 P333 V336 F337	L274-F278 HydrophobicContact CD2-CD2 4.22Å; L274-F278 HydrophobicContact CD2-CE2 3.84Å; L274-F278 VanDerWaalsContact O-CD2 3.28Å; L274-F278 WeakPolarHBondContact O-CD2 3.27Å; L274-F278 PolarHBondContact O-N 2.92Å; E275-F278 PolarHBondContact O-N 2.7Å; F278-R280 HydrophobicContact CB-CG 4.27Å; F278-R280 PolarHBondContact O-N 3.47Å; F278-I282 HydrophobicContact CB-CD1 3.86Å; F278-I282 HydrophobicContact CD2-CD1 3.38Å; F278-I282 HydrophobicContact CE2-CD1 4.18Å; F278-I282 HydrophobicContact CG-CD1 3.79Å; F278-P333 HydrophobicContact CD2-CG 4.5Å; F278-P333 HydrophobicContact CE2-CG 3.76Å; F278-P333 HydrophobicContact CZ-CG 4.02Å; F278-V336 HydrophobicContact CD1-CB 4.5Å; F278-V336 HydrophobicContact CD1-CG1 3.52Å; F278-V336 HydrophobicContact CD1-CG2 4.15Å; F278-V336 HydrophobicContact CD2-CG2 4.4Å; F278-V336 HydrophobicContact CE1-CG1 3.44Å; F278-V336 VanDerWaalsContact CE1-CG1 3.44Å; F278-V336 HydrophobicContact CG-CG1 4.3Å; F278-V336 HydrophobicContact CG-CG2 4.11Å; F278-V336 HydrophobicContact CZ-CG1 4.1Å; F278-F337 HydrophobicContact CE1-CE2 4.18Å; F278-F337 HydrophobicContact CE1-CZ 4.01Å; F278-F337 AromaticContact CZ-CE2 3.91Å; F278-F337 HydrophobicContact CZ-CE2 3.91Å; F278-F337 HydrophobicContact CZ-CZ 4.01Å
279	G	85.9	Confident	72.8	Confident	71 Å²	71	84.1 Å²	84.1	73%	0.732	49%	0.485	S	S	*	.	S	Bend	trans	67.3	19.6	179.4	0	0	0	0	0	114.2	E275	E275-G279 VanDerWaalsContact O-CA 3.27Å; E275-G279 WeakPolarHBondContact O-CA 3.45Å; E275-G279 PolarHBondContact O-N 3.37Å
280	R	81.5	Confident	70.1	Confident	128 Å²	128	89.4 Å²	89.4	48%	0.483	52%	0.52	S	S	.	.	S	Bend	trans	-149.6	150.3	179.1	59.5	178.1	169.6	-174.4	-9.3	111.1	E275 F278 I282 G335 V336	E275-R280 WeakPolarHBondContact CA-O 3.44Å; F278-R280 HydrophobicContact CB-CG 4.27Å; F278-R280 PolarHBondContact O-N 3.47Å; R280-I282 HydrophobicContact CG-CG1 4.46Å; R280-I282 PolarHBondContact O-N 3.5Å; R280-G335 PolarHBondContact NH2-O 2.72Å; R280-V336 VanDerWaalsContact NH2-CA 3.31Å
281	S	74.1	Confident	67.6	Low	93 Å²	93	98.4 Å²	98.4	65%	0.65	55%	0.55	S	S	*	*			trans	-63.5	119.4	172.1	-170.2	0	0	0	0	109.5
282	I	72.7	Confident	65.2	Low	15 Å²	15	100.1 Å²	100.1	8%	0.077	56%	0.559	C	S	.	*			trans	-100.9	113.3	176.5	-59.1	-169.7	0	0	0	106.7	L274 F278 R280 D284 P333 Q334 V336	L274-I282 HydrophobicContact CB-CD1 4.21Å; F278-I282 HydrophobicContact CB-CD1 3.86Å; F278-I282 HydrophobicContact CD2-CD1 3.38Å; F278-I282 HydrophobicContact CE2-CD1 4.18Å; F278-I282 HydrophobicContact CG-CD1 3.79Å; R280-I282 HydrophobicContact CG-CG1 4.46Å; R280-I282 PolarHBondContact O-N 3.5Å; I282-D284 PolarHBondContact O-N 3.42Å; I282-D284 VanDerWaalsContact O-N 3.09Å; I282-P333 HydrophobicContact CD1-CB 3.96Å; I282-P333 HydrophobicContact CD1-CG 4.41Å; I282-P333 HydrophobicContact CG2-CB 3.91Å; I282-Q334 WeakPolarHBondContact CG2-O 3.49Å; I282-V336 HydrophobicContact CD1-CG2 3.35Å; I282-V336 HydrophobicContact CG1-CG2 4.14Å
283	M	58.2	Low	63	Low	168 Å²	168	98.4 Å²	98.4	83%	0.828	57%	0.565	S	S	*	*			trans	-70.7	103.6	169.1	-71.6	-163.7	169.5	0	0	107.8	G285	M283-G285 PolarHBondContact O-N 3.33Å
284	D	54.4	Low	60.4	Low	90 Å²	90	104.1 Å²	104.1	48%	0.481	59%	0.594	S	S	.	*			trans	-70.7	114.8	168	-121.9	-7.2	0	0	0	107.1	I282 A286	I282-D284 PolarHBondContact O-N 3.42Å; I282-D284 VanDerWaalsContact O-N 3.09Å; D284-A286 PolarHBondContact O-N 3.34Å
285	G	47.1	Very low	58	Low	51 Å²	51	108.4 Å²	108.4	53%	0.526	63%	0.63	S	S	.	*			trans	-66.1	27.2	177	0	0	0	0	0	114.5	M283 E287	M283-G285 PolarHBondContact O-N 3.33Å; G285-E287 PolarHBondContact O-N 2.87Å; G285-E287 VanDerWaalsContact O-N 3.08Å
286	A	47.2	Very low	55.8	Low	82 Å²	82	114.8 Å²	114.8	68%	0.678	65%	0.65	S	S	*	*			trans	-79.6	71.6	167.8	0	0	0	0	0	109.4	D284 G288	D284-A286 PolarHBondContact O-N 3.34Å; A286-G288 VanDerWaalsContact C-N 3.34Å; A286-G288 PolarHBondContact O-N 2.75Å
287	E	40.9	Very low	53.2	Low	200 Å²	200	116.7 Å²	116.7	94%	0.935	66%	0.655	S	S	*	*			trans	-65.8	100.5	153.8	-73.6	-166.4	166.8	0	0	107.6	G285	G285-E287 PolarHBondContact O-N 2.87Å; G285-E287 VanDerWaalsContact O-N 3.08Å
288	G	34.9	Very low	51.1	Low	60 Å²	60	125.5 Å²	125.5	62%	0.619	69%	0.685	S	S	*	*			trans	-171.8	75.6	-179.8	0	0	0	0	0	112	A286	A286-G288 VanDerWaalsContact C-N 3.34Å; A286-G288 PolarHBondContact O-N 2.75Å
289	E	30.5	Very low	48.9	Very low	179 Å²	179	129.6 Å²	129.6	84%	0.836	72%	0.715	S	S	*	*			trans	48.2	142.2	165.3	-67	-168.6	159.3	0	0	119.1	R291	E289-R291 PolarHBondContact O-N 3.3Å
290	P	32.8	Very low	46.9	Very low	130 Å²	130	132.7 Å²	132.7	84%	0.844	72%	0.722	S	S	*	*			trans	-65	99.4	168.6	28.4	-30.7	0	0	0	108.5	S292	P290-S292 PolarHBondContact O-N 2.79Å
291	R	38.5	Very low	45.1	Very low	230 Å²	230	130.3 Å²	130.3	87%	0.868	74%	0.737	S	S	*	*			trans	-58.5	105.6	166.3	-78.7	-174	171.7	-173.7	-1.9	107.1	E289 N293	E289-R291 PolarHBondContact O-N 3.3Å; R291-N293 PolarHBondContact O-N 2.96Å
292	S	37.5	Very low	43.5	Very low	92 Å²	92	137.2 Å²	137.2	64%	0.643	75%	0.749	S	S	*	*			trans	-52.8	131.6	166.8	59.1	0	0	0	0	107.9	P290 M294	P290-S292 PolarHBondContact O-N 2.79Å; S292-M294 PolarHBondContact O-N 3.48Å
293	N	42.1	Very low	41.8	Very low	170 Å²	170	142.4 Å²	142.4	91%	0.909	78%	0.784	S	S	*	*			trans	-62.5	79.2	168.4	-85	-28	0	0	0	109	R291 A295	R291-N293 PolarHBondContact O-N 2.96Å; N293-A295 PolarHBondContact O-N 2.82Å
294	M	35.8	Very low	40.7	Very low	163 Å²	163	141.2 Å²	141.2	80%	0.803	79%	0.786	S	S	*	*			trans	-91.1	89.7	160.6	-74.9	-163.1	87.7	0	0	107.8	S292 R296	S292-M294 PolarHBondContact O-N 3.48Å; M294-R296 PolarHBondContact O-N 3.41Å
295	A	39.4	Very low	39.9	Very low	96 Å²	96	142.5 Å²	142.5	79%	0.793	80%	0.802	S	S	*	*			trans	-53.3	112.8	161	0	0	0	0	0	108.5	N293	N293-A295 PolarHBondContact O-N 2.82Å
296	R	44.7	Very low	39.4	Very low	229 Å²	229	143 Å²	143	86%	0.864	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-61.3	135.6	164.6	-77	-178	174.6	-175.7	-0.5	108	M294 R298	M294-R296 PolarHBondContact O-N 3.41Å; R296-R298 PolarHBondContact O-N 3.29Å
297	P	36	Very low	38.8	Very low	125 Å²	125	148.2 Å²	148.2	81%	0.812	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-63	128.6	178.9	21.2	-25.8	0	0	0	109.7
298	R	48.3	Very low	38.3	Very low	233 Å²	233	142 Å²	142	88%	0.879	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-66.6	142	176.7	-71.3	179.2	-177.6	179.7	0.3	109.8	R296	R296-R298 PolarHBondContact O-N 3.29Å
299	P	43.5	Very low	38.4	Very low	117 Å²	117	148.4 Å²	148.4	76%	0.76	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-63.1	140.5	168.9	25.4	-30.7	0	0	0	110.1	G301	P299-G301 PolarHBondContact O-N 2.94Å
300	P	44	Very low	38.9	Very low	135 Å²	135	147.2 Å²	147.2	88%	0.877	82%	0.822	S	S	*	*	S	Bend	trans	-71.7	128	-177.2	26.9	-31.2	0	0	0	110.9
301	G	43.4	Very low	39.3	Very low	78 Å²	78	146.1 Å²	146.1	80%	0.804	82%	0.817	S	S	*	*			trans	148.5	6.7	168.1	0	0	0	0	0	120	P299	P299-G301 PolarHBondContact O-N 2.94Å
302	R	41.9	Very low	39.9	Very low	239 Å²	239	143.4 Å²	143.4	90%	0.902	81%	0.807	S	S	*	*			trans	-111.4	135.4	175.5	-103.2	-177.4	-179.7	-176.6	1	112.6
303	P	36.3	Very low	40.8	Very low	124 Å²	124	145 Å²	145	81%	0.805	82%	0.815	S	S	*	*			trans	-67.2	144.9	177.2	21.3	-21.4	0	0	0	111.2	S305	P303-S305 PolarHBondContact O-N 3.37Å
304	V	35.7	Very low	42	Very low	143 Å²	143	141.6 Å²	141.6	87%	0.867	81%	0.811	S	S	*	*			trans	-78.5	104.3	177.8	-178.4	0	0	0	0	108.4
305	S	37.4	Very low	44.1	Very low	116 Å²	116	136.8 Å²	136.8	81%	0.811	79%	0.787	S	S	*	*			trans	-88.4	101.6	163	56.9	0	0	0	0	108.3	P303	P303-S305 PolarHBondContact O-N 3.37Å
306	G	36.7	Very low	46.4	Very low	61 Å²	61	134.7 Å²	134.7	63%	0.629	77%	0.77	S	S	*	*			trans	-78.6	116.9	168.7	0	0	0	0	0	109.8
307	H	34.9	Very low	48.3	Very low	193 Å²	193	125.8 Å²	125.8	89%	0.894	74%	0.739	S	S	*	*			trans	-154.1	133	163.6	-95.8	16.1	0	0	0	109.8
308	G	30.8	Very low	50.7	Low	70 Å²	70	128 Å²	128	72%	0.722	74%	0.736	S	S	*	*			trans	54.4	126.7	146.6	0	0	0	0	0	120.4	D310	G308-D310 PolarHBondContact O-N 2.72Å; G308-D310 VanDerWaalsContact O-N 3.11Å
309	M	36.1	Very low	52.7	Low	193 Å²	193	122.3 Å²	122.3	95%	0.951	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	8.9	-178.6	-159.9	150.7	166.8	0	0	115.6
310	D	41	Very low	54.9	Low	155 Å²	155	117.4 Å²	117.4	83%	0.829	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131	31.3	-170.4	-74	-37.7	0	0	0	115.5	G308	G308-D310 PolarHBondContact O-N 2.72Å; G308-D310 VanDerWaalsContact O-N 3.11Å
311	S	41.8	Very low	57.1	Low	106 Å²	106	112.2 Å²	112.2	74%	0.741	65%	0.652	S	S	*	*			trans	-147.8	91.7	174.1	-58.2	0	0	0	0	111.4
312	R	51.2	Low	59.4	Low	174 Å²	174	112.8 Å²	112.8	66%	0.657	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-59.1	126.7	160.9	-75.9	-177.8	-178.5	158.1	1.8	107.5	D270 E273 A314	D270-R312 IonicContact OD2-CZ 2.8Å; D270-R312 IonicContact OD2-NH1 3.07Å; D270-R312 PolarHBondContact OD2-NH1 2.94Å; D270-R312 IonicContact OD2-NH2 3.71Å; D270-R312 PolarHBondContact OD2-NH2 3.07Å; E273-R312 IonicContact OE1-NH1 2.72Å; E273-R312 PolarHBondContact OE1-NH1 3.03Å; R312-A314 PolarHBondContact O-N 2.96Å
313	P	55.3	Low	61.9	Low	124 Å²	124	103.5 Å²	103.5	81%	0.805	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-61.6	139.4	178.4	17.5	-22.5	0	0	0	109.8	M315	P313-M315 PolarHBondContact O-N 3.33Å
314	A	67.9	Low	64.6	Low	100 Å²	100	97.8 Å²	97.8	83%	0.826	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-55.7	129.4	172.6	0	0	0	0	0	109.5	R312 A316	R312-A314 PolarHBondContact O-N 2.96Å; A314-A316 PolarHBondContact O-N 3.49Å
315	M	79.4	Confident	67.4	Low	62 Å²	62	92.2 Å²	92.2	31%	0.305	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-57	134.2	178.5	179.9	179.1	-82.3	0	0	110.2	P267 P313 E319 L320 Y323	P267-M315 HydrophobicContact CB-CE 3.76Å; P267-M315 HydrophobicContact CG-CE 3.78Å; P313-M315 PolarHBondContact O-N 3.33Å; M315-E319 HydrophobicContact CG-CB 3.56Å; M315-E319 HydrophobicContact SD-CB 4.25Å; M315-L320 HydrophobicContact CG-CB 4.34Å; M315-L320 VanDerWaalsContact SD-CA 3.5Å; M315-L320 HydrophobicContact SD-CB 3.92Å; M315-L320 HydrophobicContact SD-CD1 4.23Å; M315-Y323 HydrophobicContact CE-CD2 4.07Å
316	A	87.7	Confident	70.1	Confident	51 Å²	51	91.5 Å²	91.5	42%	0.421	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-70.9	155.9	176.4	0	0	0	0	0	110.8	A314 F318 E319 L320	A314-A316 PolarHBondContact O-N 3.49Å; A316-F318 VanDerWaalsContact C-N 3.33Å; A316-F318 PolarHBondContact O-N 2.99Å; A316-E319 HydrophobicContact CB-CG 4.24Å; A316-E319 PolarHBondContact N-OE2 2.94Å; A316-E319 VanDerWaalsContact N-OE2 3.09Å; A316-E319 WeakPolarHBondContact O-CB 3.5Å; A316-E319 PolarHBondContact O-N 3.18Å; A316-E319 VanDerWaalsContact O-N 3.12Å; A316-L320 PolarHBondContact O-N 3.21Å
317	I	84.7	Confident	73	Confident	43 Å²	43	92.6 Å²	92.6	22%	0.221	51%	0.506	C	S	.	.	H	α-helix	trans	-57.5	-43.6	-177.5	-171.8	74.8	0	0	0	113	V227 E319 L320 L321	V227-I317 HydrophobicContact CG1-CB 3.51Å; V227-I317 HydrophobicContact CG1-CD1 3.81Å; V227-I317 HydrophobicContact CG1-CG1 3.29Å; V227-I317 HydrophobicContact CG1-CG2 3.5Å; I317-E319 VanDerWaalsContact C-N 3.25Å; I317-E319 PolarHBondContact O-N 2.79Å; I317-L320 HydrophobicContact CD1-CD2 4.09Å; I317-L320 WeakPolarHBondContact O-CA 3.38Å; I317-L320 WeakPolarHBondContact O-CB 3.42Å; I317-L320 PolarHBondContact O-N 3.2Å; I317-L321 HydrophobicContact CD1-CD2 4.37Å; I317-L321 HydrophobicContact CD1-CG 4.39Å; I317-L321 HydrophobicContact CG1-CD1 4.17Å; I317-L321 HydrophobicContact CG1-CG 4.08Å; I317-L321 WeakPolarHBondContact O-CG 3.31Å; I317-L321 PolarHBondContact O-N 3.5Å
318	F	86.3	Confident	75.9	Confident	170 Å²	170	87.3 Å²	87.3	75%	0.746	49%	0.489	S	S	*	.	H	α-helix	trans	-64.1	-35.6	-178.2	-72.1	-72.5	0	0	0	111.6	A316 L320 L321 D322	A316-F318 VanDerWaalsContact C-N 3.33Å; A316-F318 PolarHBondContact O-N 2.99Å; F318-L320 VanDerWaalsContact C-N 3.34Å; F318-L321 PolarHBondContact O-N 2.93Å; F318-D322 VanDerWaalsContact O-CB 3.23Å; F318-D322 WeakPolarHBondContact O-CB 3.22Å; F318-D322 PolarHBondContact O-N 3.46Å
319	E	90.2	Very high	79	Confident	114 Å²	114	85.8 Å²	85.8	53%	0.533	47%	0.466	S	S	.	.	H	α-helix	trans	-66.3	-38.4	173.3	-61.4	172	170.7	0	0	110.9	M315 A316 I317 D322 Y323	M315-E319 HydrophobicContact CG-CB 3.56Å; M315-E319 HydrophobicContact SD-CB 4.25Å; A316-E319 HydrophobicContact CB-CG 4.24Å; A316-E319 PolarHBondContact N-OE2 2.94Å; A316-E319 VanDerWaalsContact N-OE2 3.09Å; A316-E319 WeakPolarHBondContact O-CB 3.5Å; A316-E319 PolarHBondContact O-N 3.18Å; A316-E319 VanDerWaalsContact O-N 3.12Å; I317-E319 VanDerWaalsContact C-N 3.25Å; I317-E319 PolarHBondContact O-N 2.79Å; E319-D322 PolarHBondContact O-N 3.22Å; E319-Y323 VanDerWaalsContact O-CB 3.31Å; E319-Y323 WeakPolarHBondContact O-CB 3.49Å; E319-Y323 PolarHBondContact O-N 3.23Å
320	L	90.3	Very high	81.8	Confident	15 Å²	15	76.9 Å²	76.9	8%	0.079	42%	0.423	C	S	.	.	H	α-helix	trans	-63.8	-47.6	175.3	175.6	62.2	0	0	0	112.2	S231 Y264 I266 M315 A316 I317 F318 D322 Y323 I324	S231-L320 WeakPolarHBondContact OG-CD2 3.32Å; Y264-L320 HydrophobicContact CE1-CD1 3.73Å; Y264-L320 HydrophobicContact CE1-CD2 4.07Å; I266-L320 HydrophobicContact CB-CD1 3.61Å; I266-L320 HydrophobicContact CG2-CD1 3.33Å; M315-L320 HydrophobicContact CG-CB 4.34Å; M315-L320 VanDerWaalsContact SD-CA 3.5Å; M315-L320 HydrophobicContact SD-CB 3.92Å; M315-L320 HydrophobicContact SD-CD1 4.23Å; A316-L320 PolarHBondContact O-N 3.21Å; I317-L320 HydrophobicContact CD1-CD2 4.09Å; I317-L320 WeakPolarHBondContact O-CA 3.38Å; I317-L320 WeakPolarHBondContact O-CB 3.42Å; I317-L320 PolarHBondContact O-N 3.2Å; F318-L320 VanDerWaalsContact C-N 3.34Å; L320-D322 VanDerWaalsContact C-N 3.33Å; L320-Y323 WeakPolarHBondContact O-CB 3.45Å; L320-Y323 PolarHBondContact O-N 3.23Å; L320-I324 HydrophobicContact CD1-CD1 4.34Å; L320-I324 HydrophobicContact CG-CD1 4.26Å; L320-I324 WeakPolarHBondContact O-CG1 3.46Å; L320-I324 PolarHBondContact O-N 3.48Å
321	L	90.6	Very high	84.4	Confident	26 Å²	26	76.2 Å²	76.2	14%	0.136	41%	0.412	C	S	.	.	H	α-helix	trans	-65.7	-39.7	178.9	-59.7	-176.2	0	0	0	111.1	R230 L238 I317 F318 I324 V325	R230-L321 HydrophobicContact CB-CD1 4.48Å; R230-L321 HydrophobicContact CB-CD2 3.8Å; L238-L321 HydrophobicContact CD1-CB 4.38Å; L238-L321 HydrophobicContact CD1-CD2 4.02Å; L238-L321 HydrophobicContact CD2-CD2 3.88Å; I317-L321 HydrophobicContact CD1-CD2 4.37Å; I317-L321 HydrophobicContact CD1-CG 4.39Å; I317-L321 HydrophobicContact CG1-CD1 4.17Å; I317-L321 HydrophobicContact CG1-CG 4.08Å; I317-L321 WeakPolarHBondContact O-CG 3.31Å; I317-L321 PolarHBondContact O-N 3.5Å; F318-L321 PolarHBondContact O-N 2.93Å; L321-I324 HydrophobicContact CD2-CD1 4.44Å; L321-I324 PolarHBondContact O-N 2.9Å; L321-V325 WeakPolarHBondContact O-CG2 3.46Å; L321-V325 PolarHBondContact O-N 2.67Å; L321-V325 VanDerWaalsContact O-N 3.15Å
322	D	91.6	Very high	86.9	Confident	89 Å²	89	71.6 Å²	71.6	48%	0.476	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-43.4	174	-171	69.7	0	0	0	111.4	F318 E319 L320 I324 V325 N326	F318-D322 VanDerWaalsContact O-CB 3.23Å; F318-D322 WeakPolarHBondContact O-CB 3.22Å; F318-D322 PolarHBondContact O-N 3.46Å; E319-D322 PolarHBondContact O-N 3.22Å; L320-D322 VanDerWaalsContact C-N 3.33Å; D322-I324 PolarHBondContact O-N 2.94Å; D322-V325 PolarHBondContact O-N 3.1Å; D322-V325 VanDerWaalsContact O-N 3.12Å; D322-N326 WeakPolarHBondContact O-CB 3.29Å; D322-N326 PolarHBondContact O-N 2.83Å; D322-N326 PolarHBondContact OD1-ND2 3.29Å
323	Y	93.8	Very high	88.9	Confident	45 Å²	45	63.5 Å²	63.5	18%	0.176	35%	0.349	C	S	.	.	H	α-helix	trans	-57.7	-49.6	175.5	-165	-72.9	0	0	0	111.3	I266 P267 P268 M315 E319 L320 V325 N326 E327	I266-Y323 HydrophobicContact CG2-CD1 3.29Å; I266-Y323 HydrophobicContact CG2-CD2 4.37Å; I266-Y323 HydrophobicContact CG2-CE1 3.88Å; I266-Y323 HydrophobicContact CG2-CG 3.6Å; P267-Y323 HydrophobicContact CB-CE2 4.4Å; P268-Y323 VanDerWaalsContact CD-CZ 3.47Å; P268-Y323 WeakPolarHBondContact CD-OH 3.37Å; P268-Y323 HydrophobicContact CG-CE1 4.46Å; P268-Y323 WeakPolarHBondContact CG-OH 3.38Å; M315-Y323 HydrophobicContact CE-CD2 4.07Å; E319-Y323 VanDerWaalsContact O-CB 3.31Å; E319-Y323 WeakPolarHBondContact O-CB 3.49Å; E319-Y323 PolarHBondContact O-N 3.23Å; L320-Y323 WeakPolarHBondContact O-CB 3.45Å; L320-Y323 PolarHBondContact O-N 3.23Å; Y323-V325 PolarHBondContact O-N 3.27Å; Y323-N326 PolarHBondContact O-N 3.33Å; Y323-E327 HydrophobicContact CD1-CB 3.64Å; Y323-E327 HydrophobicContact CD1-CG 4.28Å; Y323-E327 HydrophobicContact CD2-CB 3.89Å; Y323-E327 HydrophobicContact CD2-CG 3.63Å; Y323-E327 HydrophobicContact CE1-CB 3.53Å; Y323-E327 HydrophobicContact CE1-CG 4.36Å; Y323-E327 HydrophobicContact CE2-CB 3.79Å; Y323-E327 HydrophobicContact CE2-CG 3.72Å; Y323-E327 HydrophobicContact CG-CB 3.8Å; Y323-E327 HydrophobicContact CG-CG 3.91Å; Y323-E327 WeakPolarHBondContact O-CB 3.34Å; Y323-E327 PolarHBondContact O-N 3.38Å
324	I	94.2	Very high	90.5	Very high	3 Å²	3	62.4 Å²	62.4	2%	0.015	33%	0.333	C	S	.	.	H	α-helix	trans	-54.7	-42	177.6	-69.7	164.2	0	0	0	110.6	S231 P235 L238 W250 I266 L320 L321 D322 K351	S231-I324 VanDerWaalsContact O-CD1 3.22Å; S231-I324 WeakPolarHBondContact O-CD1 3.28Å; P235-I324 HydrophobicContact CG-CG2 4.07Å; L238-I324 HydrophobicContact CD1-CB 3.96Å; L238-I324 HydrophobicContact CD1-CD1 4.26Å; L238-I324 HydrophobicContact CD1-CG2 3.61Å; W250-I324 HydrophobicContact CZ2-CG2 3.98Å; I266-I324 HydrophobicContact CD1-CD1 4.34Å; I266-I324 HydrophobicContact CD1-CG1 3.57Å; L320-I324 HydrophobicContact CD1-CD1 4.34Å; L320-I324 HydrophobicContact CG-CD1 4.26Å; L320-I324 WeakPolarHBondContact O-CG1 3.46Å; L320-I324 PolarHBondContact O-N 3.48Å; L321-I324 HydrophobicContact CD2-CD1 4.44Å; L321-I324 PolarHBondContact O-N 2.9Å; D322-I324 PolarHBondContact O-N 2.94Å; I324-K351 WeakPolarHBondContact O-CE 3.37Å; I324-K351 PolarHBondContact O-NZ 3.41Å
325	V	94.2	Very high	91.4	Very high	27 Å²	27	60.7 Å²	60.7	16%	0.164	33%	0.325	C	S	.	.	H	α-helix	trans	-79.4	-36	-175.9	176.3	0	0	0	0	113.4	L238 Q239 L321 D322 Y323 K351	L238-V325 HydrophobicContact CB-CG2 3.88Å; L238-V325 HydrophobicContact CD1-CG2 4.02Å; Q239-V325 HydrophobicContact CG-CG1 3.96Å; Q239-V325 HydrophobicContact CG-CG2 4.34Å; L321-V325 WeakPolarHBondContact O-CG2 3.46Å; L321-V325 PolarHBondContact O-N 2.67Å; L321-V325 VanDerWaalsContact O-N 3.15Å; D322-V325 PolarHBondContact O-N 3.1Å; D322-V325 VanDerWaalsContact O-N 3.12Å; Y323-V325 PolarHBondContact O-N 3.27Å; V325-K351 VanDerWaalsContact O-CE 3.28Å; V325-K351 WeakPolarHBondContact O-CE 3.06Å; V325-K351 PolarHBondContact O-NZ 2.66Å
326	N	94.5	Very high	92	Very high	100 Å²	100	59.3 Å²	59.3	54%	0.535	32%	0.32	S	S	.	.	H	α-helix	trans	-115.1	-23.7	-166.6	-67.2	-45.7	0	0	0	115	D322 Y323	D322-N326 WeakPolarHBondContact O-CB 3.29Å; D322-N326 PolarHBondContact O-N 2.83Å; D322-N326 PolarHBondContact OD1-ND2 3.29Å; Y323-N326 PolarHBondContact O-N 3.33Å
327	E	95.9	Very high	92.4	Very high	85 Å²	85	57.9 Å²	57.9	40%	0.397	31%	0.305	S	S	.	.	S	Bend	trans	-96.8	163.7	-178.3	-65.4	-66.6	159.6	0	0	112.2	Y323 K351	Y323-E327 HydrophobicContact CD1-CB 3.64Å; Y323-E327 HydrophobicContact CD1-CG 4.28Å; Y323-E327 HydrophobicContact CD2-CB 3.89Å; Y323-E327 HydrophobicContact CD2-CG 3.63Å; Y323-E327 HydrophobicContact CE1-CB 3.53Å; Y323-E327 HydrophobicContact CE1-CG 4.36Å; Y323-E327 HydrophobicContact CE2-CB 3.79Å; Y323-E327 HydrophobicContact CE2-CG 3.72Å; Y323-E327 HydrophobicContact CG-CB 3.8Å; Y323-E327 HydrophobicContact CG-CG 3.91Å; Y323-E327 WeakPolarHBondContact O-CB 3.34Å; Y323-E327 PolarHBondContact O-N 3.38Å; E327-K351 PolarHBondContact O-NZ 2.94Å
328	P	96	Very high	93.1	Very high	82 Å²	82	57.4 Å²	57.4	53%	0.532	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-57.7	145.2	175	-24.6	35	0	0	0	112.2
329	P	96.4	Very high	93.6	Very high	37 Å²	37	53.6 Å²	53.6	24%	0.24	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-64.6	150.8	175.9	28.5	-34	0	0	0	110.9	W250 L349	W250-P329 HydrophobicContact CH2-CB 4.07Å; W250-P329 HydrophobicContact CZ3-CB 4.33Å; P329-L349 HydrophobicContact CB-CB 3.97Å; P329-L349 VanDerWaalsContact CB-O 3.28Å; P329-L349 WeakPolarHBondContact CB-O 3.47Å; P329-L349 WeakPolarHBondContact CG-O 3.44Å
330	P	95.7	Very high	94	Very high	6 Å²	6	50.3 Å²	50.3	4%	0.039	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-64.7	154.5	175.6	27.3	-31.8	0	0	0	110.9	L254 P265 I266 L349	L254-P330 HydrophobicContact CD1-CG 3.5Å; P265-P330 HydrophobicContact CB-CB 3.9Å; P265-P330 HydrophobicContact CB-CG 4.17Å; P265-P330 HydrophobicContact CG-CB 4.42Å; P265-P330 HydrophobicContact CG-CG 4.14Å; I266-P330 HydrophobicContact CD1-CG 4.41Å; I266-P330 HydrophobicContact CG1-CG 4.13Å; P330-L349 HydrophobicContact CG-CD1 4.02Å; P330-L349 VanDerWaalsContact O-CD1 3.29Å; P330-L349 WeakPolarHBondContact O-CD1 3.45Å
331	K	94.3	Very high	94.4	Very high	142 Å²	142	49.6 Å²	49.6	62%	0.617	28%	0.282	S	S	*	.			trans	-131	156.2	179	-63.6	179.9	-177.7	178.3	0	109.7
332	L	95.7	Very high	94.8	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.047	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-73.1	144	167.9	-72.1	173.1	0	0	0	110.1	V257 A260 I261 F337 F341 Q342 V345	V257-L332 HydrophobicContact CB-CD2 4.5Å; V257-L332 HydrophobicContact CG1-CD2 4.26Å; V257-L332 HydrophobicContact CG2-CD2 4.39Å; V257-L332 HydrophobicContact CG2-CG 4.43Å; A260-L332 HydrophobicContact CB-CD2 3.67Å; I261-L332 HydrophobicContact CG1-CD2 4.34Å; L332-F337 HydrophobicContact CB-CD2 3.92Å; L332-F337 HydrophobicContact CD1-CB 4.39Å; L332-F337 HydrophobicContact CD1-CD2 4.41Å; L332-F337 HydrophobicContact CD1-CG 4.29Å; L332-F337 HydrophobicContact CD2-CD2 3.97Å; L332-F337 HydrophobicContact CD2-CE2 3.91Å; L332-F337 HydrophobicContact CD2-CG 4.5Å; L332-F337 HydrophobicContact CD2-CZ 4.38Å; L332-F337 HydrophobicContact CG-CD2 4.33Å; L332-F341 HydrophobicContact CD1-CD1 3.46Å; L332-F341 VanDerWaalsContact CD1-CD1 3.46Å; L332-F341 HydrophobicContact CD1-CD2 4.2Å; L332-F341 HydrophobicContact CD1-CE1 3.45Å; L332-F341 VanDerWaalsContact CD1-CE1 3.45Å; L332-F341 HydrophobicContact CD1-CE2 4.19Å; L332-F341 HydrophobicContact CD1-CG 3.84Å; L332-F341 HydrophobicContact CD1-CZ 3.82Å; L332-F341 HydrophobicContact CD2-CE1 4.44Å; L332-Q342 HydrophobicContact CB-CG 4.01Å; L332-V345 HydrophobicContact CD1-CB 4.19Å; L332-V345 HydrophobicContact CD1-CG2 3.81Å; L332-V345 HydrophobicContact CG-CG1 4.46Å; L332-V345 HydrophobicContact CG-CG2 4.47Å
333	P	93.1	Very high	95.1	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.019	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-65.7	136.4	178.1	24.6	-33	0	0	0	112.1	L274 F278 I282 V336 F337	L274-P333 HydrophobicContact CD1-CB 4.4Å; L274-P333 HydrophobicContact CD2-CB 4.22Å; L274-P333 HydrophobicContact CD2-CG 4.23Å; F278-P333 HydrophobicContact CD2-CG 4.5Å; F278-P333 HydrophobicContact CE2-CG 3.76Å; F278-P333 HydrophobicContact CZ-CG 4.02Å; I282-P333 HydrophobicContact CD1-CB 3.96Å; I282-P333 HydrophobicContact CD1-CG 4.41Å; I282-P333 HydrophobicContact CG2-CB 3.91Å; P333-V336 HydrophobicContact CB-CG2 4.29Å; P333-V336 HydrophobicContact CG-CB 4.18Å; P333-V336 HydrophobicContact CG-CG2 4.15Å; P333-F337 HydrophobicContact CG-CD2 3.92Å; P333-F337 HydrophobicContact CG-CE2 3.65Å
334	Q	88.1	Confident	95.3	Very high	101 Å²	101	46.7 Å²	46.7	47%	0.472	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	149.7	177.6	-67.4	-176.1	-5.8	0	0	111.6	I282 V336	I282-Q334 WeakPolarHBondContact CG2-O 3.49Å; Q334-V336 PolarHBondContact O-N 3.48Å; Q334-V336 VanDerWaalsContact O-N 3.1Å
335	G	86	Confident	95.5	Very high	64 Å²	64	46.6 Å²	46.6	66%	0.66	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	-2.3	179.4	0	0	0	0	0	115.2	R280	R280-G335 PolarHBondContact NH2-O 2.72Å
336	V	93.2	Very high	95.7	Very high	33 Å²	33	48 Å²	48	20%	0.2	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-49.6	173.6	-179.6	0	0	0	0	112.9	F278 R280 I282 P333 Q334	F278-V336 HydrophobicContact CD1-CB 4.5Å; F278-V336 HydrophobicContact CD1-CG1 3.52Å; F278-V336 HydrophobicContact CD1-CG2 4.15Å; F278-V336 HydrophobicContact CD2-CG2 4.4Å; F278-V336 HydrophobicContact CE1-CG1 3.44Å; F278-V336 VanDerWaalsContact CE1-CG1 3.44Å; F278-V336 HydrophobicContact CG-CG1 4.3Å; F278-V336 HydrophobicContact CG-CG2 4.11Å; F278-V336 HydrophobicContact CZ-CG1 4.1Å; R280-V336 VanDerWaalsContact NH2-CA 3.31Å; I282-V336 HydrophobicContact CD1-CG2 3.35Å; I282-V336 HydrophobicContact CG1-CG2 4.14Å; P333-V336 HydrophobicContact CB-CG2 4.29Å; P333-V336 HydrophobicContact CG-CB 4.18Å; P333-V336 HydrophobicContact CG-CG2 4.15Å; Q334-V336 PolarHBondContact O-N 3.48Å; Q334-V336 VanDerWaalsContact O-N 3.1Å
337	F	96.5	Very high	95.9	Very high	22 Å²	22	46.6 Å²	46.6	10%	0.096	27%	0.266	C	S	.	.	S	Bend	trans	-104.4	156.3	-176.9	-62.1	-75.1	0	0	0	109.9	E166 A260 F278 L332 P333 F341 Q342	E166-F337 HydrophobicContact CB-CD1 4.39Å; E166-F337 WeakPolarHBondContact OE2-CA 3.19Å; A260-F337 HydrophobicContact CB-CE1 3.85Å; A260-F337 HydrophobicContact CB-CE2 4.47Å; A260-F337 HydrophobicContact CB-CZ 3.72Å; F278-F337 HydrophobicContact CE1-CE2 4.18Å; F278-F337 HydrophobicContact CE1-CZ 4.01Å; F278-F337 AromaticContact CZ-CE2 3.91Å; F278-F337 HydrophobicContact CZ-CE2 3.91Å; F278-F337 HydrophobicContact CZ-CZ 4.01Å; L332-F337 HydrophobicContact CB-CD2 3.92Å; L332-F337 HydrophobicContact CD1-CB 4.39Å; L332-F337 HydrophobicContact CD1-CD2 4.41Å; L332-F337 HydrophobicContact CD1-CG 4.29Å; L332-F337 HydrophobicContact CD2-CD2 3.97Å; L332-F337 HydrophobicContact CD2-CE2 3.91Å; L332-F337 HydrophobicContact CD2-CG 4.5Å; L332-F337 HydrophobicContact CD2-CZ 4.38Å; L332-F337 HydrophobicContact CG-CD2 4.33Å; P333-F337 HydrophobicContact CG-CD2 3.92Å; P333-F337 HydrophobicContact CG-CE2 3.65Å; F337-F341 HydrophobicContact CB-CD1 4Å; F337-F341 AromaticContact CD1-CD1 3.76Å; F337-F341 HydrophobicContact CD1-CD1 3.76Å; F337-F341 AromaticContact CD1-CE1 3.9Å; F337-F341 HydrophobicContact CD1-CE1 3.9Å; F337-F341 HydrophobicContact CE1-CE1 4.3Å; F337-F341 HydrophobicContact CG-CD1 4.07Å; F337-F341 HydrophobicContact CG-CE1 4.42Å; F337-Q342 HydrophobicContact CB-CG 4.17Å; F337-Q342 PolarHBondContact O-NE2 2.95Å
338	S	97.8	Very high	96.1	Very high	33 Å²	33	42.6 Å²	42.6	23%	0.231	25%	0.247	C	C	.	.			trans	-61.2	152.6	175.5	77.2	0	0	0	0	111.2	E166 D340 F341 Q342 R370	E166-S338 WeakPolarHBondContact OE1-CB 3.45Å; E166-S338 PolarHBondContact OE1-OG 3.25Å; E166-S338 PolarHBondContact OE2-N 2.94Å; S338-D340 PolarHBondContact O-N 3.39Å; S338-F341 PolarHBondContact O-N 2.92Å; S338-F341 PolarHBondContact OG-N 2.91Å; S338-Q342 WeakPolarHBondContact O-CG 3.38Å; S338-Q342 PolarHBondContact O-N 2.65Å; S338-Q342 VanDerWaalsContact O-N 3.08Å; S338-R370 PolarHBondContact OG-NH1 2.68Å; S338-R370 PolarHBondContact OG-NH2 3.09Å
339	S	97.8	Very high	96.2	Very high	90 Å²	90	38.7 Å²	38.7	63%	0.629	22%	0.222	S	C	*	.	H	α-helix	trans	-58.9	-34.7	175.6	51.8	0	0	0	0	112	Q342 D343	S339-Q342 PolarHBondContact O-N 3.46Å; S339-D343 WeakPolarHBondContact O-CB 3.44Å; S339-D343 PolarHBondContact O-N 3.27Å
340	D	98.1	Very high	96.3	Very high	44 Å²	44	39.3 Å²	39.3	24%	0.235	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-43.4	176.7	-67	-40.9	0	0	0	111.8	S338 D343 F344 H365 T366 F367 R370	S338-D340 PolarHBondContact O-N 3.39Å; D340-D343 PolarHBondContact O-N 3.05Å; D340-F344 VanDerWaalsContact O-CB 3.29Å; D340-F344 WeakPolarHBondContact O-CB 3.25Å; D340-F344 PolarHBondContact O-N 3.29Å; D340-H365 PolarHBondContact O-CE1 3.27Å; D340-T366 WeakPolarHBondContact OD1-CB 3.45Å; D340-T366 PolarHBondContact OD1-OG1 2.71Å; D340-F367 HydrophobicContact CB-CB 4Å; D340-R370 IonicContact OD2-NH1 2.87Å; D340-R370 PolarHBondContact OD2-NH1 2.72Å
341	F	98.7	Very high	96.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-70.4	-40.1	180	-175.5	-147.1	0	0	0	111.7	E166 L169 L256 A260 L332 F337 S338 D343 F344 V345 F367	E166-F341 HydrophobicContact CB-CD1 4.28Å; E166-F341 HydrophobicContact CG-CB 4.08Å; E166-F341 HydrophobicContact CG-CD1 3.56Å; E166-F341 HydrophobicContact CG-CE1 4.21Å; E166-F341 HydrophobicContact CG-CG 3.95Å; E166-F341 WeakPolarHBondContact OE1-CB 3.36Å; L169-F341 HydrophobicContact CB-CZ 4.21Å; L169-F341 HydrophobicContact CD1-CE1 3.99Å; L169-F341 HydrophobicContact CD1-CZ 3.75Å; L256-F341 HydrophobicContact CB-CE2 4.4Å; L256-F341 HydrophobicContact CB-CZ 4.38Å; L256-F341 HydrophobicContact CD1-CE2 4.48Å; A260-F341 HydrophobicContact CB-CE1 4.01Å; A260-F341 HydrophobicContact CB-CZ 4.3Å; L332-F341 HydrophobicContact CD1-CD1 3.46Å; L332-F341 VanDerWaalsContact CD1-CD1 3.46Å; L332-F341 HydrophobicContact CD1-CD2 4.2Å; L332-F341 HydrophobicContact CD1-CE1 3.45Å; L332-F341 VanDerWaalsContact CD1-CE1 3.45Å; L332-F341 HydrophobicContact CD1-CE2 4.19Å; L332-F341 HydrophobicContact CD1-CG 3.84Å; L332-F341 HydrophobicContact CD1-CZ 3.82Å; L332-F341 HydrophobicContact CD2-CE1 4.44Å; F337-F341 HydrophobicContact CB-CD1 4Å; F337-F341 AromaticContact CD1-CD1 3.76Å; F337-F341 HydrophobicContact CD1-CD1 3.76Å; F337-F341 AromaticContact CD1-CE1 3.9Å; F337-F341 HydrophobicContact CD1-CE1 3.9Å; F337-F341 HydrophobicContact CE1-CE1 4.3Å; F337-F341 HydrophobicContact CG-CD1 4.07Å; F337-F341 HydrophobicContact CG-CE1 4.42Å; S338-F341 PolarHBondContact O-N 2.92Å; S338-F341 PolarHBondContact OG-N 2.91Å; F341-D343 PolarHBondContact O-N 3.39Å; F341-F344 PolarHBondContact O-N 3.28Å; F341-V345 HydrophobicContact CD2-CG2 3.95Å; F341-V345 HydrophobicContact CE2-CG2 3.56Å; F341-V345 HydrophobicContact CZ-CG2 4.15Å; F341-V345 WeakPolarHBondContact O-CG2 3.28Å; F341-V345 PolarHBondContact O-N 3.24Å; F341-F367 HydrophobicContact CB-CD2 3.7Å; F341-F367 HydrophobicContact CB-CE2 3.61Å; F341-F367 HydrophobicContact CB-CG 4.43Å; F341-F367 HydrophobicContact CB-CZ 4.26Å; F341-F367 HydrophobicContact CD2-CD1 4.13Å; F341-F367 HydrophobicContact CD2-CD2 4.14Å; F341-F367 AromaticContact CD2-CE1 3.62Å; F341-F367 HydrophobicContact CD2-CE1 3.62Å; F341-F367 AromaticContact CD2-CE2 3.64Å; F341-F367 HydrophobicContact CD2-CE2 3.64Å; F341-F367 HydrophobicContact CD2-CG 4.36Å; F341-F367 AromaticContact CD2-CZ 3.35Å; F341-F367 HydrophobicContact CD2-CZ 3.35Å; F341-F367 HydrophobicContact CE2-CE1 4.01Å; F341-F367 AromaticContact CE2-CZ 3.83Å; F341-F367 HydrophobicContact CE2-CZ 3.83Å; F341-F367 HydrophobicContact CG-CD2 4.23Å; F341-F367 AromaticContact CG-CE2 3.73Å; F341-F367 HydrophobicContact CG-CE2 3.73Å; F341-F367 AromaticContact CG-CZ 3.89Å; F341-F367 HydrophobicContact CG-CZ 3.89Å
342	Q	98.4	Very high	96.5	Very high	38 Å²	38	38 Å²	38	18%	0.178	22%	0.219	C	C	.	.	H	α-helix	trans	-59.5	-45.3	173.5	-67.4	177.6	51.4	0	0	111.8	L332 F337 S338 S339 T346	L332-Q342 HydrophobicContact CB-CG 4.01Å; F337-Q342 HydrophobicContact CB-CG 4.17Å; F337-Q342 PolarHBondContact O-NE2 2.95Å; S338-Q342 WeakPolarHBondContact O-CG 3.38Å; S338-Q342 PolarHBondContact O-N 2.65Å; S338-Q342 VanDerWaalsContact O-N 3.08Å; S339-Q342 PolarHBondContact O-N 3.46Å; Q342-T346 VanDerWaalsContact O-CB 3.31Å; Q342-T346 WeakPolarHBondContact O-CB 3.11Å; Q342-T346 PolarHBondContact O-N 3.49Å; Q342-T346 PolarHBondContact O-OG1 3.46Å
343	D	98.6	Very high	96.5	Very high	62 Å²	62	39.3 Å²	39.3	33%	0.332	23%	0.229	S	C	.	.	H	α-helix	trans	-67.2	-41.7	178.8	-173.4	49.7	0	0	0	112.1	S339 D340 F341 V345 T346 K347 H365	S339-D343 WeakPolarHBondContact O-CB 3.44Å; S339-D343 PolarHBondContact O-N 3.27Å; D340-D343 PolarHBondContact O-N 3.05Å; F341-D343 PolarHBondContact O-N 3.39Å; D343-V345 PolarHBondContact O-N 3.14Å; D343-T346 PolarHBondContact O-N 3.12Å; D343-K347 WeakPolarHBondContact O-CG 3.31Å; D343-K347 PolarHBondContact O-N 3.19Å; D343-K347 IonicContact OD1-NZ 3.72Å; D343-K347 PolarHBondContact OD1-NZ 3Å; D343-K347 IonicContact OD2-NZ 3.1Å; D343-K347 PolarHBondContact OD2-NZ 3.23Å; D343-H365 IonicContact OD2-CE1 3.87Å; D343-H365 IonicContact OD2-NE2 3.99Å; D343-H365 PolarHBondContact OD2-NE2 3.07Å
344	F	98.8	Very high	96.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-56.8	-52.1	175.8	179.3	-98.6	0	0	0	111.6	L177 M252 L256 D340 F341 T346 K347 C348 L362 H365 F367 I368	L177-F344 HydrophobicContact CD1-CE2 4.2Å; L177-F344 HydrophobicContact CD1-CZ 4.02Å; M252-F344 HydrophobicContact CE-CE1 3.86Å; M252-F344 HydrophobicContact CE-CZ 3.76Å; L256-F344 HydrophobicContact CD1-CD1 4.23Å; L256-F344 HydrophobicContact CD1-CE1 3.65Å; D340-F344 VanDerWaalsContact O-CB 3.29Å; D340-F344 WeakPolarHBondContact O-CB 3.25Å; D340-F344 PolarHBondContact O-N 3.29Å; F341-F344 PolarHBondContact O-N 3.28Å; F344-T346 VanDerWaalsContact C-N 3.34Å; F344-T346 PolarHBondContact O-N 3.48Å; F344-K347 PolarHBondContact O-N 3.38Å; F344-C348 PolarHBondContact O-N 3.16Å; F344-C348 VanDerWaalsContact O-N 3.12Å; F344-C348 PolarHBondContact O-SG 3.27Å; F344-C348 VanDerWaalsContact O-SG 3.33Å; F344-L362 HydrophobicContact CD2-CD2 3.86Å; F344-L362 HydrophobicContact CE2-CB 4Å; F344-L362 HydrophobicContact CE2-CD2 3.58Å; F344-L362 HydrophobicContact CE2-CG 4.31Å; F344-L362 HydrophobicContact CZ-CD2 4.22Å; F344-H365 HydrophobicContact CD2-CB 3.89Å; F344-H365 AromaticContact CD2-CG 3.71Å; F344-H365 AromaticContact CD2-ND1 3.74Å; F344-H365 HydrophobicContact CE2-CB 4.34Å; F344-H365 PolarHBondContact N-CE1 3.39Å; F344-F367 HydrophobicContact CB-CB 3.87Å; F344-F367 HydrophobicContact CB-CD1 3.96Å; F344-F367 HydrophobicContact CB-CG 4.11Å; F344-F367 AromaticContact CD1-CD1 3.69Å; F344-F367 HydrophobicContact CD1-CD1 3.69Å; F344-F367 HydrophobicContact CD1-CE1 4.06Å; F344-F367 HydrophobicContact CD2-CB 4.34Å; F344-F367 HydrophobicContact CD2-CD1 4.02Å; F344-F367 HydrophobicContact CE1-CD1 4.17Å; F344-F367 HydrophobicContact CE1-CE1 4.34Å; F344-F367 HydrophobicContact CE2-CD1 4.45Å; F344-F367 HydrophobicContact CG-CB 4.21Å; F344-F367 AromaticContact CG-CD1 3.61Å; F344-F367 HydrophobicContact CG-CD1 3.61Å; F344-F367 HydrophobicContact CG-CE1 4.43Å; F344-F367 HydrophobicContact CG-CG 4.24Å; F344-I368 HydrophobicContact CD2-CG1 4.14Å; F344-I368 HydrophobicContact CE2-CD1 3.81Å; F344-I368 HydrophobicContact CE2-CG1 3.51Å; F344-I368 HydrophobicContact CZ-CD1 3.87Å; F344-I368 HydrophobicContact CZ-CG1 4.1Å
345	V	98.6	Very high	97.1	Very high	1 Å²	1	45 Å²	45	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-40.5	177.8	168.2	0	0	0	0	111.5	L256 V257 L332 F341 D343 K347 C348 L349	L256-V345 HydrophobicContact CB-CG2 4.23Å; V257-V345 HydrophobicContact CG2-CG1 3.35Å; L332-V345 HydrophobicContact CD1-CB 4.19Å; L332-V345 HydrophobicContact CD1-CG2 3.81Å; L332-V345 HydrophobicContact CG-CG1 4.46Å; L332-V345 HydrophobicContact CG-CG2 4.47Å; F341-V345 HydrophobicContact CD2-CG2 3.95Å; F341-V345 HydrophobicContact CE2-CG2 3.56Å; F341-V345 HydrophobicContact CZ-CG2 4.15Å; F341-V345 WeakPolarHBondContact O-CG2 3.28Å; F341-V345 PolarHBondContact O-N 3.24Å; D343-V345 PolarHBondContact O-N 3.14Å; V345-K347 VanDerWaalsContact C-N 3.3Å; V345-K347 PolarHBondContact O-N 3.13Å; V345-C348 WeakPolarHBondContact O-CB 3.47Å; V345-C348 PolarHBondContact O-N 3.32Å; V345-C348 VanDerWaalsContact O-N 3.14Å; V345-L349 HydrophobicContact CG1-CD1 3.75Å; V345-L349 HydrophobicContact CG1-CG 4.38Å; V345-L349 WeakPolarHBondContact O-CG 3.47Å; V345-L349 PolarHBondContact O-N 2.7Å
346	T	98.5	Very high	97.7	Very high	57 Å²	57	42.2 Å²	42.2	35%	0.35	24%	0.24	S	C	.	.	H	α-helix	trans	-59.1	-42.9	177.3	-62.5	0	0	0	0	111	Q342 D343 F344 C348 L349 I350	Q342-T346 VanDerWaalsContact O-CB 3.31Å; Q342-T346 WeakPolarHBondContact O-CB 3.11Å; Q342-T346 PolarHBondContact O-N 3.49Å; Q342-T346 PolarHBondContact O-OG1 3.46Å; D343-T346 PolarHBondContact O-N 3.12Å; F344-T346 VanDerWaalsContact C-N 3.34Å; F344-T346 PolarHBondContact O-N 3.48Å; T346-C348 VanDerWaalsContact C-N 3.34Å; T346-C348 PolarHBondContact O-N 2.63Å; T346-L349 PolarHBondContact O-N 3.27Å; T346-I350 WeakPolarHBondContact O-CG1 3.41Å; T346-I350 PolarHBondContact O-N 3.38Å
347	K	98.7	Very high	97.9	Very high	70 Å²	70	40.9 Å²	40.9	30%	0.304	23%	0.233	S	C	.	.	H	α-helix	trans	-65.8	-32.9	176.2	-78.4	177.7	169.3	64.1	0	113.4	D343 F344 V345 R356 A357	D343-K347 WeakPolarHBondContact O-CG 3.31Å; D343-K347 PolarHBondContact O-N 3.19Å; D343-K347 IonicContact OD1-NZ 3.72Å; D343-K347 PolarHBondContact OD1-NZ 3Å; D343-K347 IonicContact OD2-NZ 3.1Å; D343-K347 PolarHBondContact OD2-NZ 3.23Å; F344-K347 PolarHBondContact O-N 3.38Å; V345-K347 VanDerWaalsContact C-N 3.3Å; V345-K347 PolarHBondContact O-N 3.13Å; K347-R356 WeakPolarHBondContact O-CG 3.43Å; K347-A357 HydrophobicContact CB-CB 3.93Å; K347-A357 PolarHBondContact O-N 3.42Å
348	C	98.8	Very high	98	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.7	-34.1	173.1	-66	0	0	0	0	112.6	V249 W250 F344 V345 T346 R356	V249-C348 HydrophobicContact CG1-CB 3.99Å; W250-C348 WeakPolarHBondContact CA-O 3.4Å; F344-C348 PolarHBondContact O-N 3.16Å; F344-C348 VanDerWaalsContact O-N 3.12Å; F344-C348 PolarHBondContact O-SG 3.27Å; F344-C348 VanDerWaalsContact O-SG 3.33Å; V345-C348 WeakPolarHBondContact O-CB 3.47Å; V345-C348 PolarHBondContact O-N 3.32Å; V345-C348 VanDerWaalsContact O-N 3.14Å; T346-C348 VanDerWaalsContact C-N 3.34Å; T346-C348 PolarHBondContact O-N 2.63Å; C348-R356 WeakPolarHBondContact O-CD 3.36Å; C348-R356 WeakPolarHBondContact O-CG 3.32Å; C348-R356 PolarHBondContact O-NE 3.08Å
349	L	98.6	Very high	98	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	18.6	-173.1	-66.1	178.2	0	0	0	114.2	W250 L254 V257 P329 P330 V345 T346 K351	W250-L349 HydrophobicContact CD2-CD2 3.91Å; W250-L349 HydrophobicContact CE3-CD2 4.01Å; W250-L349 HydrophobicContact CG-CD2 4.37Å; W250-L349 HydrophobicContact CZ2-CD2 4.41Å; W250-L349 HydrophobicContact CZ3-CB 4.38Å; W250-L349 HydrophobicContact CZ3-CD2 4.33Å; W250-L349 WeakPolarHBondContact CZ3-O 3.43Å; L254-L349 HydrophobicContact CB-CD2 4.22Å; L254-L349 HydrophobicContact CD1-CD2 4.43Å; V257-L349 HydrophobicContact CG2-CD1 3.96Å; P329-L349 HydrophobicContact CB-CB 3.97Å; P329-L349 VanDerWaalsContact CB-O 3.28Å; P329-L349 WeakPolarHBondContact CB-O 3.47Å; P329-L349 WeakPolarHBondContact CG-O 3.44Å; P330-L349 HydrophobicContact CG-CD1 4.02Å; P330-L349 VanDerWaalsContact O-CD1 3.29Å; P330-L349 WeakPolarHBondContact O-CD1 3.45Å; V345-L349 HydrophobicContact CG1-CD1 3.75Å; V345-L349 HydrophobicContact CG1-CG 4.38Å; V345-L349 WeakPolarHBondContact O-CG 3.47Å; V345-L349 PolarHBondContact O-N 2.7Å; T346-L349 PolarHBondContact O-N 3.27Å; L349-K351 PolarHBondContact O-N 2.73Å
350	I	98.5	Very high	97.9	Very high	49 Å²	49	45.3 Å²	45.3	25%	0.251	24%	0.24	S	C	.	.			trans	-64.9	125.5	169.1	-63.7	174.4	0	0	0	108.7	T346 N352 E355 R356	T346-I350 WeakPolarHBondContact O-CG1 3.41Å; T346-I350 PolarHBondContact O-N 3.38Å; I350-N352 HydrophobicContact CG2-CB 4.45Å; I350-E355 WeakPolarHBondContact CD1-O 3.38Å; I350-E355 HydrophobicContact CG2-CB 3.79Å; I350-R356 HydrophobicContact CB-CB 4.1Å; I350-R356 HydrophobicContact CB-CG 4.45Å; I350-R356 VanDerWaalsContact O-CZ 3.31Å; I350-R356 PolarHBondContact O-NE 2.8Å; I350-R356 PolarHBondContact O-NH2 2.92Å
351	K	96.6	Very high	97.9	Very high	53 Å²	53	48.9 Å²	48.9	23%	0.23	26%	0.257	C	S	.	.	S	Bend	trans	-67.3	-40.2	-175.6	-63.8	-173.8	69.7	153.3	0	112.5	P235 W250 I324 V325 E327 L349 P353 R356	P235-K351 HydrophobicContact CG-CB 4.35Å; P235-K351 HydrophobicContact CG-CG 4.32Å; W250-K351 HydrophobicContact CH2-CG 4.1Å; W250-K351 HydrophobicContact CZ3-CG 3.9Å; I324-K351 WeakPolarHBondContact O-CE 3.37Å; I324-K351 PolarHBondContact O-NZ 3.41Å; V325-K351 VanDerWaalsContact O-CE 3.28Å; V325-K351 WeakPolarHBondContact O-CE 3.06Å; V325-K351 PolarHBondContact O-NZ 2.66Å; E327-K351 PolarHBondContact O-NZ 2.94Å; L349-K351 PolarHBondContact O-N 2.73Å; K351-P353 VanDerWaalsContact O-CD 3.25Å; K351-P353 WeakPolarHBondContact O-CD 3.45Å; K351-R356 PolarHBondContact O-NH2 3.2Å; K351-R356 VanDerWaalsContact O-NH2 3.15Å
352	N	96.8	Very high	97.9	Very high	67 Å²	67	48.9 Å²	48.9	36%	0.358	26%	0.257	S	S	.	.	S	Bend	trans	-71.1	111.6	174.1	-177.2	-4.2	0	0	0	109.8	I350 A354 E355 R356	I350-N352 HydrophobicContact CG2-CB 4.45Å; N352-A354 PolarHBondContact O-N 3Å; N352-A354 VanDerWaalsContact O-N 3.15Å; N352-A354 PolarHBondContact OD1-N 3.43Å; N352-A354 VanDerWaalsContact OD1-N 3.13Å; N352-E355 HydrophobicContact CB-CB 4.26Å; N352-E355 HydrophobicContact CB-CG 4.36Å; N352-E355 VanDerWaalsContact ND2-CD 3.33Å; N352-E355 PolarHBondContact ND2-OE1 2.78Å; N352-E355 PolarHBondContact O-N 3.33Å; N352-E355 VanDerWaalsContact O-N 3.09Å; N352-R356 PolarHBondContact O-N 2.98Å
353	P	96.8	Very high	97.9	Very high	38 Å²	38	48.8 Å²	48.8	25%	0.247	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.8	-176.1	27.4	-36.2	0	0	0	113.6	E236 Q246 K351	E236-P353 HydrophobicContact CB-CG 4.09Å; E236-P353 HydrophobicContact CG-CB 4.21Å; E236-P353 HydrophobicContact CG-CG 4.02Å; Q246-P353 HydrophobicContact CB-CB 4.13Å; Q246-P353 PolarHBondContact NE2-O 2.57Å; K351-P353 VanDerWaalsContact O-CD 3.25Å; K351-P353 WeakPolarHBondContact O-CD 3.45Å
354	A	96.2	Very high	97.8	Very high	91 Å²	91	50.5 Å²	50.5	75%	0.752	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-25	176.7	0	0	0	0	0	113.3	N352	N352-A354 PolarHBondContact O-N 3Å; N352-A354 VanDerWaalsContact O-N 3.15Å; N352-A354 PolarHBondContact OD1-N 3.43Å; N352-A354 VanDerWaalsContact OD1-N 3.13Å
355	E	97.6	Very high	97.8	Very high	132 Å²	132	51.4 Å²	51.4	62%	0.617	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-20	176.9	-69.9	167.6	-154.8	0	0	112.3	I350 N352	I350-E355 WeakPolarHBondContact CD1-O 3.38Å; I350-E355 HydrophobicContact CG2-CB 3.79Å; N352-E355 HydrophobicContact CB-CB 4.26Å; N352-E355 HydrophobicContact CB-CG 4.36Å; N352-E355 VanDerWaalsContact ND2-CD 3.33Å; N352-E355 PolarHBondContact ND2-OE1 2.78Å; N352-E355 PolarHBondContact O-N 3.33Å; N352-E355 VanDerWaalsContact O-N 3.09Å
356	R	98.4	Very high	97.8	Very high	5 Å²	5	54.9 Å²	54.9	2%	0.019	29%	0.291	C	S	.	.	S	Bend	trans	-58.2	137.1	173.8	-168.4	-176.7	-61.1	151.3	9	109.9	E236 Q246 V249 K347 C348 I350 K351 N352 D358	E236-R356 IonicContact OE1-CZ 2.7Å; E236-R356 IonicContact OE1-NH1 3.1Å; E236-R356 PolarHBondContact OE1-NH1 3.46Å; E236-R356 IonicContact OE1-NH2 2.77Å; E236-R356 IonicContact OE2-CZ 2.97Å; E236-R356 IonicContact OE2-NH1 2.9Å; E236-R356 PolarHBondContact OE2-NH1 2.86Å; E236-R356 IonicContact OE2-NH2 3.82Å; E236-R356 PolarHBondContact OE2-NH2 3.15Å; Q246-R356 VanDerWaalsContact C-NH1 3.32Å; Q246-R356 PolarHBondContact NE2-O 3.41Å; Q246-R356 VanDerWaalsContact O-CD 3.31Å; Q246-R356 WeakPolarHBondContact O-CD 3.33Å; Q246-R356 PolarHBondContact O-NH1 2.88Å; V249-R356 HydrophobicContact CG1-CG 4.09Å; K347-R356 WeakPolarHBondContact O-CG 3.43Å; C348-R356 WeakPolarHBondContact O-CD 3.36Å; C348-R356 WeakPolarHBondContact O-CG 3.32Å; C348-R356 PolarHBondContact O-NE 3.08Å; I350-R356 HydrophobicContact CB-CB 4.1Å; I350-R356 HydrophobicContact CB-CG 4.45Å; I350-R356 VanDerWaalsContact O-CZ 3.31Å; I350-R356 PolarHBondContact O-NE 2.8Å; I350-R356 PolarHBondContact O-NH2 2.92Å; K351-R356 PolarHBondContact O-NH2 3.2Å; K351-R356 VanDerWaalsContact O-NH2 3.15Å; N352-R356 PolarHBondContact O-N 2.98Å; R356-D358 PolarHBondContact O-N 3.18Å
357	A	98.1	Very high	97.8	Very high	6 Å²	6	52.1 Å²	52.1	5%	0.05	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-61.3	136.8	179.1	0	0	0	0	0	110.7	K347 M361 L362	K347-A357 HydrophobicContact CB-CB 3.93Å; K347-A357 PolarHBondContact O-N 3.42Å; A357-M361 HydrophobicContact CB-CB 4.15Å; A357-M361 HydrophobicContact CB-SD 4.48Å; A357-L362 HydrophobicContact CB-CD1 4.45Å; A357-L362 HydrophobicContact CB-CD2 3.73Å; A357-L362 HydrophobicContact CB-CG 3.83Å
358	D	97.5	Very high	97.8	Very high	60 Å²	60	48.8 Å²	48.8	32%	0.321	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-82.9	171.4	173.5	70.2	31.2	0	0	0	111.7	R356 K360 M361 L362	R356-D358 PolarHBondContact O-N 3.18Å; D358-K360 PolarHBondContact O-N 3.32Å; D358-K360 WeakPolarHBondContact OD1-CA 3.05Å; D358-K360 WeakPolarHBondContact OD1-CB 3.32Å; D358-K360 PolarHBondContact OD1-N 3.48Å; D358-M361 PolarHBondContact O-N 3.09Å; D358-M361 WeakPolarHBondContact OD1-CG 3.37Å; D358-M361 PolarHBondContact OD1-N 3.28Å; D358-L362 WeakPolarHBondContact O-CG 3.36Å; D358-L362 PolarHBondContact O-N 3.34Å
359	L	97.3	Very high	97.8	Very high	16 Å²	16	52.7 Å²	52.7	8%	0.084	28%	0.277	C	S	.	.	H	α-helix	trans	-56.6	-35.2	-179.6	-65.1	180	0	0	0	112.8	L177 L180 A181 V245 V249 L362 M363	L177-L359 HydrophobicContact CD2-CD2 3.71Å; L180-L359 HydrophobicContact CB-CD1 4.12Å; L180-L359 HydrophobicContact CB-CD2 4.03Å; L180-L359 HydrophobicContact CD1-CD2 4.26Å; A181-L359 HydrophobicContact CB-CD1 4.22Å; V245-L359 HydrophobicContact CG2-CD1 3.78Å; V245-L359 HydrophobicContact CG2-CG 4.26Å; V249-L359 HydrophobicContact CG2-CD2 3.91Å; L359-L362 PolarHBondContact O-N 3.32Å; L359-M363 WeakPolarHBondContact O-CB 3.38Å; L359-M363 PolarHBondContact O-N 3.15Å
360	K	96.8	Very high	97.7	Very high	161 Å²	161	55.9 Å²	55.9	70%	0.7	29%	0.289	S	S	*	.	H	α-helix	trans	-72.1	-41.6	-178.6	-176.5	-178.7	179.3	-179	0	111.1	D358 N364	D358-K360 PolarHBondContact O-N 3.32Å; D358-K360 WeakPolarHBondContact OD1-CA 3.05Å; D358-K360 WeakPolarHBondContact OD1-CB 3.32Å; D358-K360 PolarHBondContact OD1-N 3.48Å; K360-N364 PolarHBondContact O-N 2.84Å; K360-N364 PolarHBondContact O-ND2 3.27Å
361	M	98	Very high	97.7	Very high	120 Å²	120	53.5 Å²	53.5	59%	0.591	28%	0.277	S	S	*	.	H	α-helix	trans	-61.9	-45.7	173.5	-67.9	-178.6	-173.9	0	0	110.5	A357 D358 N364 H365	A357-M361 HydrophobicContact CB-CB 4.15Å; A357-M361 HydrophobicContact CB-SD 4.48Å; D358-M361 PolarHBondContact O-N 3.09Å; D358-M361 WeakPolarHBondContact OD1-CG 3.37Å; D358-M361 PolarHBondContact OD1-N 3.28Å; M361-N364 CarbonylContact O-C 3.5Å; M361-N364 PolarHBondContact O-N 2.8Å; M361-H365 PolarHBondContact O-N 3.13Å; M361-H365 VanDerWaalsContact O-N 3.15Å
362	L	98.4	Very high	97.6	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-41	-178.9	-68.2	172.8	0	0	0	112.7	L177 V249 F344 A357 D358 L359 N364 H365 I368	L177-L362 HydrophobicContact CD1-CB 3.92Å; L177-L362 HydrophobicContact CD2-CB 3.78Å; L177-L362 HydrophobicContact CD2-CD1 3.92Å; V249-L362 HydrophobicContact CB-CD1 4.44Å; V249-L362 HydrophobicContact CG1-CD1 3.53Å; V249-L362 HydrophobicContact CG2-CD1 4.06Å; F344-L362 HydrophobicContact CD2-CD2 3.86Å; F344-L362 HydrophobicContact CE2-CB 4Å; F344-L362 HydrophobicContact CE2-CD2 3.58Å; F344-L362 HydrophobicContact CE2-CG 4.31Å; F344-L362 HydrophobicContact CZ-CD2 4.22Å; A357-L362 HydrophobicContact CB-CD1 4.45Å; A357-L362 HydrophobicContact CB-CD2 3.73Å; A357-L362 HydrophobicContact CB-CG 3.83Å; D358-L362 WeakPolarHBondContact O-CG 3.36Å; D358-L362 PolarHBondContact O-N 3.34Å; L359-L362 PolarHBondContact O-N 3.32Å; L362-N364 PolarHBondContact O-N 3Å; L362-N364 VanDerWaalsContact O-N 3.13Å; L362-H365 WeakPolarHBondContact O-CB 3.37Å; L362-H365 PolarHBondContact O-N 3.19Å; L362-I368 VanDerWaalsContact O-CG1 3.25Å; L362-I368 WeakPolarHBondContact O-CG1 3.16Å
363	M	97.6	Very high	97.6	Very high	36 Å²	36	56.3 Å²	56.3	18%	0.177	30%	0.297	C	S	.	.	H	α-helix	trans	-62.4	-20.5	176.4	-158.6	70.1	73.9	0	0	113.3	L177 R178 L359 K369	L177-M363 HydrophobicContact CB-CE 3.65Å; L177-M363 HydrophobicContact CB-SD 4.19Å; R178-M363 HydrophobicContact CG-CE 3.78Å; R178-M363 HydrophobicContact CG-SD 4.09Å; L359-M363 WeakPolarHBondContact O-CB 3.38Å; L359-M363 PolarHBondContact O-N 3.15Å; M363-K369 PolarHBondContact O-NZ 2.76Å; M363-K369 VanDerWaalsContact O-NZ 3.15Å
364	N	97.9	Very high	97.5	Very high	98 Å²	98	57.1 Å²	57.1	52%	0.524	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	5.5	177.2	-67.3	-64.5	0	0	0	113.5	K360 M361 L362	K360-N364 PolarHBondContact O-N 2.84Å; K360-N364 PolarHBondContact O-ND2 3.27Å; M361-N364 CarbonylContact O-C 3.5Å; M361-N364 PolarHBondContact O-N 2.8Å; L362-N364 PolarHBondContact O-N 3Å; L362-N364 VanDerWaalsContact O-N 3.13Å
365	H	98.7	Very high	97.4	Very high	18 Å²	18	62.3 Å²	62.3	8%	0.083	31%	0.306	C	S	.	.	S	Bend	trans	-67.4	147.9	179.1	-166.3	-85.5	0	0	0	111.5	D340 D343 F344 M361 L362 F367 I368 K369	D340-H365 PolarHBondContact O-CE1 3.27Å; D343-H365 IonicContact OD2-CE1 3.87Å; D343-H365 IonicContact OD2-NE2 3.99Å; D343-H365 PolarHBondContact OD2-NE2 3.07Å; F344-H365 HydrophobicContact CD2-CB 3.89Å; F344-H365 AromaticContact CD2-CG 3.71Å; F344-H365 AromaticContact CD2-ND1 3.74Å; F344-H365 HydrophobicContact CE2-CB 4.34Å; F344-H365 PolarHBondContact N-CE1 3.39Å; M361-H365 PolarHBondContact O-N 3.13Å; M361-H365 VanDerWaalsContact O-N 3.15Å; L362-H365 WeakPolarHBondContact O-CB 3.37Å; L362-H365 PolarHBondContact O-N 3.19Å; H365-F367 VanDerWaalsContact C-N 3.32Å; H365-F367 WeakPolarHBondContact ND1-CB 3.28Å; H365-F367 PolarHBondContact ND1-N 3.09Å; H365-F367 PolarHBondContact O-N 3.02Å; H365-I368 HydrophobicContact CB-CG1 4.47Å; H365-I368 PolarHBondContact O-N 3.15Å; H365-K369 PolarHBondContact O-N 3.32Å
366	T	98.4	Very high	97.3	Very high	74 Å²	74	57.6 Å²	57.6	45%	0.454	29%	0.286	S	S	.	.	H	α-helix	trans	-54.5	-46.3	-178.7	52.9	0	0	0	0	112.2	D340 I368 K369 R370	D340-T366 WeakPolarHBondContact OD1-CB 3.45Å; D340-T366 PolarHBondContact OD1-OG1 2.71Å; T366-I368 VanDerWaalsContact C-N 3.31Å; T366-I368 PolarHBondContact O-N 3.14Å; T366-K369 PolarHBondContact O-N 3.32Å; T366-R370 WeakPolarHBondContact O-CB 3.43Å; T366-R370 PolarHBondContact O-N 3.02Å
367	F	98.7	Very high	97.2	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-51.2	-46.4	173.5	179.7	-115.1	0	0	0	113.3	E166 D340 F341 F344 H365 S371	E166-F367 HydrophobicContact CG-CE2 3.91Å; E166-F367 HydrophobicContact CG-CZ 4.47Å; D340-F367 HydrophobicContact CB-CB 4Å; F341-F367 HydrophobicContact CB-CD2 3.7Å; F341-F367 HydrophobicContact CB-CE2 3.61Å; F341-F367 HydrophobicContact CB-CG 4.43Å; F341-F367 HydrophobicContact CB-CZ 4.26Å; F341-F367 HydrophobicContact CD2-CD1 4.13Å; F341-F367 HydrophobicContact CD2-CD2 4.14Å; F341-F367 AromaticContact CD2-CE1 3.62Å; F341-F367 HydrophobicContact CD2-CE1 3.62Å; F341-F367 AromaticContact CD2-CE2 3.64Å; F341-F367 HydrophobicContact CD2-CE2 3.64Å; F341-F367 HydrophobicContact CD2-CG 4.36Å; F341-F367 AromaticContact CD2-CZ 3.35Å; F341-F367 HydrophobicContact CD2-CZ 3.35Å; F341-F367 HydrophobicContact CE2-CE1 4.01Å; F341-F367 AromaticContact CE2-CZ 3.83Å; F341-F367 HydrophobicContact CE2-CZ 3.83Å; F341-F367 HydrophobicContact CG-CD2 4.23Å; F341-F367 AromaticContact CG-CE2 3.73Å; F341-F367 HydrophobicContact CG-CE2 3.73Å; F341-F367 AromaticContact CG-CZ 3.89Å; F341-F367 HydrophobicContact CG-CZ 3.89Å; F344-F367 HydrophobicContact CB-CB 3.87Å; F344-F367 HydrophobicContact CB-CD1 3.96Å; F344-F367 HydrophobicContact CB-CG 4.11Å; F344-F367 AromaticContact CD1-CD1 3.69Å; F344-F367 HydrophobicContact CD1-CD1 3.69Å; F344-F367 HydrophobicContact CD1-CE1 4.06Å; F344-F367 HydrophobicContact CD2-CB 4.34Å; F344-F367 HydrophobicContact CD2-CD1 4.02Å; F344-F367 HydrophobicContact CE1-CD1 4.17Å; F344-F367 HydrophobicContact CE1-CE1 4.34Å; F344-F367 HydrophobicContact CE2-CD1 4.45Å; F344-F367 HydrophobicContact CG-CB 4.21Å; F344-F367 AromaticContact CG-CD1 3.61Å; F344-F367 HydrophobicContact CG-CD1 3.61Å; F344-F367 HydrophobicContact CG-CE1 4.43Å; F344-F367 HydrophobicContact CG-CG 4.24Å; H365-F367 VanDerWaalsContact C-N 3.32Å; H365-F367 WeakPolarHBondContact ND1-CB 3.28Å; H365-F367 PolarHBondContact ND1-N 3.09Å; H365-F367 PolarHBondContact O-N 3.02Å; F367-S371 VanDerWaalsContact O-CB 3.29Å; F367-S371 WeakPolarHBondContact O-CB 3.25Å; F367-S371 PolarHBondContact O-N 3.12Å; F367-S371 PolarHBondContact O-OG 3.27Å
368	I	98.6	Very high	97.1	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-70.3	-46.1	179.9	-65.3	-58.2	0	0	0	110.4	I174 L177 F344 L362 H365 T366 R370 S371 E372	I174-I368 HydrophobicContact CG1-CD1 4.17Å; I174-I368 HydrophobicContact CG1-CG2 4.02Å; L177-I368 HydrophobicContact CD1-CD1 3.83Å; L177-I368 HydrophobicContact CD1-CG1 3.9Å; F344-I368 HydrophobicContact CD2-CG1 4.14Å; F344-I368 HydrophobicContact CE2-CD1 3.81Å; F344-I368 HydrophobicContact CE2-CG1 3.51Å; F344-I368 HydrophobicContact CZ-CD1 3.87Å; F344-I368 HydrophobicContact CZ-CG1 4.1Å; L362-I368 VanDerWaalsContact O-CG1 3.25Å; L362-I368 WeakPolarHBondContact O-CG1 3.16Å; H365-I368 HydrophobicContact CB-CG1 4.47Å; H365-I368 PolarHBondContact O-N 3.15Å; T366-I368 VanDerWaalsContact C-N 3.31Å; T366-I368 PolarHBondContact O-N 3.14Å; I368-R370 VanDerWaalsContact C-N 3.3Å; I368-R370 PolarHBondContact O-N 3.13Å; I368-S371 CarbonylContact O-C 3.51Å; I368-S371 PolarHBondContact O-N 3.34Å; I368-S371 VanDerWaalsContact O-N 3.15Å; I368-E372 HydrophobicContact CG2-CG 4.34Å; I368-E372 WeakPolarHBondContact O-CG 3.32Å; I368-E372 PolarHBondContact O-N 2.97Å
369	K	98.1	Very high	97.1	Very high	82 Å²	82	59.8 Å²	59.8	36%	0.357	30%	0.297	S	S	.	.	H	α-helix	trans	-60.5	-39.1	178.1	-67.4	-42.9	-166.7	-160	0	113	M363 H365 T366 E372	M363-K369 PolarHBondContact O-NZ 2.76Å; M363-K369 VanDerWaalsContact O-NZ 3.15Å; H365-K369 PolarHBondContact O-N 3.32Å; T366-K369 PolarHBondContact O-N 3.32Å; K369-E372 VanDerWaalsContact CD-OE2 3.23Å; K369-E372 WeakPolarHBondContact CD-OE2 3.46Å; K369-E372 IonicContact NZ-OE2 3.58Å; K369-E372 PolarHBondContact NZ-OE2 3.3Å; K369-E372 PolarHBondContact O-N 3.08Å
370	R	97.6	Very high	97	Very high	67 Å²	67	59.7 Å²	59.7	25%	0.253	30%	0.3	S	S	.	.	H	α-helix	trans	-64.7	-48.6	173.2	-162.8	-173.2	73.5	-152.1	1.5	110.9	E166 S338 D340 T366 I368 E372 V373 E374	E166-R370 IonicContact OE1-CZ 2.75Å; E166-R370 IonicContact OE1-NH2 3.92Å; E166-R370 PolarHBondContact OE1-NH2 2.77Å; S338-R370 PolarHBondContact OG-NH1 2.68Å; S338-R370 PolarHBondContact OG-NH2 3.09Å; D340-R370 IonicContact OD2-NH1 2.87Å; D340-R370 PolarHBondContact OD2-NH1 2.72Å; T366-R370 WeakPolarHBondContact O-CB 3.43Å; T366-R370 PolarHBondContact O-N 3.02Å; I368-R370 VanDerWaalsContact C-N 3.3Å; I368-R370 PolarHBondContact O-N 3.13Å; R370-E372 VanDerWaalsContact C-N 3.26Å; R370-E372 PolarHBondContact O-N 3.11Å; R370-V373 WeakPolarHBondContact O-CG2 3.46Å; R370-V373 PolarHBondContact O-N 2.85Å; R370-E374 WeakPolarHBondContact CD-OE1 3.44Å; R370-E374 WeakPolarHBondContact CG-OE1 3.36Å; R370-E374 IonicContact CZ-OE1 2.8Å; R370-E374 IonicContact NE-OE1 3.18Å; R370-E374 PolarHBondContact NE-OE1 2.92Å; R370-E374 IonicContact NH2-OE1 3.42Å; R370-E374 WeakPolarHBondContact O-CG 3.41Å; R370-E374 PolarHBondContact O-N 3.01Å
371	S	97.8	Very high	97.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-26.7	178.9	-57.8	0	0	0	0	113.3	G170 K171 F367 I368	G170-S371 VanDerWaalsContact CA-OG 3.25Å; G170-S371 WeakPolarHBondContact CA-OG 3.45Å; K171-S371 WeakPolarHBondContact CE-O 3.18Å; K171-S371 PolarHBondContact NZ-O 3.31Å; F367-S371 VanDerWaalsContact O-CB 3.29Å; F367-S371 WeakPolarHBondContact O-CB 3.25Å; F367-S371 PolarHBondContact O-N 3.12Å; F367-S371 PolarHBondContact O-OG 3.27Å; I368-S371 CarbonylContact O-C 3.51Å; I368-S371 PolarHBondContact O-N 3.34Å; I368-S371 VanDerWaalsContact O-N 3.15Å
372	E	94.8	Very high	97.1	Very high	61 Å²	61	48.5 Å²	48.5	29%	0.285	25%	0.247	S	C	.	.	H	α-helix	trans	-67.3	-38.9	176.6	-79.5	-177	144	0	0	111.4	I174 R178 I368 K369 R370	I174-E372 HydrophobicContact CD1-CB 4.42Å; I174-E372 HydrophobicContact CD1-CG 3.69Å; I174-E372 HydrophobicContact CG1-CG 4.19Å; R178-E372 IonicContact CZ-OE1 2.62Å; R178-E372 IonicContact NH2-OE1 2.75Å; R178-E372 PolarHBondContact NH2-OE1 3.09Å; I368-E372 HydrophobicContact CG2-CG 4.34Å; I368-E372 WeakPolarHBondContact O-CG 3.32Å; I368-E372 PolarHBondContact O-N 2.97Å; K369-E372 VanDerWaalsContact CD-OE2 3.23Å; K369-E372 WeakPolarHBondContact CD-OE2 3.46Å; K369-E372 IonicContact NZ-OE2 3.58Å; K369-E372 PolarHBondContact NZ-OE2 3.3Å; K369-E372 PolarHBondContact O-N 3.08Å; R370-E372 VanDerWaalsContact C-N 3.26Å; R370-E372 PolarHBondContact O-N 3.11Å
373	V	95.7	Very high	97	Very high	118 Å²	118	48.9 Å²	48.9	72%	0.715	25%	0.249	S	C	*	.	H	α-helix	trans	-90.1	-19.2	-178.1	-59.2	0	0	0	0	114	R370 E375	R370-V373 WeakPolarHBondContact O-CG2 3.46Å; R370-V373 PolarHBondContact O-N 2.85Å; V373-E375 PolarHBondContact O-N 3.49Å
374	E	94.8	Very high	97	Very high	54 Å²	54	55.9 Å²	55.9	25%	0.252	28%	0.279	S	S	.	.	S	Bend	trans	-64.4	125.3	175.8	-79.6	170.5	-169.4	0	0	111	K171 R370 V376	K171-E374 VanDerWaalsContact CE-O 3.25Å; K171-E374 WeakPolarHBondContact CE-O 3.29Å; K171-E374 PolarHBondContact NZ-O 3.49Å; R370-E374 WeakPolarHBondContact CD-OE1 3.44Å; R370-E374 WeakPolarHBondContact CG-OE1 3.36Å; R370-E374 IonicContact CZ-OE1 2.8Å; R370-E374 IonicContact NE-OE1 3.18Å; R370-E374 PolarHBondContact NE-OE1 2.92Å; R370-E374 IonicContact NH2-OE1 3.42Å; R370-E374 WeakPolarHBondContact O-CG 3.41Å; R370-E374 PolarHBondContact O-N 3.01Å; E374-V376 HydrophobicContact CB-CG2 4.09Å; E374-V376 PolarHBondContact O-N 2.88Å
375	E	94.5	Very high	96.9	Very high	201 Å²	201	52.9 Å²	52.9	94%	0.939	26%	0.264	S	S	*	.			trans	-81.3	103.8	172.6	-66.9	-167.9	157.7	0	0	110	V373	V373-E375 PolarHBondContact O-N 3.49Å
376	V	94.9	Very high	96.8	Very high	33 Å²	33	54.2 Å²	54.2	20%	0.2	27%	0.271	C	S	.	.			trans	-119.9	119.9	-178.3	-176.7	0	0	0	0	109.1	E167 I168 K171 E374 F378	E167-V376 HydrophobicContact CB-CG2 4.04Å; E167-V376 HydrophobicContact CG-CG1 4.26Å; I168-V376 HydrophobicContact CD1-CG1 3.53Å; I168-V376 HydrophobicContact CG1-CG1 4.46Å; K171-V376 HydrophobicContact CG-CB 4.19Å; E374-V376 HydrophobicContact CB-CG2 4.09Å; E374-V376 PolarHBondContact O-N 2.88Å; V376-F378 PolarHBondContact O-N 2.85Å
377	D	96.1	Very high	96.6	Very high	96 Å²	96	58 Å²	58	51%	0.513	29%	0.288	S	S	.	.			trans	-76.5	73	172.9	-176.6	12.9	0	0	0	110.7	A379 G380 W381	D377-A379 VanDerWaalsContact C-N 3.28Å; D377-A379 PolarHBondContact O-N 3.05Å; D377-G380 PolarHBondContact O-N 2.71Å; D377-G380 PolarHBondContact OD1-N 2.7Å; D377-G380 WeakPolarHBondContact OD2-CA 3.31Å; D377-W381 WeakPolarHBondContact O-CB 3.36Å; D377-W381 PolarHBondContact O-N 3.35Å
378	F	97	Very high	96.4	Very high	13 Å²	13	60.5 Å²	60.5	6%	0.057	30%	0.302	C	S	.	.	H	α-helix	trans	-59.2	-40.9	178.8	-176.5	-82.7	0	0	0	111.6	I168 K171 V172 V201 I207 V376 W381 L382	I168-F378 HydrophobicContact CD1-CD2 4.07Å; I168-F378 HydrophobicContact CG2-CD2 3.75Å; I168-F378 HydrophobicContact CG2-CE2 3.54Å; K171-F378 HydrophobicContact CB-CD2 4.32Å; V172-F378 HydrophobicContact CG2-CE2 4.06Å; V201-F378 HydrophobicContact CB-CE1 4.27Å; V201-F378 HydrophobicContact CB-CZ 4.36Å; V201-F378 HydrophobicContact CG1-CE1 4.18Å; V201-F378 HydrophobicContact CG1-CZ 3.83Å; I207-F378 HydrophobicContact CD1-CD2 3.98Å; I207-F378 HydrophobicContact CD1-CE1 4.15Å; I207-F378 HydrophobicContact CD1-CE2 3.53Å; I207-F378 HydrophobicContact CD1-CG 4.47Å; I207-F378 HydrophobicContact CD1-CZ 3.64Å; I207-F378 HydrophobicContact CG1-CD1 4.46Å; I207-F378 HydrophobicContact CG1-CE1 3.83Å; I207-F378 HydrophobicContact CG1-CE2 4.08Å; I207-F378 HydrophobicContact CG1-CZ 3.63Å; V376-F378 PolarHBondContact O-N 2.85Å; F378-W381 HydrophobicContact CE2-CE3 4.36Å; F378-W381 HydrophobicContact CE2-CZ3 4.16Å; F378-W381 HydrophobicContact CZ-CZ3 4.27Å; F378-W381 PolarHBondContact O-N 2.79Å; F378-L382 HydrophobicContact CE1-CB 4.37Å; F378-L382 HydrophobicContact CE1-CD2 4.15Å; F378-L382 VanDerWaalsContact O-CB 3.3Å; F378-L382 WeakPolarHBondContact O-CB 3.47Å; F378-L382 PolarHBondContact O-N 3.22Å
379	A	96.5	Very high	95.8	Very high	7 Å²	7	69.3 Å²	69.3	6%	0.058	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-45	-179.3	0	0	0	0	0	111.5	D377 L382 C383	D377-A379 VanDerWaalsContact C-N 3.28Å; D377-A379 PolarHBondContact O-N 3.05Å; A379-L382 PolarHBondContact O-N 3.12Å; A379-C383 WeakPolarHBondContact O-CB 3.28Å; A379-C383 PolarHBondContact O-N 3.15Å; A379-C383 PolarHBondContact O-SG 3.39Å
380	G	96.7	Very high	94.5	Very high	14 Å²	14	70 Å²	70	14%	0.144	35%	0.347	C	S	.	.	H	α-helix	trans	-65.7	-43.4	175.5	0	0	0	0	0	113.5	D377 L382 C383 K384	D377-G380 PolarHBondContact O-N 2.71Å; D377-G380 PolarHBondContact OD1-N 2.7Å; D377-G380 WeakPolarHBondContact OD2-CA 3.31Å; G380-L382 VanDerWaalsContact C-N 3.35Å; G380-L382 PolarHBondContact O-N 2.88Å; G380-C383 PolarHBondContact O-N 3.45Å; G380-K384 VanDerWaalsContact O-CB 3.3Å; G380-K384 WeakPolarHBondContact O-CB 3.38Å; G380-K384 PolarHBondContact O-N 3.41Å
381	W	97.8	Very high	92.9	Very high	47 Å²	47	69.2 Å²	69.2	18%	0.178	35%	0.35	C	S	.	.	H	α-helix	trans	-58	-47.8	173.4	170.6	81.5	0	0	0	111.7	V157 A161 I164 I168 D377 F378 K384 T385	V157-W381 HydrophobicContact CG1-CH2 3.53Å; V157-W381 HydrophobicContact CG1-CZ2 4.34Å; V157-W381 HydrophobicContact CG1-CZ3 4.08Å; A161-W381 HydrophobicContact CB-CZ2 4.3Å; I164-W381 HydrophobicContact CD1-CH2 4.16Å; I164-W381 HydrophobicContact CG1-CH2 4.16Å; I164-W381 HydrophobicContact CG1-CZ2 4.3Å; I164-W381 HydrophobicContact CG2-CH2 3.9Å; I164-W381 HydrophobicContact CG2-CZ2 4Å; I168-W381 HydrophobicContact CD1-CB 3.82Å; I168-W381 HydrophobicContact CD1-CD2 3.71Å; I168-W381 HydrophobicContact CD1-CE3 3.87Å; I168-W381 HydrophobicContact CD1-CG 3.67Å; I168-W381 HydrophobicContact CG1-CD2 3.83Å; I168-W381 HydrophobicContact CG1-CE3 4.18Å; I168-W381 HydrophobicContact CG1-CG 4.02Å; I168-W381 HydrophobicContact CG2-CD2 4.18Å; I168-W381 HydrophobicContact CG2-CE3 3.74Å; I168-W381 HydrophobicContact CG2-CH2 3.81Å; I168-W381 HydrophobicContact CG2-CZ2 4.23Å; I168-W381 HydrophobicContact CG2-CZ3 3.55Å; D377-W381 WeakPolarHBondContact O-CB 3.36Å; D377-W381 PolarHBondContact O-N 3.35Å; F378-W381 HydrophobicContact CE2-CE3 4.36Å; F378-W381 HydrophobicContact CE2-CZ3 4.16Å; F378-W381 HydrophobicContact CZ-CZ3 4.27Å; F378-W381 PolarHBondContact O-N 2.79Å; W381-K384 PolarHBondContact O-N 2.9Å; W381-T385 WeakPolarHBondContact O-CB 3.34Å; W381-T385 PolarHBondContact O-N 3.05Å; W381-T385 PolarHBondContact O-OG1 3.32Å
382	L	98	Very high	90.5	Very high	0 Å²	0	75.3 Å²	75.3	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-64.3	-48.6	-179.7	178.4	67.2	0	0	0	111.5	V157 V201 N202 F378 A379 G380 K384 T385 M386	V157-L382 HydrophobicContact CG1-CD1 4.21Å; V157-L382 HydrophobicContact CG2-CD1 3.8Å; V201-L382 HydrophobicContact CB-CD2 3.87Å; V201-L382 HydrophobicContact CG2-CD1 3.64Å; V201-L382 HydrophobicContact CG2-CD2 3.72Å; V201-L382 HydrophobicContact CG2-CG 4.34Å; N202-L382 WeakPolarHBondContact O-CD2 3.44Å; F378-L382 HydrophobicContact CE1-CB 4.37Å; F378-L382 HydrophobicContact CE1-CD2 4.15Å; F378-L382 VanDerWaalsContact O-CB 3.3Å; F378-L382 WeakPolarHBondContact O-CB 3.47Å; F378-L382 PolarHBondContact O-N 3.22Å; A379-L382 PolarHBondContact O-N 3.12Å; G380-L382 VanDerWaalsContact C-N 3.35Å; G380-L382 PolarHBondContact O-N 2.88Å; L382-K384 VanDerWaalsContact C-N 3.28Å; L382-K384 PolarHBondContact O-N 3.31Å; L382-T385 PolarHBondContact O-N 2.74Å; L382-T385 VanDerWaalsContact O-N 3.13Å; L382-M386 HydrophobicContact CD1-CG 3.71Å; L382-M386 HydrophobicContact CG-CG 4.46Å; L382-M386 WeakPolarHBondContact O-CB 3.23Å; L382-M386 PolarHBondContact O-N 2.81Å
383	C	97.4	Very high	88.1	Confident	7 Å²	7	77.5 Å²	77.5	5%	0.047	41%	0.411	C	S	.	.	H	α-helix	trans	-61.5	-39.3	-179.1	-69.5	0	0	0	0	111.6	A379 G380 N387 L388 Q390	A379-C383 WeakPolarHBondContact O-CB 3.28Å; A379-C383 PolarHBondContact O-N 3.15Å; A379-C383 PolarHBondContact O-SG 3.39Å; G380-C383 PolarHBondContact O-N 3.45Å; C383-N387 CarbonylContact O-C 3.54Å; C383-N387 VanDerWaalsContact O-CA 3.32Å; C383-N387 WeakPolarHBondContact O-CA 3.21Å; C383-N387 PolarHBondContact O-N 3.41Å; C383-L388 HydrophobicContact CB-CB 4.26Å; C383-L388 WeakPolarHBondContact CB-O 3.38Å; C383-L388 PolarHBondContact O-N 3.03Å; C383-Q390 HydrophobicContact CB-CG 3.82Å; C383-Q390 VanDerWaalsContact SG-CG 3.6Å
384	K	96.8	Very high	85.4	Confident	184 Å²	184	76.6 Å²	76.6	80%	0.8	41%	0.407	S	S	*	.	H	α-helix	trans	-64.5	-43.5	174	-177.3	-178.7	177.9	-177	0	112	G380 W381 L382	G380-K384 VanDerWaalsContact O-CB 3.3Å; G380-K384 WeakPolarHBondContact O-CB 3.38Å; G380-K384 PolarHBondContact O-N 3.41Å; W381-K384 PolarHBondContact O-N 2.9Å; L382-K384 VanDerWaalsContact C-N 3.28Å; L382-K384 PolarHBondContact O-N 3.31Å
385	T	97.1	Very high	83	Confident	34 Å²	34	77.5 Å²	77.5	21%	0.209	42%	0.417	C	S	.	.	H	α-helix	trans	-67.7	-43	-177.3	-59.4	0	0	0	0	111.7	V157 E160 A161 W381 L382	V157-T385 HydrophobicContact CG1-CG2 4.19Å; E160-T385 HydrophobicContact CB-CG2 4.14Å; A161-T385 HydrophobicContact CB-CG2 3.78Å; W381-T385 WeakPolarHBondContact O-CB 3.34Å; W381-T385 PolarHBondContact O-N 3.05Å; W381-T385 PolarHBondContact O-OG1 3.32Å; L382-T385 PolarHBondContact O-N 2.74Å; L382-T385 VanDerWaalsContact O-N 3.13Å
386	M	96	Very high	80.4	Confident	46 Å²	46	77.6 Å²	77.6	23%	0.227	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	5.9	-175.5	-61.7	-58.1	-70.5	0	0	113.5	V157 E160 L382 L388	V157-M386 HydrophobicContact CB-SD 4.22Å; V157-M386 HydrophobicContact CG1-SD 4.44Å; V157-M386 HydrophobicContact CG2-CE 4.41Å; V157-M386 HydrophobicContact CG2-CG 4.13Å; V157-M386 HydrophobicContact CG2-SD 3.87Å; E160-M386 HydrophobicContact CB-SD 4.1Å; E160-M386 HydrophobicContact CG-CE 4.42Å; E160-M386 HydrophobicContact CG-SD 3.84Å; L382-M386 HydrophobicContact CD1-CG 3.71Å; L382-M386 HydrophobicContact CG-CG 4.46Å; L382-M386 WeakPolarHBondContact O-CB 3.23Å; L382-M386 PolarHBondContact O-N 2.81Å; M386-L388 VanDerWaalsContact C-N 3.33Å; M386-L388 HydrophobicContact CB-CD1 3.92Å; M386-L388 HydrophobicContact CB-CG 3.84Å; M386-L388 PolarHBondContact O-N 3.47Å
387	N	94.6	Very high	77.5	Confident	153 Å²	153	82.6 Å²	82.6	82%	0.818	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	47.8	-176.2	-167.1	39.3	0	0	0	113.4	C383	C383-N387 CarbonylContact O-C 3.54Å; C383-N387 VanDerWaalsContact O-CA 3.32Å; C383-N387 WeakPolarHBondContact O-CA 3.21Å; C383-N387 PolarHBondContact O-N 3.41Å
388	L	92.8	Very high	74.2	Confident	54 Å²	54	84.2 Å²	84.2	28%	0.283	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-101	152.5	177.7	-55.6	173.5	0	0	0	110.9	C383 M386	C383-L388 HydrophobicContact CB-CB 4.26Å; C383-L388 WeakPolarHBondContact CB-O 3.38Å; C383-L388 PolarHBondContact O-N 3.03Å; M386-L388 VanDerWaalsContact C-N 3.33Å; M386-L388 HydrophobicContact CB-CD1 3.92Å; M386-L388 HydrophobicContact CB-CG 3.84Å; M386-L388 PolarHBondContact O-N 3.47Å
389	H	86.9	Confident	71.1	Confident	184 Å²	184	96 Å²	96	85%	0.852	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-79	125.8	168.2	-63.9	-62.3	0	0	0	109.6
390	Q	71.5	Confident	69.9	Low	98 Å²	98	100.5 Å²	100.5	46%	0.458	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-61.8	127.5	169	-84.3	-174.2	-26.4	0	0	109	C383 S392	C383-Q390 HydrophobicContact CB-CG 3.82Å; C383-Q390 VanDerWaalsContact SG-CG 3.6Å; Q390-S392 PolarHBondContact O-N 2.73Å
391	P	64.4	Low	68.4	Low	50 Å²	50	105.1 Å²	105.1	33%	0.325	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-62.3	138.8	174.5	21.9	-28.8	0	0	0	109.8	R204 T393	R204-P391 HydrophobicContact CG-CG 3.99Å; P391-T393 PolarHBondContact O-N 3.44Å
392	S	46.6	Very low	66.8	Low	128 Å²	128	108.3 Å²	108.3	90%	0.895	57%	0.572	S	S	*	*	S	Bend	trans	-63.6	3.6	-175	-31.8	0	0	0	0	115.3	Q390	Q390-S392 PolarHBondContact O-N 2.73Å
393	T	44.5	Very low	65	Low	106 Å²	106	114.6 Å²	114.6	65%	0.65	61%	0.605	S	S	*	*	S	Bend	trans	-82.2	123.9	-179.5	-37.8	0	0	0	0	108.8	P391 T395	P391-T393 PolarHBondContact O-N 3.44Å; T393-T395 PolarHBondContact O-N 3.07Å
394	P	38.3	Very low	63	Low	100 Å²	100	121.4 Å²	121.4	65%	0.649	64%	0.64	S	S	*	*			trans	-65.8	113.7	-170.2	25.4	-31.7	0	0	0	110.3
395	T	44.2	Very low	60.7	Low	73 Å²	73	117.2 Å²	117.2	45%	0.448	63%	0.63	S	S	.	*			trans	-78.8	-7.1	163	39.5	0	0	0	0	112.1	T393	T393-T395 PolarHBondContact O-N 3.07Å
396	R	39.8	Very low	58.1	Low	203 Å²	203	123.1 Å²	123.1	77%	0.766	66%	0.66	S	S	*	*			trans	-92.6	111.9	171	-74.7	-177.2	174.1	-178.6	-2.7	109.8	T398	R396-T398 VanDerWaalsContact C-N 3.28Å; R396-T398 PolarHBondContact O-N 3.29Å
397	T	34.2	Very low	55.2	Low	138 Å²	138	129.1 Å²	129.1	85%	0.847	69%	0.693	S	S	*	*			trans	-60.6	100.9	143.8	35.2	0	0	0	0	106.5	E399	T397-E399 PolarHBondContact O-N 2.89Å
398	T	28.2	Very low	51.9	Low	130 Å²	130	127.1 Å²	127.1	80%	0.798	68%	0.682	S	S	*	*			trans	-67.8	102.9	162.1	46	0	0	0	0	107	R396	R396-T398 VanDerWaalsContact C-N 3.28Å; R396-T398 PolarHBondContact O-N 3.29Å
399	E	31.8	Very low	48.2	Very low	261 Å²	261	133.7 Å²	133.7	100%	1.22	72%	0.719	S	S	*	*			trans	-88.8	0	148.2	-74.4	-166.2	159.1	0	0	109.4	T397	T397-E399 PolarHBondContact O-N 2.89Å

Retrieved 399 of 399 residues in 396 ms (Link to these results)

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